A0A3Q0KP58_SCHMA Loading...

Putative spindle assembly checkpoint component MAD1 (Mitotic arrest deficient protein 1)

AlphaFold DB , UniProt , Accession A0A3Q0KP58, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 695 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.2	Very low	39.5	Very low	176 Å²	176	130.7 Å²	130.7	87%	0.867	69%	0.686	S	S	*	*				0	-20.9	0	-145.4	164.2	-176.4	0	0	113.2	D3 A4 W18	M1-D3 PolarHBondContact O-N 3.4Å; M1-A4 PolarHBondContact O-N 3.23Å; M1-W18 HydrophobicContact CE-CZ2 4.16Å
2	N	40.2	Very low	39.5	Very low	138 Å²	138	126.7 Å²	126.7	74%	0.738	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-60	-31.7	-168.2	-62.6	13.2	0	0	0	116.3	A4 L5	N2-A4 VanDerWaalsContact C-N 3.28Å; N2-A4 PolarHBondContact O-N 3.23Å; N2-L5 PolarHBondContact O-N 2.91Å
3	D	44	Very low	39.7	Very low	119 Å²	119	127.4 Å²	127.4	64%	0.636	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-73.1	-17	-178.6	-61.4	-70	0	0	0	114.3	M1 L5	M1-D3 PolarHBondContact O-N 3.4Å; D3-L5 PolarHBondContact O-N 3.37Å
4	A	38.8	Very low	40.4	Very low	62 Å²	62	125.6 Å²	125.6	51%	0.512	67%	0.666	S	S	.	*	G	3₁₀ helix	trans	-71.3	-17.9	178.6	0	0	0	0	0	113.6	M1 N2	M1-A4 PolarHBondContact O-N 3.23Å; N2-A4 VanDerWaalsContact C-N 3.28Å; N2-A4 PolarHBondContact O-N 3.23Å
5	L	42.4	Very low	40.9	Very low	156 Å²	156	119.7 Å²	119.7	82%	0.817	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-88.8	5.8	-175.1	-68.2	169.3	0	0	0	114.2	N2 D3	N2-L5 PolarHBondContact O-N 2.91Å; D3-L5 PolarHBondContact O-N 3.37Å
6	K	41.4	Very low	41.2	Very low	166 Å²	166	122.4 Å²	122.4	72%	0.722	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-91.3	-7.1	178.3	-77.5	178.2	178.8	163.2	0	114.8
7	Y	37	Very low	41.6	Very low	155 Å²	155	123.1 Å²	123.1	61%	0.608	65%	0.652	S	S	*	*	S	Bend	trans	-96.2	139.3	-178.8	-72.9	-81.5	0	0	0	111.6
8	P	38.3	Very low	42.4	Very low	75 Å²	75	123.6 Å²	123.6	49%	0.487	64%	0.644	S	S	.	*			trans	-57.2	145	172.6	-24.2	34.5	0	0	0	111.8	S10 Q11	P8-S10 PolarHBondContact O-N 3.5Å; P8-Q11 PolarHBondContact O-N 3.48Å
9	I	37.6	Very low	42.7	Very low	156 Å²	156	120.9 Å²	120.9	80%	0.8	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-54.1	-31.6	-177.5	-64.6	169.6	0	0	0	112.1	Q11 L12	I9-Q11 PolarHBondContact O-N 3.22Å; I9-Q11 VanDerWaalsContact O-N 3.08Å; I9-L12 PolarHBondContact O-N 3Å
10	S	36.2	Very low	43.3	Very low	112 Å²	112	119.5 Å²	119.5	78%	0.783	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-62.4	-9.6	174.8	55.3	0	0	0	0	115.5	P8	P8-S10 PolarHBondContact O-N 3.5Å
11	Q	39.9	Very low	43.7	Very low	123 Å²	123	119.6 Å²	119.6	58%	0.575	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-110	-5	177.9	-62.6	-172.6	-9	0	0	113.9	P8 I9 V13	P8-Q11 PolarHBondContact O-N 3.48Å; I9-Q11 PolarHBondContact O-N 3.22Å; I9-Q11 VanDerWaalsContact O-N 3.08Å; Q11-V13 PolarHBondContact O-N 2.82Å; Q11-V13 VanDerWaalsContact O-N 3.11Å
12	L	38.7	Very low	44.1	Very low	82 Å²	82	113.6 Å²	113.6	43%	0.429	60%	0.595	S	S	.	*			trans	-76	101.3	175.6	-87.3	100.3	0	0	0	111.6	I9 I14	I9-L12 PolarHBondContact O-N 3Å; L12-I14 VanDerWaalsContact C-N 3.27Å; L12-I14 HydrophobicContact CB-CG1 4.1Å; L12-I14 HydrophobicContact CD2-CG1 4.41Å; L12-I14 PolarHBondContact O-N 3.03Å
13	V	43	Very low	44.7	Very low	136 Å²	136	110.2 Å²	110.2	82%	0.824	58%	0.579	S	S	*	*			trans	-77.3	81.1	164.4	-174.8	0	0	0	0	108.7	Q11 G15	Q11-V13 PolarHBondContact O-N 2.82Å; Q11-V13 VanDerWaalsContact O-N 3.11Å; V13-G15 VanDerWaalsContact C-N 3.33Å; V13-G15 PolarHBondContact O-N 3.45Å
14	I	49.4	Very low	45.1	Very low	103 Å²	103	110 Å²	110	53%	0.528	57%	0.574	S	S	.	*			trans	-71.9	90.7	172.7	-50.5	179.4	0	0	0	108.3	L12 W18	L12-I14 VanDerWaalsContact C-N 3.27Å; L12-I14 HydrophobicContact CB-CG1 4.1Å; L12-I14 HydrophobicContact CD2-CG1 4.41Å; L12-I14 PolarHBondContact O-N 3.03Å; I14-W18 HydrophobicContact CG2-CB 4.4Å; I14-W18 HydrophobicContact CG2-CE3 4.06Å
15	G	48.1	Very low	45.6	Very low	36 Å²	36	114.3 Å²	114.3	37%	0.371	58%	0.578	S	S	.	*			trans	-82.7	163	169.6	0	0	0	0	0	112.1	V13 E17 W18	V13-G15 VanDerWaalsContact C-N 3.33Å; V13-G15 PolarHBondContact O-N 3.45Å; G15-E17 PolarHBondContact O-N 3.19Å; G15-E17 VanDerWaalsContact O-N 3.14Å; G15-W18 PolarHBondContact O-N 2.8Å
16	E	45.6	Very low	45.8	Very low	164 Å²	164	110.6 Å²	110.6	77%	0.766	56%	0.559	S	S	*	*	H	α-helix	trans	-54.8	-33.8	-179.3	-63.8	171.6	133.7	0	0	112.5	W18 L19 V20	E16-W18 PolarHBondContact O-N 3.26Å; E16-W18 VanDerWaalsContact O-N 3.15Å; E16-L19 PolarHBondContact O-N 3.48Å; E16-L19 VanDerWaalsContact O-N 3.17Å; E16-V20 WeakPolarHBondContact O-CG2 3.38Å; E16-V20 PolarHBondContact O-N 3.42Å
17	E	47.6	Very low	46.1	Very low	134 Å²	134	108.9 Å²	108.9	63%	0.626	55%	0.553	S	S	*	*	H	α-helix	trans	-50.3	-35.6	172	-91.4	-151.5	104.7	0	0	114.3	G15 K21	G15-E17 PolarHBondContact O-N 3.19Å; G15-E17 VanDerWaalsContact O-N 3.14Å; E17-K21 VanDerWaalsContact CD-NZ 3.3Å; E17-K21 WeakPolarHBondContact O-CB 3.43Å; E17-K21 WeakPolarHBondContact O-CD 3.33Å; E17-K21 WeakPolarHBondContact O-CG 3.35Å; E17-K21 PolarHBondContact O-N 3.01Å; E17-K21 WeakPolarHBondContact OE1-CE 3.41Å; E17-K21 IonicContact OE1-NZ 2.63Å; E17-K21 PolarHBondContact OE1-NZ 3Å; E17-K21 IonicContact OE2-NZ 2.61Å
18	W	55.4	Low	46.7	Very low	131 Å²	131	107 Å²	107	50%	0.496	55%	0.554	S	S	.	*	H	α-helix	trans	-73.2	-42.8	-178.1	-171.4	87.8	0	0	0	111	M1 I14 G15 E16 K21 V22	M1-W18 HydrophobicContact CE-CZ2 4.16Å; I14-W18 HydrophobicContact CG2-CB 4.4Å; I14-W18 HydrophobicContact CG2-CE3 4.06Å; G15-W18 PolarHBondContact O-N 2.8Å; E16-W18 PolarHBondContact O-N 3.26Å; E16-W18 VanDerWaalsContact O-N 3.15Å; W18-K21 PolarHBondContact O-N 3.02Å; W18-V22 HydrophobicContact CD2-CG2 4.22Å; W18-V22 HydrophobicContact CE3-CG2 4.14Å; W18-V22 HydrophobicContact CH2-CG2 4.03Å; W18-V22 HydrophobicContact CZ2-CG2 4.1Å; W18-V22 HydrophobicContact CZ3-CG2 4.05Å; W18-V22 WeakPolarHBondContact O-CG2 3.38Å; W18-V22 PolarHBondContact O-N 3.05Å
19	L	48.7	Very low	47	Very low	74 Å²	74	109.4 Å²	109.4	39%	0.387	56%	0.558	S	S	.	*	H	α-helix	trans	-63.4	-45.1	173.6	-90.1	161.5	0	0	0	111.4	E16 K21 V22 V23	E16-L19 PolarHBondContact O-N 3.48Å; E16-L19 VanDerWaalsContact O-N 3.17Å; L19-K21 VanDerWaalsContact C-N 3.32Å; L19-K21 PolarHBondContact O-N 3.1Å; L19-V22 PolarHBondContact O-N 3.23Å; L19-V22 VanDerWaalsContact O-N 3.11Å; L19-V23 WeakPolarHBondContact O-CG2 3.48Å; L19-V23 PolarHBondContact O-N 3.43Å
20	V	53.8	Low	47	Very low	91 Å²	91	107.7 Å²	107.7	55%	0.552	56%	0.555	S	S	*	*	H	α-helix	trans	-59	-42.8	175.2	172.8	0	0	0	0	111.2	E16 V22 V23 H24	E16-V20 WeakPolarHBondContact O-CG2 3.38Å; E16-V20 PolarHBondContact O-N 3.42Å; V20-V22 VanDerWaalsContact C-N 3.32Å; V20-V22 PolarHBondContact O-N 3.47Å; V20-V23 PolarHBondContact O-N 3.03Å; V20-H24 WeakPolarHBondContact O-CB 3.39Å; V20-H24 PolarHBondContact O-N 3.21Å
21	K	51.7	Low	47	Very low	123 Å²	123	104.7 Å²	104.7	54%	0.535	53%	0.532	S	S	.	.	H	α-helix	trans	-67.2	-29	176.4	-75.6	165.1	-173.1	161.4	0	113.3	E17 W18 L19 Y25	E17-K21 VanDerWaalsContact CD-NZ 3.3Å; E17-K21 WeakPolarHBondContact O-CB 3.43Å; E17-K21 WeakPolarHBondContact O-CD 3.33Å; E17-K21 WeakPolarHBondContact O-CG 3.35Å; E17-K21 PolarHBondContact O-N 3.01Å; E17-K21 WeakPolarHBondContact OE1-CE 3.41Å; E17-K21 IonicContact OE1-NZ 2.63Å; E17-K21 PolarHBondContact OE1-NZ 3Å; E17-K21 IonicContact OE2-NZ 2.61Å; W18-K21 PolarHBondContact O-N 3.02Å; L19-K21 VanDerWaalsContact C-N 3.32Å; L19-K21 PolarHBondContact O-N 3.1Å; K21-Y25 WeakPolarHBondContact O-CB 3.2Å; K21-Y25 PolarHBondContact O-N 3.36Å
22	V	49	Very low	46.8	Very low	50 Å²	50	100.1 Å²	100.1	30%	0.303	51%	0.512	S	S	.	.	H	α-helix	trans	-74.8	-47.4	173.7	169.4	0	0	0	0	111.3	W18 L19 V20 Y25 L26	W18-V22 HydrophobicContact CD2-CG2 4.22Å; W18-V22 HydrophobicContact CE3-CG2 4.14Å; W18-V22 HydrophobicContact CH2-CG2 4.03Å; W18-V22 HydrophobicContact CZ2-CG2 4.1Å; W18-V22 HydrophobicContact CZ3-CG2 4.05Å; W18-V22 WeakPolarHBondContact O-CG2 3.38Å; W18-V22 PolarHBondContact O-N 3.05Å; L19-V22 PolarHBondContact O-N 3.23Å; L19-V22 VanDerWaalsContact O-N 3.11Å; V20-V22 VanDerWaalsContact C-N 3.32Å; V20-V22 PolarHBondContact O-N 3.47Å; V22-Y25 PolarHBondContact O-N 3.32Å; V22-L26 HydrophobicContact CG1-CD1 3.91Å; V22-L26 WeakPolarHBondContact O-CG 3.42Å; V22-L26 PolarHBondContact O-N 3.36Å; V22-L26 VanDerWaalsContact O-N 3.14Å
23	V	52.7	Low	46.6	Very low	66 Å²	66	97.6 Å²	97.6	40%	0.4	50%	0.498	S	S	.	.	H	α-helix	trans	-59.1	-50.4	176.6	172.8	0	0	0	0	110.6	L19 V20 Y25 L26 E27	L19-V23 WeakPolarHBondContact O-CG2 3.48Å; L19-V23 PolarHBondContact O-N 3.43Å; V20-V23 PolarHBondContact O-N 3.03Å; V23-Y25 PolarHBondContact O-N 3.45Å; V23-L26 PolarHBondContact O-N 2.83Å; V23-E27 HydrophobicContact CG1-CG 4.33Å; V23-E27 PolarHBondContact O-N 3.18Å
24	H	52.9	Low	46.3	Very low	114 Å²	114	94 Å²	94	53%	0.528	47%	0.47	S	S	.	.	H	α-helix	trans	-68	-18.8	-176.7	-156.6	0.8	0	0	0	113.3	V20 E27 N28	V20-H24 WeakPolarHBondContact O-CB 3.39Å; V20-H24 PolarHBondContact O-N 3.21Å; H24-E27 IonicContact ND1-OE2 3.64Å; H24-N28 PolarHBondContact O-ND2 2.97Å
25	Y	48.7	Very low	45.6	Very low	154 Å²	154	94.1 Å²	94.1	60%	0.604	47%	0.471	S	S	*	.	H	α-helix	trans	-76.1	-44.2	168.7	-171.3	-98	0	0	0	111.5	K21 V22 V23 N28	K21-Y25 WeakPolarHBondContact O-CB 3.2Å; K21-Y25 PolarHBondContact O-N 3.36Å; V22-Y25 PolarHBondContact O-N 3.32Å; V23-Y25 PolarHBondContact O-N 3.45Å; Y25-N28 PolarHBondContact O-N 3.24Å
26	L	46.1	Very low	45	Very low	78 Å²	78	99.3 Å²	99.3	41%	0.408	49%	0.485	S	S	.	.	H	α-helix	trans	-67.9	-37.1	-178.1	-68.1	166.5	0	0	0	113.1	V22 V23 N28 E29	V22-L26 HydrophobicContact CG1-CD1 3.91Å; V22-L26 WeakPolarHBondContact O-CG 3.42Å; V22-L26 PolarHBondContact O-N 3.36Å; V22-L26 VanDerWaalsContact O-N 3.14Å; V23-L26 PolarHBondContact O-N 2.83Å; L26-N28 PolarHBondContact O-N 2.83Å; L26-N28 VanDerWaalsContact O-N 3.15Å; L26-E29 PolarHBondContact O-N 3.39Å
27	E	48	Very low	44.8	Very low	129 Å²	129	93.4 Å²	93.4	60%	0.603	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-22	176	-71.2	179.4	134.7	0	0	113.7	V23 H24	V23-E27 HydrophobicContact CG1-CG 4.33Å; V23-E27 PolarHBondContact O-N 3.18Å; H24-E27 IonicContact ND1-OE2 3.64Å
28	N	49.3	Very low	44.3	Very low	116 Å²	116	91.8 Å²	91.8	62%	0.62	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-15.2	-176	-81.1	-73.1	0	0	0	114.3	H24 Y25 L26	H24-N28 PolarHBondContact O-ND2 2.97Å; Y25-N28 PolarHBondContact O-N 3.24Å; L26-N28 PolarHBondContact O-N 2.83Å; L26-N28 VanDerWaalsContact O-N 3.15Å
29	E	45.6	Very low	43.7	Very low	126 Å²	126	92 Å²	92	59%	0.589	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-30.5	-178.7	-69.5	-165	127.4	0	0	113.7	L26 V31	L26-E29 PolarHBondContact O-N 3.39Å; E29-V31 PolarHBondContact O-N 2.98Å
30	T	37.5	Very low	43.4	Very low	120 Å²	120	91.4 Å²	91.4	74%	0.736	47%	0.467	S	S	*	.			trans	-85.9	50	-170	60.4	0	0	0	0	115.1
31	V	36.1	Very low	43.1	Very low	48 Å²	48	91.6 Å²	91.6	29%	0.291	47%	0.472	S	S	.	.			trans	-142.6	109.7	142.9	-124.6	0	0	0	0	104.6	E29 L558 K561	E29-V31 PolarHBondContact O-N 2.98Å; V31-L558 HydrophobicContact CG1-CD2 3.32Å; V31-L558 HydrophobicContact CG1-CG 3.91Å; V31-K561 HydrophobicContact CB-CB 3.63Å; V31-K561 HydrophobicContact CB-CD 4.08Å; V31-K561 HydrophobicContact CB-CG 4.35Å; V31-K561 HydrophobicContact CG1-CB 3.56Å; V31-K561 WeakPolarHBondContact O-CD 3.39Å; V31-K561 PolarHBondContact O-NZ 3.39Å
32	N	34.8	Very low	42.7	Very low	28 Å²	28	91.9 Å²	91.9	15%	0.15	47%	0.471	C	S	.	.				-166.4	99.5	93.3	-175.7	-22.6	0	0	0	114.3	E560 K561 L562 S563 L564 N565	N32-E560 PolarHBondContact ND2-O 2.85Å; N32-E560 PolarHBondContact OD1-O 3.31Å; N32-K561 CarbonylContact C-O 3.18Å; N32-K561 VanDerWaalsContact CA-O 3.23Å; N32-K561 WeakPolarHBondContact CA-O 3.36Å; N32-K561 HydrophobicContact CB-CB 3.66Å; N32-K561 HydrophobicContact CB-CD 4.07Å; N32-K561 HydrophobicContact CB-CG 4.11Å; N32-K561 WeakPolarHBondContact ND2-CA 3.35Å; N32-K561 VanDerWaalsContact OD1-CA 3.22Å; N32-K561 WeakPolarHBondContact OD1-CA 3.29Å; N32-K561 PolarHBondContact OD1-O 2.8Å; N32-L562 PolarHBondContact OD1-N 2.95Å; N32-S563 PolarHBondContact OD1-N 2.91Å; N32-L564 HydrophobicContact CB-CB 4.01Å; N32-L564 WeakPolarHBondContact ND2-CB 3.44Å; N32-L564 WeakPolarHBondContact OD1-CB 3.4Å; N32-L564 PolarHBondContact OD1-N 2.88Å; N32-N565 VanDerWaalsContact O-CA 3.23Å; N32-N565 WeakPolarHBondContact O-CA 3.28Å; N32-N565 WeakPolarHBondContact O-CB 3.47Å; N32-N565 PolarHBondContact O-N 2.91Å
33	D	35.1	Very low	42.7	Very low	28 Å²	28	92.1 Å²	92.1	15%	0.15	48%	0.478	C	S	.	.			trans	99.3	-161.5	147	-159.9	15.2	0	0	0	126	K561 L562 S563 L564 N565 L566	D33-K561 PolarHBondContact N-O 3.22Å; D33-L562 HydrophobicContact CB-CD1 4.35Å; D33-L562 VanDerWaalsContact CG-CA 3.41Å; D33-L562 WeakPolarHBondContact OD1-CD1 3.47Å; D33-L562 VanDerWaalsContact OD1-CG 3.27Å; D33-L562 WeakPolarHBondContact OD1-CG 3.38Å; D33-S563 VanDerWaalsContact CG-N 3.25Å; D33-S563 WeakPolarHBondContact OD2-CA 3.33Å; D33-S563 PolarHBondContact OD2-N 3.49Å; D33-L564 PolarHBondContact OD2-N 3.13Å; D33-N565 HydrophobicContact CB-CB 3.94Å; D33-N565 PolarHBondContact O-ND2 2.79Å; D33-L566 VanDerWaalsContact CG-CG 3.5Å; D33-L566 WeakPolarHBondContact OD1-CG 3.4Å; D33-L566 VanDerWaalsContact OD2-CA 3.24Å; D33-L566 WeakPolarHBondContact OD2-CA 3.49Å; D33-L566 WeakPolarHBondContact OD2-CB 3.22Å; D33-L566 WeakPolarHBondContact OD2-CD1 3.38Å; D33-L566 WeakPolarHBondContact OD2-CG 3.5Å; D33-L566 PolarHBondContact OD2-N 3.11Å
34	R	36.8	Very low	42.7	Very low	62 Å²	62	92.5 Å²	92.5	23%	0.234	48%	0.481	C	S	.	.			trans	-9.7	120	-153.5	-94.9	169.5	-157.1	137.3	-4.8	115	N565 L566 D570	R34-N565 WeakPolarHBondContact CB-O 3.5Å; R34-N565 PolarHBondContact O-ND2 3.13Å; R34-L566 VanDerWaalsContact CD-CA 3.41Å; R34-L566 VanDerWaalsContact CD-O 3.32Å; R34-L566 WeakPolarHBondContact CD-O 3.47Å; R34-L566 VanDerWaalsContact CG-CA 3.41Å; R34-L566 HydrophobicContact CG-CB 3.9Å; R34-L566 HydrophobicContact CG-CD2 3.59Å; R34-L566 HydrophobicContact CG-CG 3.71Å; R34-L566 VanDerWaalsContact CZ-CD2 3.45Å; R34-L566 PolarHBondContact NH1-O 2.85Å; R34-D570 IonicContact CZ-OD1 3.27Å; R34-D570 VanDerWaalsContact CZ-OD1 3.22Å; R34-D570 IonicContact CZ-OD2 2.82Å; R34-D570 IonicContact NE-OD1 3.91Å; R34-D570 IonicContact NH1-OD1 2.7Å; R34-D570 PolarHBondContact NH1-OD1 3.39Å; R34-D570 IonicContact NH1-OD2 3.93Å; R34-D570 PolarHBondContact NH1-OD2 2.81Å; R34-D570 IonicContact NH2-OD1 2.77Å; R34-D570 IonicContact NH2-OD2 3.62Å
35	I	34.1	Very low	42.5	Very low	105 Å²	105	91.2 Å²	91.2	54%	0.538	47%	0.474	S	S	.	.	S	Bend	cis	51.6	52.6	46	-38.3	-177.8	0	0	0	112.4	L562	I35-L562 HydrophobicContact CD1-CD1 4.11Å; I35-L562 HydrophobicContact CD1-CD2 4.35Å
36	E	36.7	Very low	42.6	Very low	145 Å²	145	87.8 Å²	87.8	68%	0.678	47%	0.466	S	S	*	.	S	Bend	trans	-175.9	-11.7	140.8	-107.8	180	-172.8	0	0	112.2	I573	E36-I573 WeakPolarHBondContact OE2-CD1 3.41Å
37	K	39.7	Very low	43.1	Very low	39 Å²	39	88.8 Å²	88.8	17%	0.17	47%	0.468	C	S	.	.			trans	-126.2	31.3	-176.3	-88.1	131.6	163.1	-61.2	0	115.5	N39 S569 Y572 I573 Q576	K37-N39 VanDerWaalsContact C-N 3.27Å; K37-N39 PolarHBondContact O-N 3.43Å; K37-S569 VanDerWaalsContact CD-OG 3.3Å; K37-S569 WeakPolarHBondContact CD-OG 3.32Å; K37-Y572 HydrophobicContact CB-CD1 3.64Å; K37-Y572 HydrophobicContact CB-CE1 3.77Å; K37-Y572 HydrophobicContact CD-CD1 3.49Å; K37-Y572 VanDerWaalsContact CD-CD1 3.49Å; K37-Y572 HydrophobicContact CD-CE1 4.1Å; K37-Y572 HydrophobicContact CD-CG 4.04Å; K37-Y572 VanDerWaalsContact CE-C 3.48Å; K37-Y572 HydrophobicContact CG-CD1 3.56Å; K37-Y572 HydrophobicContact CG-CE1 3.67Å; K37-Y572 PolarHBondContact NZ-O 3.32Å; K37-I573 HydrophobicContact CD-CG1 3.92Å; K37-I573 VanDerWaalsContact CE-N 3.3Å; K37-Q576 VanDerWaalsContact NZ-CG 3.27Å
38	T	38.4	Very low	43.4	Very low	100 Å²	100	91.2 Å²	91.2	61%	0.613	47%	0.472	S	S	*	.	H	α-helix	trans	-64.7	-19.4	-172.9	39.5	0	0	0	0	115.4
39	N	41.9	Very low	43.8	Very low	136 Å²	136	87.5 Å²	87.5	73%	0.727	45%	0.452	S	S	*	.	H	α-helix	trans	-75.1	-40.2	-179.7	-81.6	-9.3	0	0	0	114.7	K37 A43	K37-N39 VanDerWaalsContact C-N 3.27Å; K37-N39 PolarHBondContact O-N 3.43Å; N39-A43 VanDerWaalsContact O-CB 3.31Å; N39-A43 WeakPolarHBondContact O-CB 3.39Å; N39-A43 PolarHBondContact O-N 3.22Å
40	T	43.3	Very low	44.3	Very low	62 Å²	62	87 Å²	87	38%	0.38	45%	0.448	S	S	.	.	H	α-helix	trans	-75.4	-36.2	-166.7	-12.5	0	0	0	0	113.8	T44 Y572	T40-T44 PolarHBondContact O-N 2.87Å; T40-T44 VanDerWaalsContact O-N 3.09Å; T40-T44 PolarHBondContact O-OG1 3.1Å; T40-Y572 PolarHBondContact OG1-OH 3.01Å; T40-Y572 VanDerWaalsContact OG1-OH 3.12Å
41	S	46.1	Very low	45.5	Very low	94 Å²	94	85.3 Å²	85.3	66%	0.657	43%	0.434	S	S	*	.	H	α-helix	trans	-65.7	-47	174.8	-174.9	0	0	0	0	110.5	A43 T44 F45	S41-A43 PolarHBondContact O-N 3.03Å; S41-T44 WeakPolarHBondContact O-CB 3.35Å; S41-T44 PolarHBondContact O-N 3.27Å; S41-T44 VanDerWaalsContact O-N 3.09Å; S41-F45 PolarHBondContact O-N 2.96Å
42	Y	45	Very low	46.5	Very low	129 Å²	129	86.4 Å²	86.4	51%	0.506	44%	0.44	S	S	.	.	H	α-helix	trans	-63.2	-40.5	178.1	-162.9	-106.3	0	0	0	112.4	T44 F45 L46	Y42-T44 VanDerWaalsContact C-N 3.32Å; Y42-T44 PolarHBondContact O-N 3.42Å; Y42-F45 HydrophobicContact CE2-CD1 4.47Å; Y42-F45 WeakPolarHBondContact O-CB 3.42Å; Y42-F45 PolarHBondContact O-N 3Å; Y42-L46 HydrophobicContact CD1-CD1 3.74Å; Y42-L46 HydrophobicContact CD1-CG 4.15Å; Y42-L46 HydrophobicContact CE1-CD1 3.66Å; Y42-L46 HydrophobicContact CE1-CD2 4.36Å; Y42-L46 HydrophobicContact CE1-CG 4.04Å; Y42-L46 WeakPolarHBondContact O-CB 3.48Å; Y42-L46 WeakPolarHBondContact O-CG 3.47Å; Y42-L46 PolarHBondContact O-N 2.89Å
43	A	48.4	Very low	47.6	Very low	55 Å²	55	88.1 Å²	88.1	46%	0.455	45%	0.449	S	S	.	.	H	α-helix	trans	-61.7	-37.2	172.4	0	0	0	0	0	112.7	N39 S41 Q47	N39-A43 VanDerWaalsContact O-CB 3.31Å; N39-A43 WeakPolarHBondContact O-CB 3.39Å; N39-A43 PolarHBondContact O-N 3.22Å; S41-A43 PolarHBondContact O-N 3.03Å; A43-Q47 WeakPolarHBondContact O-CB 3.37Å; A43-Q47 PolarHBondContact O-N 2.83Å
44	T	51.6	Low	48.9	Very low	75 Å²	75	90 Å²	90	46%	0.46	46%	0.459	S	S	.	.	H	α-helix	trans	-71	-36.1	177	-51.8	0	0	0	0	111.8	T40 S41 Y42 R48	T40-T44 PolarHBondContact O-N 2.87Å; T40-T44 VanDerWaalsContact O-N 3.09Å; T40-T44 PolarHBondContact O-OG1 3.1Å; S41-T44 WeakPolarHBondContact O-CB 3.35Å; S41-T44 PolarHBondContact O-N 3.27Å; S41-T44 VanDerWaalsContact O-N 3.09Å; Y42-T44 VanDerWaalsContact C-N 3.32Å; Y42-T44 PolarHBondContact O-N 3.42Å; T44-R48 WeakPolarHBondContact O-CG 3.36Å; T44-R48 PolarHBondContact O-N 3.35Å
45	F	50	Low	50.1	Low	87 Å²	87	91.2 Å²	91.2	38%	0.382	47%	0.469	S	S	.	.	H	α-helix	trans	-64.8	-49.3	172	173.4	-102.4	0	0	0	111.5	S41 Y42 Q47 R48 I49	S41-F45 PolarHBondContact O-N 2.96Å; Y42-F45 HydrophobicContact CE2-CD1 4.47Å; Y42-F45 WeakPolarHBondContact O-CB 3.42Å; Y42-F45 PolarHBondContact O-N 3Å; F45-Q47 VanDerWaalsContact C-N 3.32Å; F45-Q47 PolarHBondContact O-N 3.35Å; F45-R48 PolarHBondContact O-N 3.08Å; F45-R48 VanDerWaalsContact O-N 3.13Å; F45-I49 HydrophobicContact CD1-CD1 4.11Å; F45-I49 HydrophobicContact CE1-CD1 3.5Å; F45-I49 VanDerWaalsContact CE1-CD1 3.5Å; F45-I49 HydrophobicContact CE2-CD1 4.08Å; F45-I49 HydrophobicContact CZ-CD1 3.49Å; F45-I49 VanDerWaalsContact CZ-CD1 3.49Å; F45-I49 HydrophobicContact CZ-CG1 4.48Å; F45-I49 PolarHBondContact O-N 3.31Å
46	L	50.1	Low	51.1	Low	82 Å²	82	88.4 Å²	88.4	43%	0.429	45%	0.453	S	S	.	.	H	α-helix	trans	-58.6	-41.7	174.1	-73	176.3	0	0	0	111.9	Y42 R48 I49 K50	Y42-L46 HydrophobicContact CD1-CD1 3.74Å; Y42-L46 HydrophobicContact CD1-CG 4.15Å; Y42-L46 HydrophobicContact CE1-CD1 3.66Å; Y42-L46 HydrophobicContact CE1-CD2 4.36Å; Y42-L46 HydrophobicContact CE1-CG 4.04Å; Y42-L46 WeakPolarHBondContact O-CB 3.48Å; Y42-L46 WeakPolarHBondContact O-CG 3.47Å; Y42-L46 PolarHBondContact O-N 2.89Å; L46-R48 PolarHBondContact O-N 3.17Å; L46-I49 PolarHBondContact O-N 3.21Å; L46-K50 WeakPolarHBondContact O-CB 3.46Å; L46-K50 PolarHBondContact O-N 2.86Å
47	Q	57	Low	52.5	Low	99 Å²	99	87.2 Å²	87.2	46%	0.463	45%	0.448	S	S	.	.	H	α-helix	trans	-66.2	-35.7	176.4	-170.8	60.9	51.3	0	0	111.9	A43 F45 K50 N51	A43-Q47 WeakPolarHBondContact O-CB 3.37Å; A43-Q47 PolarHBondContact O-N 2.83Å; F45-Q47 VanDerWaalsContact C-N 3.32Å; F45-Q47 PolarHBondContact O-N 3.35Å; Q47-K50 PolarHBondContact O-N 3.11Å; Q47-N51 PolarHBondContact NE2-OD1 3.08Å; Q47-N51 PolarHBondContact O-N 3.04Å; Q47-N51 PolarHBondContact O-OD1 3.41Å
48	R	54.3	Low	53.9	Low	179 Å²	179	91.7 Å²	91.7	68%	0.675	47%	0.469	S	S	*	.	H	α-helix	trans	-67.5	-40.6	173	-78.8	179.9	173	175.4	-1.1	112.6	T44 F45 L46 K50 V52	T44-R48 WeakPolarHBondContact O-CG 3.36Å; T44-R48 PolarHBondContact O-N 3.35Å; F45-R48 PolarHBondContact O-N 3.08Å; F45-R48 VanDerWaalsContact O-N 3.13Å; L46-R48 PolarHBondContact O-N 3.17Å; R48-K50 VanDerWaalsContact C-N 3.29Å; R48-V52 WeakPolarHBondContact O-CG2 3.42Å; R48-V52 PolarHBondContact O-N 3.3Å
49	I	56.5	Low	54.9	Low	39 Å²	39	89.8 Å²	89.8	20%	0.2	45%	0.454	C	S	.	.	H	α-helix	trans	-62.6	-40	171.3	-71.7	179.5	0	0	0	110.3	F45 L46 V52 I53 I145	F45-I49 HydrophobicContact CD1-CD1 4.11Å; F45-I49 HydrophobicContact CE1-CD1 3.5Å; F45-I49 VanDerWaalsContact CE1-CD1 3.5Å; F45-I49 HydrophobicContact CE2-CD1 4.08Å; F45-I49 HydrophobicContact CZ-CD1 3.49Å; F45-I49 VanDerWaalsContact CZ-CD1 3.49Å; F45-I49 HydrophobicContact CZ-CG1 4.48Å; F45-I49 PolarHBondContact O-N 3.31Å; L46-I49 PolarHBondContact O-N 3.21Å; I49-V52 WeakPolarHBondContact O-CB 3.35Å; I49-V52 PolarHBondContact O-N 3.43Å; I49-I53 HydrophobicContact CG2-CD1 3.86Å; I49-I53 HydrophobicContact CG2-CG1 4.45Å; I49-I53 WeakPolarHBondContact O-CG1 3.45Å; I49-I53 PolarHBondContact O-N 3.15Å; I49-I145 HydrophobicContact CD1-CD1 4.32Å
50	K	57.5	Low	56	Low	116 Å²	116	88.3 Å²	88.3	50%	0.504	44%	0.443	S	S	.	.	H	α-helix	trans	-63.4	-51	176.6	-163.3	179.9	179.8	-170.8	0	111.7	L46 Q47 R48 V52 I53 D54	L46-K50 WeakPolarHBondContact O-CB 3.46Å; L46-K50 PolarHBondContact O-N 2.86Å; Q47-K50 PolarHBondContact O-N 3.11Å; R48-K50 VanDerWaalsContact C-N 3.29Å; K50-V52 PolarHBondContact O-N 3.45Å; K50-V52 VanDerWaalsContact O-N 3.12Å; K50-I53 CarbonylContact O-C 3.36Å; K50-I53 WeakPolarHBondContact O-CA 3.35Å; K50-I53 WeakPolarHBondContact O-CB 3.21Å; K50-I53 PolarHBondContact O-N 3.49Å; K50-D54 PolarHBondContact O-N 3.36Å
51	N	61.6	Low	57.2	Low	83 Å²	83	89.1 Å²	89.1	44%	0.444	45%	0.452	S	S	.	.	H	α-helix	trans	-55.2	-32.2	173.4	-75.1	44	0	0	0	112.8	Q47 D54 I55	Q47-N51 PolarHBondContact NE2-OD1 3.08Å; Q47-N51 PolarHBondContact O-N 3.04Å; Q47-N51 PolarHBondContact O-OD1 3.41Å; N51-D54 WeakPolarHBondContact CA-OD2 2.91Å; N51-I55 WeakPolarHBondContact O-CD1 3.29Å; N51-I55 VanDerWaalsContact O-CG1 3.27Å; N51-I55 WeakPolarHBondContact O-CG1 3.42Å; N51-I55 PolarHBondContact O-N 3.05Å
52	V	56.7	Low	58.3	Low	71 Å²	71	89.8 Å²	89.8	43%	0.43	45%	0.448	S	S	.	.	H	α-helix	trans	-71.4	-43.2	172.7	168.6	0	0	0	0	111.2	R48 I49 K50 D54 I55 F56	R48-V52 WeakPolarHBondContact O-CG2 3.42Å; R48-V52 PolarHBondContact O-N 3.3Å; I49-V52 WeakPolarHBondContact O-CB 3.35Å; I49-V52 PolarHBondContact O-N 3.43Å; K50-V52 PolarHBondContact O-N 3.45Å; K50-V52 VanDerWaalsContact O-N 3.12Å; V52-D54 VanDerWaalsContact C-N 3.35Å; V52-I55 PolarHBondContact O-N 3.04Å; V52-F56 HydrophobicContact CG1-CD2 4.03Å; V52-F56 HydrophobicContact CG1-CE2 3.65Å; V52-F56 WeakPolarHBondContact O-CD2 3.48Å; V52-F56 PolarHBondContact O-N 2.99Å
53	I	58.7	Low	59.3	Low	65 Å²	65	84.2 Å²	84.2	33%	0.333	43%	0.427	S	S	.	.	H	α-helix	trans	-61.4	-42.8	173.6	-68	165.3	0	0	0	110.9	I49 K50 I55 F56 E57	I49-I53 HydrophobicContact CG2-CD1 3.86Å; I49-I53 HydrophobicContact CG2-CG1 4.45Å; I49-I53 WeakPolarHBondContact O-CG1 3.45Å; I49-I53 PolarHBondContact O-N 3.15Å; K50-I53 CarbonylContact O-C 3.36Å; K50-I53 WeakPolarHBondContact O-CA 3.35Å; K50-I53 WeakPolarHBondContact O-CB 3.21Å; K50-I53 PolarHBondContact O-N 3.49Å; I53-I55 VanDerWaalsContact C-N 3.26Å; I53-I55 PolarHBondContact O-N 3.16Å; I53-F56 CarbonylContact O-C 3.55Å; I53-F56 WeakPolarHBondContact O-CA 3.38Å; I53-F56 WeakPolarHBondContact O-CB 3.26Å; I53-F56 PolarHBondContact O-N 3.26Å; I53-E57 HydrophobicContact CG2-CG 4.43Å; I53-E57 PolarHBondContact O-N 3.34Å
54	D	61.8	Low	60.4	Low	67 Å²	67	85.3 Å²	85.3	36%	0.358	43%	0.428	S	S	.	.	H	α-helix	trans	-59	-38.6	177	-54.4	-30.2	0	0	0	110.6	K50 N51 V52 E57 E58	K50-D54 PolarHBondContact O-N 3.36Å; N51-D54 WeakPolarHBondContact CA-OD2 2.91Å; V52-D54 VanDerWaalsContact C-N 3.35Å; D54-E57 PolarHBondContact O-N 3.16Å; D54-E58 WeakPolarHBondContact O-CB 3.46Å; D54-E58 PolarHBondContact O-N 3.04Å
55	I	62.5	Low	61.4	Low	88 Å²	88	86.5 Å²	86.5	45%	0.451	43%	0.428	S	S	.	.	H	α-helix	trans	-69.6	-34.1	172.8	-69.1	164	0	0	0	112.2	N51 V52 I53 I59	N51-I55 WeakPolarHBondContact O-CD1 3.29Å; N51-I55 VanDerWaalsContact O-CG1 3.27Å; N51-I55 WeakPolarHBondContact O-CG1 3.42Å; N51-I55 PolarHBondContact O-N 3.05Å; V52-I55 PolarHBondContact O-N 3.04Å; I53-I55 VanDerWaalsContact C-N 3.26Å; I53-I55 PolarHBondContact O-N 3.16Å; I55-I59 HydrophobicContact CG2-CD1 3.94Å; I55-I59 WeakPolarHBondContact O-CB 3.47Å; I55-I59 WeakPolarHBondContact O-CD1 3.43Å; I55-I59 VanDerWaalsContact O-CG1 3.22Å; I55-I59 WeakPolarHBondContact O-CG1 3.37Å; I55-I59 PolarHBondContact O-N 3.43Å
56	F	55.1	Low	62.2	Low	46 Å²	46	84.8 Å²	84.8	20%	0.202	42%	0.424	C	S	.	.	H	α-helix	trans	-65.5	-42.4	172	-84	-132.3	0	0	0	110.8	V52 I53 I59 E60 L134 K138	V52-F56 HydrophobicContact CG1-CD2 4.03Å; V52-F56 HydrophobicContact CG1-CE2 3.65Å; V52-F56 WeakPolarHBondContact O-CD2 3.48Å; V52-F56 PolarHBondContact O-N 2.99Å; I53-F56 CarbonylContact O-C 3.55Å; I53-F56 WeakPolarHBondContact O-CA 3.38Å; I53-F56 WeakPolarHBondContact O-CB 3.26Å; I53-F56 PolarHBondContact O-N 3.26Å; F56-I59 PolarHBondContact O-N 3.42Å; F56-E60 WeakPolarHBondContact O-CB 3.32Å; F56-E60 PolarHBondContact O-N 3.35Å; F56-L134 HydrophobicContact CD1-CB 4.23Å; F56-L134 HydrophobicContact CE1-CB 3.64Å; F56-L134 HydrophobicContact CE1-CD2 4.11Å; F56-L134 HydrophobicContact CE1-CG 4.4Å; F56-L134 WeakPolarHBondContact CE1-O 3.44Å; F56-L134 HydrophobicContact CE2-CD2 3.93Å; F56-L134 HydrophobicContact CZ-CB 4.04Å; F56-L134 HydrophobicContact CZ-CD2 3.61Å; F56-L134 HydrophobicContact CZ-CG 4.38Å; F56-K138 HydrophobicContact CE1-CB 4.19Å
57	E	66.5	Low	63	Low	120 Å²	120	84.6 Å²	84.6	56%	0.561	42%	0.421	S	S	*	.	H	α-helix	trans	-67.8	-37.2	177.8	-69.8	-177.4	-169.4	0	0	111.8	I53 D54 E60 S61	I53-E57 HydrophobicContact CG2-CG 4.43Å; I53-E57 PolarHBondContact O-N 3.34Å; D54-E57 PolarHBondContact O-N 3.16Å; E57-E60 PolarHBondContact O-N 2.89Å; E57-S61 VanDerWaalsContact O-CB 3.31Å; E57-S61 WeakPolarHBondContact O-CB 3.5Å; E57-S61 PolarHBondContact O-N 3.2Å
58	E	68.3	Low	63.9	Low	133 Å²	133	84.5 Å²	84.5	62%	0.621	42%	0.424	S	S	*	.	H	α-helix	trans	-60.5	-48.8	170.3	-174.1	177.4	-147.8	0	0	111.2	D54 E60 S61 D62	D54-E58 WeakPolarHBondContact O-CB 3.46Å; D54-E58 PolarHBondContact O-N 3.04Å; E58-E60 VanDerWaalsContact C-N 3.33Å; E58-E60 PolarHBondContact O-N 2.99Å; E58-S61 WeakPolarHBondContact O-CB 3.46Å; E58-S61 PolarHBondContact O-N 3.15Å; E58-D62 PolarHBondContact O-N 2.82Å
59	I	60.9	Low	64.8	Low	59 Å²	59	81.4 Å²	81.4	30%	0.303	42%	0.415	S	S	.	.	H	α-helix	trans	-61.8	-38.8	176.9	-71.9	167	0	0	0	111.8	I55 F56 L63	I55-I59 HydrophobicContact CG2-CD1 3.94Å; I55-I59 WeakPolarHBondContact O-CB 3.47Å; I55-I59 WeakPolarHBondContact O-CD1 3.43Å; I55-I59 VanDerWaalsContact O-CG1 3.22Å; I55-I59 WeakPolarHBondContact O-CG1 3.37Å; I55-I59 PolarHBondContact O-N 3.43Å; F56-I59 PolarHBondContact O-N 3.42Å; I59-L63 WeakPolarHBondContact O-CB 3.29Å; I59-L63 PolarHBondContact O-N 3.06Å
60	E	64.3	Low	65.2	Low	105 Å²	105	80.2 Å²	80.2	49%	0.491	41%	0.409	S	S	.	.	H	α-helix	trans	-70.6	-38.7	178.7	-169	156.7	-140.4	0	0	111.5	F56 E57 E58 L63 V64 L131	F56-E60 WeakPolarHBondContact O-CB 3.32Å; F56-E60 PolarHBondContact O-N 3.35Å; E57-E60 PolarHBondContact O-N 2.89Å; E58-E60 VanDerWaalsContact C-N 3.33Å; E58-E60 PolarHBondContact O-N 2.99Å; E60-L63 WeakPolarHBondContact O-CB 3.39Å; E60-L63 PolarHBondContact O-N 3.49Å; E60-V64 WeakPolarHBondContact O-CG2 3.34Å; E60-V64 PolarHBondContact O-N 3.08Å; E60-L131 HydrophobicContact CB-CD1 4.49Å
61	S	69.2	Low	65.9	Low	80 Å²	80	79.5 Å²	79.5	56%	0.559	41%	0.408	S	S	*	.	H	α-helix	trans	-61.1	-45.9	171.2	-174	0	0	0	0	112.4	E57 E58 L63 V64 H65	E57-S61 VanDerWaalsContact O-CB 3.31Å; E57-S61 WeakPolarHBondContact O-CB 3.5Å; E57-S61 PolarHBondContact O-N 3.2Å; E58-S61 WeakPolarHBondContact O-CB 3.46Å; E58-S61 PolarHBondContact O-N 3.15Å; S61-L63 VanDerWaalsContact C-N 3.28Å; S61-L63 PolarHBondContact O-N 3.22Å; S61-V64 PolarHBondContact O-N 3.2Å; S61-H65 PolarHBondContact O-N 3.38Å
62	D	69.3	Low	66.5	Low	107 Å²	107	81.8 Å²	81.8	57%	0.572	42%	0.416	S	S	*	.	H	α-helix	trans	-63.5	-34.4	176.8	-119.5	12.5	0	0	0	112	E58 T66	E58-D62 PolarHBondContact O-N 2.82Å; D62-T66 VanDerWaalsContact O-CB 3.3Å; D62-T66 WeakPolarHBondContact O-CB 3.49Å; D62-T66 PolarHBondContact O-N 3.24Å; D62-T66 PolarHBondContact O-OG1 3.43Å
63	L	65.1	Low	67.1	Low	12 Å²	12	81 Å²	81	6%	0.063	41%	0.411	C	S	.	.	H	α-helix	trans	-65.3	-47.2	174.4	-144.3	171.4	0	0	0	110.8	I59 E60 S61 T66 E67 Y124 V127 L131	I59-L63 WeakPolarHBondContact O-CB 3.29Å; I59-L63 PolarHBondContact O-N 3.06Å; E60-L63 WeakPolarHBondContact O-CB 3.39Å; E60-L63 PolarHBondContact O-N 3.49Å; S61-L63 VanDerWaalsContact C-N 3.28Å; S61-L63 PolarHBondContact O-N 3.22Å; L63-T66 PolarHBondContact O-N 3.27Å; L63-E67 PolarHBondContact O-N 2.9Å; L63-Y124 HydrophobicContact CD2-CD2 4.04Å; L63-Y124 HydrophobicContact CD2-CE2 3.6Å; L63-V127 HydrophobicContact CD1-CG1 3.76Å; L63-V127 HydrophobicContact CG-CG1 3.76Å; L63-L131 HydrophobicContact CD1-CB 4.07Å; L63-L131 HydrophobicContact CD1-CD1 4.08Å; L63-L131 HydrophobicContact CD1-CD2 3.89Å; L63-L131 HydrophobicContact CD1-CG 4.23Å
64	V	71.6	Confident	67.7	Low	79 Å²	79	82 Å²	82	48%	0.479	41%	0.411	S	S	.	.	H	α-helix	trans	-63.7	-40.7	175.5	171.5	0	0	0	0	111.6	E60 S61 T66 E67 N68	E60-V64 WeakPolarHBondContact O-CG2 3.34Å; E60-V64 PolarHBondContact O-N 3.08Å; S61-V64 PolarHBondContact O-N 3.2Å; V64-T66 VanDerWaalsContact C-N 3.34Å; V64-T66 PolarHBondContact O-N 3.03Å; V64-E67 PolarHBondContact O-N 3.4Å; V64-N68 PolarHBondContact O-N 2.86Å; V64-N68 PolarHBondContact O-ND2 3.27Å
65	H	72.4	Confident	68.2	Low	100 Å²	100	88 Å²	88	46%	0.463	43%	0.428	S	S	.	.	H	α-helix	trans	-61.8	-43.7	173.7	-177.3	74.8	0	0	0	111.2	S61 N68 K69	S61-H65 PolarHBondContact O-N 3.38Å; H65-N68 PolarHBondContact O-N 2.91Å; H65-K69 PolarHBondContact NE2-NZ 2.84Å; H65-K69 WeakPolarHBondContact O-CB 3.37Å; H65-K69 PolarHBondContact O-N 3.49Å
66	T	66.2	Low	68.6	Low	50 Å²	50	87.8 Å²	87.8	31%	0.307	43%	0.431	S	S	.	.	H	α-helix	trans	-64.7	-41.8	178.2	-58.9	0	0	0	0	112	D62 L63 V64 K69 I70	D62-T66 VanDerWaalsContact O-CB 3.3Å; D62-T66 WeakPolarHBondContact O-CB 3.49Å; D62-T66 PolarHBondContact O-N 3.24Å; D62-T66 PolarHBondContact O-OG1 3.43Å; L63-T66 PolarHBondContact O-N 3.27Å; V64-T66 VanDerWaalsContact C-N 3.34Å; V64-T66 PolarHBondContact O-N 3.03Å; T66-K69 WeakPolarHBondContact O-CB 3.44Å; T66-K69 PolarHBondContact O-N 2.72Å; T66-I70 HydrophobicContact CG2-CD1 4.28Å; T66-I70 WeakPolarHBondContact O-CG1 3.41Å; T66-I70 PolarHBondContact O-N 3.35Å
67	E	68.1	Low	69	Low	78 Å²	78	87.2 Å²	87.2	36%	0.364	43%	0.431	S	S	.	.	H	α-helix	trans	-64.7	-42.3	176.9	-176.4	164.2	-148.2	0	0	112.2	L63 V64 K69 I70 H71 Y124	L63-E67 PolarHBondContact O-N 2.9Å; V64-E67 PolarHBondContact O-N 3.4Å; E67-K69 VanDerWaalsContact C-N 3.32Å; E67-K69 PolarHBondContact O-N 3.23Å; E67-I70 WeakPolarHBondContact O-CB 3.46Å; E67-I70 PolarHBondContact O-N 3.38Å; E67-H71 PolarHBondContact O-N 3.42Å; E67-Y124 HydrophobicContact CB-CE2 4.46Å
68	N	74.3	Confident	69	Low	97 Å²	97	90.1 Å²	90.1	52%	0.519	44%	0.438	S	S	.	.	H	α-helix	trans	-58.9	-43.2	172.3	-79.3	-62.7	0	0	0	111.8	V64 H65 I70 H71 E72	V64-N68 PolarHBondContact O-N 2.86Å; V64-N68 PolarHBondContact O-ND2 3.27Å; H65-N68 PolarHBondContact O-N 2.91Å; N68-I70 VanDerWaalsContact C-N 3.35Å; N68-I70 PolarHBondContact O-N 3.04Å; N68-H71 WeakPolarHBondContact O-CA 3.4Å; N68-H71 WeakPolarHBondContact O-CB 3.34Å; N68-H71 PolarHBondContact O-N 3.35Å; N68-E72 PolarHBondContact O-N 2.93Å
69	K	73.3	Confident	69.1	Low	115 Å²	115	87.6 Å²	87.6	50%	0.5	43%	0.432	S	S	.	.	H	α-helix	trans	-62.5	-38.4	176.7	-137.4	166.5	-161.9	150.2	0	112.7	H65 T66 E67 T73	H65-K69 PolarHBondContact NE2-NZ 2.84Å; H65-K69 WeakPolarHBondContact O-CB 3.37Å; H65-K69 PolarHBondContact O-N 3.49Å; T66-K69 WeakPolarHBondContact O-CB 3.44Å; T66-K69 PolarHBondContact O-N 2.72Å; E67-K69 VanDerWaalsContact C-N 3.32Å; E67-K69 PolarHBondContact O-N 3.23Å; K69-T73 WeakPolarHBondContact O-CB 3.48Å; K69-T73 PolarHBondContact O-N 3.04Å; K69-T73 PolarHBondContact O-OG1 3.3Å
70	I	66.7	Low	69	Low	13 Å²	13	87.2 Å²	87.2	7%	0.067	43%	0.43	C	S	.	.	H	α-helix	trans	-63.8	-42.9	171.2	-68.7	166	0	0	0	110.2	T66 E67 N68 T73 R74 T120 Y124	T66-I70 HydrophobicContact CG2-CD1 4.28Å; T66-I70 WeakPolarHBondContact O-CG1 3.41Å; T66-I70 PolarHBondContact O-N 3.35Å; E67-I70 WeakPolarHBondContact O-CB 3.46Å; E67-I70 PolarHBondContact O-N 3.38Å; N68-I70 VanDerWaalsContact C-N 3.35Å; N68-I70 PolarHBondContact O-N 3.04Å; I70-T73 PolarHBondContact O-N 3.48Å; I70-R74 HydrophobicContact CG2-CG 4.39Å; I70-R74 VanDerWaalsContact CG2-CZ 3.4Å; I70-R74 WeakPolarHBondContact O-CB 3.32Å; I70-R74 VanDerWaalsContact O-CG 3.29Å; I70-R74 WeakPolarHBondContact O-CG 3.46Å; I70-R74 PolarHBondContact O-N 2.98Å; I70-T120 HydrophobicContact CD1-CG2 3.96Å; I70-T120 HydrophobicContact CG1-CG2 3.69Å; I70-Y124 HydrophobicContact CD1-CD2 4.19Å; I70-Y124 HydrophobicContact CD1-CG 4.3Å
71	H	72.4	Confident	68.8	Low	102 Å²	102	83.7 Å²	83.7	47%	0.472	42%	0.422	S	S	.	.	H	α-helix	trans	-63.5	-43.8	178.2	-97.6	-89.3	0	0	0	113.1	E67 N68 R74 R75	E67-H71 PolarHBondContact O-N 3.42Å; N68-H71 WeakPolarHBondContact O-CA 3.4Å; N68-H71 WeakPolarHBondContact O-CB 3.34Å; N68-H71 PolarHBondContact O-N 3.35Å; H71-R74 PolarHBondContact O-N 3.31Å; H71-R75 WeakPolarHBondContact O-CB 3.4Å; H71-R75 PolarHBondContact O-N 3.03Å
72	E	73.6	Confident	68.5	Low	131 Å²	131	84.8 Å²	84.8	61%	0.612	42%	0.421	S	S	*	.	H	α-helix	trans	-61.7	-46.2	172.3	-69	-166.1	126.9	0	0	111.9	N68 R74 R75 T76	N68-E72 PolarHBondContact O-N 2.93Å; E72-R74 VanDerWaalsContact C-N 3.34Å; E72-R74 PolarHBondContact O-N 3.41Å; E72-R75 WeakPolarHBondContact O-CA 3.43Å; E72-R75 VanDerWaalsContact O-CB 3.23Å; E72-R75 WeakPolarHBondContact O-CB 3.22Å; E72-R75 PolarHBondContact O-N 3.44Å; E72-T76 PolarHBondContact O-N 3.18Å; E72-T76 PolarHBondContact O-OG1 3.18Å
73	T	68.3	Low	67.9	Low	53 Å²	53	84.8 Å²	84.8	33%	0.325	42%	0.418	S	S	.	.	H	α-helix	trans	-60.8	-42	179.6	-55.5	0	0	0	0	111.7	K69 I70 R75 T76 V77 I117	K69-T73 WeakPolarHBondContact O-CB 3.48Å; K69-T73 PolarHBondContact O-N 3.04Å; K69-T73 PolarHBondContact O-OG1 3.3Å; I70-T73 PolarHBondContact O-N 3.48Å; T73-R75 VanDerWaalsContact C-N 3.33Å; T73-R75 PolarHBondContact O-N 2.84Å; T73-T76 PolarHBondContact O-N 2.9Å; T73-V77 PolarHBondContact O-N 3.13Å; T73-I117 HydrophobicContact CG2-CD1 4.12Å; T73-I117 HydrophobicContact CG2-CG1 3.89Å
74	R	71.3	Confident	67.4	Low	88 Å²	88	86.6 Å²	86.6	33%	0.332	43%	0.425	S	S	.	.	H	α-helix	trans	-61	-39.7	172.5	-74	171.7	179.8	160.9	2.1	111.8	I70 H71 E72 V77 Y78	I70-R74 HydrophobicContact CG2-CG 4.39Å; I70-R74 VanDerWaalsContact CG2-CZ 3.4Å; I70-R74 WeakPolarHBondContact O-CB 3.32Å; I70-R74 VanDerWaalsContact O-CG 3.29Å; I70-R74 WeakPolarHBondContact O-CG 3.46Å; I70-R74 PolarHBondContact O-N 2.98Å; H71-R74 PolarHBondContact O-N 3.31Å; E72-R74 VanDerWaalsContact C-N 3.34Å; E72-R74 PolarHBondContact O-N 3.41Å; R74-V77 PolarHBondContact O-N 3.21Å; R74-Y78 PolarHBondContact O-N 2.84Å
75	R	73.3	Confident	66.5	Low	193 Å²	193	88.8 Å²	88.8	73%	0.728	43%	0.434	S	S	*	.	H	α-helix	trans	-62.4	-45.8	177	-150.7	179.3	-156.9	160.7	5.5	111.4	H71 E72 T73 V77 Y78 T79	H71-R75 WeakPolarHBondContact O-CB 3.4Å; H71-R75 PolarHBondContact O-N 3.03Å; E72-R75 WeakPolarHBondContact O-CA 3.43Å; E72-R75 VanDerWaalsContact O-CB 3.23Å; E72-R75 WeakPolarHBondContact O-CB 3.22Å; E72-R75 PolarHBondContact O-N 3.44Å; T73-R75 VanDerWaalsContact C-N 3.33Å; T73-R75 PolarHBondContact O-N 2.84Å; R75-V77 PolarHBondContact O-N 3.22Å; R75-Y78 WeakPolarHBondContact O-CB 3.48Å; R75-Y78 PolarHBondContact O-N 2.71Å; R75-T79 PolarHBondContact O-N 3.47Å; R75-T79 PolarHBondContact O-OG1 2.89Å
76	T	70.5	Confident	65.5	Low	82 Å²	82	93.8 Å²	93.8	50%	0.503	45%	0.449	S	S	.	.	H	α-helix	trans	-63.3	-40.1	177.2	-56.9	0	0	0	0	112.2	E72 T73 T79 L80	E72-T76 PolarHBondContact O-N 3.18Å; E72-T76 PolarHBondContact O-OG1 3.18Å; T73-T76 PolarHBondContact O-N 2.9Å; T76-T79 PolarHBondContact O-N 3.42Å; T76-L80 HydrophobicContact CG2-CD1 4.31Å; T76-L80 PolarHBondContact O-N 3.36Å
77	V	64	Low	64.7	Low	35 Å²	35	96.3 Å²	96.3	21%	0.212	46%	0.46	C	S	.	.	H	α-helix	trans	-66.1	-36	174.3	169.1	0	0	0	0	112.3	T73 R74 R75 L80 G81 L113 I117	T73-V77 PolarHBondContact O-N 3.13Å; R74-V77 PolarHBondContact O-N 3.21Å; R75-V77 PolarHBondContact O-N 3.22Å; V77-L80 PolarHBondContact O-N 3.01Å; V77-G81 PolarHBondContact O-N 2.97Å; V77-L113 HydrophobicContact CG2-CB 4.33Å; V77-L113 HydrophobicContact CG2-CD1 4.4Å; V77-I117 HydrophobicContact CB-CD1 4.46Å; V77-I117 HydrophobicContact CG2-CD1 3.77Å
78	Y	66.9	Low	63.7	Low	181 Å²	181	95.9 Å²	95.9	71%	0.71	48%	0.477	S	S	*	.	H	α-helix	trans	-61.9	-42.1	170.9	-104.5	-77.8	0	0	0	112.3	R74 R75 G81 N82	R74-Y78 PolarHBondContact O-N 2.84Å; R75-Y78 WeakPolarHBondContact O-CB 3.48Å; R75-Y78 PolarHBondContact O-N 2.71Å; Y78-G81 PolarHBondContact O-N 2.95Å; Y78-N82 PolarHBondContact O-N 3.1Å
79	T	69	Low	62.4	Low	79 Å²	79	101.7 Å²	101.7	49%	0.485	49%	0.491	S	S	.	.	H	α-helix	trans	-63.4	-43.7	176.2	-54.3	0	0	0	0	112	R75 T76 N82 Q83	R75-T79 PolarHBondContact O-N 3.47Å; R75-T79 PolarHBondContact O-OG1 2.89Å; T76-T79 PolarHBondContact O-N 3.42Å; T79-N82 PolarHBondContact O-N 3.25Å; T79-Q83 WeakPolarHBondContact O-CG 3.32Å; T79-Q83 PolarHBondContact O-N 3.32Å
80	L	58.7	Low	61.1	Low	52 Å²	52	103.8 Å²	103.8	27%	0.272	50%	0.501	S	S	.	.	H	α-helix	trans	-65.6	-38.9	175.4	-77.1	163.8	0	0	0	112.4	T76 V77 N82 Q83 F84 L113	T76-L80 HydrophobicContact CG2-CD1 4.31Å; T76-L80 PolarHBondContact O-N 3.36Å; V77-L80 PolarHBondContact O-N 3.01Å; L80-N82 PolarHBondContact O-N 3.15Å; L80-Q83 WeakPolarHBondContact O-CB 3.42Å; L80-Q83 PolarHBondContact O-N 3.02Å; L80-Q83 VanDerWaalsContact O-N 3.1Å; L80-F84 PolarHBondContact O-N 3.08Å; L80-L113 HydrophobicContact CD1-CD1 3.8Å
81	G	61.2	Low	60.1	Low	30 Å²	30	108.1 Å²	108.1	31%	0.309	53%	0.531	S	S	.	.	H	α-helix	trans	-58.4	-46.6	173.4	0	0	0	0	0	112.1	V77 Y78 Q83 F84 D85	V77-G81 PolarHBondContact O-N 2.97Å; Y78-G81 PolarHBondContact O-N 2.95Å; G81-Q83 PolarHBondContact O-N 3Å; G81-F84 PolarHBondContact O-N 2.97Å; G81-F84 VanDerWaalsContact O-N 3.13Å; G81-D85 PolarHBondContact O-N 3.47Å
82	N	61.8	Low	58.9	Low	103 Å²	103	108.4 Å²	108.4	55%	0.551	54%	0.535	S	S	*	.	H	α-helix	trans	-64.7	-21.1	175.3	-74.2	-22.8	0	0	0	113.9	Y78 T79 L80	Y78-N82 PolarHBondContact O-N 3.1Å; T79-N82 PolarHBondContact O-N 3.25Å; L80-N82 PolarHBondContact O-N 3.15Å
83	Q	58.3	Low	57.7	Low	108 Å²	108	109.5 Å²	109.5	51%	0.505	55%	0.546	S	S	.	.	H	α-helix	trans	-80.1	-40.7	171.2	-71.1	174.9	-15.1	0	0	111.4	T79 L80 G81 R86 L87	T79-Q83 WeakPolarHBondContact O-CG 3.32Å; T79-Q83 PolarHBondContact O-N 3.32Å; L80-Q83 WeakPolarHBondContact O-CB 3.42Å; L80-Q83 PolarHBondContact O-N 3.02Å; L80-Q83 VanDerWaalsContact O-N 3.1Å; G81-Q83 PolarHBondContact O-N 3Å; Q83-R86 WeakPolarHBondContact O-CB 3.45Å; Q83-R86 PolarHBondContact O-N 3.36Å; Q83-L87 PolarHBondContact O-N 3.25Å
84	F	53.1	Low	56.9	Low	50 Å²	50	115.6 Å²	115.6	22%	0.219	57%	0.57	C	S	.	*	H	α-helix	trans	-63	-40.6	173.1	-95.6	-83.4	0	0	0	112.7	L80 G81 R86 L87 G88 H103 A106	L80-F84 PolarHBondContact O-N 3.08Å; G81-F84 PolarHBondContact O-N 2.97Å; G81-F84 VanDerWaalsContact O-N 3.13Å; F84-R86 PolarHBondContact O-N 3.13Å; F84-L87 PolarHBondContact O-N 2.76Å; F84-G88 PolarHBondContact O-N 3.26Å; F84-H103 AromaticContact CE1-CD2 3.95Å; F84-A106 HydrophobicContact CE2-CB 3.87Å; F84-A106 HydrophobicContact CZ-CB 3.58Å
85	D	52.6	Low	56	Low	125 Å²	125	113.9 Å²	113.9	67%	0.668	57%	0.567	S	S	*	*	H	α-helix	trans	-64.2	-18.7	175.5	-99.6	22.7	0	0	0	113.7	G81	G81-D85 PolarHBondContact O-N 3.47Å
86	R	53.2	Low	55.2	Low	204 Å²	204	108.8 Å²	108.8	77%	0.77	56%	0.559	S	S	*	*	H	α-helix	trans	-81.8	-33.2	169.8	-73.6	177.9	169.4	-160	-3.2	112.5	Q83 F84	Q83-R86 WeakPolarHBondContact O-CB 3.45Å; Q83-R86 PolarHBondContact O-N 3.36Å; F84-R86 PolarHBondContact O-N 3.13Å
87	L	48.5	Very low	54.8	Low	103 Å²	103	112.9 Å²	112.9	54%	0.539	57%	0.57	S	S	.	*	H	α-helix	trans	-77.8	-34	176.8	-72.9	166.4	0	0	0	112.4	Q83 F84 R89 F90	Q83-L87 PolarHBondContact O-N 3.25Å; F84-L87 PolarHBondContact O-N 2.76Å; L87-R89 PolarHBondContact O-N 3.48Å; L87-F90 PolarHBondContact O-N 3.33Å; L87-F90 VanDerWaalsContact O-N 3.17Å
88	G	46.6	Very low	54.7	Low	69 Å²	69	116 Å²	116	71%	0.711	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	13.2	179.2	0	0	0	0	0	116.4	F84	F84-G88 PolarHBondContact O-N 3.26Å
89	R	47.9	Very low	54.2	Low	219 Å²	219	110.3 Å²	110.3	83%	0.826	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	-5.9	173.2	-63.9	-171.9	179	-133.8	-2.9	113.8	L87	L87-R89 PolarHBondContact O-N 3.48Å
90	F	45.5	Very low	53.7	Low	159 Å²	159	110.4 Å²	110.4	70%	0.697	57%	0.568	S	S	*	*	S	Bend	trans	-99.1	139.2	175.1	-74	-88	0	0	0	111.3	L87 L92	L87-F90 PolarHBondContact O-N 3.33Å; L87-F90 VanDerWaalsContact O-N 3.17Å; F90-L92 PolarHBondContact O-N 2.9Å
91	C	45.1	Very low	54.2	Low	104 Å²	104	114.1 Å²	114.1	70%	0.703	58%	0.582	S	S	*	*			trans	-71.9	128.2	177.3	-65.4	0	0	0	0	110.6	N93	C91-N93 PolarHBondContact O-N 3.01Å
92	L	47.9	Very low	54.3	Low	108 Å²	108	118.7 Å²	118.7	57%	0.565	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-2.3	-172.3	-79	158.6	0	0	0	116.2	F90 I95	F90-L92 PolarHBondContact O-N 2.9Å; L92-I95 HydrophobicContact CD2-CD1 4.28Å
93	N	49.3	Very low	54.4	Low	155 Å²	155	117.2 Å²	117.2	83%	0.829	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-8.4	-170.1	-64.9	2.7	0	0	0	114.5	C91	C91-N93 PolarHBondContact O-N 3.01Å
94	E	50.9	Low	55	Low	180 Å²	180	115.7 Å²	115.7	84%	0.841	58%	0.58	S	S	*	*	S	Bend	trans	-122.6	11.2	-175.7	-61.5	-173.7	157.9	0	0	113.2
95	I	51.3	Low	56	Low	52 Å²	52	118.8 Å²	118.8	27%	0.267	60%	0.595	S	S	.	*			trans	-82.1	126.8	-173.2	-61.6	-177.5	0	0	0	110.4	L92 V99 Q100	L92-I95 HydrophobicContact CD2-CD1 4.28Å; I95-V99 HydrophobicContact CG2-CB 3.63Å; I95-V99 HydrophobicContact CG2-CG1 3.64Å; I95-Q100 HydrophobicContact CG2-CB 4.38Å
96	P	57.2	Low	56.5	Low	86 Å²	86	114.4 Å²	114.4	56%	0.558	58%	0.577	S	S	*	*			trans	-59.4	142.3	176.4	-25.5	35	0	0	0	112.7	V98 V99 Q100	P96-V98 PolarHBondContact O-N 3.37Å; P96-V99 PolarHBondContact O-N 3.49Å; P96-Q100 PolarHBondContact O-N 3.39Å; P96-Q100 VanDerWaalsContact O-N 3.07Å
97	F	62.2	Low	57.2	Low	169 Å²	169	106.9 Å²	106.9	74%	0.741	56%	0.556	S	S	*	*	H	α-helix	trans	-50	-33.1	-175.9	179.8	-102.8	0	0	0	114.7	Q100 K101	F97-Q100 PolarHBondContact O-N 3.35Å; F97-K101 WeakPolarHBondContact O-CB 3.48Å; F97-K101 PolarHBondContact O-N 3.37Å
98	V	62.3	Low	58.4	Low	99 Å²	99	107.2 Å²	107.2	60%	0.6	56%	0.558	S	S	*	*	H	α-helix	trans	-61.8	-48.4	174.6	-179.7	0	0	0	0	111.4	P96 Q100 K101 E102	P96-V98 PolarHBondContact O-N 3.37Å; V98-Q100 VanDerWaalsContact C-N 3.35Å; V98-K101 WeakPolarHBondContact O-CB 3.33Å; V98-K101 PolarHBondContact O-N 2.91Å; V98-E102 PolarHBondContact O-N 2.61Å
99	V	56.5	Low	59.6	Low	63 Å²	63	108.3 Å²	108.3	38%	0.382	55%	0.547	S	S	.	.	H	α-helix	trans	-71.4	-31.9	-179.6	-179.5	0	0	0	0	111	I95 P96 E102 H103	I95-V99 HydrophobicContact CG2-CB 3.63Å; I95-V99 HydrophobicContact CG2-CG1 3.64Å; P96-V99 PolarHBondContact O-N 3.49Å; V99-E102 PolarHBondContact O-N 3.43Å; V99-H103 WeakPolarHBondContact O-CB 3.39Å; V99-H103 PolarHBondContact O-N 2.97Å
100	Q	58.4	Low	60.6	Low	80 Å²	80	99.3 Å²	99.3	37%	0.374	52%	0.516	S	S	.	.	H	α-helix	trans	-68.6	-37.3	172.1	-167.7	158.8	12.7	0	0	111.9	I95 P96 F97 V98 H103 D104	I95-Q100 HydrophobicContact CG2-CB 4.38Å; P96-Q100 PolarHBondContact O-N 3.39Å; P96-Q100 VanDerWaalsContact O-N 3.07Å; F97-Q100 PolarHBondContact O-N 3.35Å; V98-Q100 VanDerWaalsContact C-N 3.35Å; Q100-H103 WeakPolarHBondContact O-CB 3.37Å; Q100-H103 PolarHBondContact O-N 2.71Å; Q100-D104 VanDerWaalsContact O-CG 3.28Å; Q100-D104 PolarHBondContact O-N 2.73Å
101	K	69.1	Low	62	Low	131 Å²	131	95.6 Å²	95.6	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-64.9	-37.7	171.3	-169.9	-179.2	179.3	-174.5	0	112.3	F97 V98 Q105	F97-K101 WeakPolarHBondContact O-CB 3.48Å; F97-K101 PolarHBondContact O-N 3.37Å; V98-K101 WeakPolarHBondContact O-CB 3.33Å; V98-K101 PolarHBondContact O-N 2.91Å; K101-Q105 VanDerWaalsContact O-CB 3.29Å; K101-Q105 WeakPolarHBondContact O-CB 3.36Å; K101-Q105 PolarHBondContact O-N 2.89Å
102	E	61.9	Low	63.3	Low	126 Å²	126	93 Å²	93	59%	0.589	49%	0.492	S	S	*	.	H	α-helix	trans	-65.1	-43.5	171.6	-72.9	-176.4	158	0	0	112.2	V98 V99 D104 Q105 A106	V98-E102 PolarHBondContact O-N 2.61Å; V99-E102 PolarHBondContact O-N 3.43Å; E102-D104 PolarHBondContact O-N 2.73Å; E102-Q105 PolarHBondContact O-N 3.33Å; E102-A106 VanDerWaalsContact O-CB 3.22Å; E102-A106 WeakPolarHBondContact O-CB 3.23Å; E102-A106 PolarHBondContact O-N 2.96Å
103	H	65.2	Low	64.3	Low	72 Å²	72	90.2 Å²	90.2	33%	0.333	48%	0.477	S	S	.	.	H	α-helix	trans	-56.9	-48.9	173.9	168.9	-86.2	0	0	0	111.5	F84 V99 Q100 A106 S107	F84-H103 AromaticContact CE1-CD2 3.95Å; V99-H103 WeakPolarHBondContact O-CB 3.39Å; V99-H103 PolarHBondContact O-N 2.97Å; Q100-H103 WeakPolarHBondContact O-CB 3.37Å; Q100-H103 PolarHBondContact O-N 2.71Å; H103-A106 PolarHBondContact O-N 3.36Å; H103-S107 VanDerWaalsContact O-CB 3.32Å; H103-S107 WeakPolarHBondContact O-CB 3.49Å; H103-S107 PolarHBondContact O-N 3.44Å
104	D	71.4	Confident	65.4	Low	75 Å²	75	90.7 Å²	90.7	40%	0.401	47%	0.468	S	S	.	.	H	α-helix	trans	-69.5	-36.7	-177.9	-66.7	-9.6	0	0	0	111.4	Q100 E102 S107 N108	Q100-D104 VanDerWaalsContact O-CG 3.28Å; Q100-D104 PolarHBondContact O-N 2.73Å; E102-D104 PolarHBondContact O-N 2.73Å; D104-S107 PolarHBondContact O-N 3.29Å; D104-N108 WeakPolarHBondContact O-CB 3.47Å; D104-N108 VanDerWaalsContact O-CG 3.29Å; D104-N108 PolarHBondContact O-N 3.23Å; D104-N108 PolarHBondContact O-ND2 3.36Å
105	Q	72.7	Confident	66.7	Low	115 Å²	115	90 Å²	90	54%	0.537	46%	0.457	S	S	.	.	H	α-helix	trans	-67.3	-38.6	172.6	-172.1	161.5	-14.4	0	0	111.9	K101 E102 N108 N109	K101-Q105 VanDerWaalsContact O-CB 3.29Å; K101-Q105 WeakPolarHBondContact O-CB 3.36Å; K101-Q105 PolarHBondContact O-N 2.89Å; E102-Q105 PolarHBondContact O-N 3.33Å; Q105-N108 PolarHBondContact O-N 3.42Å; Q105-N109 WeakPolarHBondContact O-CB 3.44Å; Q105-N109 PolarHBondContact O-N 3.23Å; Q105-N109 PolarHBondContact O-ND2 3.42Å; Q105-N109 PolarHBondContact O-OD1 3.4Å
106	A	63.2	Low	67.8	Low	34 Å²	34	91.1 Å²	91.1	28%	0.281	46%	0.464	S	S	.	.	H	α-helix	trans	-68.6	-35.1	174.2	0	0	0	0	0	112.5	F84 E102 H103 N109 L110	F84-A106 HydrophobicContact CE2-CB 3.87Å; F84-A106 HydrophobicContact CZ-CB 3.58Å; E102-A106 VanDerWaalsContact O-CB 3.22Å; E102-A106 WeakPolarHBondContact O-CB 3.23Å; E102-A106 PolarHBondContact O-N 2.96Å; H103-A106 PolarHBondContact O-N 3.36Å; A106-N109 PolarHBondContact O-N 3.44Å; A106-L110 WeakPolarHBondContact O-CB 3.42Å; A106-L110 PolarHBondContact O-N 2.99Å
107	S	68.7	Low	68.3	Low	46 Å²	46	89 Å²	89	32%	0.322	45%	0.447	S	S	.	.	H	α-helix	trans	-68.1	-41.6	174	-175.8	0	0	0	0	112	H103 D104 L110 T111	H103-S107 VanDerWaalsContact O-CB 3.32Å; H103-S107 WeakPolarHBondContact O-CB 3.49Å; H103-S107 PolarHBondContact O-N 3.44Å; D104-S107 PolarHBondContact O-N 3.29Å; S107-L110 PolarHBondContact O-N 3.22Å; S107-T111 WeakPolarHBondContact O-CB 3.07Å; S107-T111 PolarHBondContact O-N 3.17Å; S107-T111 PolarHBondContact O-OG1 3.09Å
108	N	73.1	Confident	68.9	Low	109 Å²	109	87.1 Å²	87.1	58%	0.583	44%	0.439	S	S	*	.	H	α-helix	trans	-62.4	-44.2	171.1	-76.3	-48.2	0	0	0	111.5	D104 Q105 L110 T111 A112	D104-N108 WeakPolarHBondContact O-CB 3.47Å; D104-N108 VanDerWaalsContact O-CG 3.29Å; D104-N108 PolarHBondContact O-N 3.23Å; D104-N108 PolarHBondContact O-ND2 3.36Å; Q105-N108 PolarHBondContact O-N 3.42Å; N108-L110 PolarHBondContact O-N 3.39Å; N108-T111 PolarHBondContact O-N 3.03Å; N108-A112 PolarHBondContact O-N 3.13Å
109	N	73	Confident	69.6	Low	92 Å²	92	86.6 Å²	86.6	49%	0.492	43%	0.428	S	S	.	.	H	α-helix	trans	-60.9	-42.9	173.9	-71.6	-16.7	0	0	0	112.1	Q105 A106 T111 A112 L113	Q105-N109 WeakPolarHBondContact O-CB 3.44Å; Q105-N109 PolarHBondContact O-N 3.23Å; Q105-N109 PolarHBondContact O-ND2 3.42Å; Q105-N109 PolarHBondContact O-OD1 3.4Å; A106-N109 PolarHBondContact O-N 3.44Å; N109-T111 VanDerWaalsContact C-N 3.29Å; N109-T111 PolarHBondContact O-N 3.44Å; N109-A112 PolarHBondContact O-N 3.27Å; N109-L113 WeakPolarHBondContact O-CB 3.45Å; N109-L113 VanDerWaalsContact O-CG 3.31Å; N109-L113 WeakPolarHBondContact O-CG 3.11Å; N109-L113 PolarHBondContact O-N 3.16Å
110	L	68.9	Low	70.1	Confident	31 Å²	31	85.8 Å²	85.8	16%	0.162	42%	0.424	C	S	.	.	H	α-helix	trans	-62.1	-38.2	175.9	-165.5	81.3	0	0	0	111.5	A106 S107 N108 L113 R114	A106-L110 WeakPolarHBondContact O-CB 3.42Å; A106-L110 PolarHBondContact O-N 2.99Å; S107-L110 PolarHBondContact O-N 3.22Å; N108-L110 PolarHBondContact O-N 3.39Å; L110-L113 PolarHBondContact O-N 2.84Å; L110-R114 WeakPolarHBondContact O-CB 3.38Å; L110-R114 VanDerWaalsContact O-CG 3.29Å; L110-R114 WeakPolarHBondContact O-CG 3.44Å; L110-R114 PolarHBondContact O-N 3.42Å
111	T	73.3	Confident	70.6	Confident	80 Å²	80	85.5 Å²	85.5	49%	0.491	42%	0.423	S	S	.	.	H	α-helix	trans	-69.4	-43.2	177.8	-58.3	0	0	0	0	111.4	S107 N108 N109 R114 W115	S107-T111 WeakPolarHBondContact O-CB 3.07Å; S107-T111 PolarHBondContact O-N 3.17Å; S107-T111 PolarHBondContact O-OG1 3.09Å; N108-T111 PolarHBondContact O-N 3.03Å; N109-T111 VanDerWaalsContact C-N 3.29Å; N109-T111 PolarHBondContact O-N 3.44Å; T111-R114 PolarHBondContact O-N 3.21Å; T111-W115 PolarHBondContact O-N 3.41Å
112	A	73.4	Confident	70.9	Confident	50 Å²	50	83.4 Å²	83.4	41%	0.413	42%	0.415	S	S	.	.	H	α-helix	trans	-62.8	-41.6	172.9	0	0	0	0	0	112.3	N108 N109 W115 N116	N108-A112 PolarHBondContact O-N 3.13Å; N109-A112 PolarHBondContact O-N 3.27Å; A112-W115 PolarHBondContact O-N 2.9Å; A112-N116 WeakPolarHBondContact O-CB 3.48Å; A112-N116 PolarHBondContact O-N 3.31Å
113	L	68.7	Low	71.3	Confident	49 Å²	49	81.1 Å²	81.1	26%	0.257	40%	0.404	S	S	.	.	H	α-helix	trans	-63	-42.2	174.5	-76.7	167.1	0	0	0	112.2	V77 L80 N109 L110 W115 N116 I117	V77-L113 HydrophobicContact CG2-CB 4.33Å; V77-L113 HydrophobicContact CG2-CD1 4.4Å; L80-L113 HydrophobicContact CD1-CD1 3.8Å; N109-L113 WeakPolarHBondContact O-CB 3.45Å; N109-L113 VanDerWaalsContact O-CG 3.31Å; N109-L113 WeakPolarHBondContact O-CG 3.11Å; N109-L113 PolarHBondContact O-N 3.16Å; L110-L113 PolarHBondContact O-N 2.84Å; L113-W115 VanDerWaalsContact C-N 3.35Å; L113-W115 PolarHBondContact O-N 2.91Å; L113-N116 PolarHBondContact O-N 3.25Å; L113-I117 WeakPolarHBondContact O-CB 3.36Å; L113-I117 WeakPolarHBondContact O-CG1 3.41Å; L113-I117 PolarHBondContact O-N 2.9Å
114	R	71.8	Confident	71.5	Confident	166 Å²	166	80 Å²	80	63%	0.626	40%	0.397	S	S	*	.	H	α-helix	trans	-61.8	-41	174.1	-76.9	172.3	175.5	-174.1	-0.3	112.1	L110 T111 K118	L110-R114 WeakPolarHBondContact O-CB 3.38Å; L110-R114 VanDerWaalsContact O-CG 3.29Å; L110-R114 WeakPolarHBondContact O-CG 3.44Å; L110-R114 PolarHBondContact O-N 3.42Å; T111-R114 PolarHBondContact O-N 3.21Å; R114-K118 PolarHBondContact O-N 3.14Å; R114-K118 VanDerWaalsContact O-N 3.08Å
115	W	78.2	Confident	71.6	Confident	164 Å²	164	80.3 Å²	80.3	62%	0.621	40%	0.399	S	S	*	.	H	α-helix	trans	-66.2	-45.3	176	-175.6	89.2	0	0	0	112	T111 A112 L113 K118 K119	T111-W115 PolarHBondContact O-N 3.41Å; A112-W115 PolarHBondContact O-N 2.9Å; L113-W115 VanDerWaalsContact C-N 3.35Å; L113-W115 PolarHBondContact O-N 2.91Å; W115-K118 WeakPolarHBondContact O-CB 3.31Å; W115-K118 PolarHBondContact O-N 2.86Å; W115-K119 HydrophobicContact CH2-CD 3.74Å; W115-K119 HydrophobicContact CZ2-CD 4.43Å; W115-K119 HydrophobicContact CZ3-CD 3.89Å; W115-K119 PolarHBondContact O-N 3Å
116	N	73.9	Confident	71.7	Confident	76 Å²	76	81.3 Å²	81.3	41%	0.406	40%	0.402	S	S	.	.	H	α-helix	trans	-59.1	-48	175.1	-78.5	-22.2	0	0	0	111.8	A112 L113 K118 K119 T120	A112-N116 WeakPolarHBondContact O-CB 3.48Å; A112-N116 PolarHBondContact O-N 3.31Å; L113-N116 PolarHBondContact O-N 3.25Å; N116-K118 VanDerWaalsContact C-N 3.29Å; N116-K118 PolarHBondContact O-N 3.07Å; N116-K119 PolarHBondContact O-N 3.21Å; N116-K119 VanDerWaalsContact O-N 3.13Å; N116-T120 PolarHBondContact O-N 3.21Å; N116-T120 PolarHBondContact O-OG1 3.11Å; N116-T120 VanDerWaalsContact O-OG1 3.1Å
117	I	68.8	Low	71.9	Confident	41 Å²	41	82.3 Å²	82.3	21%	0.21	40%	0.404	C	S	.	.	H	α-helix	trans	-57.4	-42.5	176	-73.5	170.7	0	0	0	111.2	T73 V77 L113 Q121	T73-I117 HydrophobicContact CG2-CD1 4.12Å; T73-I117 HydrophobicContact CG2-CG1 3.89Å; V77-I117 HydrophobicContact CB-CD1 4.46Å; V77-I117 HydrophobicContact CG2-CD1 3.77Å; L113-I117 WeakPolarHBondContact O-CB 3.36Å; L113-I117 WeakPolarHBondContact O-CG1 3.41Å; L113-I117 PolarHBondContact O-N 2.9Å; I117-Q121 VanDerWaalsContact O-CB 3.29Å; I117-Q121 WeakPolarHBondContact O-CB 3.33Å; I117-Q121 PolarHBondContact O-N 3.13Å
118	K	75.6	Confident	71.8	Confident	130 Å²	130	83.8 Å²	83.8	57%	0.565	41%	0.405	S	S	*	.	H	α-helix	trans	-61.5	-47.3	175.9	-167.6	-171.8	-178	-119.4	0	111.3	R114 W115 N116 Q121 E122	R114-K118 PolarHBondContact O-N 3.14Å; R114-K118 VanDerWaalsContact O-N 3.08Å; W115-K118 WeakPolarHBondContact O-CB 3.31Å; W115-K118 PolarHBondContact O-N 2.86Å; N116-K118 VanDerWaalsContact C-N 3.29Å; N116-K118 PolarHBondContact O-N 3.07Å; K118-Q121 PolarHBondContact O-N 3.37Å; K118-E122 WeakPolarHBondContact CE-OE1 3.5Å; K118-E122 IonicContact NZ-OE1 2.67Å; K118-E122 PolarHBondContact NZ-OE1 3.39Å; K118-E122 WeakPolarHBondContact O-CG 3.31Å; K118-E122 PolarHBondContact O-N 3Å
119	K	76.4	Confident	71.8	Confident	88 Å²	88	83.1 Å²	83.1	38%	0.383	41%	0.405	S	S	.	.	H	α-helix	trans	-60.3	-49	178.7	-176.7	177.1	-178.1	-76.5	0	111.9	W115 N116 Q121 E122 E123	W115-K119 HydrophobicContact CH2-CD 3.74Å; W115-K119 HydrophobicContact CZ2-CD 4.43Å; W115-K119 HydrophobicContact CZ3-CD 3.89Å; W115-K119 PolarHBondContact O-N 3Å; N116-K119 PolarHBondContact O-N 3.21Å; N116-K119 VanDerWaalsContact O-N 3.13Å; K119-Q121 VanDerWaalsContact C-N 3.27Å; K119-Q121 PolarHBondContact O-N 3.44Å; K119-E122 PolarHBondContact O-N 3.29Å; K119-E123 WeakPolarHBondContact CE-OE1 3.4Å; K119-E123 IonicContact NZ-OE1 2.67Å; K119-E123 PolarHBondContact NZ-OE1 2.91Å; K119-E123 IonicContact NZ-OE2 3.85Å; K119-E123 WeakPolarHBondContact O-CG 3.46Å; K119-E123 PolarHBondContact O-N 2.87Å
120	T	66.5	Low	71.6	Confident	47 Å²	47	86.1 Å²	86.1	29%	0.288	41%	0.409	S	S	.	.	H	α-helix	trans	-65.4	-30.6	178.7	-50.5	0	0	0	0	111.9	I70 N116 E123 Y124	I70-T120 HydrophobicContact CD1-CG2 3.96Å; I70-T120 HydrophobicContact CG1-CG2 3.69Å; N116-T120 PolarHBondContact O-N 3.21Å; N116-T120 PolarHBondContact O-OG1 3.11Å; N116-T120 VanDerWaalsContact O-OG1 3.1Å; T120-E123 PolarHBondContact O-N 3.43Å; T120-Y124 WeakPolarHBondContact O-CB 3.41Å; T120-Y124 PolarHBondContact O-N 3.39Å
121	Q	68.8	Low	71.6	Confident	74 Å²	74	86.7 Å²	86.7	35%	0.346	41%	0.412	S	S	.	.	H	α-helix	trans	-76.8	-30.6	174.4	-166.6	141.4	-10.9	0	0	113	I117 K118 K119 N125	I117-Q121 VanDerWaalsContact O-CB 3.29Å; I117-Q121 WeakPolarHBondContact O-CB 3.33Å; I117-Q121 PolarHBondContact O-N 3.13Å; K118-Q121 PolarHBondContact O-N 3.37Å; K119-Q121 VanDerWaalsContact C-N 3.27Å; K119-Q121 PolarHBondContact O-N 3.44Å; Q121-N125 WeakPolarHBondContact O-CB 3.39Å; Q121-N125 PolarHBondContact O-N 3.17Å; Q121-N125 PolarHBondContact O-ND2 3.05Å
122	E	76.6	Confident	71.5	Confident	86 Å²	86	91.1 Å²	91.1	40%	0.402	42%	0.42	S	S	.	.	H	α-helix	trans	-68	-33.6	167.5	-72.6	175.5	-163.4	0	0	112.1	K118 K119 K126	K118-E122 WeakPolarHBondContact CE-OE1 3.5Å; K118-E122 IonicContact NZ-OE1 2.67Å; K118-E122 PolarHBondContact NZ-OE1 3.39Å; K118-E122 WeakPolarHBondContact O-CG 3.31Å; K118-E122 PolarHBondContact O-N 3Å; K119-E122 PolarHBondContact O-N 3.29Å; E122-K126 WeakPolarHBondContact O-CG 3.41Å; E122-K126 PolarHBondContact O-N 3.15Å
123	E	69.4	Low	71.3	Confident	79 Å²	79	91.6 Å²	91.6	37%	0.369	42%	0.421	S	S	.	.	H	α-helix	trans	-69.6	-48.9	172.1	-73.4	163.8	174.4	0	0	111.4	K119 T120 N125 K126 V127	K119-E123 WeakPolarHBondContact CE-OE1 3.4Å; K119-E123 IonicContact NZ-OE1 2.67Å; K119-E123 PolarHBondContact NZ-OE1 2.91Å; K119-E123 IonicContact NZ-OE2 3.85Å; K119-E123 WeakPolarHBondContact O-CG 3.46Å; K119-E123 PolarHBondContact O-N 2.87Å; T120-E123 PolarHBondContact O-N 3.43Å; E123-N125 VanDerWaalsContact C-N 3.32Å; E123-N125 PolarHBondContact O-N 3.39Å; E123-K126 WeakPolarHBondContact O-CB 3.09Å; E123-K126 PolarHBondContact O-N 3Å; E123-V127 PolarHBondContact O-N 2.93Å
124	Y	69.3	Low	71.1	Confident	47 Å²	47	91.3 Å²	91.3	18%	0.184	42%	0.419	C	S	.	.	H	α-helix	trans	-52.4	-47.4	173	173.6	-90.4	0	0	0	111.9	L63 E67 I70 T120 K126 V127 F128	L63-Y124 HydrophobicContact CD2-CD2 4.04Å; L63-Y124 HydrophobicContact CD2-CE2 3.6Å; E67-Y124 HydrophobicContact CB-CE2 4.46Å; I70-Y124 HydrophobicContact CD1-CD2 4.19Å; I70-Y124 HydrophobicContact CD1-CG 4.3Å; T120-Y124 WeakPolarHBondContact O-CB 3.41Å; T120-Y124 PolarHBondContact O-N 3.39Å; Y124-K126 VanDerWaalsContact C-N 3.27Å; Y124-K126 PolarHBondContact O-N 3.39Å; Y124-V127 PolarHBondContact O-N 3.01Å; Y124-V127 VanDerWaalsContact O-N 3.17Å; Y124-F128 HydrophobicContact CE1-CB 4.29Å; Y124-F128 WeakPolarHBondContact O-CB 3.47Å; Y124-F128 PolarHBondContact O-N 2.86Å
125	N	73.6	Confident	70.9	Confident	83 Å²	83	86.1 Å²	86.1	44%	0.444	41%	0.412	S	S	.	.	H	α-helix	trans	-61.3	-33.8	178.6	-74.2	-16.2	0	0	0	112.8	Q121 E123 T129	Q121-N125 WeakPolarHBondContact O-CB 3.39Å; Q121-N125 PolarHBondContact O-N 3.17Å; Q121-N125 PolarHBondContact O-ND2 3.05Å; E123-N125 VanDerWaalsContact C-N 3.32Å; E123-N125 PolarHBondContact O-N 3.39Å; N125-T129 WeakPolarHBondContact O-CB 3.29Å; N125-T129 PolarHBondContact O-N 2.92Å; N125-T129 PolarHBondContact O-OG1 2.85Å
126	K	74.6	Confident	70.5	Confident	135 Å²	135	81.4 Å²	81.4	59%	0.587	41%	0.407	S	S	*	.	H	α-helix	trans	-69.8	-43.5	174.5	-70.6	164.7	-176.1	168.7	0	111.6	E122 E123 Y124 T129 R130	E122-K126 WeakPolarHBondContact O-CG 3.41Å; E122-K126 PolarHBondContact O-N 3.15Å; E123-K126 WeakPolarHBondContact O-CB 3.09Å; E123-K126 PolarHBondContact O-N 3Å; Y124-K126 VanDerWaalsContact C-N 3.27Å; Y124-K126 PolarHBondContact O-N 3.39Å; K126-T129 PolarHBondContact O-N 3.34Å; K126-R130 PolarHBondContact O-N 3.42Å
127	V	66.5	Low	70.3	Confident	55 Å²	55	80 Å²	80	33%	0.333	40%	0.402	S	S	.	.	H	α-helix	trans	-68.2	-42.9	178.2	-173.5	0	0	0	0	110.8	L63 E123 Y124 T129 R130 L131	L63-V127 HydrophobicContact CD1-CG1 3.76Å; L63-V127 HydrophobicContact CG-CG1 3.76Å; E123-V127 PolarHBondContact O-N 2.93Å; Y124-V127 PolarHBondContact O-N 3.01Å; Y124-V127 VanDerWaalsContact O-N 3.17Å; V127-T129 VanDerWaalsContact C-N 3.32Å; V127-T129 PolarHBondContact O-N 3.24Å; V127-R130 CarbonylContact O-C 3.48Å; V127-R130 WeakPolarHBondContact O-CB 3.43Å; V127-R130 PolarHBondContact O-N 3.17Å; V127-R130 VanDerWaalsContact O-N 3.14Å; V127-L131 PolarHBondContact O-N 3.45Å
128	F	68.3	Low	70.4	Confident	77 Å²	77	82.6 Å²	82.6	34%	0.338	41%	0.412	S	S	.	.	H	α-helix	trans	-61.2	-38.1	174.7	-175.8	-94.8	0	0	0	112.7	Y124 L131 R132	Y124-F128 HydrophobicContact CE1-CB 4.29Å; Y124-F128 WeakPolarHBondContact O-CB 3.47Å; Y124-F128 PolarHBondContact O-N 2.86Å; F128-L131 PolarHBondContact O-N 3.38Å; F128-R132 PolarHBondContact O-N 3.42Å
129	T	72.7	Confident	70.4	Confident	95 Å²	95	82.9 Å²	82.9	58%	0.583	41%	0.413	S	S	*	.	H	α-helix	trans	-65.6	-41.7	174.3	-56.6	0	0	0	0	111.2	N125 K126 V127 R132 S133	N125-T129 WeakPolarHBondContact O-CB 3.29Å; N125-T129 PolarHBondContact O-N 2.92Å; N125-T129 PolarHBondContact O-OG1 2.85Å; K126-T129 PolarHBondContact O-N 3.34Å; V127-T129 VanDerWaalsContact C-N 3.32Å; V127-T129 PolarHBondContact O-N 3.24Å; T129-R132 PolarHBondContact O-N 3.38Å; T129-S133 PolarHBondContact O-N 3.15Å; T129-S133 VanDerWaalsContact O-N 3.12Å; T129-S133 PolarHBondContact O-OG 3.05Å
130	R	68.7	Low	70.2	Confident	156 Å²	156	81.3 Å²	81.3	59%	0.589	41%	0.413	S	S	*	.	H	α-helix	trans	-62.2	-44.1	172.4	-78	176.5	162.3	-172.9	-8	112.3	K126 V127 R132 S133 L134	K126-R130 PolarHBondContact O-N 3.42Å; V127-R130 CarbonylContact O-C 3.48Å; V127-R130 WeakPolarHBondContact O-CB 3.43Å; V127-R130 PolarHBondContact O-N 3.17Å; V127-R130 VanDerWaalsContact O-N 3.14Å; R130-R132 VanDerWaalsContact C-N 3.28Å; R130-R132 PolarHBondContact O-N 3.06Å; R130-S133 WeakPolarHBondContact CA-OG 3.5Å; R130-S133 PolarHBondContact O-N 3.33Å; R130-S133 PolarHBondContact O-OG 3.09Å; R130-L134 VanDerWaalsContact O-CB 3.31Å; R130-L134 WeakPolarHBondContact O-CB 3.12Å; R130-L134 WeakPolarHBondContact O-CG 3.32Å; R130-L134 PolarHBondContact O-N 3.07Å
131	L	68.4	Low	70.3	Confident	43 Å²	43	81.9 Å²	81.9	23%	0.225	41%	0.414	C	S	.	.	H	α-helix	trans	-57.8	-42.6	176.5	-168.4	83.9	0	0	0	110.7	E60 L63 V127 F128 L134 A135	E60-L131 HydrophobicContact CB-CD1 4.49Å; L63-L131 HydrophobicContact CD1-CB 4.07Å; L63-L131 HydrophobicContact CD1-CD1 4.08Å; L63-L131 HydrophobicContact CD1-CD2 3.89Å; L63-L131 HydrophobicContact CD1-CG 4.23Å; V127-L131 PolarHBondContact O-N 3.45Å; F128-L131 PolarHBondContact O-N 3.38Å; L131-L134 PolarHBondContact O-N 3.28Å; L131-A135 WeakPolarHBondContact O-CB 3.31Å; L131-A135 PolarHBondContact O-N 3.22Å
132	R	70.8	Confident	70.4	Confident	172 Å²	172	82.7 Å²	82.7	65%	0.649	42%	0.418	S	S	*	.	H	α-helix	trans	-65	-41.2	177	-177.4	176.5	-73.3	177.4	-4.2	113.1	F128 T129 R130 A136	F128-R132 PolarHBondContact O-N 3.42Å; T129-R132 PolarHBondContact O-N 3.38Å; R130-R132 VanDerWaalsContact C-N 3.28Å; R130-R132 PolarHBondContact O-N 3.06Å; R132-A136 PolarHBondContact O-N 3.13Å
133	S	69.3	Low	70.4	Confident	61 Å²	61	82.9 Å²	82.9	43%	0.427	42%	0.421	S	S	.	.	H	α-helix	trans	-67.4	-43.2	174.3	52.8	0	0	0	0	111.4	T129 R130 A135 A136 T137	T129-S133 PolarHBondContact O-N 3.15Å; T129-S133 VanDerWaalsContact O-N 3.12Å; T129-S133 PolarHBondContact O-OG 3.05Å; R130-S133 WeakPolarHBondContact CA-OG 3.5Å; R130-S133 PolarHBondContact O-N 3.33Å; R130-S133 PolarHBondContact O-OG 3.09Å; S133-A135 PolarHBondContact O-N 2.84Å; S133-A136 WeakPolarHBondContact O-CB 3.49Å; S133-A136 PolarHBondContact O-N 3.47Å; S133-A136 VanDerWaalsContact O-N 3.12Å; S133-T137 PolarHBondContact O-N 3.23Å; S133-T137 PolarHBondContact O-OG1 3.11Å; S133-T137 VanDerWaalsContact O-OG1 3.05Å
134	L	65.8	Low	70.5	Confident	42 Å²	42	83 Å²	83	22%	0.22	42%	0.422	C	S	.	.	H	α-helix	trans	-60.2	-43.5	177.3	-73.3	167.9	0	0	0	111.8	F56 R130 L131 A136 T137 K138	F56-L134 HydrophobicContact CD1-CB 4.23Å; F56-L134 HydrophobicContact CE1-CB 3.64Å; F56-L134 HydrophobicContact CE1-CD2 4.11Å; F56-L134 HydrophobicContact CE1-CG 4.4Å; F56-L134 WeakPolarHBondContact CE1-O 3.44Å; F56-L134 HydrophobicContact CE2-CD2 3.93Å; F56-L134 HydrophobicContact CZ-CB 4.04Å; F56-L134 HydrophobicContact CZ-CD2 3.61Å; F56-L134 HydrophobicContact CZ-CG 4.38Å; R130-L134 VanDerWaalsContact O-CB 3.31Å; R130-L134 WeakPolarHBondContact O-CB 3.12Å; R130-L134 WeakPolarHBondContact O-CG 3.32Å; R130-L134 PolarHBondContact O-N 3.07Å; L131-L134 PolarHBondContact O-N 3.28Å; L134-A136 VanDerWaalsContact C-N 3.3Å; L134-A136 PolarHBondContact O-N 3.48Å; L134-T137 WeakPolarHBondContact O-CB 3.47Å; L134-T137 PolarHBondContact O-N 2.95Å; L134-T137 VanDerWaalsContact O-N 3.14Å; L134-K138 PolarHBondContact O-N 2.89Å
135	A	66.2	Low	70.4	Confident	58 Å²	58	83.6 Å²	83.6	48%	0.479	43%	0.427	S	S	.	.	H	α-helix	trans	-62.9	-33.6	175.3	0	0	0	0	0	112.9	L131 S133 K139	L131-A135 WeakPolarHBondContact O-CB 3.31Å; L131-A135 PolarHBondContact O-N 3.22Å; S133-A135 PolarHBondContact O-N 2.84Å; A135-K139 PolarHBondContact O-N 3.38Å
136	A	70.4	Confident	70.3	Confident	64 Å²	64	83.3 Å²	83.3	53%	0.529	43%	0.432	S	S	.	.	H	α-helix	trans	-69	-40.9	171.9	0	0	0	0	0	111.7	R132 S133 L134 K139 S140	R132-A136 PolarHBondContact O-N 3.13Å; S133-A136 WeakPolarHBondContact O-CB 3.49Å; S133-A136 PolarHBondContact O-N 3.47Å; S133-A136 VanDerWaalsContact O-N 3.12Å; L134-A136 VanDerWaalsContact C-N 3.3Å; L134-A136 PolarHBondContact O-N 3.48Å; A136-K139 PolarHBondContact O-N 3.23Å; A136-S140 PolarHBondContact O-N 3.16Å
137	T	68.8	Low	70.1	Confident	48 Å²	48	83.4 Å²	83.4	29%	0.294	44%	0.435	S	S	.	.	H	α-helix	trans	-61.8	-45.1	173.8	-44.9	0	0	0	0	111.7	S133 L134 K139 S140 I141	S133-T137 PolarHBondContact O-N 3.23Å; S133-T137 PolarHBondContact O-OG1 3.11Å; S133-T137 VanDerWaalsContact O-OG1 3.05Å; L134-T137 WeakPolarHBondContact O-CB 3.47Å; L134-T137 PolarHBondContact O-N 2.95Å; L134-T137 VanDerWaalsContact O-N 3.14Å; T137-K139 VanDerWaalsContact C-N 3.31Å; T137-K139 PolarHBondContact O-N 3.03Å; T137-S140 WeakPolarHBondContact O-CB 3.47Å; T137-S140 PolarHBondContact O-N 3.35Å; T137-S140 VanDerWaalsContact O-N 3.07Å; T137-I141 HydrophobicContact CG2-CD1 4.09Å; T137-I141 WeakPolarHBondContact O-CG1 3.41Å; T137-I141 PolarHBondContact O-N 3.48Å
138	K	71	Confident	70	Confident	95 Å²	95	85.7 Å²	85.7	41%	0.413	45%	0.445	S	S	.	.	H	α-helix	trans	-53.7	-47.5	174.4	174.9	171.4	176.4	171.4	0	111.2	F56 L134 S140 I141 E142	F56-K138 HydrophobicContact CE1-CB 4.19Å; L134-K138 PolarHBondContact O-N 2.89Å; K138-S140 VanDerWaalsContact C-N 3.32Å; K138-S140 PolarHBondContact O-N 3.47Å; K138-I141 PolarHBondContact O-N 3.28Å; K138-E142 WeakPolarHBondContact CE-OE1 3.45Å; K138-E142 HydrophobicContact CG-CG 4.45Å; K138-E142 WeakPolarHBondContact CG-OE1 3.4Å; K138-E142 WeakPolarHBondContact O-CG 3.41Å; K138-E142 PolarHBondContact O-N 3.09Å
139	K	76.3	Confident	69.9	Low	135 Å²	135	85.9 Å²	85.9	59%	0.587	45%	0.452	S	S	*	.	H	α-helix	trans	-66.6	-28.9	178.2	-169.8	170.6	-177.9	175.9	0	113.9	A135 A136 T137 N143	A135-K139 PolarHBondContact O-N 3.38Å; A136-K139 PolarHBondContact O-N 3.23Å; T137-K139 VanDerWaalsContact C-N 3.31Å; T137-K139 PolarHBondContact O-N 3.03Å; K139-N143 PolarHBondContact O-N 2.99Å
140	S	71.4	Confident	69.6	Low	55 Å²	55	83.1 Å²	83.1	39%	0.385	44%	0.442	S	S	.	.	H	α-helix	trans	-66.1	-50.4	170.5	-157.6	0	0	0	0	110.6	A136 T137 K138 E142 N143 E144	A136-S140 PolarHBondContact O-N 3.16Å; T137-S140 WeakPolarHBondContact O-CB 3.47Å; T137-S140 PolarHBondContact O-N 3.35Å; T137-S140 VanDerWaalsContact O-N 3.07Å; K138-S140 VanDerWaalsContact C-N 3.32Å; K138-S140 PolarHBondContact O-N 3.47Å; S140-E142 VanDerWaalsContact C-N 3.32Å; S140-E142 PolarHBondContact O-N 3.24Å; S140-N143 WeakPolarHBondContact O-CA 3.43Å; S140-N143 WeakPolarHBondContact O-CB 3.4Å; S140-N143 PolarHBondContact O-N 3.1Å; S140-E144 VanDerWaalsContact C-OE1 3.27Å; S140-E144 WeakPolarHBondContact CB-OE1 3.35Å; S140-E144 WeakPolarHBondContact O-CG 3.46Å; S140-E144 PolarHBondContact O-N 3.11Å; S140-E144 PolarHBondContact OG-OE1 3.31Å
141	I	68.5	Low	69.5	Low	59 Å²	59	79.1 Å²	79.1	30%	0.303	44%	0.437	S	S	.	.	H	α-helix	trans	-59.9	-40.5	178.6	-65.4	165.8	0	0	0	111.2	T137 K138 N143 E144 I145	T137-I141 HydrophobicContact CG2-CD1 4.09Å; T137-I141 WeakPolarHBondContact O-CG1 3.41Å; T137-I141 PolarHBondContact O-N 3.48Å; K138-I141 PolarHBondContact O-N 3.28Å; I141-N143 PolarHBondContact O-N 3.28Å; I141-E144 PolarHBondContact O-N 3.36Å; I141-I145 HydrophobicContact CG2-CD1 3.73Å; I141-I145 HydrophobicContact CG2-CG1 4.32Å; I141-I145 WeakPolarHBondContact O-CB 3.37Å; I141-I145 VanDerWaalsContact O-CG1 3.24Å; I141-I145 WeakPolarHBondContact O-CG1 3.36Å; I141-I145 PolarHBondContact O-N 3.31Å
142	E	72.2	Confident	69.3	Low	92 Å²	92	80.6 Å²	80.6	43%	0.43	45%	0.448	S	S	.	.	H	α-helix	trans	-62.4	-39.4	174.8	-73	166.9	170.4	0	0	112.5	K138 S140 S146	K138-E142 WeakPolarHBondContact CE-OE1 3.45Å; K138-E142 HydrophobicContact CG-CG 4.45Å; K138-E142 WeakPolarHBondContact CG-OE1 3.4Å; K138-E142 WeakPolarHBondContact O-CG 3.41Å; K138-E142 PolarHBondContact O-N 3.09Å; S140-E142 VanDerWaalsContact C-N 3.32Å; S140-E142 PolarHBondContact O-N 3.24Å; E142-S146 WeakPolarHBondContact O-CB 3.35Å; E142-S146 PolarHBondContact O-N 3.09Å; E142-S146 VanDerWaalsContact O-N 3.09Å; E142-S146 PolarHBondContact O-OG 3.3Å
143	N	75.9	Confident	69.1	Low	90 Å²	90	75.8 Å²	75.8	48%	0.481	44%	0.441	S	S	.	.	H	α-helix	trans	-68.1	-42.5	173.2	-80.4	-18.2	0	0	0	112	K139 S140 I141 S146 Q147	K139-N143 PolarHBondContact O-N 2.99Å; S140-N143 WeakPolarHBondContact O-CA 3.43Å; S140-N143 WeakPolarHBondContact O-CB 3.4Å; S140-N143 PolarHBondContact O-N 3.1Å; I141-N143 PolarHBondContact O-N 3.28Å; N143-S146 WeakPolarHBondContact O-CB 3.34Å; N143-S146 PolarHBondContact O-N 3.45Å; N143-Q147 WeakPolarHBondContact O-CG 3.27Å; N143-Q147 PolarHBondContact O-N 3.06Å
144	E	71.5	Confident	69.2	Low	80 Å²	80	78.1 Å²	78.1	37%	0.374	45%	0.448	S	S	.	.	H	α-helix	trans	-64.7	-44.6	179	-70.9	155.5	-135.8	0	0	111.3	S140 I141 S146 Q147 L148	S140-E144 VanDerWaalsContact C-OE1 3.27Å; S140-E144 WeakPolarHBondContact CB-OE1 3.35Å; S140-E144 WeakPolarHBondContact O-CG 3.46Å; S140-E144 PolarHBondContact O-N 3.11Å; S140-E144 PolarHBondContact OG-OE1 3.31Å; I141-E144 PolarHBondContact O-N 3.36Å; E144-S146 VanDerWaalsContact C-N 3.29Å; E144-S146 PolarHBondContact O-N 2.94Å; E144-Q147 PolarHBondContact O-N 2.9Å; E144-L148 WeakPolarHBondContact O-CB 3.34Å; E144-L148 WeakPolarHBondContact O-CG 3.45Å; E144-L148 PolarHBondContact O-N 2.98Å
145	I	67.2	Low	69.2	Low	60 Å²	60	80.4 Å²	80.4	31%	0.308	46%	0.463	S	S	.	.	H	α-helix	trans	-58.6	-41.5	171.8	-71.2	168.2	0	0	0	110.7	I49 I141 L148 T149	I49-I145 HydrophobicContact CD1-CD1 4.32Å; I141-I145 HydrophobicContact CG2-CD1 3.73Å; I141-I145 HydrophobicContact CG2-CG1 4.32Å; I141-I145 WeakPolarHBondContact O-CB 3.37Å; I141-I145 VanDerWaalsContact O-CG1 3.24Å; I141-I145 WeakPolarHBondContact O-CG1 3.36Å; I141-I145 PolarHBondContact O-N 3.31Å; I145-L148 PolarHBondContact O-N 3.3Å; I145-T149 WeakPolarHBondContact O-CB 3.46Å; I145-T149 PolarHBondContact O-N 3.5Å; I145-T149 PolarHBondContact O-OG1 3.41Å
146	S	70.9	Confident	69.5	Low	77 Å²	77	82.4 Å²	82.4	54%	0.538	47%	0.466	S	S	.	.	H	α-helix	trans	-63.5	-42	177.3	-59.6	0	0	0	0	111.8	E142 N143 E144 T149 G150	E142-S146 WeakPolarHBondContact O-CB 3.35Å; E142-S146 PolarHBondContact O-N 3.09Å; E142-S146 VanDerWaalsContact O-N 3.09Å; E142-S146 PolarHBondContact O-OG 3.3Å; N143-S146 WeakPolarHBondContact O-CB 3.34Å; N143-S146 PolarHBondContact O-N 3.45Å; E144-S146 VanDerWaalsContact C-N 3.29Å; E144-S146 PolarHBondContact O-N 2.94Å; S146-T149 PolarHBondContact O-N 2.61Å; S146-G150 PolarHBondContact O-N 3.38Å; S146-G150 VanDerWaalsContact O-N 3.07Å
147	Q	70.2	Confident	69.6	Low	137 Å²	137	85 Å²	85	64%	0.64	47%	0.467	S	S	*	.	H	α-helix	trans	-66.2	-45.1	175.2	-69.7	177.2	23.8	0	0	112.2	N143 E144 T149 G150 C151	N143-Q147 WeakPolarHBondContact O-CG 3.27Å; N143-Q147 PolarHBondContact O-N 3.06Å; E144-Q147 PolarHBondContact O-N 2.9Å; Q147-T149 VanDerWaalsContact C-N 3.29Å; Q147-T149 PolarHBondContact O-N 2.96Å; Q147-G150 PolarHBondContact O-N 3Å; Q147-C151 PolarHBondContact O-N 3.32Å; Q147-C151 PolarHBondContact O-SG 3.48Å
148	L	65.8	Low	70	Confident	104 Å²	104	87 Å²	87	55%	0.545	47%	0.472	S	S	.	.	H	α-helix	trans	-61.3	-37.2	175.9	-71.7	169.2	0	0	0	112	E144 I145 C151 T152	E144-L148 WeakPolarHBondContact O-CB 3.34Å; E144-L148 WeakPolarHBondContact O-CG 3.45Å; E144-L148 PolarHBondContact O-N 2.98Å; I145-L148 PolarHBondContact O-N 3.3Å; L148-C151 PolarHBondContact O-N 3.27Å; L148-T152 PolarHBondContact O-N 2.87Å; L148-T152 PolarHBondContact O-OG1 3.01Å
149	T	65.2	Low	70	Confident	81 Å²	81	85.2 Å²	85.2	50%	0.497	47%	0.471	S	S	.	.	H	α-helix	trans	-65.5	-41.8	175.5	-56	0	0	0	0	110.9	I145 S146 Q147 T152 S153	I145-T149 WeakPolarHBondContact O-CB 3.46Å; I145-T149 PolarHBondContact O-N 3.5Å; I145-T149 PolarHBondContact O-OG1 3.41Å; S146-T149 PolarHBondContact O-N 2.61Å; Q147-T149 VanDerWaalsContact C-N 3.29Å; Q147-T149 PolarHBondContact O-N 2.96Å; T149-T152 WeakPolarHBondContact O-CB 3.26Å; T149-T152 PolarHBondContact O-N 3.38Å; T149-S153 PolarHBondContact O-N 3.16Å
150	G	67.5	Low	70	Confident	36 Å²	36	84 Å²	84	37%	0.371	47%	0.471	S	S	.	.	H	α-helix	trans	-63.6	-39.1	172.3	0	0	0	0	0	113.7	S146 Q147 T152 S153	S146-G150 PolarHBondContact O-N 3.38Å; S146-G150 VanDerWaalsContact O-N 3.07Å; Q147-G150 PolarHBondContact O-N 3Å; G150-T152 VanDerWaalsContact C-N 3.3Å; G150-T152 PolarHBondContact O-N 3.45Å; G150-S153 PolarHBondContact O-OG 2.77Å
151	C	66.2	Low	70.3	Confident	72 Å²	72	85.7 Å²	85.7	49%	0.486	47%	0.474	S	S	.	.	H	α-helix	trans	-65.6	-33.2	172.4	-71.7	0	0	0	0	112.4	Q147 L148 S153 L154 V155	Q147-C151 PolarHBondContact O-N 3.32Å; Q147-C151 PolarHBondContact O-SG 3.48Å; L148-C151 PolarHBondContact O-N 3.27Å; C151-S153 PolarHBondContact O-N 3.4Å; C151-L154 PolarHBondContact O-N 3.13Å; C151-V155 WeakPolarHBondContact O-CG2 3.47Å; C151-V155 PolarHBondContact O-N 3.46Å
152	T	63.8	Low	70.3	Confident	75 Å²	75	85.2 Å²	85.2	46%	0.46	47%	0.474	S	S	.	.	H	α-helix	trans	-65.4	-37.6	-178.8	-59.3	0	0	0	0	112.5	L148 T149 G150 V155 N156	L148-T152 PolarHBondContact O-N 2.87Å; L148-T152 PolarHBondContact O-OG1 3.01Å; T149-T152 WeakPolarHBondContact O-CB 3.26Å; T149-T152 PolarHBondContact O-N 3.38Å; G150-T152 VanDerWaalsContact C-N 3.3Å; G150-T152 PolarHBondContact O-N 3.45Å; T152-V155 PolarHBondContact O-N 3.04Å; T152-N156 VanDerWaalsContact O-CG 3.28Å; T152-N156 PolarHBondContact O-N 3.27Å; T152-N156 PolarHBondContact O-ND2 3.26Å
153	S	67	Low	70.5	Confident	71 Å²	71	86.9 Å²	86.9	50%	0.497	48%	0.482	S	S	.	.	H	α-helix	trans	-65.2	-43.3	175.8	61.7	0	0	0	0	112	T149 G150 C151 V155 N156 E157	T149-S153 PolarHBondContact O-N 3.16Å; G150-S153 PolarHBondContact O-OG 2.77Å; C151-S153 PolarHBondContact O-N 3.4Å; S153-V155 VanDerWaalsContact C-N 3.32Å; S153-V155 PolarHBondContact O-N 3.35Å; S153-N156 PolarHBondContact O-N 3.21Å; S153-E157 PolarHBondContact O-N 3.29Å
154	L	70.5	Confident	70.7	Confident	109 Å²	109	87.1 Å²	87.1	57%	0.571	49%	0.487	S	S	*	.	H	α-helix	trans	-64.4	-34.1	176.1	-65.6	172.8	0	0	0	112.7	C151 K158	C151-L154 PolarHBondContact O-N 3.13Å; L154-K158 WeakPolarHBondContact O-CB 3.43Å; L154-K158 PolarHBondContact O-N 3.01Å
155	V	67	Low	71.1	Confident	90 Å²	90	88.8 Å²	88.8	55%	0.545	50%	0.495	S	S	.	.	H	α-helix	trans	-66.3	-44.2	172.7	168.3	0	0	0	0	110.9	C151 T152 S153 K158 S159	C151-V155 WeakPolarHBondContact O-CG2 3.47Å; C151-V155 PolarHBondContact O-N 3.46Å; T152-V155 PolarHBondContact O-N 3.04Å; S153-V155 VanDerWaalsContact C-N 3.32Å; S153-V155 PolarHBondContact O-N 3.35Å; V155-K158 PolarHBondContact O-N 2.92Å; V155-S159 WeakPolarHBondContact O-CB 3.45Å; V155-S159 PolarHBondContact O-N 3.33Å
156	N	71.5	Confident	71.4	Confident	101 Å²	101	90.9 Å²	90.9	54%	0.54	51%	0.506	S	S	.	.	H	α-helix	trans	-66	-44.3	178.9	-69	-16.7	0	0	0	112.4	T152 S153 S159 L160	T152-N156 VanDerWaalsContact O-CG 3.28Å; T152-N156 PolarHBondContact O-N 3.27Å; T152-N156 PolarHBondContact O-ND2 3.26Å; S153-N156 PolarHBondContact O-N 3.21Å; N156-S159 WeakPolarHBondContact O-CB 3.48Å; N156-S159 PolarHBondContact O-N 3.04Å; N156-L160 PolarHBondContact O-N 2.94Å
157	E	73.4	Confident	71.9	Confident	117 Å²	117	93.7 Å²	93.7	55%	0.547	51%	0.508	S	S	.	.	H	α-helix	trans	-59.6	-48.4	175	-177.7	-179.3	-167	0	0	111.2	S153 S159 L160 I161	S153-E157 PolarHBondContact O-N 3.29Å; E157-S159 VanDerWaalsContact C-N 3.3Å; E157-S159 PolarHBondContact O-N 3.2Å; E157-L160 PolarHBondContact O-N 3.15Å; E157-I161 HydrophobicContact CG-CD1 4.12Å; E157-I161 WeakPolarHBondContact O-CG1 3.49Å; E157-I161 PolarHBondContact O-N 3.14Å
158	K	76.1	Confident	72.4	Confident	92 Å²	92	88.4 Å²	88.4	40%	0.4	49%	0.491	S	S	.	.	H	α-helix	trans	-59.9	-38.1	176	-178	-177.6	175.5	-170.5	0	112.6	L154 V155 T162	L154-K158 WeakPolarHBondContact O-CB 3.43Å; L154-K158 PolarHBondContact O-N 3.01Å; V155-K158 PolarHBondContact O-N 2.92Å; K158-T162 PolarHBondContact O-N 3.35Å; K158-T162 PolarHBondContact O-OG1 3.03Å; K158-T162 VanDerWaalsContact O-OG1 3.09Å
159	S	71.1	Confident	72.8	Confident	56 Å²	56	87.4 Å²	87.4	39%	0.392	49%	0.485	S	S	.	.	H	α-helix	trans	-62	-50.1	174.6	-167.5	0	0	0	0	111.3	V155 N156 E157 I161 T162 E163	V155-S159 WeakPolarHBondContact O-CB 3.45Å; V155-S159 PolarHBondContact O-N 3.33Å; N156-S159 WeakPolarHBondContact O-CB 3.48Å; N156-S159 PolarHBondContact O-N 3.04Å; E157-S159 VanDerWaalsContact C-N 3.3Å; E157-S159 PolarHBondContact O-N 3.2Å; S159-I161 VanDerWaalsContact C-N 3.33Å; S159-I161 PolarHBondContact O-N 3.19Å; S159-T162 WeakPolarHBondContact CA-OG1 3.44Å; S159-T162 PolarHBondContact O-N 2.89Å; S159-T162 VanDerWaalsContact O-N 3.13Å; S159-T162 PolarHBondContact O-OG1 3.48Å; S159-E163 WeakPolarHBondContact O-CB 3.43Å; S159-E163 PolarHBondContact O-N 3.39Å
160	L	77.4	Confident	73.1	Confident	111 Å²	111	88.6 Å²	88.6	58%	0.581	49%	0.487	S	S	*	.	H	α-helix	trans	-61.9	-38.7	179.9	-169.5	72.3	0	0	0	112.5	N156 E157 T164	N156-L160 PolarHBondContact O-N 2.94Å; E157-L160 PolarHBondContact O-N 3.15Å; L160-T164 WeakPolarHBondContact O-CB 3.49Å; L160-T164 PolarHBondContact O-N 3.21Å; L160-T164 PolarHBondContact O-OG1 3.42Å
161	I	76.6	Confident	73.8	Confident	89 Å²	89	91.4 Å²	91.4	46%	0.456	49%	0.494	S	S	.	.	H	α-helix	trans	-61.6	-50.7	171.9	-67.8	166.4	0	0	0	110	E157 S159 E163 T164 E165	E157-I161 HydrophobicContact CG-CD1 4.12Å; E157-I161 WeakPolarHBondContact O-CG1 3.49Å; E157-I161 PolarHBondContact O-N 3.14Å; S159-I161 VanDerWaalsContact C-N 3.33Å; S159-I161 PolarHBondContact O-N 3.19Å; I161-E163 VanDerWaalsContact C-N 3.34Å; I161-E163 PolarHBondContact O-N 2.98Å; I161-T164 WeakPolarHBondContact O-CB 3.45Å; I161-T164 PolarHBondContact O-N 2.9Å; I161-E165 HydrophobicContact CG2-CG 4.42Å; I161-E165 WeakPolarHBondContact O-CG 3.2Å; I161-E165 PolarHBondContact O-N 2.93Å
162	T	69.7	Low	74.4	Confident	49 Å²	49	95.5 Å²	95.5	30%	0.301	50%	0.499	S	S	.	.	H	α-helix	trans	-65.5	-33.4	-179.6	49.1	0	0	0	0	113.7	K158 S159 E165 L166	K158-T162 PolarHBondContact O-N 3.35Å; K158-T162 PolarHBondContact O-OG1 3.03Å; K158-T162 VanDerWaalsContact O-OG1 3.09Å; S159-T162 WeakPolarHBondContact CA-OG1 3.44Å; S159-T162 PolarHBondContact O-N 2.89Å; S159-T162 VanDerWaalsContact O-N 3.13Å; S159-T162 PolarHBondContact O-OG1 3.48Å; T162-E165 PolarHBondContact O-N 3.33Å; T162-L166 WeakPolarHBondContact O-CB 3.25Å; T162-L166 WeakPolarHBondContact O-CG 3.36Å; T162-L166 PolarHBondContact O-N 3.43Å
163	E	75.6	Confident	74.8	Confident	128 Å²	128	96.1 Å²	96.1	60%	0.598	50%	0.503	S	S	*	.	H	α-helix	trans	-64.9	-42.3	173.6	-172.5	-179.7	174.5	0	0	111	S159 I161 L166 K167	S159-E163 WeakPolarHBondContact O-CB 3.43Å; S159-E163 PolarHBondContact O-N 3.39Å; I161-E163 VanDerWaalsContact C-N 3.34Å; I161-E163 PolarHBondContact O-N 2.98Å; E163-L166 PolarHBondContact O-N 3.42Å; E163-K167 WeakPolarHBondContact O-CB 3.41Å; E163-K167 PolarHBondContact O-N 3.48Å
164	T	79.8	Confident	75.3	Confident	94 Å²	94	96.2 Å²	96.2	58%	0.577	50%	0.5	S	S	*	.	H	α-helix	trans	-65.3	-43.1	175.7	-55.1	0	0	0	0	111.7	L160 I161 G168	L160-T164 WeakPolarHBondContact O-CB 3.49Å; L160-T164 PolarHBondContact O-N 3.21Å; L160-T164 PolarHBondContact O-OG1 3.42Å; I161-T164 WeakPolarHBondContact O-CB 3.45Å; I161-T164 PolarHBondContact O-N 2.9Å; T164-G168 PolarHBondContact O-N 3Å
165	E	80	Confident	75.7	Confident	115 Å²	115	97.2 Å²	97.2	54%	0.537	50%	0.502	S	S	.	.	H	α-helix	trans	-62	-45.2	174.6	-73	-177	148	0	0	111.8	I161 T162 G168 I169	I161-E165 HydrophobicContact CG2-CG 4.42Å; I161-E165 WeakPolarHBondContact O-CG 3.2Å; I161-E165 PolarHBondContact O-N 2.93Å; T162-E165 PolarHBondContact O-N 3.33Å; E165-G168 CarbonylContact O-C 3.15Å; E165-G168 PolarHBondContact O-N 3Å; E165-I169 WeakPolarHBondContact O-CG1 3.45Å; E165-I169 PolarHBondContact O-N 2.68Å
166	L	74.9	Confident	76.1	Confident	104 Å²	104	95.8 Å²	95.8	55%	0.545	50%	0.5	S	S	.	.	H	α-helix	trans	-63	-45	178.1	-77	168.9	0	0	0	111.8	T162 E163 G168 I169 I170	T162-L166 WeakPolarHBondContact O-CB 3.25Å; T162-L166 WeakPolarHBondContact O-CG 3.36Å; T162-L166 PolarHBondContact O-N 3.43Å; E163-L166 PolarHBondContact O-N 3.42Å; L166-G168 PolarHBondContact O-N 3.37Å; L166-I169 WeakPolarHBondContact O-CB 3.4Å; L166-I169 PolarHBondContact O-N 3.38Å; L166-I170 WeakPolarHBondContact O-CG1 3.48Å; L166-I170 PolarHBondContact O-N 3.32Å
167	K	81	Confident	76.3	Confident	136 Å²	136	96.2 Å²	96.2	59%	0.591	50%	0.502	S	S	*	.	H	α-helix	trans	-58.9	-48.1	174.6	-173.5	173.1	-177.6	175.6	0	111.4	E163 I169 I170 D171	E163-K167 WeakPolarHBondContact O-CB 3.41Å; E163-K167 PolarHBondContact O-N 3.48Å; K167-I169 PolarHBondContact O-N 3.34Å; K167-I169 VanDerWaalsContact O-N 3.16Å; K167-I170 PolarHBondContact O-N 3.17Å; K167-I170 VanDerWaalsContact O-N 3.09Å; K167-D171 PolarHBondContact O-N 3.47Å
168	G	81.4	Confident	76.7	Confident	26 Å²	26	95.4 Å²	95.4	27%	0.268	50%	0.498	S	S	.	.	H	α-helix	trans	-64.7	-14.7	174.7	0	0	0	0	0	114.6	T164 E165 L166 R172	T164-G168 PolarHBondContact O-N 3Å; E165-G168 CarbonylContact O-C 3.15Å; E165-G168 PolarHBondContact O-N 3Å; L166-G168 PolarHBondContact O-N 3.37Å; G168-R172 VanDerWaalsContact O-CZ 3.32Å; G168-R172 PolarHBondContact O-NE 3.41Å; G168-R172 PolarHBondContact O-NH2 3.38Å
169	I	72.7	Confident	76.9	Confident	84 Å²	84	95 Å²	95	43%	0.431	50%	0.503	S	S	.	.	H	α-helix	trans	-83.2	-48.3	168	-70.9	162.8	0	0	0	110	E165 L166 K167 D171 R172 T173	E165-I169 WeakPolarHBondContact O-CG1 3.45Å; E165-I169 PolarHBondContact O-N 2.68Å; L166-I169 WeakPolarHBondContact O-CB 3.4Å; L166-I169 PolarHBondContact O-N 3.38Å; K167-I169 PolarHBondContact O-N 3.34Å; K167-I169 VanDerWaalsContact O-N 3.16Å; I169-D171 VanDerWaalsContact C-N 3.33Å; I169-D171 PolarHBondContact O-N 3.4Å; I169-R172 PolarHBondContact O-N 3.1Å; I169-T173 PolarHBondContact O-N 2.97Å; I169-T173 PolarHBondContact O-OG1 2.95Å; I169-T173 VanDerWaalsContact O-OG1 3.12Å
170	I	72.7	Confident	77.2	Confident	106 Å²	106	97.9 Å²	97.9	54%	0.544	51%	0.514	S	S	.	.	H	α-helix	trans	-54.9	-47.4	179.2	-68.4	163.4	0	0	0	111.2	L166 K167 R172 T173 T174	L166-I170 WeakPolarHBondContact O-CG1 3.48Å; L166-I170 PolarHBondContact O-N 3.32Å; K167-I170 PolarHBondContact O-N 3.17Å; K167-I170 VanDerWaalsContact O-N 3.09Å; I170-R172 PolarHBondContact O-N 3.14Å; I170-T173 PolarHBondContact O-N 2.78Å; I170-T174 PolarHBondContact O-N 3.3Å; I170-T174 PolarHBondContact O-OG1 2.94Å; I170-T174 VanDerWaalsContact O-OG1 3.07Å
171	D	81.2	Confident	77.1	Confident	94 Å²	94	96.4 Å²	96.4	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-60.1	-45.7	-179.1	-64.3	-26.9	0	0	0	111.6	K167 I169 T174 E175	K167-D171 PolarHBondContact O-N 3.47Å; I169-D171 VanDerWaalsContact C-N 3.33Å; I169-D171 PolarHBondContact O-N 3.4Å; D171-T174 PolarHBondContact O-N 3.25Å; D171-E175 PolarHBondContact O-N 3.05Å
172	R	78.2	Confident	77.4	Confident	158 Å²	158	97.4 Å²	97.4	60%	0.596	51%	0.51	S	S	*	.	H	α-helix	trans	-66.5	-35	175.8	-78.1	-179.9	-70	168.9	-1.4	113	G168 I169 I170 A176	G168-R172 VanDerWaalsContact O-CZ 3.32Å; G168-R172 PolarHBondContact O-NE 3.41Å; G168-R172 PolarHBondContact O-NH2 3.38Å; I169-R172 PolarHBondContact O-N 3.1Å; I170-R172 PolarHBondContact O-N 3.14Å; R172-A176 WeakPolarHBondContact O-CB 3.44Å; R172-A176 PolarHBondContact O-N 2.99Å
173	T	72.4	Confident	77.6	Confident	88 Å²	88	97.7 Å²	97.7	54%	0.54	52%	0.518	S	S	.	.	H	α-helix	trans	-66.6	-38.8	174.9	-61.1	0	0	0	0	111.3	I169 I170 A176 L177	I169-T173 PolarHBondContact O-N 2.97Å; I169-T173 PolarHBondContact O-OG1 2.95Å; I169-T173 VanDerWaalsContact O-OG1 3.12Å; I170-T173 PolarHBondContact O-N 2.78Å; T173-A176 PolarHBondContact O-N 3.19Å; T173-L177 WeakPolarHBondContact O-CB 3.49Å; T173-L177 PolarHBondContact O-N 2.9Å
174	T	78.1	Confident	77.5	Confident	73 Å²	73	95.8 Å²	95.8	45%	0.448	51%	0.511	S	S	.	.	H	α-helix	trans	-64.3	-47.6	174.5	-57.9	0	0	0	0	111.8	I170 D171 A176 L177 E178	I170-T174 PolarHBondContact O-N 3.3Å; I170-T174 PolarHBondContact O-OG1 2.94Å; I170-T174 VanDerWaalsContact O-OG1 3.07Å; D171-T174 PolarHBondContact O-N 3.25Å; T174-A176 VanDerWaalsContact C-N 3.33Å; T174-A176 PolarHBondContact O-N 2.85Å; T174-L177 PolarHBondContact O-N 3Å; T174-E178 PolarHBondContact O-N 3.46Å
175	E	79.7	Confident	77.4	Confident	131 Å²	131	94.8 Å²	94.8	61%	0.612	51%	0.506	S	S	*	.	H	α-helix	trans	-60.1	-41.2	176.8	-175	-179.5	-159.3	0	0	112.3	D171 T179	D171-E175 PolarHBondContact O-N 3.05Å; E175-T179 WeakPolarHBondContact O-CB 3.41Å; E175-T179 PolarHBondContact O-N 3.37Å; E175-T179 PolarHBondContact O-OG1 2.91Å
176	A	74.7	Confident	77.5	Confident	60 Å²	60	96.1 Å²	96.1	50%	0.496	51%	0.509	S	S	.	.	H	α-helix	trans	-64.3	-40.7	175.3	0	0	0	0	0	112.3	R172 T173 T174 T179 L180	R172-A176 WeakPolarHBondContact O-CB 3.44Å; R172-A176 PolarHBondContact O-N 2.99Å; T173-A176 PolarHBondContact O-N 3.19Å; T174-A176 VanDerWaalsContact C-N 3.33Å; T174-A176 PolarHBondContact O-N 2.85Å; A176-T179 PolarHBondContact O-N 2.96Å; A176-L180 WeakPolarHBondContact O-CB 3.29Å; A176-L180 PolarHBondContact O-N 3.33Å
177	L	76.1	Confident	77.7	Confident	110 Å²	110	96.3 Å²	96.3	58%	0.576	51%	0.51	S	S	*	.	H	α-helix	trans	-67.4	-41.2	178	-177	63.5	0	0	0	112.3	T173 T174 T179 L180 T181	T173-L177 WeakPolarHBondContact O-CB 3.49Å; T173-L177 PolarHBondContact O-N 2.9Å; T174-L177 PolarHBondContact O-N 3Å; L177-T179 VanDerWaalsContact C-N 3.33Å; L177-L180 PolarHBondContact O-N 3.05Å; L177-T181 WeakPolarHBondContact O-CB 3.42Å; L177-T181 PolarHBondContact O-N 3.48Å; L177-T181 PolarHBondContact O-OG1 2.96Å
178	E	81.2	Confident	77.6	Confident	100 Å²	100	94 Å²	94	47%	0.467	51%	0.505	S	S	.	.	H	α-helix	trans	-60.7	-44.1	171.7	-83.8	-161.4	-149	0	0	111.5	T174 T181 K182	T174-E178 PolarHBondContact O-N 3.46Å; E178-T181 PolarHBondContact O-N 3.19Å; E178-K182 WeakPolarHBondContact O-CB 3.48Å; E178-K182 WeakPolarHBondContact O-CD 3.48Å; E178-K182 WeakPolarHBondContact O-CG 3.49Å; E178-K182 PolarHBondContact O-N 3.24Å; E178-K182 WeakPolarHBondContact OE2-CE 3.39Å; E178-K182 IonicContact OE2-NZ 3.84Å; E178-K182 PolarHBondContact OE2-NZ 3.21Å
179	T	80.8	Confident	77.8	Confident	83 Å²	83	97.3 Å²	97.3	51%	0.509	51%	0.513	S	S	.	.	H	α-helix	trans	-64.5	-42.7	-179.8	-60.4	0	0	0	0	111.4	E175 A176 L177 K182 A183	E175-T179 WeakPolarHBondContact O-CB 3.41Å; E175-T179 PolarHBondContact O-N 3.37Å; E175-T179 PolarHBondContact O-OG1 2.91Å; A176-T179 PolarHBondContact O-N 2.96Å; L177-T179 VanDerWaalsContact C-N 3.33Å; T179-K182 PolarHBondContact O-N 3.33Å; T179-A183 WeakPolarHBondContact O-CB 3.48Å; T179-A183 PolarHBondContact O-N 3.03Å
180	L	76.3	Confident	77.9	Confident	117 Å²	117	97.4 Å²	97.4	61%	0.613	52%	0.518	S	S	*	.	H	α-helix	trans	-61.3	-43.8	173.7	-178.6	62.1	0	0	0	111.7	A176 L177 A183 N184	A176-L180 WeakPolarHBondContact O-CB 3.29Å; A176-L180 PolarHBondContact O-N 3.33Å; L177-L180 PolarHBondContact O-N 3.05Å; L180-A183 PolarHBondContact O-N 2.78Å; L180-N184 WeakPolarHBondContact O-CB 3.45Å; L180-N184 PolarHBondContact O-N 3.36Å
181	T	75.1	Confident	78.1	Confident	79 Å²	79	97.1 Å²	97.1	49%	0.485	51%	0.514	S	S	.	.	H	α-helix	trans	-61.4	-45.9	176.3	-57.7	0	0	0	0	111.5	L177 E178 A183 N184 T185	L177-T181 WeakPolarHBondContact O-CB 3.42Å; L177-T181 PolarHBondContact O-N 3.48Å; L177-T181 PolarHBondContact O-OG1 2.96Å; E178-T181 PolarHBondContact O-N 3.19Å; T181-A183 VanDerWaalsContact C-N 3.27Å; T181-A183 PolarHBondContact O-N 2.95Å; T181-N184 PolarHBondContact O-N 2.99Å; T181-T185 PolarHBondContact O-N 3.22Å; T181-T185 VanDerWaalsContact O-N 3.08Å; T181-T185 PolarHBondContact O-OG1 3.14Å
182	K	83.4	Confident	78.1	Confident	110 Å²	110	98.3 Å²	98.3	48%	0.478	52%	0.519	S	S	.	.	H	α-helix	trans	-66	-24.8	177	-68.6	162	-168.5	168.3	0	113.3	E178 T179 T185 K186	E178-K182 WeakPolarHBondContact O-CB 3.48Å; E178-K182 WeakPolarHBondContact O-CD 3.48Å; E178-K182 WeakPolarHBondContact O-CG 3.49Å; E178-K182 PolarHBondContact O-N 3.24Å; E178-K182 WeakPolarHBondContact OE2-CE 3.39Å; E178-K182 IonicContact OE2-NZ 3.84Å; E178-K182 PolarHBondContact OE2-NZ 3.21Å; T179-K182 PolarHBondContact O-N 3.33Å; K182-T185 PolarHBondContact O-OG1 2.99Å; K182-K186 WeakPolarHBondContact O-CG 3.33Å
183	A	73.4	Confident	78.1	Confident	55 Å²	55	98.7 Å²	98.7	46%	0.455	52%	0.521	S	S	.	.	H	α-helix	trans	-79.2	-43.6	172.4	0	0	0	0	0	111.7	T179 L180 T181 T185 K186 L187	T179-A183 WeakPolarHBondContact O-CB 3.48Å; T179-A183 PolarHBondContact O-N 3.03Å; L180-A183 PolarHBondContact O-N 2.78Å; T181-A183 VanDerWaalsContact C-N 3.27Å; T181-A183 PolarHBondContact O-N 2.95Å; A183-T185 PolarHBondContact O-N 2.92Å; A183-K186 PolarHBondContact O-N 2.99Å; A183-L187 PolarHBondContact O-N 2.87Å
184	N	73.8	Confident	78.4	Confident	88 Å²	88	101.1 Å²	101.1	47%	0.471	52%	0.521	S	S	.	.	H	α-helix	trans	-66.9	-36.9	-177.6	-163.6	27.1	0	0	0	112.6	L180 T181 L187 N188	L180-N184 WeakPolarHBondContact O-CB 3.45Å; L180-N184 PolarHBondContact O-N 3.36Å; T181-N184 PolarHBondContact O-N 2.99Å; N184-L187 PolarHBondContact O-N 3.04Å; N184-N188 PolarHBondContact O-N 3.31Å; N184-N188 PolarHBondContact O-ND2 3.35Å
185	T	79.4	Confident	78.6	Confident	74 Å²	74	101.1 Å²	101.1	45%	0.454	52%	0.518	S	S	.	.	H	α-helix	trans	-62.7	-45.9	172.7	50.7	0	0	0	0	112	T181 K182 A183 L187 N188 E189	T181-T185 PolarHBondContact O-N 3.22Å; T181-T185 VanDerWaalsContact O-N 3.08Å; T181-T185 PolarHBondContact O-OG1 3.14Å; K182-T185 PolarHBondContact O-OG1 2.99Å; A183-T185 PolarHBondContact O-N 2.92Å; T185-L187 VanDerWaalsContact C-N 3.32Å; T185-L187 PolarHBondContact O-N 3.29Å; T185-N188 PolarHBondContact O-N 3.1Å; T185-E189 PolarHBondContact O-N 3.17Å
186	K	81.7	Confident	78.7	Confident	142 Å²	142	97.4 Å²	97.4	62%	0.617	51%	0.51	S	S	*	.	H	α-helix	trans	-61	-37.7	175.1	-73	178.2	179.3	-179.2	0	112.9	K182 A183 T190	K182-K186 WeakPolarHBondContact O-CG 3.33Å; A183-K186 PolarHBondContact O-N 2.99Å; K186-T190 WeakPolarHBondContact O-CB 3.33Å; K186-T190 PolarHBondContact O-N 3.46Å; K186-T190 PolarHBondContact O-OG1 3.01Å
187	L	78.2	Confident	78.9	Confident	108 Å²	108	99.4 Å²	99.4	57%	0.565	52%	0.516	S	S	*	.	H	α-helix	trans	-63.1	-47.7	175.2	-179.4	60.4	0	0	0	111	A183 N184 T185 T190 Q191	A183-L187 PolarHBondContact O-N 2.87Å; N184-L187 PolarHBondContact O-N 3.04Å; T185-L187 VanDerWaalsContact C-N 3.32Å; T185-L187 PolarHBondContact O-N 3.29Å; L187-T190 PolarHBondContact O-N 3.09Å; L187-Q191 PolarHBondContact O-N 2.96Å
188	N	79.8	Confident	79.1	Confident	88 Å²	88	98.5 Å²	98.5	47%	0.471	51%	0.507	S	S	.	.	H	α-helix	trans	-62.2	-44.3	177.6	-72.3	-34.5	0	0	0	112.5	N184 T185 T190 Q191 I192	N184-N188 PolarHBondContact O-N 3.31Å; N184-N188 PolarHBondContact O-ND2 3.35Å; T185-N188 PolarHBondContact O-N 3.1Å; N188-T190 VanDerWaalsContact C-N 3.31Å; N188-T190 PolarHBondContact O-N 3.11Å; N188-Q191 PolarHBondContact O-N 3.34Å; N188-I192 WeakPolarHBondContact O-CG1 3.49Å; N188-I192 PolarHBondContact O-N 3.04Å
189	E	83.9	Confident	79.1	Confident	95 Å²	95	100.1 Å²	100.1	44%	0.444	52%	0.515	S	S	.	.	H	α-helix	trans	-57.6	-43.6	172.4	-79.9	-170.7	-132.8	0	0	112.4	T185 Q191 I192 R193	T185-E189 PolarHBondContact O-N 3.17Å; E189-Q191 VanDerWaalsContact C-N 3.35Å; E189-I192 PolarHBondContact O-N 3.44Å; E189-R193 VanDerWaalsContact O-CG 3.27Å; E189-R193 WeakPolarHBondContact O-CG 3.4Å; E189-R193 PolarHBondContact O-N 2.97Å; E189-R193 IonicContact OE2-CZ 3.74Å; E189-R193 IonicContact OE2-NE 3.22Å; E189-R193 IonicContact OE2-NH2 2.61Å; E189-R193 PolarHBondContact OE2-NH2 2.65Å
190	T	76.2	Confident	79.2	Confident	86 Å²	86	102.6 Å²	102.6	53%	0.528	52%	0.518	S	S	.	.	H	α-helix	trans	-65.3	-40.5	-179.6	-56.8	0	0	0	0	110.9	K186 L187 N188 R193 Y194	K186-T190 WeakPolarHBondContact O-CB 3.33Å; K186-T190 PolarHBondContact O-N 3.46Å; K186-T190 PolarHBondContact O-OG1 3.01Å; L187-T190 PolarHBondContact O-N 3.09Å; N188-T190 VanDerWaalsContact C-N 3.31Å; N188-T190 PolarHBondContact O-N 3.11Å; T190-R193 PolarHBondContact O-N 3.02Å; T190-Y194 WeakPolarHBondContact O-CB 3.26Å; T190-Y194 PolarHBondContact O-N 3.07Å
191	Q	76	Confident	79	Confident	100 Å²	100	99.1 Å²	99.1	47%	0.467	50%	0.504	S	S	.	.	H	α-helix	trans	-65.7	-39.2	176.7	-171.3	65	2.4	0	0	112.5	L187 N188 E189 Y194 N195	L187-Q191 PolarHBondContact O-N 2.96Å; N188-Q191 PolarHBondContact O-N 3.34Å; E189-Q191 VanDerWaalsContact C-N 3.35Å; Q191-Y194 PolarHBondContact O-N 2.93Å; Q191-N195 WeakPolarHBondContact O-CB 3.46Å; Q191-N195 VanDerWaalsContact O-CG 3.31Å; Q191-N195 PolarHBondContact O-N 3.43Å; Q191-N195 PolarHBondContact O-ND2 3.07Å
192	I	81.8	Confident	79.4	Confident	120 Å²	120	98.9 Å²	98.9	62%	0.615	50%	0.497	S	S	*	.	H	α-helix	trans	-62.9	-46.6	173.8	-68.5	164.1	0	0	0	110.5	N188 E189 Y194 N195 A196	N188-I192 WeakPolarHBondContact O-CG1 3.49Å; N188-I192 PolarHBondContact O-N 3.04Å; E189-I192 PolarHBondContact O-N 3.44Å; I192-Y194 PolarHBondContact O-N 3.27Å; I192-N195 PolarHBondContact O-N 3.38Å; I192-A196 PolarHBondContact O-N 3Å
193	R	78.6	Confident	79.4	Confident	166 Å²	166	99.2 Å²	99.2	63%	0.626	50%	0.501	S	S	*	.	H	α-helix	trans	-61.7	-43	176.9	-67.2	171.2	-161.2	-143	10.3	111.8	E189 T190 A196 V197	E189-R193 VanDerWaalsContact O-CG 3.27Å; E189-R193 WeakPolarHBondContact O-CG 3.4Å; E189-R193 PolarHBondContact O-N 2.97Å; E189-R193 IonicContact OE2-CZ 3.74Å; E189-R193 IonicContact OE2-NE 3.22Å; E189-R193 IonicContact OE2-NH2 2.61Å; E189-R193 PolarHBondContact OE2-NH2 2.65Å; T190-R193 PolarHBondContact O-N 3.02Å; R193-A196 PolarHBondContact O-N 2.95Å; R193-V197 WeakPolarHBondContact O-CG2 3.42Å; R193-V197 PolarHBondContact O-N 2.82Å
194	Y	78.4	Confident	79.8	Confident	139 Å²	139	101.3 Å²	101.3	55%	0.545	50%	0.503	S	S	.	.	H	α-helix	trans	-59.5	-48.3	175.7	172.6	-98.4	0	0	0	111.9	T190 Q191 I192 A196 V197 K198	T190-Y194 WeakPolarHBondContact O-CB 3.26Å; T190-Y194 PolarHBondContact O-N 3.07Å; Q191-Y194 PolarHBondContact O-N 2.93Å; I192-Y194 PolarHBondContact O-N 3.27Å; Y194-A196 PolarHBondContact O-N 3.49Å; Y194-V197 PolarHBondContact O-N 2.94Å; Y194-K198 HydrophobicContact CE1-CD 4.48Å; Y194-K198 WeakPolarHBondContact O-CB 3.43Å; Y194-K198 PolarHBondContact O-N 2.86Å
195	N	81.3	Confident	80	Confident	73 Å²	73	104 Å²	104	39%	0.39	51%	0.506	S	S	.	.	H	α-helix	trans	-61.4	-41.8	179.1	-74.6	-21.5	0	0	0	112.3	Q191 I192 K198 Q199	Q191-N195 WeakPolarHBondContact O-CB 3.46Å; Q191-N195 VanDerWaalsContact O-CG 3.31Å; Q191-N195 PolarHBondContact O-N 3.43Å; Q191-N195 PolarHBondContact O-ND2 3.07Å; I192-N195 PolarHBondContact O-N 3.38Å; N195-K198 PolarHBondContact O-N 3.31Å; N195-Q199 WeakPolarHBondContact O-CG 3.41Å; N195-Q199 PolarHBondContact O-N 3.08Å
196	A	82.1	Confident	80.2	Confident	53 Å²	53	106.7 Å²	106.7	44%	0.438	52%	0.516	S	S	.	.	H	α-helix	trans	-64.9	-41.7	176.8	0	0	0	0	0	112.6	I192 R193 Y194 K200	I192-A196 PolarHBondContact O-N 3Å; R193-A196 PolarHBondContact O-N 2.95Å; Y194-A196 PolarHBondContact O-N 3.49Å; A196-K200 PolarHBondContact O-N 3.15Å; A196-K200 VanDerWaalsContact O-N 3.11Å
197	V	78.7	Confident	80.3	Confident	102 Å²	102	104.1 Å²	104.1	62%	0.618	51%	0.509	S	S	*	.	H	α-helix	trans	-64.9	-41.3	174.3	171.2	0	0	0	0	111.1	R193 Y194 K200 S201	R193-V197 WeakPolarHBondContact O-CG2 3.42Å; R193-V197 PolarHBondContact O-N 2.82Å; Y194-V197 PolarHBondContact O-N 2.94Å; V197-K200 PolarHBondContact O-N 3.47Å; V197-S201 PolarHBondContact O-N 3.29Å
198	K	81	Confident	80.4	Confident	91 Å²	91	104.3 Å²	104.3	40%	0.396	51%	0.51	S	S	.	.	H	α-helix	trans	-59.1	-53.1	176	-179.4	-177.4	169.4	-176.1	0	111.2	Y194 N195 K200 S201 E202	Y194-K198 HydrophobicContact CE1-CD 4.48Å; Y194-K198 WeakPolarHBondContact O-CB 3.43Å; Y194-K198 PolarHBondContact O-N 2.86Å; N195-K198 PolarHBondContact O-N 3.31Å; K198-K200 VanDerWaalsContact C-N 3.34Å; K198-K200 PolarHBondContact O-N 3.26Å; K198-S201 WeakPolarHBondContact O-CA 3.42Å; K198-S201 WeakPolarHBondContact O-CB 3.49Å; K198-S201 PolarHBondContact O-N 3.29Å; K198-S201 PolarHBondContact O-OG 3.06Å; K198-E202 WeakPolarHBondContact CE-OE1 3.5Å; K198-E202 IonicContact NZ-OE1 3.74Å; K198-E202 WeakPolarHBondContact O-CG 3.47Å; K198-E202 PolarHBondContact O-N 3.42Å
199	Q	81.9	Confident	80.4	Confident	133 Å²	133	102.4 Å²	102.4	62%	0.621	51%	0.506	S	S	*	.	H	α-helix	trans	-56	-46.9	178.7	-75.4	175.9	-27.9	0	0	111.9	N195 S201 E202 E203	N195-Q199 WeakPolarHBondContact O-CG 3.41Å; N195-Q199 PolarHBondContact O-N 3.08Å; Q199-S201 VanDerWaalsContact C-N 3.29Å; Q199-S201 PolarHBondContact O-N 2.79Å; Q199-E202 WeakPolarHBondContact O-CB 3.35Å; Q199-E202 PolarHBondContact O-N 3.03Å; Q199-E203 PolarHBondContact O-N 3.31Å
200	K	83.2	Confident	80.4	Confident	135 Å²	135	99.8 Å²	99.8	59%	0.587	50%	0.498	S	S	*	.	H	α-helix	trans	-62.5	-34.4	176.7	-170	169.7	-176.1	173.1	0	112.9	A196 V197 K198 E202 I204	A196-K200 PolarHBondContact O-N 3.15Å; A196-K200 VanDerWaalsContact O-N 3.11Å; V197-K200 PolarHBondContact O-N 3.47Å; K198-K200 VanDerWaalsContact C-N 3.34Å; K198-K200 PolarHBondContact O-N 3.26Å; K200-E202 VanDerWaalsContact C-N 3.28Å; K200-E202 PolarHBondContact O-N 3.12Å; K200-I204 HydrophobicContact CG-CD1 4.13Å; K200-I204 WeakPolarHBondContact O-CD1 3.22Å; K200-I204 VanDerWaalsContact O-CG1 3.25Å; K200-I204 WeakPolarHBondContact O-CG1 3.36Å; K200-I204 PolarHBondContact O-N 3.07Å; K200-I204 VanDerWaalsContact O-N 3.09Å
201	S	72.1	Confident	80.7	Confident	44 Å²	44	99.8 Å²	99.8	31%	0.308	50%	0.495	S	S	.	.	H	α-helix	trans	-68.8	-25.8	173.7	84.7	0	0	0	0	113.4	V197 K198 Q199 R205	V197-S201 PolarHBondContact O-N 3.29Å; K198-S201 WeakPolarHBondContact O-CA 3.42Å; K198-S201 WeakPolarHBondContact O-CB 3.49Å; K198-S201 PolarHBondContact O-N 3.29Å; K198-S201 PolarHBondContact O-OG 3.06Å; Q199-S201 VanDerWaalsContact C-N 3.29Å; Q199-S201 PolarHBondContact O-N 2.79Å; S201-R205 WeakPolarHBondContact O-CB 3.27Å; S201-R205 WeakPolarHBondContact O-CG 3.37Å; S201-R205 PolarHBondContact O-N 3.42Å; S201-R205 PolarHBondContact O-NE 2.9Å; S201-R205 PolarHBondContact OG-NH2 3.42Å
202	E	82.6	Confident	80.9	Confident	75 Å²	75	98.3 Å²	98.3	35%	0.35	49%	0.493	S	S	.	.	H	α-helix	trans	-82	-42.4	179.4	-70.6	169.7	167.5	0	0	109.9	K198 Q199 K200 R205 M206	K198-E202 WeakPolarHBondContact CE-OE1 3.5Å; K198-E202 IonicContact NZ-OE1 3.74Å; K198-E202 WeakPolarHBondContact O-CG 3.47Å; K198-E202 PolarHBondContact O-N 3.42Å; Q199-E202 WeakPolarHBondContact O-CB 3.35Å; Q199-E202 PolarHBondContact O-N 3.03Å; K200-E202 VanDerWaalsContact C-N 3.28Å; K200-E202 PolarHBondContact O-N 3.12Å; E202-R205 PolarHBondContact O-N 2.82Å; E202-R205 IonicContact OE1-NH2 2.68Å; E202-M206 WeakPolarHBondContact O-CG 3.39Å; E202-M206 PolarHBondContact O-N 3.15Å
203	E	84.4	Confident	80.9	Confident	117 Å²	117	99.8 Å²	99.8	55%	0.547	49%	0.49	S	S	.	.	H	α-helix	trans	-55.1	-51.1	169.5	-174.2	-171.4	-178.8	0	0	112.2	Q199 R205 M206 N207	Q199-E203 PolarHBondContact O-N 3.31Å; E203-R205 VanDerWaalsContact C-N 3.31Å; E203-R205 PolarHBondContact O-N 3.32Å; E203-M206 PolarHBondContact O-N 2.78Å; E203-N207 PolarHBondContact O-N 2.98Å; E203-N207 PolarHBondContact O-ND2 2.94Å
204	I	80.1	Confident	81.1	Confident	99 Å²	99	96.5 Å²	96.5	51%	0.508	48%	0.481	S	S	.	.	H	α-helix	trans	-60.2	-40.9	178.7	-69.7	166.6	0	0	0	111.3	K200 L208	K200-I204 HydrophobicContact CG-CD1 4.13Å; K200-I204 WeakPolarHBondContact O-CD1 3.22Å; K200-I204 VanDerWaalsContact O-CG1 3.25Å; K200-I204 WeakPolarHBondContact O-CG1 3.36Å; K200-I204 PolarHBondContact O-N 3.07Å; K200-I204 VanDerWaalsContact O-N 3.09Å; I204-L208 WeakPolarHBondContact O-CB 3.43Å; I204-L208 PolarHBondContact O-N 2.98Å
205	R	78.8	Confident	81	Confident	143 Å²	143	92.8 Å²	92.8	54%	0.54	48%	0.479	S	S	.	.	H	α-helix	trans	-65.1	-41.5	176.3	-82.1	178.8	-78.6	157.8	-9.8	112.3	S201 E202 E203 A209	S201-R205 WeakPolarHBondContact O-CB 3.27Å; S201-R205 WeakPolarHBondContact O-CG 3.37Å; S201-R205 PolarHBondContact O-N 3.42Å; S201-R205 PolarHBondContact O-NE 2.9Å; S201-R205 PolarHBondContact OG-NH2 3.42Å; E202-R205 PolarHBondContact O-N 2.82Å; E202-R205 IonicContact OE1-NH2 2.68Å; E203-R205 VanDerWaalsContact C-N 3.31Å; E203-R205 PolarHBondContact O-N 3.32Å; R205-A209 VanDerWaalsContact O-CB 3.26Å; R205-A209 WeakPolarHBondContact O-CB 3.32Å; R205-A209 PolarHBondContact O-N 2.75Å
206	M	83.9	Confident	81.1	Confident	132 Å²	132	94.5 Å²	94.5	65%	0.65	49%	0.485	S	S	*	.	H	α-helix	trans	-65.8	-40.2	177.8	-72.3	-63.4	-69.8	0	0	112.4	E202 E203 A209 S210	E202-M206 WeakPolarHBondContact O-CG 3.39Å; E202-M206 PolarHBondContact O-N 3.15Å; E203-M206 PolarHBondContact O-N 2.78Å; M206-A209 PolarHBondContact O-N 3.14Å; M206-S210 PolarHBondContact O-N 3.19Å
207	N	82.6	Confident	81.1	Confident	87 Å²	87	97.8 Å²	97.8	47%	0.465	49%	0.491	S	S	.	.	H	α-helix	trans	-66.1	-48.6	176.2	-69.8	-21.5	0	0	0	111.3	E203 A209 S210 D211	E203-N207 PolarHBondContact O-N 2.98Å; E203-N207 PolarHBondContact O-ND2 2.94Å; N207-A209 VanDerWaalsContact C-N 3.3Å; N207-A209 PolarHBondContact O-N 3.09Å; N207-S210 WeakPolarHBondContact O-CA 3.48Å; N207-S210 VanDerWaalsContact O-CB 3.26Å; N207-S210 WeakPolarHBondContact O-CB 3.41Å; N207-S210 PolarHBondContact O-N 3Å; N207-D211 PolarHBondContact O-N 3.45Å
208	L	82.3	Confident	81.2	Confident	113 Å²	113	98.1 Å²	98.1	59%	0.592	49%	0.489	S	S	*	.	H	α-helix	trans	-58.7	-41.2	175.9	-175.2	63.5	0	0	0	112	I204 S210 D211 V212	I204-L208 WeakPolarHBondContact O-CB 3.43Å; I204-L208 PolarHBondContact O-N 2.98Å; L208-S210 PolarHBondContact O-N 3.38Å; L208-D211 PolarHBondContact O-N 3.45Å; L208-V212 WeakPolarHBondContact O-CG2 3.25Å; L208-V212 PolarHBondContact O-N 3.31Å
209	A	79.3	Confident	81	Confident	47 Å²	47	98.6 Å²	98.6	39%	0.388	50%	0.495	S	S	.	.	H	α-helix	trans	-70.6	-13.1	174.5	0	0	0	0	0	113.9	R205 M206 N207 R213	R205-A209 VanDerWaalsContact O-CB 3.26Å; R205-A209 WeakPolarHBondContact O-CB 3.32Å; R205-A209 PolarHBondContact O-N 2.75Å; M206-A209 PolarHBondContact O-N 3.14Å; N207-A209 VanDerWaalsContact C-N 3.3Å; N207-A209 PolarHBondContact O-N 3.09Å; A209-R213 PolarHBondContact O-NE 3.01Å; A209-R213 PolarHBondContact O-NH2 3.34Å
210	S	83.5	Confident	81	Confident	40 Å²	40	95.7 Å²	95.7	28%	0.28	49%	0.487	S	S	.	.	H	α-helix	trans	-80.9	-45.4	166.7	-171.6	0	0	0	0	110.8	M206 N207 L208 R213 K214	M206-S210 PolarHBondContact O-N 3.19Å; N207-S210 WeakPolarHBondContact O-CA 3.48Å; N207-S210 VanDerWaalsContact O-CB 3.26Å; N207-S210 WeakPolarHBondContact O-CB 3.41Å; N207-S210 PolarHBondContact O-N 3Å; L208-S210 PolarHBondContact O-N 3.38Å; S210-R213 PolarHBondContact O-N 2.87Å; S210-K214 WeakPolarHBondContact O-CG 3.22Å; S210-K214 PolarHBondContact O-N 3.49Å; S210-K214 VanDerWaalsContact O-N 3.17Å; S210-K214 WeakPolarHBondContact OG-CE 3.32Å; S210-K214 PolarHBondContact OG-NZ 2.85Å
211	D	82.1	Confident	80.8	Confident	86 Å²	86	93 Å²	93	46%	0.46	48%	0.479	S	S	.	.	H	α-helix	trans	-73.4	-33	-175	-65.4	-30.1	0	0	0	113.1	N207 L208 K214 A215	N207-D211 PolarHBondContact O-N 3.45Å; L208-D211 PolarHBondContact O-N 3.45Å; D211-K214 PolarHBondContact O-N 3.42Å; D211-K214 IonicContact OD1-NZ 2.73Å; D211-K214 PolarHBondContact OD1-NZ 2.91Å; D211-A215 PolarHBondContact O-N 2.71Å
212	V	80	Confident	80.9	Confident	70 Å²	70	93.5 Å²	93.5	42%	0.424	49%	0.486	S	S	.	.	H	α-helix	trans	-58.7	-47.8	169.6	169.8	0	0	0	0	111.1	L208 K214 A215 E216	L208-V212 WeakPolarHBondContact O-CG2 3.25Å; L208-V212 PolarHBondContact O-N 3.31Å; V212-K214 VanDerWaalsContact C-N 3.33Å; V212-K214 PolarHBondContact O-N 2.99Å; V212-A215 WeakPolarHBondContact O-CA 3.33Å; V212-A215 WeakPolarHBondContact O-CB 3.38Å; V212-A215 PolarHBondContact O-N 3.11Å; V212-E216 HydrophobicContact CG1-CG 4.39Å; V212-E216 WeakPolarHBondContact O-CG 2.87Å; V212-E216 PolarHBondContact O-N 3Å
213	R	81.5	Confident	80.6	Confident	150 Å²	150	95.1 Å²	95.1	57%	0.566	49%	0.493	S	S	*	.	H	α-helix	trans	-61.4	-39.2	178.2	-78.8	179.9	-71.4	152.7	-1.9	112.8	A209 S210 A215 E216 E217	A209-R213 PolarHBondContact O-NE 3.01Å; A209-R213 PolarHBondContact O-NH2 3.34Å; S210-R213 PolarHBondContact O-N 2.87Å; R213-A215 VanDerWaalsContact C-N 3.31Å; R213-A215 PolarHBondContact O-N 3.37Å; R213-E216 WeakPolarHBondContact CA-OE2 3.33Å; R213-E216 PolarHBondContact O-N 3.36Å; R213-E217 WeakPolarHBondContact O-CB 2.92Å; R213-E217 PolarHBondContact O-N 3.4Å
214	K	83.3	Confident	80.4	Confident	98 Å²	98	93.5 Å²	93.5	43%	0.426	49%	0.489	S	S	.	.	H	α-helix	trans	-63.3	-37.2	172.8	-64	168.5	-158.5	157.7	0	111.5	S210 D211 V212 N218	S210-K214 WeakPolarHBondContact O-CG 3.22Å; S210-K214 PolarHBondContact O-N 3.49Å; S210-K214 VanDerWaalsContact O-N 3.17Å; S210-K214 WeakPolarHBondContact OG-CE 3.32Å; S210-K214 PolarHBondContact OG-NZ 2.85Å; D211-K214 PolarHBondContact O-N 3.42Å; D211-K214 IonicContact OD1-NZ 2.73Å; D211-K214 PolarHBondContact OD1-NZ 2.91Å; V212-K214 VanDerWaalsContact C-N 3.33Å; V212-K214 PolarHBondContact O-N 2.99Å; K214-N218 WeakPolarHBondContact O-CB 3.49Å; K214-N218 PolarHBondContact O-N 3.33Å; K214-N218 PolarHBondContact O-ND2 3.45Å
215	A	76.8	Confident	80.1	Confident	61 Å²	61	96 Å²	96	50%	0.504	50%	0.495	S	S	.	.	H	α-helix	trans	-68.4	-40.9	177	0	0	0	0	0	111.9	D211 V212 R213 N218 L219	D211-A215 PolarHBondContact O-N 2.71Å; V212-A215 WeakPolarHBondContact O-CA 3.33Å; V212-A215 WeakPolarHBondContact O-CB 3.38Å; V212-A215 PolarHBondContact O-N 3.11Å; R213-A215 VanDerWaalsContact C-N 3.31Å; R213-A215 PolarHBondContact O-N 3.37Å; A215-N218 PolarHBondContact O-N 3.07Å; A215-L219 WeakPolarHBondContact O-CB 3.48Å; A215-L219 PolarHBondContact O-N 3.16Å
216	E	82.5	Confident	79.7	Confident	109 Å²	109	94.7 Å²	94.7	51%	0.509	50%	0.499	S	S	.	.	H	α-helix	trans	-63	-43.3	174.7	-67.7	168.8	149.2	0	0	112	V212 R213 L219 T220	V212-E216 HydrophobicContact CG1-CG 4.39Å; V212-E216 WeakPolarHBondContact O-CG 2.87Å; V212-E216 PolarHBondContact O-N 3Å; R213-E216 WeakPolarHBondContact CA-OE2 3.33Å; R213-E216 PolarHBondContact O-N 3.36Å; E216-L219 PolarHBondContact O-N 2.96Å; E216-T220 WeakPolarHBondContact O-CB 3.5Å; E216-T220 PolarHBondContact O-N 3.29Å; E216-T220 PolarHBondContact O-OG1 3.09Å
217	E	82.6	Confident	79.3	Confident	122 Å²	122	95.4 Å²	95.4	57%	0.57	50%	0.498	S	S	*	.	H	α-helix	trans	-63.1	-45.9	174.8	-176.9	178	-168.3	0	0	111.7	R213 L219 T220 N221	R213-E217 WeakPolarHBondContact O-CB 2.92Å; R213-E217 PolarHBondContact O-N 3.4Å; E217-L219 PolarHBondContact O-N 3.48Å; E217-T220 PolarHBondContact O-N 3.44Å; E217-N221 WeakPolarHBondContact O-CB 3.35Å; E217-N221 PolarHBondContact O-N 3.37Å; E217-N221 PolarHBondContact O-ND2 3.03Å; E217-N221 VanDerWaalsContact O-ND2 3.13Å
218	N	81	Confident	78.9	Confident	108 Å²	108	97 Å²	97	58%	0.578	50%	0.503	S	S	*	.	H	α-helix	trans	-63.1	-40	175.8	-80.4	-58.6	0	0	0	112.4	K214 A215 N221 A222	K214-N218 WeakPolarHBondContact O-CB 3.49Å; K214-N218 PolarHBondContact O-N 3.33Å; K214-N218 PolarHBondContact O-ND2 3.45Å; A215-N218 PolarHBondContact O-N 3.07Å; N218-N221 PolarHBondContact O-N 3.26Å; N218-A222 WeakPolarHBondContact O-CB 3.36Å; N218-A222 PolarHBondContact O-N 3.14Å
219	L	77.2	Confident	78	Confident	101 Å²	101	94.1 Å²	94.1	53%	0.529	50%	0.495	S	S	.	.	H	α-helix	trans	-62.8	-44.9	175.1	178.5	61.6	0	0	0	111.3	A215 E216 E217 N221 A222 Q223	A215-L219 WeakPolarHBondContact O-CB 3.48Å; A215-L219 PolarHBondContact O-N 3.16Å; E216-L219 PolarHBondContact O-N 2.96Å; E217-L219 PolarHBondContact O-N 3.48Å; L219-N221 PolarHBondContact O-N 3.49Å; L219-A222 PolarHBondContact O-N 3.44Å; L219-Q223 HydrophobicContact CD1-CG 4.41Å; L219-Q223 WeakPolarHBondContact O-CG 3.34Å; L219-Q223 PolarHBondContact O-N 3.1Å
220	T	81.1	Confident	77.5	Confident	72 Å²	72	96 Å²	96	44%	0.442	50%	0.502	S	S	.	.	H	α-helix	trans	-60.8	-44.6	177	-54.5	0	0	0	0	111.2	E216 E217 A222 Q223 N224	E216-T220 WeakPolarHBondContact O-CB 3.5Å; E216-T220 PolarHBondContact O-N 3.29Å; E216-T220 PolarHBondContact O-OG1 3.09Å; E217-T220 PolarHBondContact O-N 3.44Å; T220-A222 VanDerWaalsContact C-N 3.35Å; T220-A222 PolarHBondContact O-N 3.33Å; T220-Q223 PolarHBondContact O-N 2.91Å; T220-N224 PolarHBondContact O-N 2.77Å; T220-N224 PolarHBondContact O-ND2 2.81Å
221	N	80.5	Confident	77	Confident	78 Å²	78	99.1 Å²	99.1	42%	0.417	52%	0.515	S	S	.	.	H	α-helix	trans	-64	-36.4	175.6	-76.7	-41.7	0	0	0	113	E217 N218 L219 K225	E217-N221 WeakPolarHBondContact O-CB 3.35Å; E217-N221 PolarHBondContact O-N 3.37Å; E217-N221 PolarHBondContact O-ND2 3.03Å; E217-N221 VanDerWaalsContact O-ND2 3.13Å; N218-N221 PolarHBondContact O-N 3.26Å; L219-N221 PolarHBondContact O-N 3.49Å; N221-K225 WeakPolarHBondContact O-CG 3.39Å; N221-K225 PolarHBondContact O-N 2.76Å
222	A	73.6	Confident	76.5	Confident	55 Å²	55	99.3 Å²	99.3	46%	0.455	52%	0.515	S	S	.	.	H	α-helix	trans	-69	-40.8	174.6	0	0	0	0	0	112.5	N218 L219 T220 K225 L226	N218-A222 WeakPolarHBondContact O-CB 3.36Å; N218-A222 PolarHBondContact O-N 3.14Å; L219-A222 PolarHBondContact O-N 3.44Å; T220-A222 VanDerWaalsContact C-N 3.35Å; T220-A222 PolarHBondContact O-N 3.33Å; A222-K225 PolarHBondContact O-N 2.91Å; A222-L226 WeakPolarHBondContact O-CB 3.31Å; A222-L226 PolarHBondContact O-N 2.99Å
223	Q	76.3	Confident	75.7	Confident	110 Å²	110	100.8 Å²	100.8	51%	0.514	52%	0.518	S	S	.	.	H	α-helix	trans	-62.4	-41.1	176.2	-74	173.8	-3.3	0	0	112.2	L219 T220 L226 K227	L219-Q223 HydrophobicContact CD1-CG 4.41Å; L219-Q223 WeakPolarHBondContact O-CG 3.34Å; L219-Q223 PolarHBondContact O-N 3.1Å; T220-Q223 PolarHBondContact O-N 2.91Å; Q223-L226 PolarHBondContact O-N 2.75Å; Q223-K227 WeakPolarHBondContact O-CB 3.42Å; Q223-K227 PolarHBondContact O-N 2.87Å
224	N	78.7	Confident	75.3	Confident	83 Å²	83	97.4 Å²	97.4	44%	0.444	52%	0.515	S	S	.	.	H	α-helix	trans	-61.4	-48.3	175.5	-73.2	-27	0	0	0	111.7	T220 L226 K227 E228	T220-N224 PolarHBondContact O-N 2.77Å; T220-N224 PolarHBondContact O-ND2 2.81Å; N224-L226 VanDerWaalsContact C-N 3.34Å; N224-L226 PolarHBondContact O-N 3.2Å; N224-K227 WeakPolarHBondContact O-CB 2.94Å; N224-K227 PolarHBondContact O-N 3.5Å; N224-K227 VanDerWaalsContact O-N 3.16Å; N224-E228 PolarHBondContact O-N 3.42Å
225	K	75.2	Confident	74.9	Confident	150 Å²	150	97.6 Å²	97.6	65%	0.652	52%	0.52	S	S	*	.	H	α-helix	trans	-62.5	-37.4	176.7	-71.7	-179.7	176.8	-175.5	0	113.2	N221 A222 K227 E228 A229	N221-K225 WeakPolarHBondContact O-CG 3.39Å; N221-K225 PolarHBondContact O-N 2.76Å; A222-K225 PolarHBondContact O-N 2.91Å; K225-K227 VanDerWaalsContact C-N 3.35Å; K225-E228 PolarHBondContact O-N 3.32Å; K225-A229 PolarHBondContact O-N 3.3Å
226	L	69.8	Low	74.5	Confident	117 Å²	117	99 Å²	99	61%	0.613	52%	0.519	S	S	*	.	H	α-helix	trans	-64	-41.1	174.8	-178.8	61.2	0	0	0	111.4	A222 Q223 N224 A229 V230	A222-L226 WeakPolarHBondContact O-CB 3.31Å; A222-L226 PolarHBondContact O-N 2.99Å; Q223-L226 PolarHBondContact O-N 2.75Å; N224-L226 VanDerWaalsContact C-N 3.34Å; N224-L226 PolarHBondContact O-N 3.2Å; L226-A229 PolarHBondContact O-N 3.25Å; L226-V230 HydrophobicContact CD1-CG2 4.43Å; L226-V230 WeakPolarHBondContact O-CG2 3.33Å; L226-V230 PolarHBondContact O-N 2.99Å
227	K	75.3	Confident	74	Confident	146 Å²	146	99.1 Å²	99.1	64%	0.635	52%	0.517	S	S	*	.	H	α-helix	trans	-64	-38.7	176.5	-171.6	179.6	-179.9	-177.9	0	112.3	Q223 N224 K225 N231	Q223-K227 WeakPolarHBondContact O-CB 3.42Å; Q223-K227 PolarHBondContact O-N 2.87Å; N224-K227 WeakPolarHBondContact O-CB 2.94Å; N224-K227 PolarHBondContact O-N 3.5Å; N224-K227 VanDerWaalsContact O-N 3.16Å; K225-K227 VanDerWaalsContact C-N 3.35Å; K227-N231 VanDerWaalsContact O-CG 3.26Å; K227-N231 PolarHBondContact O-N 3.41Å; K227-N231 PolarHBondContact O-ND2 3.31Å
228	E	73.8	Confident	73.5	Confident	122 Å²	122	98.2 Å²	98.2	57%	0.57	51%	0.513	S	S	*	.	H	α-helix	trans	-62.7	-47.6	172.6	-69.9	170.8	167.2	0	0	111.6	N224 K225 V230 N231 I232	N224-E228 PolarHBondContact O-N 3.42Å; K225-E228 PolarHBondContact O-N 3.32Å; E228-V230 PolarHBondContact O-N 3.19Å; E228-N231 PolarHBondContact O-N 3.41Å; E228-I232 WeakPolarHBondContact O-CG1 3.34Å; E228-I232 PolarHBondContact O-N 3.36Å
229	A	64.9	Low	73.2	Confident	52 Å²	52	98.1 Å²	98.1	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-61.1	-43.3	179	0	0	0	0	0	112.9	K225 L226 N231 I232 E233	K225-A229 PolarHBondContact O-N 3.3Å; L226-A229 PolarHBondContact O-N 3.25Å; A229-N231 VanDerWaalsContact C-N 3.27Å; A229-N231 PolarHBondContact O-N 2.98Å; A229-I232 PolarHBondContact O-N 2.71Å; A229-I232 VanDerWaalsContact O-N 3.11Å; A229-E233 PolarHBondContact O-N 2.76Å; A229-E233 VanDerWaalsContact O-N 3.1Å
230	V	68.7	Low	73	Confident	86 Å²	86	98.4 Å²	98.4	52%	0.521	51%	0.51	S	S	.	.	H	α-helix	trans	-61.4	-33.8	177.3	168.3	0	0	0	0	112.1	L226 E228 I232 P234	L226-V230 HydrophobicContact CD1-CG2 4.43Å; L226-V230 WeakPolarHBondContact O-CG2 3.33Å; L226-V230 PolarHBondContact O-N 2.99Å; E228-V230 PolarHBondContact O-N 3.19Å; V230-I232 VanDerWaalsContact C-N 3.35Å; V230-P234 VanDerWaalsContact O-CD 3.31Å; V230-P234 WeakPolarHBondContact O-CD 3.46Å
231	N	72.3	Confident	72.7	Confident	105 Å²	105	99 Å²	99	56%	0.561	51%	0.51	S	S	*	.	H	α-helix	trans	-71.8	-27.3	176.1	-68.4	-22.7	0	0	0	113.1	K227 E228 A229	K227-N231 VanDerWaalsContact O-CG 3.26Å; K227-N231 PolarHBondContact O-N 3.41Å; K227-N231 PolarHBondContact O-ND2 3.31Å; E228-N231 PolarHBondContact O-N 3.41Å; A229-N231 VanDerWaalsContact C-N 3.27Å; A229-N231 PolarHBondContact O-N 2.98Å
232	I	70.9	Confident	72.5	Confident	90 Å²	90	99.2 Å²	99.2	46%	0.462	51%	0.511	S	S	.	.	H	α-helix	trans	-87.4	-34.2	-175.9	-66.1	166.7	0	0	0	112	E228 A229 V230 I235 L236	E228-I232 WeakPolarHBondContact O-CG1 3.34Å; E228-I232 PolarHBondContact O-N 3.36Å; A229-I232 PolarHBondContact O-N 2.71Å; A229-I232 VanDerWaalsContact O-N 3.11Å; V230-I232 VanDerWaalsContact C-N 3.35Å; I232-I235 WeakPolarHBondContact O-CB 3.42Å; I232-I235 PolarHBondContact O-N 3.25Å; I232-L236 HydrophobicContact CG2-CD1 3.79Å; I232-L236 HydrophobicContact CG2-CG 4.03Å; I232-L236 PolarHBondContact O-N 2.95Å
233	E	65	Low	72.6	Confident	102 Å²	102	101.9 Å²	101.9	48%	0.477	52%	0.515	S	S	.	.	H	α-helix	trans	-48.9	-47.6	-178.6	-164.2	-167.8	-179.1	0	0	115.4	A229 I235 L236 K237	A229-E233 PolarHBondContact O-N 2.76Å; A229-E233 VanDerWaalsContact O-N 3.1Å; E233-I235 VanDerWaalsContact C-N 3.29Å; E233-I235 PolarHBondContact O-N 3Å; E233-L236 PolarHBondContact O-N 3.32Å; E233-K237 HydrophobicContact CG-CD 4.39Å; E233-K237 WeakPolarHBondContact O-CG 3.25Å; E233-K237 PolarHBondContact O-N 3Å; E233-K237 VanDerWaalsContact O-N 3.16Å; E233-K237 WeakPolarHBondContact OE1-CE 3.29Å; E233-K237 IonicContact OE1-NZ 3.7Å; E233-K237 PolarHBondContact OE1-NZ 3.08Å; E233-K237 IonicContact OE2-NZ 2.74Å
234	P	71.5	Confident	72.6	Confident	79 Å²	79	103.8 Å²	103.8	51%	0.513	52%	0.522	S	S	.	.	H	α-helix	trans	-66.2	-29.2	179.9	25.7	-34.8	0	0	0	113.4	V230 Q238	V230-P234 VanDerWaalsContact O-CD 3.31Å; V230-P234 WeakPolarHBondContact O-CD 3.46Å; P234-Q238 PolarHBondContact O-N 3.3Å
235	I	74.9	Confident	72.6	Confident	101 Å²	101	104.8 Å²	104.8	52%	0.518	53%	0.527	S	S	.	.	H	α-helix	trans	-67.2	-51.6	178.8	-53.5	176.9	0	0	0	109.3	I232 E233 K237 Q238 E239	I232-I235 WeakPolarHBondContact O-CB 3.42Å; I232-I235 PolarHBondContact O-N 3.25Å; E233-I235 VanDerWaalsContact C-N 3.29Å; E233-I235 PolarHBondContact O-N 3Å; I235-K237 VanDerWaalsContact C-N 3.32Å; I235-K237 PolarHBondContact O-N 3.33Å; I235-Q238 PolarHBondContact O-N 3.28Å; I235-Q238 VanDerWaalsContact O-N 3.09Å; I235-E239 PolarHBondContact O-N 2.98Å; I235-E239 VanDerWaalsContact O-N 3.11Å
236	L	69.5	Low	72.8	Confident	92 Å²	92	105 Å²	105	48%	0.482	53%	0.528	S	S	.	.	H	α-helix	trans	-60.5	-39.2	179.2	-66.7	174.1	0	0	0	112.3	I232 E233 Q238 E239 I240	I232-L236 HydrophobicContact CG2-CD1 3.79Å; I232-L236 HydrophobicContact CG2-CG 4.03Å; I232-L236 PolarHBondContact O-N 2.95Å; E233-L236 PolarHBondContact O-N 3.32Å; L236-Q238 VanDerWaalsContact C-N 3.32Å; L236-Q238 PolarHBondContact O-N 3.21Å; L236-E239 PolarHBondContact O-N 3.05Å; L236-I240 WeakPolarHBondContact O-CG1 3.32Å; L236-I240 PolarHBondContact O-N 2.91Å; L236-I240 VanDerWaalsContact O-N 3.09Å
237	K	70.6	Confident	73.1	Confident	111 Å²	111	104.2 Å²	104.2	48%	0.483	52%	0.523	S	S	.	.	H	α-helix	trans	-59.4	-41.6	174.7	-75.8	175.3	-178.6	168.2	0	112.1	E233 I235 I241	E233-K237 HydrophobicContact CG-CD 4.39Å; E233-K237 WeakPolarHBondContact O-CG 3.25Å; E233-K237 PolarHBondContact O-N 3Å; E233-K237 VanDerWaalsContact O-N 3.16Å; E233-K237 WeakPolarHBondContact OE1-CE 3.29Å; E233-K237 IonicContact OE1-NZ 3.7Å; E233-K237 PolarHBondContact OE1-NZ 3.08Å; E233-K237 IonicContact OE2-NZ 2.74Å; I235-K237 VanDerWaalsContact C-N 3.32Å; I235-K237 PolarHBondContact O-N 3.33Å; K237-I241 WeakPolarHBondContact O-CG1 3.35Å; K237-I241 PolarHBondContact O-N 3.33Å
238	Q	73.3	Confident	73.2	Confident	103 Å²	103	102.1 Å²	102.1	48%	0.481	52%	0.516	S	S	.	.	H	α-helix	trans	-69	-38.3	178.9	-171.5	58.2	57.5	0	0	112.4	P234 I235 L236 I241 N242	P234-Q238 PolarHBondContact O-N 3.3Å; I235-Q238 PolarHBondContact O-N 3.28Å; I235-Q238 VanDerWaalsContact O-N 3.09Å; L236-Q238 VanDerWaalsContact C-N 3.32Å; L236-Q238 PolarHBondContact O-N 3.21Å; Q238-I241 PolarHBondContact O-N 3.07Å; Q238-N242 PolarHBondContact NE2-OD1 3.13Å; Q238-N242 VanDerWaalsContact NE2-OD1 3.07Å; Q238-N242 PolarHBondContact O-N 2.81Å; Q238-N242 PolarHBondContact O-ND2 3.13Å; Q238-N242 PolarHBondContact O-OD1 3.41Å
239	E	74	Confident	73.5	Confident	105 Å²	105	99.4 Å²	99.4	49%	0.491	51%	0.51	S	S	.	.	H	α-helix	trans	-64.3	-40.8	176.2	-67.3	-167.7	139.2	0	0	112.5	I235 L236 I241 N242 M243	I235-E239 PolarHBondContact O-N 2.98Å; I235-E239 VanDerWaalsContact O-N 3.11Å; L236-E239 PolarHBondContact O-N 3.05Å; E239-I241 VanDerWaalsContact C-N 3.35Å; E239-I241 PolarHBondContact O-N 3.45Å; E239-N242 PolarHBondContact O-N 3.47Å; E239-M243 HydrophobicContact CB-CE 4.45Å; E239-M243 WeakPolarHBondContact O-CG 3.16Å; E239-M243 PolarHBondContact O-N 2.96Å
240	I	72.7	Confident	74.2	Confident	107 Å²	107	101.8 Å²	101.8	55%	0.549	52%	0.515	S	S	.	.	H	α-helix	trans	-60.7	-42.8	176.2	-69.1	166	0	0	0	111.4	L236 M243 K244	L236-I240 WeakPolarHBondContact O-CG1 3.32Å; L236-I240 PolarHBondContact O-N 2.91Å; L236-I240 VanDerWaalsContact O-N 3.09Å; I240-M243 HydrophobicContact CG1-CE 4.41Å; I240-M243 PolarHBondContact O-N 3.44Å; I240-K244 WeakPolarHBondContact O-CB 3.36Å; I240-K244 PolarHBondContact O-N 3.35Å
241	I	75.5	Confident	74.6	Confident	86 Å²	86	102.7 Å²	102.7	44%	0.441	51%	0.512	S	S	.	.	H	α-helix	trans	-61.6	-46.7	175.4	-67.1	165.7	0	0	0	110.5	K237 Q238 E239 M243 K244 N245	K237-I241 WeakPolarHBondContact O-CG1 3.35Å; K237-I241 PolarHBondContact O-N 3.33Å; Q238-I241 PolarHBondContact O-N 3.07Å; E239-I241 VanDerWaalsContact C-N 3.35Å; E239-I241 PolarHBondContact O-N 3.45Å; I241-M243 VanDerWaalsContact C-N 3.32Å; I241-M243 PolarHBondContact O-N 3.49Å; I241-K244 PolarHBondContact O-N 3.07Å; I241-N245 PolarHBondContact O-N 3.46Å; I241-N245 VanDerWaalsContact O-N 3.11Å
242	N	77.2	Confident	74.9	Confident	82 Å²	82	103.1 Å²	103.1	44%	0.439	51%	0.513	S	S	.	.	H	α-helix	trans	-61.8	-38.2	179.6	-67.1	-13.6	0	0	0	112.4	Q238 E239 K246	Q238-N242 PolarHBondContact NE2-OD1 3.13Å; Q238-N242 VanDerWaalsContact NE2-OD1 3.07Å; Q238-N242 PolarHBondContact O-N 2.81Å; Q238-N242 PolarHBondContact O-ND2 3.13Å; Q238-N242 PolarHBondContact O-OD1 3.41Å; E239-N242 PolarHBondContact O-N 3.47Å; N242-K246 PolarHBondContact O-N 3.32Å
243	M	75.4	Confident	75.5	Confident	110 Å²	110	105.5 Å²	105.5	54%	0.542	52%	0.52	S	S	.	.	H	α-helix	trans	-68.8	-44.5	175.4	-73.6	-171.4	-79.1	0	0	112.4	E239 I240 I241 N245 K246 I247	E239-M243 HydrophobicContact CB-CE 4.45Å; E239-M243 WeakPolarHBondContact O-CG 3.16Å; E239-M243 PolarHBondContact O-N 2.96Å; I240-M243 HydrophobicContact CG1-CE 4.41Å; I240-M243 PolarHBondContact O-N 3.44Å; I241-M243 VanDerWaalsContact C-N 3.32Å; I241-M243 PolarHBondContact O-N 3.49Å; M243-N245 VanDerWaalsContact C-N 3.32Å; M243-N245 PolarHBondContact O-N 2.97Å; M243-K246 PolarHBondContact O-N 3.45Å; M243-K246 VanDerWaalsContact O-N 3.17Å; M243-I247 PolarHBondContact O-N 3.36Å; M243-I247 VanDerWaalsContact O-N 3.16Å
244	K	75.7	Confident	76.1	Confident	150 Å²	150	105.3 Å²	105.3	65%	0.652	52%	0.521	S	S	*	.	H	α-helix	trans	-59.2	-42.5	179	-168.1	175.6	-177.3	179.8	0	112	I240 I241 K246 I247 E248	I240-K244 WeakPolarHBondContact O-CB 3.36Å; I240-K244 PolarHBondContact O-N 3.35Å; I241-K244 PolarHBondContact O-N 3.07Å; K244-K246 VanDerWaalsContact C-N 3.35Å; K244-K246 PolarHBondContact O-N 3.45Å; K244-I247 PolarHBondContact O-N 3Å; K244-E248 PolarHBondContact O-N 3.01Å
245	N	78.6	Confident	76.3	Confident	105 Å²	105	108 Å²	108	56%	0.561	53%	0.527	S	S	*	.	H	α-helix	trans	-64.3	-35.8	177.9	-67.8	-12.7	0	0	0	112.9	I241 M243 S249	I241-N245 PolarHBondContact O-N 3.46Å; I241-N245 VanDerWaalsContact O-N 3.11Å; M243-N245 VanDerWaalsContact C-N 3.32Å; M243-N245 PolarHBondContact O-N 2.97Å; N245-S249 PolarHBondContact O-N 2.75Å
246	K	80.3	Confident	76.5	Confident	154 Å²	154	107.5 Å²	107.5	67%	0.67	53%	0.529	S	S	*	.	H	α-helix	trans	-66.2	-41.2	174.3	-78.7	-179.8	175.4	176.5	0	112.5	N242 M243 K244 S249 I250	N242-K246 PolarHBondContact O-N 3.32Å; M243-K246 PolarHBondContact O-N 3.45Å; M243-K246 VanDerWaalsContact O-N 3.17Å; K244-K246 VanDerWaalsContact C-N 3.35Å; K244-K246 PolarHBondContact O-N 3.45Å; K246-S249 PolarHBondContact O-N 3.04Å; K246-I250 WeakPolarHBondContact O-CG1 3.28Å; K246-I250 PolarHBondContact O-N 2.93Å
247	I	74.7	Confident	76.9	Confident	100 Å²	100	108.9 Å²	108.9	51%	0.513	54%	0.536	S	S	.	.	H	α-helix	trans	-62.2	-45.2	-179.1	-69.2	168.2	0	0	0	111.2	M243 K244 S249 I250 K251	M243-I247 PolarHBondContact O-N 3.36Å; M243-I247 VanDerWaalsContact O-N 3.16Å; K244-I247 PolarHBondContact O-N 3Å; I247-S249 VanDerWaalsContact C-N 3.34Å; I247-S249 PolarHBondContact O-N 3.43Å; I247-I250 PolarHBondContact O-N 3.11Å; I247-I250 VanDerWaalsContact O-N 3.13Å; I247-K251 PolarHBondContact O-N 3.45Å; I247-K251 VanDerWaalsContact O-N 3.09Å
248	E	77.6	Confident	77.3	Confident	103 Å²	103	107.8 Å²	107.8	48%	0.481	54%	0.539	S	S	.	.	H	α-helix	trans	-68.9	-33.8	-177.7	-139	62.4	-154.9	0	0	112.3	K244 I250 K251 L252	K244-E248 PolarHBondContact O-N 3.01Å; E248-I250 VanDerWaalsContact C-N 3.29Å; E248-I250 PolarHBondContact O-N 1.99Å; E248-K251 PolarHBondContact O-N 3.35Å; E248-K251 VanDerWaalsContact OE1-CD 3.22Å; E248-K251 WeakPolarHBondContact OE1-CD 3.23Å; E248-K251 IonicContact OE1-NZ 2.71Å; E248-K251 PolarHBondContact OE1-NZ 3.13Å; E248-K251 IonicContact OE2-NZ 2.73Å; E248-K251 PolarHBondContact OE2-NZ 3.37Å; E248-L252 PolarHBondContact O-N 2.7Å
249	S	79.9	Confident	77.4	Confident	64 Å²	64	106.6 Å²	106.6	45%	0.448	53%	0.534	S	S	.	.	H	α-helix	trans	-62.8	-33.1	171.5	-172.1	0	0	0	0	113	N245 K246 I247	N245-S249 PolarHBondContact O-N 2.75Å; K246-S249 PolarHBondContact O-N 3.04Å; I247-S249 VanDerWaalsContact C-N 3.34Å; I247-S249 PolarHBondContact O-N 3.43Å
250	I	79.7	Confident	77.6	Confident	103 Å²	103	104.6 Å²	104.6	53%	0.528	53%	0.528	S	S	.	.	H	α-helix	trans	-73.6	-44.6	177.5	-68.7	165.8	0	0	0	110.9	K246 I247 E248 L252 K253 I254	K246-I250 WeakPolarHBondContact O-CG1 3.28Å; K246-I250 PolarHBondContact O-N 2.93Å; I247-I250 PolarHBondContact O-N 3.11Å; I247-I250 VanDerWaalsContact O-N 3.13Å; E248-I250 VanDerWaalsContact C-N 3.29Å; E248-I250 PolarHBondContact O-N 1.99Å; I250-L252 VanDerWaalsContact C-N 3.32Å; I250-L252 PolarHBondContact O-N 3.25Å; I250-K253 PolarHBondContact O-N 3.14Å; I250-I254 HydrophobicContact CG2-CD1 3.92Å; I250-I254 WeakPolarHBondContact O-CG1 3.31Å; I250-I254 PolarHBondContact O-N 3.41Å; I250-I254 VanDerWaalsContact O-N 3.13Å
251	K	77.5	Confident	77.9	Confident	105 Å²	105	106.8 Å²	106.8	46%	0.457	53%	0.534	S	S	.	.	H	α-helix	trans	-53.5	-48.1	175.5	-76.2	174.2	178	164.3	0	112.2	I247 E248 K253 I254 Q255	I247-K251 PolarHBondContact O-N 3.45Å; I247-K251 VanDerWaalsContact O-N 3.09Å; E248-K251 PolarHBondContact O-N 3.35Å; E248-K251 VanDerWaalsContact OE1-CD 3.22Å; E248-K251 WeakPolarHBondContact OE1-CD 3.23Å; E248-K251 IonicContact OE1-NZ 2.71Å; E248-K251 PolarHBondContact OE1-NZ 3.13Å; E248-K251 IonicContact OE2-NZ 2.73Å; E248-K251 PolarHBondContact OE2-NZ 3.37Å; K251-K253 VanDerWaalsContact C-N 3.29Å; K251-K253 PolarHBondContact O-N 2.47Å; K251-I254 PolarHBondContact O-N 2.61Å; K251-I254 VanDerWaalsContact O-N 3.15Å; K251-Q255 PolarHBondContact O-N 3.42Å
252	L	79.2	Confident	77.9	Confident	114 Å²	114	108.9 Å²	108.9	60%	0.597	54%	0.537	S	S	*	.	H	α-helix	trans	-57.5	-43.5	-177.1	-165	74.8	0	0	0	111.4	E248 I250 Q255 T256	E248-L252 PolarHBondContact O-N 2.7Å; I250-L252 VanDerWaalsContact C-N 3.32Å; I250-L252 PolarHBondContact O-N 3.25Å; L252-Q255 WeakPolarHBondContact O-CB 3.35Å; L252-Q255 PolarHBondContact O-N 2.94Å; L252-T256 PolarHBondContact O-N 2.9Å; L252-T256 VanDerWaalsContact O-N 3.08Å; L252-T256 PolarHBondContact O-OG1 3.33Å
253	K	82.9	Confident	77.8	Confident	139 Å²	139	109.4 Å²	109.4	60%	0.604	54%	0.536	S	S	*	.	H	α-helix	trans	-65.1	-40.9	177.4	-68.6	177.2	-179.2	-178.3	0	112.9	I250 K251 Q255 T256 L257	I250-K253 PolarHBondContact O-N 3.14Å; K251-K253 VanDerWaalsContact C-N 3.29Å; K251-K253 PolarHBondContact O-N 2.47Å; K253-Q255 VanDerWaalsContact C-N 3.28Å; K253-Q255 PolarHBondContact O-N 3.35Å; K253-T256 PolarHBondContact O-N 2.96Å; K253-L257 PolarHBondContact O-N 2.98Å
254	I	77.7	Confident	77.9	Confident	98 Å²	98	109.2 Å²	109.2	50%	0.503	54%	0.537	S	S	.	.	H	α-helix	trans	-60.5	-43.2	174.7	-66.7	168.6	0	0	0	109.6	I250 K251 T256 L257 T258	I250-I254 HydrophobicContact CG2-CD1 3.92Å; I250-I254 WeakPolarHBondContact O-CG1 3.31Å; I250-I254 PolarHBondContact O-N 3.41Å; I250-I254 VanDerWaalsContact O-N 3.13Å; K251-I254 PolarHBondContact O-N 2.61Å; K251-I254 VanDerWaalsContact O-N 3.15Å; I254-T256 PolarHBondContact O-N 3.03Å; I254-L257 WeakPolarHBondContact O-CB 3.47Å; I254-L257 PolarHBondContact O-N 3.29Å; I254-T258 PolarHBondContact O-N 3.36Å; I254-T258 PolarHBondContact O-OG1 2.77Å
255	Q	76.4	Confident	78	Confident	136 Å²	136	107.4 Å²	107.4	64%	0.636	53%	0.531	S	S	*	.	H	α-helix	trans	-63	-40.2	179.4	-151.6	169.8	11.4	0	0	112.5	K251 L252 K253 T258 E259	K251-Q255 PolarHBondContact O-N 3.42Å; L252-Q255 WeakPolarHBondContact O-CB 3.35Å; L252-Q255 PolarHBondContact O-N 2.94Å; K253-Q255 VanDerWaalsContact C-N 3.28Å; K253-Q255 PolarHBondContact O-N 3.35Å; Q255-T258 PolarHBondContact O-N 3.23Å; Q255-E259 PolarHBondContact O-N 3.44Å
256	T	78.3	Confident	77.8	Confident	90 Å²	90	107.7 Å²	107.7	55%	0.552	53%	0.529	S	S	*	.	H	α-helix	trans	-65.6	-39.2	173.8	-40.6	0	0	0	0	112.7	L252 K253 I254 T260	L252-T256 PolarHBondContact O-N 2.9Å; L252-T256 VanDerWaalsContact O-N 3.08Å; L252-T256 PolarHBondContact O-OG1 3.33Å; K253-T256 PolarHBondContact O-N 2.96Å; I254-T256 PolarHBondContact O-N 3.03Å; T256-T260 PolarHBondContact O-N 2.89Å; T256-T260 PolarHBondContact O-OG1 2.86Å
257	L	77.8	Confident	77.7	Confident	121 Å²	121	104.7 Å²	104.7	63%	0.634	52%	0.52	S	S	*	.	H	α-helix	trans	-65.3	-38.3	175.3	-91.8	158.9	0	0	0	112.2	K253 I254 T260 F261	K253-L257 PolarHBondContact O-N 2.98Å; I254-L257 WeakPolarHBondContact O-CB 3.47Å; I254-L257 PolarHBondContact O-N 3.29Å; L257-T260 WeakPolarHBondContact CA-OG1 3.46Å; L257-T260 PolarHBondContact O-OG1 3.5Å; L257-T260 VanDerWaalsContact O-OG1 3.13Å; L257-F261 WeakPolarHBondContact O-CB 3.4Å; L257-F261 PolarHBondContact O-N 2.97Å
258	T	79	Confident	77.7	Confident	88 Å²	88	106.3 Å²	106.3	54%	0.54	52%	0.523	S	S	.	.	H	α-helix	trans	-64.4	-45.7	178.5	-55.2	0	0	0	0	112	I254 Q255 F261 R262	I254-T258 PolarHBondContact O-N 3.36Å; I254-T258 PolarHBondContact O-OG1 2.77Å; Q255-T258 PolarHBondContact O-N 3.23Å; T258-F261 PolarHBondContact O-N 2.84Å; T258-R262 PolarHBondContact O-N 3.27Å; T258-R262 VanDerWaalsContact O-N 3.08Å
259	E	75.8	Confident	77.6	Confident	79 Å²	79	105.1 Å²	105.1	37%	0.369	52%	0.52	S	S	.	.	H	α-helix	trans	-70.6	-37.4	-178.2	-170.6	58.3	-157.3	0	0	112.3	Q255 F261 R262 Q263	Q255-E259 PolarHBondContact O-N 3.44Å; E259-F261 VanDerWaalsContact C-N 3.33Å; E259-F261 PolarHBondContact O-N 2.79Å; E259-R262 PolarHBondContact O-N 2.92Å; E259-R262 IonicContact OE1-CZ 3.66Å; E259-R262 IonicContact OE1-NE 3.04Å; E259-R262 PolarHBondContact OE1-NE 2.8Å; E259-R262 IonicContact OE1-NH2 3.49Å; E259-R262 PolarHBondContact OE1-NH2 2.73Å; E259-R262 IonicContact OE2-CZ 3.88Å; E259-R262 IonicContact OE2-NE 2.72Å; E259-R262 PolarHBondContact OE2-NE 2.78Å; E259-R262 IonicContact OE2-NH2 3.44Å; E259-R262 PolarHBondContact OE2-NH2 2.82Å; E259-Q263 WeakPolarHBondContact O-CG 3.22Å; E259-Q263 PolarHBondContact O-N 3.29Å
260	T	78.2	Confident	77.4	Confident	62 Å²	62	108 Å²	108	38%	0.38	53%	0.526	S	S	.	.	H	α-helix	trans	-67.1	-32.8	174	45.3	0	0	0	0	112.6	T256 L257 N264	T256-T260 PolarHBondContact O-N 2.89Å; T256-T260 PolarHBondContact O-OG1 2.86Å; L257-T260 WeakPolarHBondContact CA-OG1 3.46Å; L257-T260 PolarHBondContact O-OG1 3.5Å; L257-T260 VanDerWaalsContact O-OG1 3.13Å; T260-N264 PolarHBondContact O-N 3.44Å; T260-N264 PolarHBondContact O-ND2 3.22Å
261	F	77.5	Confident	77.2	Confident	154 Å²	154	107.7 Å²	107.7	68%	0.675	53%	0.525	S	S	*	.	H	α-helix	trans	-64.9	-43.2	171.4	-161.1	-87.1	0	0	0	111.8	L257 T258 E259 Q263 N264 E265	L257-F261 WeakPolarHBondContact O-CB 3.4Å; L257-F261 PolarHBondContact O-N 2.97Å; T258-F261 PolarHBondContact O-N 2.84Å; E259-F261 VanDerWaalsContact C-N 3.33Å; E259-F261 PolarHBondContact O-N 2.79Å; F261-Q263 VanDerWaalsContact C-N 3.34Å; F261-Q263 PolarHBondContact O-N 3.34Å; F261-N264 PolarHBondContact O-N 3.11Å; F261-E265 PolarHBondContact O-N 3.2Å
262	R	76.1	Confident	77.1	Confident	130 Å²	130	108.1 Å²	108.1	49%	0.491	53%	0.528	S	S	.	.	H	α-helix	trans	-62.1	-39.1	178.2	-164	174.3	75.1	108.1	6.2	112.6	T258 E259 E265 Q266	T258-R262 PolarHBondContact O-N 3.27Å; T258-R262 VanDerWaalsContact O-N 3.08Å; E259-R262 PolarHBondContact O-N 2.92Å; E259-R262 IonicContact OE1-CZ 3.66Å; E259-R262 IonicContact OE1-NE 3.04Å; E259-R262 PolarHBondContact OE1-NE 2.8Å; E259-R262 IonicContact OE1-NH2 3.49Å; E259-R262 PolarHBondContact OE1-NH2 2.73Å; E259-R262 IonicContact OE2-CZ 3.88Å; E259-R262 IonicContact OE2-NE 2.72Å; E259-R262 PolarHBondContact OE2-NE 2.78Å; E259-R262 IonicContact OE2-NH2 3.44Å; E259-R262 PolarHBondContact OE2-NH2 2.82Å; R262-E265 PolarHBondContact O-N 2.94Å; R262-Q266 PolarHBondContact O-N 3.31Å; R262-Q266 VanDerWaalsContact O-N 3.16Å
263	Q	76.3	Confident	76.8	Confident	93 Å²	93	108.4 Å²	108.4	44%	0.435	53%	0.526	S	S	.	.	H	α-helix	trans	-62.6	-44.3	174.4	-70.7	168.9	5.3	0	0	111.9	E259 F261 E265 Q266 I267	E259-Q263 WeakPolarHBondContact O-CG 3.22Å; E259-Q263 PolarHBondContact O-N 3.29Å; F261-Q263 VanDerWaalsContact C-N 3.34Å; F261-Q263 PolarHBondContact O-N 3.34Å; Q263-E265 VanDerWaalsContact C-N 3.32Å; Q263-E265 PolarHBondContact O-N 3.02Å; Q263-Q266 PolarHBondContact O-N 3.3Å; Q263-I267 WeakPolarHBondContact O-CG1 3.43Å; Q263-I267 PolarHBondContact O-N 2.97Å; Q263-I267 VanDerWaalsContact O-N 3.16Å
264	N	77.5	Confident	76.3	Confident	105 Å²	105	107 Å²	107	56%	0.561	52%	0.522	S	S	*	.	H	α-helix	trans	-63	-37.3	176.5	-70.1	-31.6	0	0	0	112.4	T260 F261 I267 F268	T260-N264 PolarHBondContact O-N 3.44Å; T260-N264 PolarHBondContact O-ND2 3.22Å; F261-N264 PolarHBondContact O-N 3.11Å; N264-I267 PolarHBondContact O-N 3.48Å; N264-F268 WeakPolarHBondContact O-CB 3.38Å; N264-F268 PolarHBondContact O-N 3.03Å
265	E	76.8	Confident	75.8	Confident	112 Å²	112	108.2 Å²	108.2	52%	0.523	53%	0.528	S	S	.	.	H	α-helix	trans	-65.2	-37.6	175.9	-174.2	175.1	-163.1	0	0	112.5	F261 R262 Q263 N269	F261-E265 PolarHBondContact O-N 3.2Å; R262-E265 PolarHBondContact O-N 2.94Å; Q263-E265 VanDerWaalsContact C-N 3.32Å; Q263-E265 PolarHBondContact O-N 3.02Å; E265-N269 PolarHBondContact O-N 3.42Å; E265-N269 VanDerWaalsContact O-N 3.15Å; E265-N269 PolarHBondContact O-ND2 2.79Å
266	Q	75.2	Confident	75.3	Confident	112 Å²	112	106.2 Å²	106.2	52%	0.523	52%	0.521	S	S	.	.	H	α-helix	trans	-63.3	-49.4	173.8	-68.6	-175.3	-75.1	0	0	111.4	R262 Q263 F268 N269 E270	R262-Q266 PolarHBondContact O-N 3.31Å; R262-Q266 VanDerWaalsContact O-N 3.16Å; Q263-Q266 PolarHBondContact O-N 3.3Å; Q266-F268 VanDerWaalsContact C-N 3.3Å; Q266-F268 PolarHBondContact O-N 3.31Å; Q266-N269 PolarHBondContact O-N 2.96Å; Q266-N269 VanDerWaalsContact O-N 3.11Å; Q266-E270 PolarHBondContact O-N 3.3Å
267	I	76.7	Confident	74.6	Confident	91 Å²	91	109.4 Å²	109.4	47%	0.467	53%	0.527	S	S	.	.	H	α-helix	trans	-58.1	-42.1	178.4	-64.7	165	0	0	0	111.2	Q263 N264 N269 E270 L271	Q263-I267 WeakPolarHBondContact O-CG1 3.43Å; Q263-I267 PolarHBondContact O-N 2.97Å; Q263-I267 VanDerWaalsContact O-N 3.16Å; N264-I267 PolarHBondContact O-N 3.48Å; I267-N269 VanDerWaalsContact C-N 3.35Å; I267-N269 PolarHBondContact O-N 2.87Å; I267-E270 PolarHBondContact O-N 2.94Å; I267-L271 HydrophobicContact CG2-CD1 4.16Å; I267-L271 WeakPolarHBondContact O-CG 3.4Å; I267-L271 PolarHBondContact O-N 3.18Å
268	F	76.1	Confident	73.6	Confident	133 Å²	133	109.6 Å²	109.6	58%	0.583	53%	0.528	S	S	*	.	H	α-helix	trans	-62.6	-39.9	177.5	-175.1	-101.6	0	0	0	112.6	N264 Q266 L271 K272	N264-F268 WeakPolarHBondContact O-CB 3.38Å; N264-F268 PolarHBondContact O-N 3.03Å; Q266-F268 VanDerWaalsContact C-N 3.3Å; Q266-F268 PolarHBondContact O-N 3.31Å; F268-L271 PolarHBondContact O-N 2.99Å; F268-K272 WeakPolarHBondContact O-CB 3.37Å; F268-K272 PolarHBondContact O-N 3.4Å
269	N	75.4	Confident	72.5	Confident	79 Å²	79	112.3 Å²	112.3	42%	0.422	54%	0.539	S	S	.	.	H	α-helix	trans	-69.2	-34.9	177	-78.4	-62.8	0	0	0	112.7	E265 Q266 I267 K272 Q273	E265-N269 PolarHBondContact O-N 3.42Å; E265-N269 VanDerWaalsContact O-N 3.15Å; E265-N269 PolarHBondContact O-ND2 2.79Å; Q266-N269 PolarHBondContact O-N 2.96Å; Q266-N269 VanDerWaalsContact O-N 3.11Å; I267-N269 VanDerWaalsContact C-N 3.35Å; I267-N269 PolarHBondContact O-N 2.87Å; N269-K272 PolarHBondContact O-N 3.03Å; N269-Q273 WeakPolarHBondContact O-CG 3.44Å; N269-Q273 PolarHBondContact O-N 3.02Å; N269-Q273 VanDerWaalsContact O-N 3.13Å
270	E	75.2	Confident	71.5	Confident	123 Å²	123	117 Å²	117	58%	0.575	56%	0.559	S	S	*	*	H	α-helix	trans	-63.8	-47.8	172.4	-69.7	-176.7	175.1	0	0	112	Q266 I267 K272 Q273 Q274	Q266-E270 PolarHBondContact O-N 3.3Å; I267-E270 PolarHBondContact O-N 2.94Å; E270-K272 VanDerWaalsContact C-N 3.28Å; E270-K272 PolarHBondContact O-N 3.03Å; E270-Q273 WeakPolarHBondContact O-CB 3.47Å; E270-Q273 PolarHBondContact O-N 3.49Å; E270-Q273 VanDerWaalsContact O-N 3.11Å; E270-Q274 WeakPolarHBondContact O-CG 3.3Å; E270-Q274 PolarHBondContact O-N 3.47Å
271	L	75.5	Confident	70.3	Confident	97 Å²	97	120.5 Å²	120.5	51%	0.508	58%	0.575	S	S	.	*	H	α-helix	trans	-58.6	-40	175.8	-71.4	169.4	0	0	0	111.8	I267 F268 Q273 Q274 L275	I267-L271 HydrophobicContact CG2-CD1 4.16Å; I267-L271 WeakPolarHBondContact O-CG 3.4Å; I267-L271 PolarHBondContact O-N 3.18Å; F268-L271 PolarHBondContact O-N 2.99Å; L271-Q273 VanDerWaalsContact C-N 3.33Å; L271-Q273 PolarHBondContact O-N 2.9Å; L271-Q274 PolarHBondContact O-N 3.18Å; L271-L275 PolarHBondContact O-N 2.94Å
272	K	76.3	Confident	68.7	Low	115 Å²	115	119.8 Å²	119.8	50%	0.5	58%	0.577	S	S	.	*	H	α-helix	trans	-62.4	-37.5	176.1	-164	173.4	-176.7	178.9	0	112.3	F268 N269 E270 I276	F268-K272 WeakPolarHBondContact O-CB 3.37Å; F268-K272 PolarHBondContact O-N 3.4Å; N269-K272 PolarHBondContact O-N 3.03Å; E270-K272 VanDerWaalsContact C-N 3.28Å; E270-K272 PolarHBondContact O-N 3.03Å; K272-I276 WeakPolarHBondContact O-CD1 2.26Å; K272-I276 WeakPolarHBondContact O-CG1 3.37Å; K272-I276 PolarHBondContact O-N 3.31Å
273	Q	71.7	Confident	67.2	Low	120 Å²	120	121 Å²	121	56%	0.561	59%	0.593	S	S	*	*	H	α-helix	trans	-70	-37.6	173.5	-71.9	-69.9	-10.3	0	0	112.8	N269 E270 L271 I276 K277	N269-Q273 WeakPolarHBondContact O-CG 3.44Å; N269-Q273 PolarHBondContact O-N 3.02Å; N269-Q273 VanDerWaalsContact O-N 3.13Å; E270-Q273 WeakPolarHBondContact O-CB 3.47Å; E270-Q273 PolarHBondContact O-N 3.49Å; E270-Q273 VanDerWaalsContact O-N 3.11Å; L271-Q273 VanDerWaalsContact C-N 3.33Å; L271-Q273 PolarHBondContact O-N 2.9Å; Q273-I276 PolarHBondContact O-N 2.99Å; Q273-K277 PolarHBondContact O-N 2.78Å
274	Q	73.6	Confident	65.9	Low	110 Å²	110	122.7 Å²	122.7	51%	0.514	61%	0.606	S	S	.	*	H	α-helix	trans	-63	-42.9	174.1	-65.9	177.4	25.2	0	0	111.4	E270 L271 I276 K277 L278	E270-Q274 WeakPolarHBondContact O-CG 3.3Å; E270-Q274 PolarHBondContact O-N 3.47Å; L271-Q274 PolarHBondContact O-N 3.18Å; Q274-I276 VanDerWaalsContact C-N 3.35Å; Q274-I276 PolarHBondContact O-N 3Å; Q274-K277 PolarHBondContact O-N 3.11Å; Q274-L278 PolarHBondContact O-N 2.9Å
275	L	67	Low	64.7	Low	122 Å²	122	125.2 Å²	125.2	64%	0.639	61%	0.612	S	S	*	*	H	α-helix	trans	-60.6	-41.6	177.2	-166.4	72.6	0	0	0	112.3	L271 K277 L278 N279	L271-L275 PolarHBondContact O-N 2.94Å; L275-K277 VanDerWaalsContact C-N 3.32Å; L275-K277 PolarHBondContact O-N 2.94Å; L275-L278 PolarHBondContact O-N 3.24Å; L275-N279 WeakPolarHBondContact O-CB 3.39Å; L275-N279 PolarHBondContact O-N 3.5Å
276	I	66.5	Low	63.7	Low	94 Å²	94	127.3 Å²	127.3	48%	0.482	62%	0.621	S	S	.	*	H	α-helix	trans	-64.6	-35	177	-69	165.4	0	0	0	111.8	K272 Q273 Q274	K272-I276 WeakPolarHBondContact O-CD1 2.26Å; K272-I276 WeakPolarHBondContact O-CG1 3.37Å; K272-I276 PolarHBondContact O-N 3.31Å; Q273-I276 PolarHBondContact O-N 2.99Å; Q274-I276 VanDerWaalsContact C-N 3.35Å; Q274-I276 PolarHBondContact O-N 3Å
277	K	61.7	Low	62.8	Low	157 Å²	157	127.6 Å²	127.6	68%	0.683	63%	0.626	S	S	*	*	H	α-helix	trans	-68.5	-44.2	173.7	-72.8	-179.8	178.5	178.1	0	112	Q273 Q274 L275 N279 K280	Q273-K277 PolarHBondContact O-N 2.78Å; Q274-K277 PolarHBondContact O-N 3.11Å; L275-K277 VanDerWaalsContact C-N 3.32Å; L275-K277 PolarHBondContact O-N 2.94Å; K277-N279 PolarHBondContact O-N 3.29Å; K277-K280 PolarHBondContact O-N 3.26Å
278	L	57.2	Low	61.9	Low	126 Å²	126	127.4 Å²	127.4	66%	0.66	63%	0.625	S	S	*	*	H	α-helix	trans	-61.1	-41.9	177.7	-81.7	160.7	0	0	0	112.3	Q274 L275 K280 N281	Q274-L278 PolarHBondContact O-N 2.9Å; L275-L278 PolarHBondContact O-N 3.24Å; L278-K280 PolarHBondContact O-N 3.28Å; L278-N281 PolarHBondContact O-N 3.3Å
279	N	55.4	Low	61.1	Low	145 Å²	145	125.4 Å²	125.4	78%	0.775	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-2.6	-175	-158.6	27.9	0	0	0	114.9	L275 K277	L275-N279 WeakPolarHBondContact O-CB 3.39Å; L275-N279 PolarHBondContact O-N 3.5Å; K277-N279 PolarHBondContact O-N 3.29Å
280	K	55	Low	60.4	Low	178 Å²	178	127.5 Å²	127.5	77%	0.774	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-13.6	173.1	-77.2	-169.6	172.8	-174.2	0	114.7	K277 L278	K277-K280 PolarHBondContact O-N 3.26Å; L278-K280 PolarHBondContact O-N 3.28Å
281	N	53.9	Low	60	Low	135 Å²	135	126.3 Å²	126.3	72%	0.722	63%	0.625	S	S	*	*	S	Bend	trans	-113.6	-7.3	-155.2	-83.8	11.2	0	0	0	118	L278	L278-N281 PolarHBondContact O-N 3.3Å
282	L	44.5	Very low	59.4	Low	139 Å²	139	126 Å²	126	73%	0.728	62%	0.623	S	S	*	*			trans	-132	117.7	-166.4	-135.9	73.8	0	0	0	116.8	N284	L282-N284 PolarHBondContact O-N 3.33Å
283	N	43.1	Very low	59	Low	154 Å²	154	125.2 Å²	125.2	82%	0.824	62%	0.624	S	S	*	*			trans	-86.2	90.1	168.3	-89.6	-24.5	0	0	0	111
284	N	50.8	Low	58.9	Low	130 Å²	130	125 Å²	125	70%	0.695	63%	0.625	S	S	*	*			trans	-166.4	80.6	157.2	-103.5	-30	0	0	0	110.5	L282	L282-N284 PolarHBondContact O-N 3.33Å
285	K	51.2	Low	58.8	Low	158 Å²	158	127.7 Å²	127.7	69%	0.687	63%	0.631	S	S	*	*			trans	-76.2	-42	-163.8	-75.3	-175.8	173.9	179	0	115.7	I289	K285-I289 WeakPolarHBondContact O-CD1 3.42Å; K285-I289 WeakPolarHBondContact O-CG1 3.39Å
286	Q	55.5	Low	58.8	Low	155 Å²	155	125.4 Å²	125.4	72%	0.724	62%	0.619	S	S	*	*	H	α-helix	trans	-64.6	-59.9	-165.4	-129.9	73.5	2.8	0	0	113.4	I288 I289	Q286-I288 VanDerWaalsContact C-N 3.27Å; Q286-I288 PolarHBondContact O-N 3.47Å; Q286-I289 PolarHBondContact O-N 2.86Å
287	N	57.2	Low	58.8	Low	118 Å²	118	128 Å²	128	63%	0.631	63%	0.626	S	S	*	*	H	α-helix	trans	-74.2	-15.8	-165.5	-150.9	-9.6	0	0	0	113.6	N291	N287-N291 PolarHBondContact O-ND2 3.25Å; N287-N291 PolarHBondContact OD1-ND2 3.03Å
288	I	58	Low	59.1	Low	87 Å²	87	127.8 Å²	127.8	45%	0.446	63%	0.625	S	S	.	*	H	α-helix	trans	-83	-33.9	176.2	-62	177.6	0	0	0	110.9	Q286 L292	Q286-I288 VanDerWaalsContact C-N 3.27Å; Q286-I288 PolarHBondContact O-N 3.47Å; I288-L292 HydrophobicContact CG2-CD1 3.89Å; I288-L292 HydrophobicContact CG2-CG 4.37Å; I288-L292 WeakPolarHBondContact O-CB 3.44Å; I288-L292 WeakPolarHBondContact O-CG 3Å; I288-L292 PolarHBondContact O-N 3.12Å
289	I	58.7	Low	59.5	Low	92 Å²	92	124.5 Å²	124.5	47%	0.472	61%	0.609	S	S	.	*	H	α-helix	trans	-68.3	-42.3	-177.4	-69.8	170.7	0	0	0	111.5	K285 Q286 L292 L293	K285-I289 WeakPolarHBondContact O-CD1 3.42Å; K285-I289 WeakPolarHBondContact O-CG1 3.39Å; Q286-I289 PolarHBondContact O-N 2.86Å; I289-L292 PolarHBondContact O-N 2.77Å; I289-L293 HydrophobicContact CG2-CD1 3.96Å; I289-L293 WeakPolarHBondContact O-CG 3.27Å; I289-L293 PolarHBondContact O-N 3.1Å
290	E	59.6	Low	59.6	Low	123 Å²	123	123 Å²	123	58%	0.575	60%	0.597	S	S	*	*	H	α-helix	trans	-66.3	-43.2	179.3	-65.2	-176.7	142.5	0	0	112	L292 L293 I294	E290-L292 PolarHBondContact O-N 3.24Å; E290-L293 PolarHBondContact O-N 3.42Å; E290-I294 WeakPolarHBondContact O-CG1 3.41Å; E290-I294 PolarHBondContact O-N 3.25Å
291	N	68	Low	60	Low	98 Å²	98	120.7 Å²	120.7	52%	0.524	59%	0.589	S	S	.	*	H	α-helix	trans	-64.9	-37.3	175.6	-77.6	-71.7	0	0	0	112.3	N287 W295	N287-N291 PolarHBondContact O-ND2 3.25Å; N287-N291 PolarHBondContact OD1-ND2 3.03Å; N291-W295 WeakPolarHBondContact O-CB 3.22Å; N291-W295 PolarHBondContact O-N 3.26Å
292	L	61.7	Low	60.4	Low	90 Å²	90	118.6 Å²	118.6	47%	0.471	58%	0.578	S	S	.	*	H	α-helix	trans	-65.2	-41.7	171.3	-79.1	171	0	0	0	112.2	I288 I289 E290 I294 W295 I296	I288-L292 HydrophobicContact CG2-CD1 3.89Å; I288-L292 HydrophobicContact CG2-CG 4.37Å; I288-L292 WeakPolarHBondContact O-CB 3.44Å; I288-L292 WeakPolarHBondContact O-CG 3Å; I288-L292 PolarHBondContact O-N 3.12Å; I289-L292 PolarHBondContact O-N 2.77Å; E290-L292 PolarHBondContact O-N 3.24Å; L292-I294 PolarHBondContact O-N 3.3Å; L292-W295 PolarHBondContact O-N 3.24Å; L292-I296 WeakPolarHBondContact O-CB 3.43Å; L292-I296 WeakPolarHBondContact O-CD1 3.38Å; L292-I296 WeakPolarHBondContact O-CG1 3.48Å; L292-I296 PolarHBondContact O-N 3.45Å
293	L	68.1	Low	61	Low	99 Å²	99	116.6 Å²	116.6	52%	0.518	57%	0.567	S	S	.	*	H	α-helix	trans	-63.6	-39.6	177.7	-79.7	165.5	0	0	0	112.6	I289 E290 K297	I289-L293 HydrophobicContact CG2-CD1 3.96Å; I289-L293 WeakPolarHBondContact O-CG 3.27Å; I289-L293 PolarHBondContact O-N 3.1Å; E290-L293 PolarHBondContact O-N 3.42Å; L293-K297 PolarHBondContact O-N 3.22Å
294	I	70.5	Confident	61.8	Low	114 Å²	114	114.1 Å²	114.1	59%	0.585	55%	0.554	S	S	*	*	H	α-helix	trans	-65.2	-43.5	174.1	-67.2	166.3	0	0	0	110.5	E290 L292 K298	E290-I294 WeakPolarHBondContact O-CG1 3.41Å; E290-I294 PolarHBondContact O-N 3.25Å; L292-I294 PolarHBondContact O-N 3.3Å; I294-K298 WeakPolarHBondContact O-CB 3.47Å; I294-K298 PolarHBondContact O-N 3.45Å; I294-K298 VanDerWaalsContact O-N 3.1Å
295	W	71.7	Confident	62.2	Low	167 Å²	167	114 Å²	114	63%	0.633	55%	0.553	S	S	*	*	H	α-helix	trans	-66.4	-39.5	177.7	-172.6	89.5	0	0	0	112.5	N291 L292 N299	N291-W295 WeakPolarHBondContact O-CB 3.22Å; N291-W295 PolarHBondContact O-N 3.26Å; L292-W295 PolarHBondContact O-N 3.24Å; W295-N299 VanDerWaalsContact CD2-ND2 3.33Å; W295-N299 PolarHBondContact O-N 2.98Å; W295-N299 VanDerWaalsContact O-N 3.13Å; W295-N299 PolarHBondContact O-ND2 3.37Å
296	I	66.5	Low	62.5	Low	75 Å²	75	112.6 Å²	112.6	39%	0.385	55%	0.548	S	S	.	.	H	α-helix	trans	-61.4	-56.2	175.3	-72.5	163.4	0	0	0	109.8	L292 K298 N299 E300	L292-I296 WeakPolarHBondContact O-CB 3.43Å; L292-I296 WeakPolarHBondContact O-CD1 3.38Å; L292-I296 WeakPolarHBondContact O-CG1 3.48Å; L292-I296 PolarHBondContact O-N 3.45Å; I296-K298 VanDerWaalsContact C-N 3.27Å; I296-K298 PolarHBondContact O-N 3Å; I296-N299 CarbonylContact O-C 3.57Å; I296-N299 PolarHBondContact O-N 3.1Å; I296-E300 HydrophobicContact CG2-CG 4.2Å; I296-E300 WeakPolarHBondContact O-CG 3.46Å; I296-E300 PolarHBondContact O-N 3.07Å
297	K	66.9	Low	62.6	Low	147 Å²	147	110.7 Å²	110.7	64%	0.639	54%	0.538	S	S	*	.	H	α-helix	trans	-54.7	-42.4	179.3	-81.8	-169.2	170.6	-171.8	0	113	L293 N299 E300 E301	L293-K297 PolarHBondContact O-N 3.22Å; K297-N299 VanDerWaalsContact C-N 3.28Å; K297-N299 PolarHBondContact O-N 3.16Å; K297-E300 PolarHBondContact O-N 3.18Å; K297-E301 PolarHBondContact O-N 3.09Å
298	K	67.6	Low	62.5	Low	153 Å²	153	110 Å²	110	67%	0.665	53%	0.534	S	S	*	.	H	α-helix	trans	-68.7	-25.7	-179.9	-165.9	169.8	-175.3	175.4	0	113.2	I294 I296	I294-K298 WeakPolarHBondContact O-CB 3.47Å; I294-K298 PolarHBondContact O-N 3.45Å; I294-K298 VanDerWaalsContact O-N 3.1Å; I296-K298 VanDerWaalsContact C-N 3.27Å; I296-K298 PolarHBondContact O-N 3Å
299	N	64.7	Low	62.8	Low	58 Å²	58	108.1 Å²	108.1	31%	0.31	54%	0.536	S	S	.	.	H	α-helix	trans	-84.5	-33.6	170.7	-76.2	-78.5	0	0	0	112.3	W295 I296 K297 N302 L303	W295-N299 VanDerWaalsContact CD2-ND2 3.33Å; W295-N299 PolarHBondContact O-N 2.98Å; W295-N299 VanDerWaalsContact O-N 3.13Å; W295-N299 PolarHBondContact O-ND2 3.37Å; I296-N299 CarbonylContact O-C 3.57Å; I296-N299 PolarHBondContact O-N 3.1Å; K297-N299 VanDerWaalsContact C-N 3.28Å; K297-N299 PolarHBondContact O-N 3.16Å; N299-N302 PolarHBondContact O-N 3.43Å; N299-L303 WeakPolarHBondContact O-CB 3.01Å; N299-L303 WeakPolarHBondContact O-CG 3.15Å; N299-L303 PolarHBondContact O-N 3.24Å
300	E	59.5	Low	63.1	Low	113 Å²	113	110.3 Å²	110.3	53%	0.528	54%	0.543	S	S	.	.	H	α-helix	trans	-59.8	-47.9	172.3	-72.5	-179.8	129.8	0	0	111.4	I296 K297 N302 L303 L304	I296-E300 HydrophobicContact CG2-CG 4.2Å; I296-E300 WeakPolarHBondContact O-CG 3.46Å; I296-E300 PolarHBondContact O-N 3.07Å; K297-E300 PolarHBondContact O-N 3.18Å; E300-N302 VanDerWaalsContact C-N 3.3Å; E300-N302 PolarHBondContact O-N 3.12Å; E300-L303 PolarHBondContact O-N 2.91Å; E300-L304 WeakPolarHBondContact O-CB 3.04Å; E300-L304 PolarHBondContact O-N 2.95Å
301	E	61.7	Low	63.2	Low	130 Å²	130	108.5 Å²	108.5	61%	0.607	54%	0.537	S	S	*	.	H	α-helix	trans	-60.6	-37.8	174.9	-77.2	-172.4	129.2	0	0	112.8	K297 N305	K297-E301 PolarHBondContact O-N 3.09Å; E301-N305 WeakPolarHBondContact O-CB 3.42Å; E301-N305 PolarHBondContact O-N 3.03Å; E301-N305 VanDerWaalsContact O-N 3.1Å; E301-N305 PolarHBondContact O-ND2 3.17Å
302	N	62.4	Low	63.1	Low	90 Å²	90	108.2 Å²	108.2	48%	0.481	54%	0.535	S	S	.	.	H	α-helix	trans	-72.8	-38.2	-178.5	-154	7.6	0	0	0	111.3	N299 E300 Q306	N299-N302 PolarHBondContact O-N 3.43Å; E300-N302 VanDerWaalsContact C-N 3.3Å; E300-N302 PolarHBondContact O-N 3.12Å; N302-Q306 WeakPolarHBondContact O-CG 3.17Å; N302-Q306 PolarHBondContact O-N 2.89Å
303	L	57.8	Low	63.5	Low	97 Å²	97	109.8 Å²	109.8	51%	0.508	54%	0.542	S	S	.	.	H	α-helix	trans	-65.9	-47.9	171.2	-76.2	165.3	0	0	0	111.5	N299 E300 N305 Q306 F307	N299-L303 WeakPolarHBondContact O-CB 3.01Å; N299-L303 WeakPolarHBondContact O-CG 3.15Å; N299-L303 PolarHBondContact O-N 3.24Å; E300-L303 PolarHBondContact O-N 2.91Å; L303-N305 VanDerWaalsContact C-N 3.32Å; L303-N305 PolarHBondContact O-N 3.22Å; L303-Q306 PolarHBondContact O-N 2.97Å; L303-F307 HydrophobicContact CD2-CE2 4.1Å; L303-F307 WeakPolarHBondContact O-CB 3.43Å; L303-F307 WeakPolarHBondContact O-CD2 3.28Å; L303-F307 PolarHBondContact O-N 3.19Å
304	L	59.2	Low	63.7	Low	103 Å²	103	110 Å²	110	54%	0.539	54%	0.54	S	S	.	.	H	α-helix	trans	-59.8	-42	-177.3	-166.4	71.1	0	0	0	111.6	E300 N308	E300-L304 WeakPolarHBondContact O-CB 3.04Å; E300-L304 PolarHBondContact O-N 2.95Å; L304-N308 WeakPolarHBondContact O-CB 3.1Å; L304-N308 PolarHBondContact O-N 3.04Å; L304-N308 VanDerWaalsContact O-N 3.08Å; L304-N308 PolarHBondContact O-ND2 2.9Å
305	N	59.6	Low	63.8	Low	126 Å²	126	108.5 Å²	108.5	67%	0.674	53%	0.533	S	S	*	.	H	α-helix	trans	-71.4	-34.3	177	-75.7	-53.4	0	0	0	113.5	E301 L303	E301-N305 WeakPolarHBondContact O-CB 3.42Å; E301-N305 PolarHBondContact O-N 3.03Å; E301-N305 VanDerWaalsContact O-N 3.1Å; E301-N305 PolarHBondContact O-ND2 3.17Å; L303-N305 VanDerWaalsContact C-N 3.32Å; L303-N305 PolarHBondContact O-N 3.22Å
306	Q	57.3	Low	63.9	Low	129 Å²	129	104.9 Å²	104.9	60%	0.603	53%	0.525	S	S	*	.	H	α-helix	trans	-73.5	-35.4	174.9	-72.5	-174.3	25.2	0	0	112.9	N302 L303	N302-Q306 WeakPolarHBondContact O-CG 3.17Å; N302-Q306 PolarHBondContact O-N 2.89Å; L303-Q306 PolarHBondContact O-N 2.97Å
307	F	57	Low	64.5	Low	116 Å²	116	107.5 Å²	107.5	51%	0.509	53%	0.534	S	S	.	.	H	α-helix	trans	-75.7	-49.6	-179	-89.2	-110.9	0	0	0	112.8	L303 G309 L311	L303-F307 HydrophobicContact CD2-CE2 4.1Å; L303-F307 WeakPolarHBondContact O-CB 3.43Å; L303-F307 WeakPolarHBondContact O-CD2 3.28Å; L303-F307 PolarHBondContact O-N 3.19Å; F307-G309 PolarHBondContact O-N 2.73Å; F307-L311 HydrophobicContact CD1-CD1 3.53Å; F307-L311 HydrophobicContact CE1-CD1 3.83Å; F307-L311 WeakPolarHBondContact O-CB 3.12Å; F307-L311 PolarHBondContact O-N 3.19Å; F307-L311 VanDerWaalsContact O-N 3.08Å
308	N	57	Low	64.8	Low	102 Å²	102	105.7 Å²	105.7	55%	0.545	53%	0.531	S	S	.	.	H	α-helix	trans	-66.1	-32.5	-167.7	-76.2	-17.6	0	0	0	114.5	L304 N312	L304-N308 WeakPolarHBondContact O-CB 3.1Å; L304-N308 PolarHBondContact O-N 3.04Å; L304-N308 VanDerWaalsContact O-N 3.08Å; L304-N308 PolarHBondContact O-ND2 2.9Å; N308-N312 WeakPolarHBondContact O-CB 3.27Å
309	G	63.3	Low	65.2	Low	48 Å²	48	101.7 Å²	101.7	50%	0.495	52%	0.517	S	S	.	.	H	α-helix	trans	-79.1	-50.6	178.6	0	0	0	0	0	113.3	F307	F307-G309 PolarHBondContact O-N 2.73Å
310	K	65.6	Low	65.9	Low	138 Å²	138	105.5 Å²	105.5	60%	0.6	53%	0.533	S	S	*	.	H	α-helix	trans	-79	-46.6	-170.8	-174	177.4	171.6	-175	0	112.7	N312 M313 E314	K310-N312 VanDerWaalsContact C-N 3.32Å; K310-N312 PolarHBondContact O-N 3.11Å; K310-M313 PolarHBondContact O-N 3.23Å; K310-M313 VanDerWaalsContact O-N 3.15Å; K310-E314 WeakPolarHBondContact CE-OE1 3.4Å; K310-E314 IonicContact NZ-OE1 3.51Å; K310-E314 PolarHBondContact O-N 3.5Å
311	L	60.4	Low	67	Low	86 Å²	86	105.5 Å²	105.5	45%	0.45	54%	0.536	S	S	.	.	H	α-helix	trans	-68.2	-34.4	-173.9	-145.7	165.8	0	0	0	111.1	F307 E314 L315	F307-L311 HydrophobicContact CD1-CD1 3.53Å; F307-L311 HydrophobicContact CE1-CD1 3.83Å; F307-L311 WeakPolarHBondContact O-CB 3.12Å; F307-L311 PolarHBondContact O-N 3.19Å; F307-L311 VanDerWaalsContact O-N 3.08Å; L311-E314 PolarHBondContact O-N 3.31Å; L311-L315 VanDerWaalsContact O-CB 3.29Å; L311-L315 WeakPolarHBondContact O-CB 3.21Å; L311-L315 PolarHBondContact O-N 2.74Å
312	N	66.4	Low	67.7	Low	92 Å²	92	103.7 Å²	103.7	49%	0.492	53%	0.53	S	S	.	.	H	α-helix	trans	-66.8	-35.5	174	-159.7	12	0	0	0	112.4	N308 K310 N316	N308-N312 WeakPolarHBondContact O-CB 3.27Å; K310-N312 VanDerWaalsContact C-N 3.32Å; K310-N312 PolarHBondContact O-N 3.11Å; N312-N316 PolarHBondContact O-N 3.41Å; N312-N316 PolarHBondContact O-ND2 2.76Å
313	M	70.7	Confident	68.4	Low	123 Å²	123	104.3 Å²	104.3	61%	0.606	53%	0.533	S	S	*	.	H	α-helix	trans	-73.4	-32.3	175.4	-159.7	-175.1	-63.3	0	0	112.5	K310 K317	K310-M313 PolarHBondContact O-N 3.23Å; K310-M313 VanDerWaalsContact O-N 3.15Å; M313-K317 WeakPolarHBondContact O-CG 3.44Å; M313-K317 PolarHBondContact O-N 3.29Å
314	E	71.9	Confident	69.5	Low	104 Å²	104	105.9 Å²	105.9	49%	0.486	54%	0.536	S	S	.	.	H	α-helix	trans	-73	-37.7	172.1	-72.2	175.4	180	0	0	111.8	K310 L311 K317 L318	K310-E314 WeakPolarHBondContact CE-OE1 3.4Å; K310-E314 IonicContact NZ-OE1 3.51Å; K310-E314 PolarHBondContact O-N 3.5Å; L311-E314 PolarHBondContact O-N 3.31Å; E314-K317 PolarHBondContact O-N 3.49Å; E314-L318 WeakPolarHBondContact O-CB 3.39Å; E314-L318 PolarHBondContact O-N 2.72Å
315	L	71.7	Confident	70.4	Confident	82 Å²	82	106.3 Å²	106.3	43%	0.429	53%	0.533	S	S	.	.	H	α-helix	trans	-60.9	-45	172.9	-174.6	72	0	0	0	111.7	L311 L318 N319	L311-L315 VanDerWaalsContact O-CB 3.29Å; L311-L315 WeakPolarHBondContact O-CB 3.21Å; L311-L315 PolarHBondContact O-N 2.74Å; L315-L318 WeakPolarHBondContact O-CB 3.49Å; L315-L318 PolarHBondContact O-N 2.82Å; L315-N319 PolarHBondContact O-N 3.02Å
316	N	75.6	Confident	71.2	Confident	90 Å²	90	104.6 Å²	104.6	48%	0.481	52%	0.524	S	S	.	.	H	α-helix	trans	-62.7	-43.1	176.7	-76.1	-20.4	0	0	0	112	N312 L318 N319 E320	N312-N316 PolarHBondContact O-N 3.41Å; N312-N316 PolarHBondContact O-ND2 2.76Å; N316-L318 VanDerWaalsContact C-N 3.31Å; N316-L318 PolarHBondContact O-N 2.88Å; N316-N319 PolarHBondContact O-N 3.39Å; N316-E320 WeakPolarHBondContact O-CG 3.32Å; N316-E320 PolarHBondContact O-N 3.15Å
317	K	78.1	Confident	72	Confident	131 Å²	131	104.4 Å²	104.4	57%	0.57	52%	0.523	S	S	*	.	H	α-helix	trans	-63.3	-35.3	173.6	-74.4	175.4	179	174.1	0	112.8	M313 E314 L321	M313-K317 WeakPolarHBondContact O-CG 3.44Å; M313-K317 PolarHBondContact O-N 3.29Å; E314-K317 PolarHBondContact O-N 3.49Å; K317-L321 WeakPolarHBondContact O-CB 3.36Å; K317-L321 PolarHBondContact O-N 3.29Å
318	L	73.4	Confident	73	Confident	108 Å²	108	102.6 Å²	102.6	57%	0.565	52%	0.516	S	S	*	.	H	α-helix	trans	-67.8	-40.3	175.2	-164.7	73	0	0	0	111.2	E314 L315 N316 L321 L322	E314-L318 WeakPolarHBondContact O-CB 3.39Å; E314-L318 PolarHBondContact O-N 2.72Å; L315-L318 WeakPolarHBondContact O-CB 3.49Å; L315-L318 PolarHBondContact O-N 2.82Å; N316-L318 VanDerWaalsContact C-N 3.31Å; N316-L318 PolarHBondContact O-N 2.88Å; L318-L321 PolarHBondContact O-N 2.86Å; L318-L322 VanDerWaalsContact O-CB 3.26Å; L318-L322 WeakPolarHBondContact O-CB 3.41Å; L318-L322 PolarHBondContact O-N 3.32Å
319	N	76.6	Confident	73.7	Confident	70 Å²	70	104 Å²	104	37%	0.374	52%	0.517	S	S	.	.	H	α-helix	trans	-66.8	-40.8	175	-76.7	-21.5	0	0	0	112.5	L315 N316 L322 N323	L315-N319 PolarHBondContact O-N 3.02Å; N316-N319 PolarHBondContact O-N 3.39Å; N319-L322 PolarHBondContact O-N 2.93Å; N319-N323 WeakPolarHBondContact O-CB 3.49Å; N319-N323 PolarHBondContact O-N 3.1Å; N319-N323 PolarHBondContact O-ND2 2.77Å
320	E	79.5	Confident	74	Confident	137 Å²	137	105 Å²	105	64%	0.64	52%	0.517	S	S	*	.	H	α-helix	trans	-59.6	-45.3	171.5	-74	-178.1	146.3	0	0	111.6	N316 K324	N316-E320 WeakPolarHBondContact O-CG 3.32Å; N316-E320 PolarHBondContact O-N 3.15Å; E320-K324 WeakPolarHBondContact O-CB 3.35Å; E320-K324 PolarHBondContact O-N 3.19Å
321	L	81.3	Confident	74.3	Confident	113 Å²	113	102.9 Å²	102.9	59%	0.592	51%	0.512	S	S	*	.	H	α-helix	trans	-65.2	-40.7	178.1	-161	82	0	0	0	112	K317 L318 K325	K317-L321 WeakPolarHBondContact O-CB 3.36Å; K317-L321 PolarHBondContact O-N 3.29Å; L318-L321 PolarHBondContact O-N 2.86Å; L321-K325 WeakPolarHBondContact O-CG 3.41Å; L321-K325 PolarHBondContact O-N 2.94Å
322	L	77.1	Confident	74.7	Confident	93 Å²	93	103.9 Å²	103.9	49%	0.487	52%	0.517	S	S	.	.	H	α-helix	trans	-65.3	-48.5	177.2	178.8	61.3	0	0	0	111.3	L318 N319 K324 K325 L326	L318-L322 VanDerWaalsContact O-CB 3.26Å; L318-L322 WeakPolarHBondContact O-CB 3.41Å; L318-L322 PolarHBondContact O-N 3.32Å; N319-L322 PolarHBondContact O-N 2.93Å; L322-K324 VanDerWaalsContact C-N 3.33Å; L322-K324 PolarHBondContact O-N 2.98Å; L322-K325 CarbonylContact O-C 3.05Å; L322-K325 PolarHBondContact O-N 3.23Å; L322-K325 VanDerWaalsContact O-N 3.1Å; L322-L326 HydrophobicContact CD1-CD1 4.32Å; L322-L326 HydrophobicContact CD1-CG 4.36Å; L322-L326 HydrophobicContact CG-CD1 4.08Å; L322-L326 WeakPolarHBondContact O-CG 3.4Å; L322-L326 PolarHBondContact O-N 3.49Å
323	N	77.7	Confident	74.9	Confident	103 Å²	103	105.2 Å²	105.2	55%	0.551	52%	0.518	S	S	*	.	H	α-helix	trans	-59	-45	176.9	-73.6	-16.9	0	0	0	111	N319 K325 L326 E327	N319-N323 WeakPolarHBondContact O-CB 3.49Å; N319-N323 PolarHBondContact O-N 3.1Å; N319-N323 PolarHBondContact O-ND2 2.77Å; N323-K325 VanDerWaalsContact C-N 3.29Å; N323-K325 PolarHBondContact O-N 2.96Å; N323-L326 PolarHBondContact O-N 2.9Å; N323-E327 WeakPolarHBondContact O-CB 3.23Å; N323-E327 PolarHBondContact O-N 2.97Å
324	K	80.5	Confident	74.7	Confident	130 Å²	130	105.1 Å²	105.1	57%	0.565	52%	0.518	S	S	*	.	H	α-helix	trans	-62.4	-34.4	175.8	-169.9	165.1	-173.7	166.1	0	112.9	E320 L322 E328	E320-K324 WeakPolarHBondContact O-CB 3.35Å; E320-K324 PolarHBondContact O-N 3.19Å; L322-K324 VanDerWaalsContact C-N 3.33Å; L322-K324 PolarHBondContact O-N 2.98Å; K324-E328 WeakPolarHBondContact O-CG 3.41Å; K324-E328 PolarHBondContact O-N 3.05Å
325	K	77.9	Confident	74.8	Confident	111 Å²	111	104.8 Å²	104.8	48%	0.483	52%	0.519	S	S	.	.	H	α-helix	trans	-75.5	-30.8	173.8	-72.6	-61.8	178.3	-149.4	0	113.9	L321 L322 N323 E328 F329	L321-K325 WeakPolarHBondContact O-CG 3.41Å; L321-K325 PolarHBondContact O-N 2.94Å; L322-K325 CarbonylContact O-C 3.05Å; L322-K325 PolarHBondContact O-N 3.23Å; L322-K325 VanDerWaalsContact O-N 3.1Å; N323-K325 VanDerWaalsContact C-N 3.29Å; N323-K325 PolarHBondContact O-N 2.96Å; K325-E328 WeakPolarHBondContact CD-OE2 3.48Å; K325-E328 IonicContact NZ-OE1 2.61Å; K325-E328 PolarHBondContact NZ-OE1 3.35Å; K325-E328 IonicContact NZ-OE2 3.3Å; K325-E328 PolarHBondContact NZ-OE2 2.99Å; K325-F329 VanDerWaalsContact O-CB 3.29Å; K325-F329 WeakPolarHBondContact O-CB 3.2Å; K325-F329 PolarHBondContact O-N 3.42Å
326	L	76	Confident	74.8	Confident	91 Å²	91	107.2 Å²	107.2	48%	0.476	53%	0.528	S	S	.	.	H	α-helix	trans	-69.3	-34.7	170.5	-70.1	169	0	0	0	111.6	L322 N323 S330	L322-L326 HydrophobicContact CD1-CD1 4.32Å; L322-L326 HydrophobicContact CD1-CG 4.36Å; L322-L326 HydrophobicContact CG-CD1 4.08Å; L322-L326 WeakPolarHBondContact O-CG 3.4Å; L322-L326 PolarHBondContact O-N 3.49Å; N323-L326 PolarHBondContact O-N 2.9Å; L326-S330 WeakPolarHBondContact O-CB 3.48Å; L326-S330 PolarHBondContact O-N 3.04Å; L326-S330 PolarHBondContact O-OG 3.21Å
327	E	75.1	Confident	74.8	Confident	124 Å²	124	106.5 Å²	106.5	58%	0.579	53%	0.528	S	S	*	.	H	α-helix	trans	-68.8	-47.8	173.3	-172.6	174.9	-139.1	0	0	111.7	N323 F329 S330 N331	N323-E327 WeakPolarHBondContact O-CB 3.23Å; N323-E327 PolarHBondContact O-N 2.97Å; E327-F329 VanDerWaalsContact C-N 3.32Å; E327-F329 PolarHBondContact O-N 3.47Å; E327-S330 PolarHBondContact O-N 2.73Å; E327-N331 PolarHBondContact O-N 2.9Å; E327-N331 PolarHBondContact O-ND2 2.9Å
328	E	76.4	Confident	74.6	Confident	78 Å²	78	105.1 Å²	105.1	36%	0.364	52%	0.523	S	S	.	.	H	α-helix	trans	-54.6	-46.4	170.4	-76.9	176.8	-142	0	0	111.9	K324 K325 S330 N331 I332	K324-E328 WeakPolarHBondContact O-CG 3.41Å; K324-E328 PolarHBondContact O-N 3.05Å; K325-E328 WeakPolarHBondContact CD-OE2 3.48Å; K325-E328 IonicContact NZ-OE1 2.61Å; K325-E328 PolarHBondContact NZ-OE1 3.35Å; K325-E328 IonicContact NZ-OE2 3.3Å; K325-E328 PolarHBondContact NZ-OE2 2.99Å; E328-S330 VanDerWaalsContact C-N 3.35Å; E328-S330 PolarHBondContact O-N 3.05Å; E328-N331 PolarHBondContact O-N 2.87Å; E328-I332 VanDerWaalsContact O-CG1 3.32Å; E328-I332 WeakPolarHBondContact O-CG1 3.19Å; E328-I332 PolarHBondContact O-N 2.84Å
329	F	72.5	Confident	74.6	Confident	132 Å²	132	105.5 Å²	105.5	58%	0.579	53%	0.525	S	S	*	.	H	α-helix	trans	-64.3	-37.7	177.8	-175.9	-97.6	0	0	0	112.5	K325 E327 I332 K333	K325-F329 VanDerWaalsContact O-CB 3.29Å; K325-F329 WeakPolarHBondContact O-CB 3.2Å; K325-F329 PolarHBondContact O-N 3.42Å; E327-F329 VanDerWaalsContact C-N 3.32Å; E327-F329 PolarHBondContact O-N 3.47Å; F329-I332 PolarHBondContact O-N 3.12Å; F329-K333 HydrophobicContact CE1-CD 4.46Å; F329-K333 WeakPolarHBondContact O-CB 3.46Å; F329-K333 PolarHBondContact O-N 3.03Å
330	S	69.9	Low	74.8	Confident	70 Å²	70	108.6 Å²	108.6	49%	0.49	54%	0.535	S	S	.	.	H	α-helix	trans	-65.9	-41.2	176.7	-60.7	0	0	0	0	111.6	L326 E327 E328 K333 M334	L326-S330 WeakPolarHBondContact O-CB 3.48Å; L326-S330 PolarHBondContact O-N 3.04Å; L326-S330 PolarHBondContact O-OG 3.21Å; E327-S330 PolarHBondContact O-N 2.73Å; E328-S330 VanDerWaalsContact C-N 3.35Å; E328-S330 PolarHBondContact O-N 3.05Å; S330-K333 PolarHBondContact O-N 3.36Å; S330-M334 PolarHBondContact O-N 2.8Å
331	N	71	Confident	74.8	Confident	93 Å²	93	107 Å²	107	50%	0.497	53%	0.53	S	S	.	.	H	α-helix	trans	-66.2	-41.7	175	-70.8	-31.4	0	0	0	112.1	E327 E328 K333 M334 N335	E327-N331 PolarHBondContact O-N 2.9Å; E327-N331 PolarHBondContact O-ND2 2.9Å; E328-N331 PolarHBondContact O-N 2.87Å; N331-K333 VanDerWaalsContact C-N 3.35Å; N331-K333 PolarHBondContact O-N 3.47Å; N331-M334 PolarHBondContact O-N 3.05Å; N331-N335 PolarHBondContact O-N 3.01Å
332	I	69.2	Low	74.6	Confident	106 Å²	106	105.8 Å²	105.8	54%	0.544	52%	0.521	S	S	.	.	H	α-helix	trans	-60.6	-44.9	173.6	-69.9	165.1	0	0	0	110.7	E328 F329 M334 N335 E336	E328-I332 VanDerWaalsContact O-CG1 3.32Å; E328-I332 WeakPolarHBondContact O-CG1 3.19Å; E328-I332 PolarHBondContact O-N 2.84Å; F329-I332 PolarHBondContact O-N 3.12Å; I332-M334 VanDerWaalsContact C-N 3.35Å; I332-M334 PolarHBondContact O-N 3.38Å; I332-N335 WeakPolarHBondContact O-CB 3.44Å; I332-N335 PolarHBondContact O-N 2.9Å; I332-E336 PolarHBondContact O-N 2.65Å
333	K	70.9	Confident	74.7	Confident	120 Å²	120	105.9 Å²	105.9	52%	0.522	52%	0.522	S	S	.	.	H	α-helix	trans	-66.4	-35	178.6	-171.2	174.4	-178	179.3	0	112.7	F329 S330 N331 E336 T337	F329-K333 HydrophobicContact CE1-CD 4.46Å; F329-K333 WeakPolarHBondContact O-CB 3.46Å; F329-K333 PolarHBondContact O-N 3.03Å; S330-K333 PolarHBondContact O-N 3.36Å; N331-K333 VanDerWaalsContact C-N 3.35Å; N331-K333 PolarHBondContact O-N 3.47Å; K333-E336 PolarHBondContact O-N 3.36Å; K333-T337 PolarHBondContact O-N 3.08Å; K333-T337 PolarHBondContact O-OG1 2.83Å
334	M	66.3	Low	75	Confident	122 Å²	122	103.9 Å²	103.9	60%	0.601	51%	0.511	S	S	*	.	H	α-helix	trans	-65.9	-45.1	174	-164.7	172.2	-171.3	0	0	110.9	S330 N331 I332 E336 T337 Q338	S330-M334 PolarHBondContact O-N 2.8Å; N331-M334 PolarHBondContact O-N 3.05Å; I332-M334 VanDerWaalsContact C-N 3.35Å; I332-M334 PolarHBondContact O-N 3.38Å; M334-E336 VanDerWaalsContact C-N 3.32Å; M334-E336 PolarHBondContact O-N 2.74Å; M334-T337 WeakPolarHBondContact CA-OG1 3.45Å; M334-T337 PolarHBondContact O-N 3.02Å; M334-T337 PolarHBondContact O-OG1 2.99Å; M334-Q338 WeakPolarHBondContact O-CB 3.47Å; M334-Q338 PolarHBondContact O-N 3.06Å
335	N	73.7	Confident	75	Confident	96 Å²	96	101.5 Å²	101.5	51%	0.513	51%	0.505	S	S	.	.	H	α-helix	trans	-59.1	-40.7	172.7	-71.1	-17.1	0	0	0	112.1	N331 I332 Q338 L339	N331-N335 PolarHBondContact O-N 3.01Å; I332-N335 WeakPolarHBondContact O-CB 3.44Å; I332-N335 PolarHBondContact O-N 2.9Å; N335-Q338 PolarHBondContact O-N 3.43Å; N335-L339 WeakPolarHBondContact O-CB 3.43Å; N335-L339 WeakPolarHBondContact O-CG 3.47Å; N335-L339 PolarHBondContact O-N 3.2Å
336	E	71.4	Confident	75.1	Confident	133 Å²	133	102.7 Å²	102.7	62%	0.621	51%	0.507	S	S	*	.	H	α-helix	trans	-61	-45.9	175	-171	-173.9	179.5	0	0	111.6	I332 K333 M334 Q338 K340	I332-E336 PolarHBondContact O-N 2.65Å; K333-E336 PolarHBondContact O-N 3.36Å; M334-E336 VanDerWaalsContact C-N 3.32Å; M334-E336 PolarHBondContact O-N 2.74Å; E336-Q338 VanDerWaalsContact C-N 3.32Å; E336-Q338 PolarHBondContact O-N 3.36Å; E336-K340 WeakPolarHBondContact O-CB 3.42Å; E336-K340 PolarHBondContact O-N 3.27Å
337	T	75.3	Confident	75.5	Confident	76 Å²	76	103.6 Å²	103.6	47%	0.466	51%	0.509	S	S	.	.	H	α-helix	trans	-64.8	-34.5	174.8	49	0	0	0	0	113.1	K333 M334 K340 I341	K333-T337 PolarHBondContact O-N 3.08Å; K333-T337 PolarHBondContact O-OG1 2.83Å; M334-T337 WeakPolarHBondContact CA-OG1 3.45Å; M334-T337 PolarHBondContact O-N 3.02Å; M334-T337 PolarHBondContact O-OG1 2.99Å; T337-K340 PolarHBondContact O-N 3.41Å; T337-I341 WeakPolarHBondContact O-CG1 3.46Å; T337-I341 PolarHBondContact O-N 3.03Å
338	Q	74	Confident	76	Confident	102 Å²	102	103.9 Å²	103.9	48%	0.477	51%	0.509	S	S	.	.	H	α-helix	trans	-73	-43.8	179.3	-171.3	164.8	-19.2	0	0	111.8	M334 N335 E336 K340 I341 E342	M334-Q338 WeakPolarHBondContact O-CB 3.47Å; M334-Q338 PolarHBondContact O-N 3.06Å; N335-Q338 PolarHBondContact O-N 3.43Å; E336-Q338 VanDerWaalsContact C-N 3.32Å; E336-Q338 PolarHBondContact O-N 3.36Å; Q338-K340 VanDerWaalsContact C-N 3.25Å; Q338-K340 PolarHBondContact O-N 2.96Å; Q338-I341 PolarHBondContact O-N 3.27Å; Q338-E342 PolarHBondContact O-N 3.01Å
339	L	75	Confident	76.3	Confident	115 Å²	115	106.5 Å²	106.5	60%	0.602	52%	0.515	S	S	*	.	H	α-helix	trans	-59.8	-35.6	171.2	-74.1	169.5	0	0	0	112	N335 E342 N343	N335-L339 WeakPolarHBondContact O-CB 3.43Å; N335-L339 WeakPolarHBondContact O-CG 3.47Å; N335-L339 PolarHBondContact O-N 3.2Å; L339-E342 PolarHBondContact O-N 2.9Å; L339-N343 WeakPolarHBondContact O-CB 3.41Å; L339-N343 PolarHBondContact O-N 2.7Å
340	K	80.2	Confident	76.9	Confident	136 Å²	136	104.6 Å²	104.6	59%	0.591	51%	0.51	S	S	*	.	H	α-helix	trans	-66.2	-44.6	173.7	-169.9	168.6	-176.6	172.4	0	112.2	E336 T337 Q338 E342 N343 D344	E336-K340 WeakPolarHBondContact O-CB 3.42Å; E336-K340 PolarHBondContact O-N 3.27Å; T337-K340 PolarHBondContact O-N 3.41Å; Q338-K340 VanDerWaalsContact C-N 3.25Å; Q338-K340 PolarHBondContact O-N 2.96Å; K340-E342 VanDerWaalsContact C-N 3.3Å; K340-E342 PolarHBondContact O-N 3.25Å; K340-N343 PolarHBondContact O-N 3.1Å; K340-D344 WeakPolarHBondContact O-CB 3.34Å; K340-D344 VanDerWaalsContact O-CG 3.23Å; K340-D344 PolarHBondContact O-N 2.98Å
341	I	79.4	Confident	77.6	Confident	103 Å²	103	105.1 Å²	105.1	53%	0.528	51%	0.507	S	S	.	.	H	α-helix	trans	-61.3	-39.1	174.6	-69.5	163	0	0	0	111.3	T337 Q338 N345	T337-I341 WeakPolarHBondContact O-CG1 3.46Å; T337-I341 PolarHBondContact O-N 3.03Å; Q338-I341 PolarHBondContact O-N 3.27Å; I341-N345 WeakPolarHBondContact O-CB 3.39Å; I341-N345 VanDerWaalsContact O-CG 3.26Å; I341-N345 PolarHBondContact O-N 3.37Å; I341-N345 VanDerWaalsContact O-N 3.14Å; I341-N345 PolarHBondContact O-ND2 3.04Å
342	E	76.5	Confident	78.2	Confident	87 Å²	87	105 Å²	105	41%	0.407	51%	0.506	S	S	.	.	H	α-helix	trans	-65	-45.9	173.6	-73.3	-174.9	-170	0	0	111.9	Q338 L339 K340 N345 Y346	Q338-E342 PolarHBondContact O-N 3.01Å; L339-E342 PolarHBondContact O-N 2.9Å; K340-E342 VanDerWaalsContact C-N 3.3Å; K340-E342 PolarHBondContact O-N 3.25Å; E342-N345 CarbonylContact O-C 3.56Å; E342-N345 WeakPolarHBondContact O-CB 3.34Å; E342-N345 PolarHBondContact O-N 2.99Å; E342-N345 VanDerWaalsContact O-N 3.13Å; E342-Y346 HydrophobicContact CB-CD2 4.47Å; E342-Y346 HydrophobicContact CB-CE2 4.22Å; E342-Y346 WeakPolarHBondContact O-CD2 3.49Å; E342-Y346 PolarHBondContact O-N 3.13Å
343	N	79.8	Confident	78.9	Confident	95 Å²	95	105.4 Å²	105.4	51%	0.508	50%	0.501	S	S	.	.	H	α-helix	trans	-59.6	-48.5	176.9	-174.8	82.4	0	0	0	112.2	L339 K340 N345 Y346 E347	L339-N343 WeakPolarHBondContact O-CB 3.41Å; L339-N343 PolarHBondContact O-N 2.7Å; K340-N343 PolarHBondContact O-N 3.1Å; N343-N345 PolarHBondContact O-N 3.26Å; N343-Y346 PolarHBondContact O-N 3.23Å; N343-Y346 VanDerWaalsContact O-N 3.07Å; N343-E347 PolarHBondContact O-N 3.01Å
344	D	83.1	Confident	79.7	Confident	61 Å²	61	104.9 Å²	104.9	33%	0.326	50%	0.501	S	S	.	.	H	α-helix	trans	-59.2	-30.7	176.3	-67.1	3.4	0	0	0	111.7	K340 K348	K340-D344 WeakPolarHBondContact O-CB 3.34Å; K340-D344 VanDerWaalsContact O-CG 3.23Å; K340-D344 PolarHBondContact O-N 2.98Å; D344-K348 WeakPolarHBondContact O-CD 3.46Å; D344-K348 VanDerWaalsContact O-CG 3.23Å; D344-K348 WeakPolarHBondContact O-CG 3.5Å; D344-K348 PolarHBondContact O-N 3.39Å
345	N	81.3	Confident	80.6	Confident	80 Å²	80	103.2 Å²	103.2	43%	0.428	49%	0.494	S	S	.	.	H	α-helix	trans	-78.7	-36.2	174.5	-75.6	-31.7	0	0	0	112.9	I341 E342 N343 R349	I341-N345 WeakPolarHBondContact O-CB 3.39Å; I341-N345 VanDerWaalsContact O-CG 3.26Å; I341-N345 PolarHBondContact O-N 3.37Å; I341-N345 VanDerWaalsContact O-N 3.14Å; I341-N345 PolarHBondContact O-ND2 3.04Å; E342-N345 CarbonylContact O-C 3.56Å; E342-N345 WeakPolarHBondContact O-CB 3.34Å; E342-N345 PolarHBondContact O-N 2.99Å; E342-N345 VanDerWaalsContact O-N 3.13Å; N343-N345 PolarHBondContact O-N 3.26Å; N345-R349 WeakPolarHBondContact O-CG 3.46Å; N345-R349 PolarHBondContact O-N 3.41Å
346	Y	80.3	Confident	81.1	Confident	136 Å²	136	102.2 Å²	102.2	53%	0.533	49%	0.487	S	S	.	.	H	α-helix	trans	-65.2	-41.4	171.2	-74.8	-63.9	0	0	0	111.5	E342 N343 R349 I350	E342-Y346 HydrophobicContact CB-CD2 4.47Å; E342-Y346 HydrophobicContact CB-CE2 4.22Å; E342-Y346 WeakPolarHBondContact O-CD2 3.49Å; E342-Y346 PolarHBondContact O-N 3.13Å; N343-Y346 PolarHBondContact O-N 3.23Å; N343-Y346 VanDerWaalsContact O-N 3.07Å; Y346-R349 WeakPolarHBondContact O-CB 3.32Å; Y346-R349 PolarHBondContact O-N 3.09Å; Y346-R349 VanDerWaalsContact O-N 3.15Å; Y346-I350 VanDerWaalsContact O-CG1 3.31Å; Y346-I350 WeakPolarHBondContact O-CG1 3.36Å; Y346-I350 PolarHBondContact O-N 2.86Å
347	E	83.7	Confident	81.7	Confident	111 Å²	111	100 Å²	100	52%	0.519	48%	0.478	S	S	.	.	H	α-helix	trans	-61.7	-46.4	176.1	-172.8	168.3	-159.7	0	0	111.6	N343 R349 I350 I351	N343-E347 PolarHBondContact O-N 3.01Å; E347-R349 VanDerWaalsContact C-N 3.3Å; E347-R349 PolarHBondContact O-N 3.45Å; E347-I350 PolarHBondContact O-N 2.83Å; E347-I351 HydrophobicContact CG-CD1 4.13Å; E347-I351 WeakPolarHBondContact O-CG1 3.42Å; E347-I351 PolarHBondContact O-N 3.19Å
348	K	85.7	Confident	82.2	Confident	130 Å²	130	99.2 Å²	99.2	57%	0.565	48%	0.476	S	S	*	.	H	α-helix	trans	-56.4	-41.2	171.5	-73.9	165.1	-168.3	159.4	0	112.7	D344 N352	D344-K348 WeakPolarHBondContact O-CD 3.46Å; D344-K348 VanDerWaalsContact O-CG 3.23Å; D344-K348 WeakPolarHBondContact O-CG 3.5Å; D344-K348 PolarHBondContact O-N 3.39Å; K348-N352 WeakPolarHBondContact O-CB 3.31Å; K348-N352 PolarHBondContact O-N 2.87Å
349	R	83.8	Confident	82.8	Confident	132 Å²	132	100.4 Å²	100.4	50%	0.498	48%	0.479	S	S	.	.	H	α-helix	trans	-66.4	-42	176.4	-74.7	179.5	67.4	-177	0.1	112.1	N345 Y346 E347 N352 Y353	N345-R349 WeakPolarHBondContact O-CG 3.46Å; N345-R349 PolarHBondContact O-N 3.41Å; Y346-R349 WeakPolarHBondContact O-CB 3.32Å; Y346-R349 PolarHBondContact O-N 3.09Å; Y346-R349 VanDerWaalsContact O-N 3.15Å; E347-R349 VanDerWaalsContact C-N 3.3Å; E347-R349 PolarHBondContact O-N 3.45Å; R349-N352 PolarHBondContact O-N 3.26Å; R349-Y353 HydrophobicContact CB-CE2 4.19Å; R349-Y353 PolarHBondContact NH2-OH 3Å; R349-Y353 WeakPolarHBondContact O-CD2 3.39Å; R349-Y353 PolarHBondContact O-N 2.9Å
350	I	83.6	Confident	83.3	Confident	93 Å²	93	101.1 Å²	101.1	48%	0.477	48%	0.478	S	S	.	.	H	α-helix	trans	-60.7	-48.1	176.4	-70.8	163.2	0	0	0	110.4	Y346 E347 N352 Y353 Q354	Y346-I350 VanDerWaalsContact O-CG1 3.31Å; Y346-I350 WeakPolarHBondContact O-CG1 3.36Å; Y346-I350 PolarHBondContact O-N 2.86Å; E347-I350 PolarHBondContact O-N 2.83Å; I350-N352 VanDerWaalsContact C-N 3.29Å; I350-N352 PolarHBondContact O-N 2.91Å; I350-Y353 PolarHBondContact O-N 3.45Å; I350-Q354 HydrophobicContact CG2-CG 4.48Å; I350-Q354 WeakPolarHBondContact O-CB 3.44Å; I350-Q354 VanDerWaalsContact O-CG 3.31Å; I350-Q354 WeakPolarHBondContact O-CG 3.35Å; I350-Q354 PolarHBondContact O-N 3.2Å
351	I	85.3	Confident	83.7	Confident	81 Å²	81	102.4 Å²	102.4	42%	0.415	48%	0.479	S	S	.	.	H	α-helix	trans	-59.1	-41.3	175.8	-67.6	165.9	0	0	0	110.8	E347 Q354 N355	E347-I351 HydrophobicContact CG-CD1 4.13Å; E347-I351 WeakPolarHBondContact O-CG1 3.42Å; E347-I351 PolarHBondContact O-N 3.19Å; I351-Q354 PolarHBondContact O-N 3.38Å; I351-N355 PolarHBondContact O-N 2.78Å; I351-N355 PolarHBondContact O-ND2 2.8Å; I351-N355 VanDerWaalsContact O-ND2 3.15Å
352	N	84.2	Confident	84.1	Confident	90 Å²	90	104.7 Å²	104.7	48%	0.481	49%	0.485	S	S	.	.	H	α-helix	trans	-66.6	-43.5	178.5	-157.6	42.3	0	0	0	112.3	K348 R349 I350 Q354 N355 E356	K348-N352 WeakPolarHBondContact O-CB 3.31Å; K348-N352 PolarHBondContact O-N 2.87Å; R349-N352 PolarHBondContact O-N 3.26Å; I350-N352 VanDerWaalsContact C-N 3.29Å; I350-N352 PolarHBondContact O-N 2.91Å; N352-Q354 PolarHBondContact O-N 2.72Å; N352-N355 WeakPolarHBondContact O-CB 3.47Å; N352-N355 PolarHBondContact O-N 3.24Å; N352-E356 PolarHBondContact O-N 2.77Å
353	Y	84	Confident	84.5	Confident	115 Å²	115	103.6 Å²	103.6	45%	0.451	49%	0.487	S	S	.	.	H	α-helix	trans	-64.4	-37	174.2	-65.6	-48.8	0	0	0	112.5	R349 I350 N355 E356 I357	R349-Y353 HydrophobicContact CB-CE2 4.19Å; R349-Y353 PolarHBondContact NH2-OH 3Å; R349-Y353 WeakPolarHBondContact O-CD2 3.39Å; R349-Y353 PolarHBondContact O-N 2.9Å; I350-Y353 PolarHBondContact O-N 3.45Å; Y353-N355 VanDerWaalsContact C-N 3.33Å; Y353-N355 PolarHBondContact O-N 2.79Å; Y353-E356 PolarHBondContact O-N 2.96Å; Y353-I357 WeakPolarHBondContact O-CB 3.46Å; Y353-I357 VanDerWaalsContact O-CG1 3.29Å; Y353-I357 WeakPolarHBondContact O-CG1 3.29Å; Y353-I357 PolarHBondContact O-N 2.91Å
354	Q	86.4	Confident	84.7	Confident	109 Å²	109	103.3 Å²	103.3	51%	0.509	48%	0.484	S	S	.	.	H	α-helix	trans	-62.3	-39.7	173.2	-74.2	172.6	-7.3	0	0	112.1	I350 I351 N352 S358	I350-Q354 HydrophobicContact CG2-CG 4.48Å; I350-Q354 WeakPolarHBondContact O-CB 3.44Å; I350-Q354 VanDerWaalsContact O-CG 3.31Å; I350-Q354 WeakPolarHBondContact O-CG 3.35Å; I350-Q354 PolarHBondContact O-N 3.2Å; I351-Q354 PolarHBondContact O-N 3.38Å; N352-Q354 PolarHBondContact O-N 2.72Å; Q354-S358 WeakPolarHBondContact O-CB 3.48Å; Q354-S358 PolarHBondContact O-N 3.2Å; Q354-S358 PolarHBondContact O-OG 3.31Å
355	N	87	Confident	84.9	Confident	86 Å²	86	105.9 Å²	105.9	46%	0.46	50%	0.495	S	S	.	.	H	α-helix	trans	-64.9	-37.3	173.8	-75.9	-40.5	0	0	0	112.1	I351 N352 Y353 S358 K359	I351-N355 PolarHBondContact O-N 2.78Å; I351-N355 PolarHBondContact O-ND2 2.8Å; I351-N355 VanDerWaalsContact O-ND2 3.15Å; N352-N355 WeakPolarHBondContact O-CB 3.47Å; N352-N355 PolarHBondContact O-N 3.24Å; Y353-N355 VanDerWaalsContact C-N 3.33Å; Y353-N355 PolarHBondContact O-N 2.79Å; N355-S358 PolarHBondContact O-N 3.39Å; N355-K359 WeakPolarHBondContact O-CG 3.5Å; N355-K359 PolarHBondContact O-N 2.75Å; N355-K359 VanDerWaalsContact O-N 3.13Å
356	E	84.1	Confident	85.1	Confident	76 Å²	76	107 Å²	107	36%	0.355	50%	0.5	S	S	.	.	H	α-helix	trans	-71.1	-43.8	174.9	-68.1	-168.1	146.2	0	0	112.7	N352 Y353 S358 K359 F360	N352-E356 PolarHBondContact O-N 2.77Å; Y353-E356 PolarHBondContact O-N 2.96Å; E356-S358 PolarHBondContact O-N 3.23Å; E356-K359 WeakPolarHBondContact O-CA 3.42Å; E356-K359 WeakPolarHBondContact O-CB 3.33Å; E356-K359 PolarHBondContact O-N 3.17Å; E356-F360 HydrophobicContact CB-CD2 4.49Å; E356-F360 HydrophobicContact CB-CE2 4.15Å; E356-F360 WeakPolarHBondContact O-CD2 3.44Å; E356-F360 PolarHBondContact O-N 2.74Å
357	I	83.9	Confident	85.3	Confident	85 Å²	85	105.9 Å²	105.9	44%	0.436	50%	0.503	S	S	.	.	H	α-helix	trans	-55.7	-39.8	171.7	-69.4	163.9	0	0	0	110.8	Y353 K359 F360 R361	Y353-I357 WeakPolarHBondContact O-CB 3.46Å; Y353-I357 VanDerWaalsContact O-CG1 3.29Å; Y353-I357 WeakPolarHBondContact O-CG1 3.29Å; Y353-I357 PolarHBondContact O-N 2.91Å; I357-K359 VanDerWaalsContact C-N 3.35Å; I357-K359 PolarHBondContact O-N 3.43Å; I357-F360 PolarHBondContact O-N 3.05Å; I357-R361 WeakPolarHBondContact O-CG 3.32Å; I357-R361 PolarHBondContact O-N 3.19Å
358	S	84.7	Confident	85.4	Confident	61 Å²	61	106.4 Å²	106.4	43%	0.427	51%	0.505	S	S	.	.	H	α-helix	trans	-67.7	-29.9	175.9	-59.5	0	0	0	0	113.6	Q354 N355 E356	Q354-S358 WeakPolarHBondContact O-CB 3.48Å; Q354-S358 PolarHBondContact O-N 3.2Å; Q354-S358 PolarHBondContact O-OG 3.31Å; N355-S358 PolarHBondContact O-N 3.39Å; E356-S358 PolarHBondContact O-N 3.23Å
359	K	86.8	Confident	85.4	Confident	127 Å²	127	103.4 Å²	103.4	55%	0.552	50%	0.501	S	S	*	.	H	α-helix	trans	-70.6	-46	169.7	-66.3	167	-169.7	168.7	0	110.8	N355 E356 I357 R361 K362 S363	N355-K359 WeakPolarHBondContact O-CG 3.5Å; N355-K359 PolarHBondContact O-N 2.75Å; N355-K359 VanDerWaalsContact O-N 3.13Å; E356-K359 WeakPolarHBondContact O-CA 3.42Å; E356-K359 WeakPolarHBondContact O-CB 3.33Å; E356-K359 PolarHBondContact O-N 3.17Å; I357-K359 VanDerWaalsContact C-N 3.35Å; I357-K359 PolarHBondContact O-N 3.43Å; K359-R361 PolarHBondContact O-N 3.08Å; K359-K362 PolarHBondContact O-N 2.92Å; K359-S363 PolarHBondContact O-N 3.29Å; K359-S363 VanDerWaalsContact O-N 3.09Å; K359-S363 PolarHBondContact O-OG 3.47Å
360	F	85	Confident	85.5	Confident	130 Å²	130	105.1 Å²	105.1	57%	0.57	51%	0.507	S	S	*	.	H	α-helix	trans	-62.6	-39.6	-179.6	-68.5	-56.2	0	0	0	112.6	E356 I357 K362 S363 I364	E356-F360 HydrophobicContact CB-CD2 4.49Å; E356-F360 HydrophobicContact CB-CE2 4.15Å; E356-F360 WeakPolarHBondContact O-CD2 3.44Å; E356-F360 PolarHBondContact O-N 2.74Å; I357-F360 PolarHBondContact O-N 3.05Å; F360-K362 PolarHBondContact O-N 3.49Å; F360-S363 WeakPolarHBondContact O-CB 3.38Å; F360-S363 PolarHBondContact O-N 3.4Å; F360-I364 WeakPolarHBondContact O-CG1 3.21Å; F360-I364 PolarHBondContact O-N 3.03Å
361	R	88.7	Confident	85.6	Confident	162 Å²	162	105.7 Å²	105.7	61%	0.611	51%	0.51	S	S	*	.	H	α-helix	trans	-57.6	-48.3	174	-75.6	177.1	179	179.5	-0.9	112.5	I357 K359 S363 I364 E365	I357-R361 WeakPolarHBondContact O-CG 3.32Å; I357-R361 PolarHBondContact O-N 3.19Å; K359-R361 PolarHBondContact O-N 3.08Å; R361-S363 VanDerWaalsContact C-N 3.28Å; R361-S363 PolarHBondContact O-N 3.21Å; R361-I364 WeakPolarHBondContact O-CB 3.33Å; R361-I364 PolarHBondContact O-N 3.44Å; R361-E365 WeakPolarHBondContact O-CG 3.32Å; R361-E365 PolarHBondContact O-N 3.37Å
362	K	88.5	Confident	85.6	Confident	152 Å²	152	106.5 Å²	106.5	66%	0.661	52%	0.515	S	S	*	.	H	α-helix	trans	-61.6	-34.8	176	-69.1	-178.6	177.2	-173.4	0	113.1	K359 F360 L366	K359-K362 PolarHBondContact O-N 2.92Å; F360-K362 PolarHBondContact O-N 3.49Å; K362-L366 WeakPolarHBondContact O-CB 3.3Å; K362-L366 PolarHBondContact O-N 2.72Å; K362-L366 VanDerWaalsContact O-N 3.14Å
363	S	85.3	Confident	85.6	Confident	64 Å²	64	105.7 Å²	105.7	45%	0.448	51%	0.514	S	S	.	.	H	α-helix	trans	-68.8	-33.6	173.2	-63.2	0	0	0	0	112.8	K359 F360 R361 L367	K359-S363 PolarHBondContact O-N 3.29Å; K359-S363 VanDerWaalsContact O-N 3.09Å; K359-S363 PolarHBondContact O-OG 3.47Å; F360-S363 WeakPolarHBondContact O-CB 3.38Å; F360-S363 PolarHBondContact O-N 3.4Å; R361-S363 VanDerWaalsContact C-N 3.28Å; R361-S363 PolarHBondContact O-N 3.21Å; S363-L367 VanDerWaalsContact O-CG 3.27Å; S363-L367 WeakPolarHBondContact O-CG 2.89Å; S363-L367 PolarHBondContact O-N 3.07Å; S363-L367 VanDerWaalsContact O-N 3.15Å
364	I	83.7	Confident	85.4	Confident	88 Å²	88	102.4 Å²	102.4	45%	0.451	51%	0.51	S	S	.	.	H	α-helix	trans	-70.2	-50.3	175.2	-69	163.2	0	0	0	110.1	F360 R361 L366 L367 E368	F360-I364 WeakPolarHBondContact O-CG1 3.21Å; F360-I364 PolarHBondContact O-N 3.03Å; R361-I364 WeakPolarHBondContact O-CB 3.33Å; R361-I364 PolarHBondContact O-N 3.44Å; I364-L366 PolarHBondContact O-N 2.88Å; I364-L367 CarbonylContact O-C 3.56Å; I364-L367 WeakPolarHBondContact O-CA 3.41Å; I364-L367 WeakPolarHBondContact O-CB 3.35Å; I364-L367 PolarHBondContact O-N 3.4Å; I364-E368 HydrophobicContact CG2-CG 4.21Å; I364-E368 WeakPolarHBondContact O-CG 3.3Å; I364-E368 PolarHBondContact O-N 3.33Å
365	E	86.8	Confident	85.3	Confident	116 Å²	116	102.3 Å²	102.3	54%	0.542	51%	0.51	S	S	.	.	H	α-helix	trans	-52.2	-42.1	175.6	-69.3	162.1	-176.8	0	0	111.7	R361 S369	R361-E365 WeakPolarHBondContact O-CG 3.32Å; R361-E365 PolarHBondContact O-N 3.37Å; E365-S369 WeakPolarHBondContact O-CB 3.48Å; E365-S369 PolarHBondContact O-N 3Å
366	L	85.7	Confident	85.1	Confident	103 Å²	103	102.2 Å²	102.2	54%	0.539	51%	0.509	S	S	.	.	H	α-helix	trans	-68.4	-33.8	176	-179.1	61.7	0	0	0	113.3	K362 I364 R370	K362-L366 WeakPolarHBondContact O-CB 3.3Å; K362-L366 PolarHBondContact O-N 2.72Å; K362-L366 VanDerWaalsContact O-N 3.14Å; I364-L366 PolarHBondContact O-N 2.88Å; L366-R370 WeakPolarHBondContact O-CD 3.44Å; L366-R370 WeakPolarHBondContact O-CG 3.41Å; L366-R370 PolarHBondContact O-N 3.09Å
367	L	85	Confident	85	Confident	112 Å²	112	104.1 Å²	104.1	59%	0.586	52%	0.521	S	S	*	.	H	α-helix	trans	-74.7	-38.6	176.1	-74.4	168.7	0	0	0	111.7	S363 I364 R370 L371	S363-L367 VanDerWaalsContact O-CG 3.27Å; S363-L367 WeakPolarHBondContact O-CG 2.89Å; S363-L367 PolarHBondContact O-N 3.07Å; S363-L367 VanDerWaalsContact O-N 3.15Å; I364-L367 CarbonylContact O-C 3.56Å; I364-L367 WeakPolarHBondContact O-CA 3.41Å; I364-L367 WeakPolarHBondContact O-CB 3.35Å; I364-L367 PolarHBondContact O-N 3.4Å; L367-R370 PolarHBondContact O-N 3.09Å; L367-L371 WeakPolarHBondContact O-CB 3.25Å; L367-L371 PolarHBondContact O-N 2.92Å
368	E	85.9	Confident	84.9	Confident	122 Å²	122	106 Å²	106	57%	0.57	53%	0.531	S	S	*	.	H	α-helix	trans	-64	-45.1	175.3	-70.1	173.3	156.4	0	0	111.2	I364 R370 L371 L372	I364-E368 HydrophobicContact CG2-CG 4.21Å; I364-E368 WeakPolarHBondContact O-CG 3.3Å; I364-E368 PolarHBondContact O-N 3.33Å; E368-R370 VanDerWaalsContact C-N 3.32Å; E368-R370 PolarHBondContact O-N 3.28Å; E368-L371 WeakPolarHBondContact O-CB 3.35Å; E368-L371 PolarHBondContact O-N 3.49Å; E368-L372 PolarHBondContact O-N 2.79Å
369	S	85.5	Confident	84.7	Confident	68 Å²	68	109.5 Å²	109.5	48%	0.476	54%	0.541	S	S	.	.	H	α-helix	trans	-56.5	-44.3	172.7	174.3	0	0	0	0	112.2	E365 L372 T373	E365-S369 WeakPolarHBondContact O-CB 3.48Å; E365-S369 PolarHBondContact O-N 3Å; S369-L372 PolarHBondContact O-N 2.85Å; S369-T373 PolarHBondContact O-N 3.42Å; S369-T373 VanDerWaalsContact O-N 3.14Å; S369-T373 PolarHBondContact O-OG1 3.03Å; S369-T373 VanDerWaalsContact O-OG1 3.1Å
370	R	86.2	Confident	84.5	Confident	168 Å²	168	107.5 Å²	107.5	63%	0.634	54%	0.539	S	S	*	.	H	α-helix	trans	-71.9	-29.6	178.7	-68.6	173.1	79.9	177.1	8.1	113	L366 L367 E368 A374	L366-R370 WeakPolarHBondContact O-CD 3.44Å; L366-R370 WeakPolarHBondContact O-CG 3.41Å; L366-R370 PolarHBondContact O-N 3.09Å; L367-R370 PolarHBondContact O-N 3.09Å; E368-R370 VanDerWaalsContact C-N 3.32Å; E368-R370 PolarHBondContact O-N 3.28Å; R370-A374 WeakPolarHBondContact O-CB 3.34Å; R370-A374 PolarHBondContact O-N 3.38Å; R370-A374 VanDerWaalsContact O-N 3.1Å
371	L	84	Confident	84.1	Confident	104 Å²	104	104.9 Å²	104.9	55%	0.545	54%	0.537	S	S	.	.	H	α-helix	trans	-67	-43.4	173	179.1	61.6	0	0	0	111	L367 E368 A374 Q375	L367-L371 WeakPolarHBondContact O-CB 3.25Å; L367-L371 PolarHBondContact O-N 2.92Å; E368-L371 WeakPolarHBondContact O-CB 3.35Å; E368-L371 PolarHBondContact O-N 3.49Å; L371-A374 WeakPolarHBondContact O-CB 3.43Å; L371-A374 PolarHBondContact O-N 2.75Å; L371-Q375 WeakPolarHBondContact O-CG 3.24Å; L371-Q375 PolarHBondContact O-N 3.37Å
372	L	85.8	Confident	83.7	Confident	99 Å²	99	101.7 Å²	101.7	52%	0.518	53%	0.532	S	S	.	.	H	α-helix	trans	-60	-48.9	175.4	-171.5	67.8	0	0	0	111.1	E368 S369 A374 Q375 D376	E368-L372 PolarHBondContact O-N 2.79Å; S369-L372 PolarHBondContact O-N 2.85Å; L372-A374 PolarHBondContact O-N 3.2Å; L372-Q375 WeakPolarHBondContact O-CA 3.47Å; L372-Q375 WeakPolarHBondContact O-CB 3.44Å; L372-Q375 PolarHBondContact O-N 3.04Å; L372-D376 PolarHBondContact O-N 3.36Å
373	T	85.7	Confident	83.4	Confident	73 Å²	73	98.4 Å²	98.4	45%	0.448	53%	0.525	S	S	.	.	H	α-helix	trans	-58.4	-34.7	175.2	-49.3	0	0	0	0	112.8	S369 L377	S369-T373 PolarHBondContact O-N 3.42Å; S369-T373 VanDerWaalsContact O-N 3.14Å; S369-T373 PolarHBondContact O-OG1 3.03Å; S369-T373 VanDerWaalsContact O-OG1 3.1Å; T373-L377 HydrophobicContact CG2-CD1 4.37Å; T373-L377 VanDerWaalsContact O-CG 3.29Å; T373-L377 WeakPolarHBondContact O-CG 3.39Å; T373-L377 PolarHBondContact O-N 3.44Å; T373-L377 VanDerWaalsContact O-N 3.14Å
374	A	79.5	Confident	83.1	Confident	45 Å²	45	99.1 Å²	99.1	37%	0.372	52%	0.524	S	S	.	.	H	α-helix	trans	-71.3	-31.3	175.9	0	0	0	0	0	112.8	R370 L371 L372 L378	R370-A374 WeakPolarHBondContact O-CB 3.34Å; R370-A374 PolarHBondContact O-N 3.38Å; R370-A374 VanDerWaalsContact O-N 3.1Å; L371-A374 WeakPolarHBondContact O-CB 3.43Å; L371-A374 PolarHBondContact O-N 2.75Å; L372-A374 PolarHBondContact O-N 3.2Å; A374-L378 WeakPolarHBondContact O-CB 3.1Å; A374-L378 PolarHBondContact O-N 3.35Å; A374-L378 VanDerWaalsContact O-N 3.09Å
375	Q	82.6	Confident	82.9	Confident	107 Å²	107	101.6 Å²	101.6	50%	0.5	53%	0.528	S	S	.	.	H	α-helix	trans	-69.6	-43.4	173.3	-70.4	170.7	-19	0	0	111.3	L371 L372 L377 L378 Q379	L371-Q375 WeakPolarHBondContact O-CG 3.24Å; L371-Q375 PolarHBondContact O-N 3.37Å; L372-Q375 WeakPolarHBondContact O-CA 3.47Å; L372-Q375 WeakPolarHBondContact O-CB 3.44Å; L372-Q375 PolarHBondContact O-N 3.04Å; Q375-L377 PolarHBondContact O-N 2.83Å; Q375-L378 WeakPolarHBondContact O-CB 3.37Å; Q375-L378 PolarHBondContact O-N 3.05Å; Q375-Q379 PolarHBondContact O-N 2.89Å
376	D	83.5	Confident	82.7	Confident	84 Å²	84	99.5 Å²	99.5	45%	0.449	52%	0.521	S	S	.	.	H	α-helix	trans	-58.5	-46.7	175	-63	-35.3	0	0	0	111.4	L372 L378 Q379 V380	L372-D376 PolarHBondContact O-N 3.36Å; D376-L378 VanDerWaalsContact C-N 3.32Å; D376-L378 PolarHBondContact O-N 2.84Å; D376-Q379 WeakPolarHBondContact O-CB 3.39Å; D376-Q379 PolarHBondContact O-N 2.81Å; D376-Q379 VanDerWaalsContact O-N 3.14Å; D376-V380 WeakPolarHBondContact O-CG2 3.35Å; D376-V380 PolarHBondContact O-N 2.89Å
377	L	83.1	Confident	82.5	Confident	117 Å²	117	102.3 Å²	102.3	61%	0.613	52%	0.524	S	S	*	.	H	α-helix	trans	-63.5	-35.5	177.1	-71.6	170.2	0	0	0	112.8	T373 Q375 S381	T373-L377 HydrophobicContact CG2-CD1 4.37Å; T373-L377 VanDerWaalsContact O-CG 3.29Å; T373-L377 WeakPolarHBondContact O-CG 3.39Å; T373-L377 PolarHBondContact O-N 3.44Å; T373-L377 VanDerWaalsContact O-N 3.14Å; Q375-L377 PolarHBondContact O-N 2.83Å; L377-S381 WeakPolarHBondContact O-CB 3.44Å; L377-S381 PolarHBondContact O-N 3.01Å
378	L	80.6	Confident	82.2	Confident	123 Å²	123	101.2 Å²	101.2	64%	0.644	52%	0.523	S	S	*	.	H	α-helix	trans	-65.4	-40	171.9	-89.2	163.4	0	0	0	111.9	A374 Q375 D376 S381 N382	A374-L378 WeakPolarHBondContact O-CB 3.1Å; A374-L378 PolarHBondContact O-N 3.35Å; A374-L378 VanDerWaalsContact O-N 3.09Å; Q375-L378 WeakPolarHBondContact O-CB 3.37Å; Q375-L378 PolarHBondContact O-N 3.05Å; D376-L378 VanDerWaalsContact C-N 3.32Å; D376-L378 PolarHBondContact O-N 2.84Å; L378-S381 PolarHBondContact O-N 2.91Å; L378-N382 WeakPolarHBondContact O-CB 3.47Å; L378-N382 PolarHBondContact O-N 3.4Å
379	Q	81.5	Confident	81.8	Confident	135 Å²	135	100.5 Å²	100.5	63%	0.631	52%	0.519	S	S	*	.	H	α-helix	trans	-66.3	-40.5	177.2	-175.3	173.6	-10.3	0	0	112.1	Q375 D376 T383	Q375-Q379 PolarHBondContact O-N 2.89Å; D376-Q379 WeakPolarHBondContact O-CB 3.39Å; D376-Q379 PolarHBondContact O-N 2.81Å; D376-Q379 VanDerWaalsContact O-N 3.14Å; Q379-T383 WeakPolarHBondContact O-CB 3.07Å; Q379-T383 PolarHBondContact O-N 3.41Å; Q379-T383 PolarHBondContact O-OG1 2.96Å
380	V	81.6	Confident	81.6	Confident	86 Å²	86	103.5 Å²	103.5	52%	0.521	53%	0.529	S	S	.	.	H	α-helix	trans	-61.5	-50.7	172.6	174.7	0	0	0	0	110.6	D376 N382 T383 D384	D376-V380 WeakPolarHBondContact O-CG2 3.35Å; D376-V380 PolarHBondContact O-N 2.89Å; V380-N382 VanDerWaalsContact C-N 3.32Å; V380-N382 PolarHBondContact O-N 3.05Å; V380-T383 WeakPolarHBondContact O-CA 3.27Å; V380-T383 WeakPolarHBondContact O-CB 3.04Å; V380-T383 PolarHBondContact O-N 2.89Å; V380-D384 PolarHBondContact O-N 3.46Å
381	S	76.6	Confident	81.4	Confident	75 Å²	75	102.2 Å²	102.2	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-57.3	-42.1	178.6	-175	0	0	0	0	112.8	L377 L378 T383 D384 Y385	L377-S381 WeakPolarHBondContact O-CB 3.44Å; L377-S381 PolarHBondContact O-N 3.01Å; L378-S381 PolarHBondContact O-N 2.91Å; S381-T383 VanDerWaalsContact C-N 3.31Å; S381-T383 PolarHBondContact O-N 3.05Å; S381-D384 PolarHBondContact O-N 2.72Å; S381-Y385 WeakPolarHBondContact O-CB 3.31Å; S381-Y385 PolarHBondContact O-N 3.3Å
382	N	80.4	Confident	81.1	Confident	95 Å²	95	104 Å²	104	51%	0.508	53%	0.533	S	S	.	.	H	α-helix	trans	-67.9	-31.7	176.7	-161.7	33	0	0	0	112.3	L378 V380 N386	L378-N382 WeakPolarHBondContact O-CB 3.47Å; L378-N382 PolarHBondContact O-N 3.4Å; V380-N382 VanDerWaalsContact C-N 3.32Å; V380-N382 PolarHBondContact O-N 3.05Å; N382-N386 VanDerWaalsContact O-CG 3.23Å; N382-N386 PolarHBondContact O-N 2.89Å; N382-N386 PolarHBondContact O-ND2 3.07Å; N382-N386 VanDerWaalsContact O-ND2 3.11Å
383	T	82.9	Confident	80.7	Confident	83 Å²	83	102 Å²	102	51%	0.509	53%	0.528	S	S	.	.	H	α-helix	trans	-67.7	-43.9	174.5	-55.9	0	0	0	0	111.2	Q379 V380 S381 N386 R387	Q379-T383 WeakPolarHBondContact O-CB 3.07Å; Q379-T383 PolarHBondContact O-N 3.41Å; Q379-T383 PolarHBondContact O-OG1 2.96Å; V380-T383 WeakPolarHBondContact O-CA 3.27Å; V380-T383 WeakPolarHBondContact O-CB 3.04Å; V380-T383 PolarHBondContact O-N 2.89Å; S381-T383 VanDerWaalsContact C-N 3.31Å; S381-T383 PolarHBondContact O-N 3.05Å; T383-N386 PolarHBondContact O-N 3.37Å; T383-R387 WeakPolarHBondContact O-CB 2.91Å; T383-R387 PolarHBondContact O-N 3.21Å
384	D	78.5	Confident	80.6	Confident	79 Å²	79	101.6 Å²	101.6	42%	0.422	53%	0.528	S	S	.	.	H	α-helix	trans	-70.2	-32.4	175.8	-79.1	-35.3	0	0	0	113	V380 S381 R387 T388	V380-D384 PolarHBondContact O-N 3.46Å; S381-D384 PolarHBondContact O-N 2.72Å; D384-R387 PolarHBondContact O-N 3.39Å; D384-T388 WeakPolarHBondContact O-CB 3.27Å; D384-T388 PolarHBondContact O-N 3.42Å; D384-T388 PolarHBondContact O-OG1 2.88Å
385	Y	80.7	Confident	80.6	Confident	139 Å²	139	104.1 Å²	104.1	55%	0.545	54%	0.539	S	S	.	.	H	α-helix	trans	-58.7	-54.3	169.1	175.8	-95.3	0	0	0	111.2	S381 R387 T388 Q389	S381-Y385 WeakPolarHBondContact O-CB 3.31Å; S381-Y385 PolarHBondContact O-N 3.3Å; Y385-R387 VanDerWaalsContact C-N 3.29Å; Y385-R387 PolarHBondContact O-N 3.44Å; Y385-T388 WeakPolarHBondContact O-CA 3.24Å; Y385-T388 WeakPolarHBondContact O-CB 2.69Å; Y385-T388 PolarHBondContact O-N 2.93Å; Y385-Q389 PolarHBondContact O-N 3.22Å
386	N	82.2	Confident	80.6	Confident	73 Å²	73	103.4 Å²	103.4	39%	0.39	53%	0.534	S	S	.	.	H	α-helix	trans	-58.5	-40.8	178.1	-70.1	-29.4	0	0	0	111.9	N382 T383 T388 Q389 L390	N382-N386 VanDerWaalsContact O-CG 3.23Å; N382-N386 PolarHBondContact O-N 2.89Å; N382-N386 PolarHBondContact O-ND2 3.07Å; N382-N386 VanDerWaalsContact O-ND2 3.11Å; T383-N386 PolarHBondContact O-N 3.37Å; N386-T388 VanDerWaalsContact C-N 3.3Å; N386-T388 PolarHBondContact O-N 2.76Å; N386-Q389 PolarHBondContact O-N 3.18Å; N386-L390 WeakPolarHBondContact O-CG 3.23Å; N386-L390 PolarHBondContact O-N 3.11Å
387	R	81.6	Confident	80.5	Confident	161 Å²	161	103 Å²	103	61%	0.608	53%	0.532	S	S	*	.	H	α-helix	trans	-63.4	-35	175.9	-163.5	179.8	-160.2	171.2	7.1	112.8	T383 D384 Y385 K391	T383-R387 WeakPolarHBondContact O-CB 2.91Å; T383-R387 PolarHBondContact O-N 3.21Å; D384-R387 PolarHBondContact O-N 3.39Å; Y385-R387 VanDerWaalsContact C-N 3.29Å; Y385-R387 PolarHBondContact O-N 3.44Å; R387-K391 WeakPolarHBondContact O-CG 3.14Å; R387-K391 PolarHBondContact O-N 3.29Å
388	T	77.1	Confident	80.4	Confident	90 Å²	90	101.6 Å²	101.6	55%	0.552	53%	0.525	S	S	*	.	H	α-helix	trans	-74.3	-39.5	176.1	-57	0	0	0	0	111.3	D384 Y385 N386 K391 H392	D384-T388 WeakPolarHBondContact O-CB 3.27Å; D384-T388 PolarHBondContact O-N 3.42Å; D384-T388 PolarHBondContact O-OG1 2.88Å; Y385-T388 WeakPolarHBondContact O-CA 3.24Å; Y385-T388 WeakPolarHBondContact O-CB 2.69Å; Y385-T388 PolarHBondContact O-N 2.93Å; N386-T388 VanDerWaalsContact C-N 3.3Å; N386-T388 PolarHBondContact O-N 2.76Å; T388-K391 PolarHBondContact O-N 2.98Å; T388-H392 PolarHBondContact O-N 3.33Å
389	Q	78.3	Confident	80.4	Confident	107 Å²	107	100 Å²	100	50%	0.5	52%	0.516	S	S	.	.	H	α-helix	trans	-63.1	-41.3	175.4	-169.2	176.5	7.9	0	0	112.1	Y385 N386 H392 S393	Y385-Q389 PolarHBondContact O-N 3.22Å; N386-Q389 PolarHBondContact O-N 3.18Å; Q389-H392 WeakPolarHBondContact O-CB 3.16Å; Q389-H392 PolarHBondContact O-N 2.76Å; Q389-S393 PolarHBondContact O-N 3.12Å
390	L	80.6	Confident	80.4	Confident	130 Å²	130	98 Å²	98	68%	0.681	51%	0.507	S	S	*	.	H	α-helix	trans	-61.4	-43.9	173.8	-74	169	0	0	0	112.3	N386 H392 S393 S394	N386-L390 WeakPolarHBondContact O-CG 3.23Å; N386-L390 PolarHBondContact O-N 3.11Å; L390-H392 VanDerWaalsContact C-N 3.32Å; L390-H392 PolarHBondContact O-N 3.35Å; L390-S393 PolarHBondContact O-N 2.76Å; L390-S394 PolarHBondContact O-N 2.93Å; L390-S394 VanDerWaalsContact O-N 3.12Å
391	K	81.9	Confident	80.5	Confident	142 Å²	142	97.8 Å²	97.8	62%	0.617	50%	0.503	S	S	*	.	H	α-helix	trans	-60	-41.7	173.1	-74.5	179.6	176.2	-176	0	112.1	R387 T388 S393 S394 V395	R387-K391 WeakPolarHBondContact O-CG 3.14Å; R387-K391 PolarHBondContact O-N 3.29Å; T388-K391 PolarHBondContact O-N 2.98Å; K391-S393 VanDerWaalsContact C-N 3.31Å; K391-S393 PolarHBondContact O-N 3.3Å; K391-S394 PolarHBondContact O-N 3.13Å; K391-V395 WeakPolarHBondContact O-CG2 3.12Å; K391-V395 PolarHBondContact O-N 3.22Å
392	H	79.2	Confident	80.6	Confident	140 Å²	140	97.7 Å²	97.7	65%	0.648	50%	0.499	S	S	*	.	H	α-helix	trans	-64.2	-34.5	177.6	-172.5	-71.6	0	0	0	112.3	T388 Q389 L390 K396	T388-H392 PolarHBondContact O-N 3.33Å; Q389-H392 WeakPolarHBondContact O-CB 3.16Å; Q389-H392 PolarHBondContact O-N 2.76Å; L390-H392 VanDerWaalsContact C-N 3.32Å; L390-H392 PolarHBondContact O-N 3.35Å; H392-K396 WeakPolarHBondContact O-CB 3.44Å; H392-K396 PolarHBondContact O-N 2.9Å; H392-K396 VanDerWaalsContact O-N 3.1Å
393	S	77.9	Confident	80.6	Confident	58 Å²	58	98.4 Å²	98.4	41%	0.406	50%	0.498	S	S	.	.	H	α-helix	trans	-63.9	-51.9	171.5	-158.9	0	0	0	0	111	Q389 L390 K391 V395 K396 D397	Q389-S393 PolarHBondContact O-N 3.12Å; L390-S393 PolarHBondContact O-N 2.76Å; K391-S393 VanDerWaalsContact C-N 3.31Å; K391-S393 PolarHBondContact O-N 3.3Å; S393-V395 VanDerWaalsContact C-N 3.3Å; S393-V395 PolarHBondContact O-N 2.92Å; S393-K396 WeakPolarHBondContact O-CA 3.33Å; S393-K396 WeakPolarHBondContact O-CB 3.36Å; S393-K396 PolarHBondContact O-N 2.88Å; S393-D397 PolarHBondContact O-N 3.2Å; S393-D397 VanDerWaalsContact O-OD2 3.07Å; S393-D397 PolarHBondContact OG-OD2 3.4Å
394	S	82.2	Confident	80.6	Confident	64 Å²	64	97.5 Å²	97.5	45%	0.448	50%	0.495	S	S	.	.	H	α-helix	trans	-52.2	-48.4	178.4	-168.5	0	0	0	0	112	L390 K391 K396 D397 D398	L390-S394 PolarHBondContact O-N 2.93Å; L390-S394 VanDerWaalsContact O-N 3.12Å; K391-S394 PolarHBondContact O-N 3.13Å; S394-K396 VanDerWaalsContact C-N 3.32Å; S394-K396 PolarHBondContact O-N 3.44Å; S394-D397 PolarHBondContact O-N 3.06Å; S394-D397 VanDerWaalsContact O-N 3.15Å; S394-D398 WeakPolarHBondContact O-CB 3.42Å; S394-D398 PolarHBondContact O-N 3.26Å; S394-D398 VanDerWaalsContact O-OD2 3.08Å
395	V	80	Confident	80.8	Confident	99 Å²	99	100.8 Å²	100.8	60%	0.6	50%	0.501	S	S	*	.	H	α-helix	trans	-65.6	-32.6	179.6	173.3	0	0	0	0	112.6	K391 S393 L399	K391-V395 WeakPolarHBondContact O-CG2 3.12Å; K391-V395 PolarHBondContact O-N 3.22Å; S393-V395 VanDerWaalsContact C-N 3.3Å; S393-V395 PolarHBondContact O-N 2.92Å; V395-L399 VanDerWaalsContact O-CB 3.29Å; V395-L399 WeakPolarHBondContact O-CB 3.36Å; V395-L399 PolarHBondContact O-N 2.91Å; V395-L399 VanDerWaalsContact O-N 3.1Å
396	K	82.9	Confident	80.6	Confident	91 Å²	91	98 Å²	98	40%	0.396	50%	0.499	S	S	.	.	H	α-helix	trans	-66.5	-43.9	172.3	179	-168.3	162.3	-69.1	0	110.9	H392 S393 S394 L399 E400	H392-K396 WeakPolarHBondContact O-CB 3.44Å; H392-K396 PolarHBondContact O-N 2.9Å; H392-K396 VanDerWaalsContact O-N 3.1Å; S393-K396 WeakPolarHBondContact O-CA 3.33Å; S393-K396 WeakPolarHBondContact O-CB 3.36Å; S393-K396 PolarHBondContact O-N 2.88Å; S394-K396 VanDerWaalsContact C-N 3.32Å; S394-K396 PolarHBondContact O-N 3.44Å; K396-L399 WeakPolarHBondContact O-CB 3.23Å; K396-L399 PolarHBondContact O-N 3.35Å; K396-E400 WeakPolarHBondContact CE-OE1 3.35Å; K396-E400 IonicContact NZ-OE1 3.73Å; K396-E400 PolarHBondContact NZ-OE1 2.96Å; K396-E400 IonicContact NZ-OE2 2.72Å; K396-E400 PolarHBondContact NZ-OE2 3.39Å; K396-E400 PolarHBondContact O-N 3.35Å
397	D	81.3	Confident	80.6	Confident	76 Å²	76	102.5 Å²	102.5	41%	0.406	51%	0.51	S	S	.	.	H	α-helix	trans	-71.6	-39.4	-175.8	-56.4	-30.9	0	0	0	110.6	S393 S394 L399 E400 L401	S393-D397 PolarHBondContact O-N 3.2Å; S393-D397 VanDerWaalsContact O-OD2 3.07Å; S393-D397 PolarHBondContact OG-OD2 3.4Å; S394-D397 PolarHBondContact O-N 3.06Å; S394-D397 VanDerWaalsContact O-N 3.15Å; D397-L399 VanDerWaalsContact C-N 3.31Å; D397-L399 PolarHBondContact O-N 2.87Å; D397-E400 PolarHBondContact O-N 2.91Å; D397-L401 WeakPolarHBondContact O-CB 3.5Å; D397-L401 PolarHBondContact O-N 2.72Å
398	D	81.4	Confident	80.6	Confident	88 Å²	88	98.6 Å²	98.6	47%	0.471	50%	0.504	S	S	.	.	H	α-helix	trans	-58.4	-39.3	168.4	-73.6	-44.3	0	0	0	112.2	S394 T402	S394-D398 WeakPolarHBondContact O-CB 3.42Å; S394-D398 PolarHBondContact O-N 3.26Å; S394-D398 VanDerWaalsContact O-OD2 3.08Å; D398-T402 VanDerWaalsContact O-CB 3.31Å; D398-T402 WeakPolarHBondContact O-CB 3.38Å; D398-T402 PolarHBondContact O-N 3.43Å; D398-T402 PolarHBondContact O-OG1 3.5Å
399	L	80.8	Confident	80.7	Confident	88 Å²	88	98.5 Å²	98.5	46%	0.461	50%	0.498	S	S	.	.	H	α-helix	trans	-70.7	-36.6	177.4	179.7	63.3	0	0	0	112.4	V395 K396 D397 K403	V395-L399 VanDerWaalsContact O-CB 3.29Å; V395-L399 WeakPolarHBondContact O-CB 3.36Å; V395-L399 PolarHBondContact O-N 2.91Å; V395-L399 VanDerWaalsContact O-N 3.1Å; K396-L399 WeakPolarHBondContact O-CB 3.23Å; K396-L399 PolarHBondContact O-N 3.35Å; D397-L399 VanDerWaalsContact C-N 3.31Å; D397-L399 PolarHBondContact O-N 2.87Å; L399-K403 HydrophobicContact CG-CD 4.34Å; L399-K403 WeakPolarHBondContact O-CB 3.37Å; L399-K403 WeakPolarHBondContact O-CD 3.46Å; L399-K403 VanDerWaalsContact O-CG 3.24Å; L399-K403 WeakPolarHBondContact O-CG 3.45Å; L399-K403 PolarHBondContact O-N 3.47Å
400	E	81.1	Confident	80.9	Confident	93 Å²	93	99.2 Å²	99.2	44%	0.435	50%	0.501	S	S	.	.	H	α-helix	trans	-71.1	-38.1	174.4	-77.2	176.7	-157.6	0	0	111.9	K396 D397 S404	K396-E400 WeakPolarHBondContact CE-OE1 3.35Å; K396-E400 IonicContact NZ-OE1 3.73Å; K396-E400 PolarHBondContact NZ-OE1 2.96Å; K396-E400 IonicContact NZ-OE2 2.72Å; K396-E400 PolarHBondContact NZ-OE2 3.39Å; K396-E400 PolarHBondContact O-N 3.35Å; D397-E400 PolarHBondContact O-N 2.91Å; E400-S404 WeakPolarHBondContact O-CB 3.23Å; E400-S404 PolarHBondContact O-N 2.85Å; E400-S404 PolarHBondContact O-OG 2.89Å
401	L	83.7	Confident	81	Confident	82 Å²	82	97.6 Å²	97.6	43%	0.429	49%	0.493	S	S	.	.	H	α-helix	trans	-61.6	-45	170.1	-179.4	63.2	0	0	0	111.6	D397 S404 R405	D397-L401 WeakPolarHBondContact O-CB 3.5Å; D397-L401 PolarHBondContact O-N 2.72Å; L401-S404 WeakPolarHBondContact O-CB 3.48Å; L401-S404 PolarHBondContact O-N 3.23Å; L401-R405 PolarHBondContact O-N 3.09Å
402	T	78.6	Confident	81	Confident	74 Å²	74	97 Å²	97	45%	0.454	49%	0.492	S	S	.	.	H	α-helix	trans	-63.4	-48.1	178.9	-59.3	0	0	0	0	111.3	D398 S404 R405 T406	D398-T402 VanDerWaalsContact O-CB 3.31Å; D398-T402 WeakPolarHBondContact O-CB 3.38Å; D398-T402 PolarHBondContact O-N 3.43Å; D398-T402 PolarHBondContact O-OG1 3.5Å; T402-S404 PolarHBondContact O-N 3.39Å; T402-R405 PolarHBondContact O-N 3.31Å; T402-T406 PolarHBondContact O-N 2.94Å; T402-T406 PolarHBondContact O-OG1 2.86Å; T402-T406 VanDerWaalsContact O-OG1 3.1Å
403	K	80.9	Confident	80.9	Confident	110 Å²	110	96.2 Å²	96.2	48%	0.478	49%	0.487	S	S	.	.	H	α-helix	trans	-56.6	-35.7	173.6	-75.2	165.9	-179.1	168.3	0	112.7	L399 R407	L399-K403 HydrophobicContact CG-CD 4.34Å; L399-K403 WeakPolarHBondContact O-CB 3.37Å; L399-K403 WeakPolarHBondContact O-CD 3.46Å; L399-K403 VanDerWaalsContact O-CG 3.24Å; L399-K403 WeakPolarHBondContact O-CG 3.45Å; L399-K403 PolarHBondContact O-N 3.47Å; K403-R407 WeakPolarHBondContact O-CG 3.26Å; K403-R407 PolarHBondContact O-N 2.75Å
404	S	81.4	Confident	80.9	Confident	63 Å²	63	97.9 Å²	97.9	44%	0.441	49%	0.489	S	S	.	.	H	α-helix	trans	-69.4	-43.5	178.3	-57.5	0	0	0	0	111.6	E400 L401 T402 R407 T408	E400-S404 WeakPolarHBondContact O-CB 3.23Å; E400-S404 PolarHBondContact O-N 2.85Å; E400-S404 PolarHBondContact O-OG 2.89Å; L401-S404 WeakPolarHBondContact O-CB 3.48Å; L401-S404 PolarHBondContact O-N 3.23Å; T402-S404 PolarHBondContact O-N 3.39Å; S404-R407 PolarHBondContact O-N 3.21Å; S404-T408 PolarHBondContact O-N 2.81Å; S404-T408 VanDerWaalsContact O-N 3.08Å; S404-T408 PolarHBondContact O-OG1 2.71Å
405	R	82.4	Confident	80.9	Confident	149 Å²	149	99.2 Å²	99.2	56%	0.562	49%	0.49	S	S	*	.	H	α-helix	trans	-61.8	-45.1	174.2	-70.5	176.6	178.2	166.5	0.3	112.6	L401 T402 R407 T408 E409	L401-R405 PolarHBondContact O-N 3.09Å; T402-R405 PolarHBondContact O-N 3.31Å; R405-R407 PolarHBondContact O-N 3.48Å; R405-T408 PolarHBondContact O-N 2.89Å; R405-T408 PolarHBondContact O-OG1 3.34Å; R405-E409 PolarHBondContact O-N 2.85Å
406	T	77.4	Confident	80.8	Confident	80 Å²	80	99.9 Å²	99.9	49%	0.491	49%	0.488	S	S	.	.	H	α-helix	trans	-62.1	-33.8	178	-50.2	0	0	0	0	112	T402 Q410	T402-T406 PolarHBondContact O-N 2.94Å; T402-T406 PolarHBondContact O-OG1 2.86Å; T402-T406 VanDerWaalsContact O-OG1 3.1Å; T406-Q410 WeakPolarHBondContact O-CB 3.24Å; T406-Q410 PolarHBondContact O-N 3.3Å
407	R	81.7	Confident	80.4	Confident	168 Å²	168	100.1 Å²	100.1	63%	0.634	49%	0.493	S	S	*	.	H	α-helix	trans	-67.4	-48.2	173	-75.9	171.8	174.8	174.6	-3	112.3	K403 S404 R405 E409 Q410 D411	K403-R407 WeakPolarHBondContact O-CG 3.26Å; K403-R407 PolarHBondContact O-N 2.75Å; S404-R407 PolarHBondContact O-N 3.21Å; R405-R407 PolarHBondContact O-N 3.48Å; R407-E409 VanDerWaalsContact C-N 3.33Å; R407-E409 PolarHBondContact O-N 2.89Å; R407-Q410 WeakPolarHBondContact O-CA 3.22Å; R407-Q410 WeakPolarHBondContact O-CB 3.41Å; R407-Q410 PolarHBondContact O-N 3.39Å; R407-D411 PolarHBondContact O-N 2.97Å
408	T	82.8	Confident	80.3	Confident	79 Å²	79	102.4 Å²	102.4	49%	0.485	50%	0.5	S	S	.	.	H	α-helix	trans	-62.2	-41.2	178.7	49.9	0	0	0	0	111.8	S404 R405 Q410 D411 E412	S404-T408 PolarHBondContact O-N 2.81Å; S404-T408 VanDerWaalsContact O-N 3.08Å; S404-T408 PolarHBondContact O-OG1 2.71Å; R405-T408 PolarHBondContact O-N 2.89Å; R405-T408 PolarHBondContact O-OG1 3.34Å; T408-Q410 VanDerWaalsContact C-N 3.3Å; T408-Q410 PolarHBondContact O-N 3.27Å; T408-D411 PolarHBondContact O-N 2.8Å; T408-E412 WeakPolarHBondContact O-CB 3.43Å; T408-E412 WeakPolarHBondContact O-CG 3.49Å; T408-E412 PolarHBondContact O-N 2.96Å
409	E	79.5	Confident	80.2	Confident	88 Å²	88	105 Å²	105	41%	0.411	50%	0.504	S	S	.	.	H	α-helix	trans	-61.2	-36.8	172.1	-78.1	-174.8	-131.2	0	0	113.1	R405 R407 K413	R405-E409 PolarHBondContact O-N 2.85Å; R407-E409 VanDerWaalsContact C-N 3.33Å; R407-E409 PolarHBondContact O-N 2.89Å; E409-K413 WeakPolarHBondContact O-CB 3.44Å; E409-K413 WeakPolarHBondContact O-CD 3.47Å; E409-K413 WeakPolarHBondContact O-CG 3.11Å; E409-K413 PolarHBondContact O-N 3.39Å; E409-K413 IonicContact OE2-NZ 3.68Å; E409-K413 PolarHBondContact OE2-NZ 2.86Å
410	Q	82.6	Confident	79.9	Confident	122 Å²	122	105.3 Å²	105.3	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-68.3	-42.8	177	-179.5	178.1	-10.4	0	0	111	T406 R407 T408 K413 Q414	T406-Q410 WeakPolarHBondContact O-CB 3.24Å; T406-Q410 PolarHBondContact O-N 3.3Å; R407-Q410 WeakPolarHBondContact O-CA 3.22Å; R407-Q410 WeakPolarHBondContact O-CB 3.41Å; R407-Q410 PolarHBondContact O-N 3.39Å; T408-Q410 VanDerWaalsContact C-N 3.3Å; T408-Q410 PolarHBondContact O-N 3.27Å; Q410-K413 PolarHBondContact O-N 2.89Å; Q410-Q414 VanDerWaalsContact O-CB 3.26Å; Q410-Q414 WeakPolarHBondContact O-CB 3.33Å; Q410-Q414 PolarHBondContact O-N 3.01Å
411	D	81.3	Confident	79.6	Confident	96 Å²	96	105.7 Å²	105.7	51%	0.513	51%	0.507	S	S	.	.	H	α-helix	trans	-66.7	-40	177.5	-70	-34.1	0	0	0	111.8	R407 T408 Q414 N415	R407-D411 PolarHBondContact O-N 2.97Å; T408-D411 PolarHBondContact O-N 2.8Å; D411-Q414 PolarHBondContact O-N 3.26Å; D411-N415 WeakPolarHBondContact O-CB 3.21Å; D411-N415 VanDerWaalsContact O-CG 3.25Å; D411-N415 PolarHBondContact O-N 3Å; D411-N415 PolarHBondContact O-ND2 3.17Å; D411-N415 VanDerWaalsContact O-ND2 3.09Å
412	E	81.4	Confident	79.3	Confident	129 Å²	129	107.2 Å²	107.2	60%	0.603	51%	0.512	S	S	*	.	H	α-helix	trans	-58.5	-50.5	171.3	-76.4	172	-177.3	0	0	111.7	T408 Q414 N415 M416	T408-E412 WeakPolarHBondContact O-CB 3.43Å; T408-E412 WeakPolarHBondContact O-CG 3.49Å; T408-E412 PolarHBondContact O-N 2.96Å; E412-Q414 VanDerWaalsContact C-N 3.33Å; E412-Q414 PolarHBondContact O-N 3.31Å; E412-N415 PolarHBondContact O-N 2.93Å; E412-M416 PolarHBondContact O-N 3.01Å
413	K	78.8	Confident	79.2	Confident	124 Å²	124	107.7 Å²	107.7	54%	0.539	51%	0.508	S	S	.	.	H	α-helix	trans	-61.5	-40.6	177	-70.5	160.8	-162.7	162.6	0	111.2	E409 Q410 N415 M416 L417	E409-K413 WeakPolarHBondContact O-CB 3.44Å; E409-K413 WeakPolarHBondContact O-CD 3.47Å; E409-K413 WeakPolarHBondContact O-CG 3.11Å; E409-K413 PolarHBondContact O-N 3.39Å; E409-K413 IonicContact OE2-NZ 3.68Å; E409-K413 PolarHBondContact OE2-NZ 2.86Å; Q410-K413 PolarHBondContact O-N 2.89Å; K413-N415 PolarHBondContact O-N 3.14Å; K413-M416 PolarHBondContact O-N 3.29Å; K413-L417 WeakPolarHBondContact O-CB 3.15Å; K413-L417 PolarHBondContact O-N 3Å
414	Q	78	Confident	78.7	Confident	93 Å²	93	106.6 Å²	106.6	44%	0.435	51%	0.507	S	S	.	.	H	α-helix	trans	-67.1	-34.8	178.1	-172.4	62.1	70.5	0	0	112.9	Q410 D411 E412 K418	Q410-Q414 VanDerWaalsContact O-CB 3.26Å; Q410-Q414 WeakPolarHBondContact O-CB 3.33Å; Q410-Q414 PolarHBondContact O-N 3.01Å; D411-Q414 PolarHBondContact O-N 3.26Å; E412-Q414 VanDerWaalsContact C-N 3.33Å; E412-Q414 PolarHBondContact O-N 3.31Å; Q414-K418 WeakPolarHBondContact O-CG 3.5Å; Q414-K418 PolarHBondContact O-N 3.49Å
415	N	81.3	Confident	78.4	Confident	91 Å²	91	107.2 Å²	107.2	49%	0.487	51%	0.505	S	S	.	.	H	α-helix	trans	-74.9	-37.8	175	-71.4	-33.9	0	0	0	112	D411 E412 K413 L417 K418 Y419	D411-N415 WeakPolarHBondContact O-CB 3.21Å; D411-N415 VanDerWaalsContact O-CG 3.25Å; D411-N415 PolarHBondContact O-N 3Å; D411-N415 PolarHBondContact O-ND2 3.17Å; D411-N415 VanDerWaalsContact O-ND2 3.09Å; E412-N415 PolarHBondContact O-N 2.93Å; K413-N415 PolarHBondContact O-N 3.14Å; N415-L417 VanDerWaalsContact C-N 3.29Å; N415-L417 PolarHBondContact O-N 3.31Å; N415-K418 PolarHBondContact O-N 3.36Å; N415-K418 PolarHBondContact OD1-NZ 3.23Å; N415-Y419 PolarHBondContact O-N 3.22Å
416	M	77.5	Confident	78	Confident	113 Å²	113	103.4 Å²	103.4	56%	0.557	49%	0.494	S	S	*	.	H	α-helix	trans	-60.4	-40.5	170.6	-169.4	61.5	70.5	0	0	111.5	E412 K413 Y419 L420	E412-M416 PolarHBondContact O-N 3.01Å; K413-M416 PolarHBondContact O-N 3.29Å; M416-Y419 WeakPolarHBondContact O-CB 3.36Å; M416-Y419 PolarHBondContact O-N 3.15Å; M416-Y419 HydrophobicContact SD-CD1 4.3Å; M416-L420 HydrophobicContact CG-CD1 4.43Å; M416-L420 WeakPolarHBondContact O-CG 3.47Å; M416-L420 PolarHBondContact O-N 3.09Å
417	L	74.3	Confident	77.6	Confident	96 Å²	96	105.9 Å²	105.9	50%	0.503	50%	0.498	S	S	.	.	H	α-helix	trans	-64.3	-40.6	177.5	-150.3	159.7	0	0	0	111.6	K413 N415 L420 Q421	K413-L417 WeakPolarHBondContact O-CB 3.15Å; K413-L417 PolarHBondContact O-N 3Å; N415-L417 VanDerWaalsContact C-N 3.29Å; N415-L417 PolarHBondContact O-N 3.31Å; L417-L420 PolarHBondContact O-N 3.43Å; L417-Q421 WeakPolarHBondContact O-CB 3.39Å; L417-Q421 PolarHBondContact O-N 3.35Å
418	K	80.6	Confident	77.1	Confident	125 Å²	125	102.6 Å²	102.6	54%	0.543	49%	0.489	S	S	.	.	H	α-helix	trans	-62.7	-40.3	171.3	-70.8	172.3	-174.7	165	0	113	Q414 N415 Q421 H422	Q414-K418 WeakPolarHBondContact O-CG 3.5Å; Q414-K418 PolarHBondContact O-N 3.49Å; N415-K418 PolarHBondContact O-N 3.36Å; N415-K418 PolarHBondContact OD1-NZ 3.23Å; K418-Q421 WeakPolarHBondContact O-CB 3.41Å; K418-Q421 PolarHBondContact O-N 2.95Å; K418-H422 PolarHBondContact O-N 3.21Å
419	Y	78.8	Confident	76.7	Confident	141 Å²	141	102.2 Å²	102.2	55%	0.553	49%	0.485	S	S	*	.	H	α-helix	trans	-63.5	-44	177.4	173	-99.7	0	0	0	111.5	N415 M416 H422 K423	N415-Y419 PolarHBondContact O-N 3.22Å; M416-Y419 WeakPolarHBondContact O-CB 3.36Å; M416-Y419 PolarHBondContact O-N 3.15Å; M416-Y419 HydrophobicContact SD-CD1 4.3Å; Y419-H422 PolarHBondContact O-N 3Å; Y419-K423 HydrophobicContact CE1-CG 4.44Å; Y419-K423 PolarHBondContact O-N 3.3Å
420	L	74.2	Confident	76.4	Confident	96 Å²	96	103.7 Å²	103.7	50%	0.503	49%	0.492	S	S	.	.	H	α-helix	trans	-64.8	-37.8	175.1	-68.3	172.4	0	0	0	112.2	M416 L417 K423 I424	M416-L420 HydrophobicContact CG-CD1 4.43Å; M416-L420 WeakPolarHBondContact O-CG 3.47Å; M416-L420 PolarHBondContact O-N 3.09Å; L417-L420 PolarHBondContact O-N 3.43Å; L420-K423 PolarHBondContact O-N 2.96Å; L420-I424 WeakPolarHBondContact O-CG1 3.42Å; L420-I424 PolarHBondContact O-N 3.31Å
421	Q	75.4	Confident	75.7	Confident	100 Å²	100	104.9 Å²	104.9	47%	0.467	49%	0.491	S	S	.	.	H	α-helix	trans	-58	-54.3	173.6	-163.9	75.8	54.2	0	0	111	L417 K418 K423 I424 D425	L417-Q421 WeakPolarHBondContact O-CB 3.39Å; L417-Q421 PolarHBondContact O-N 3.35Å; K418-Q421 WeakPolarHBondContact O-CB 3.41Å; K418-Q421 PolarHBondContact O-N 2.95Å; Q421-K423 PolarHBondContact O-N 3.18Å; Q421-I424 WeakPolarHBondContact O-CA 3.45Å; Q421-I424 WeakPolarHBondContact O-CB 3.41Å; Q421-I424 PolarHBondContact O-N 3.46Å; Q421-D425 PolarHBondContact O-N 3.45Å
422	H	77.7	Confident	75.3	Confident	115 Å²	115	102.8 Å²	102.8	53%	0.532	48%	0.48	S	S	.	.	H	α-helix	trans	-58.3	-32.5	177.6	-170.1	-64.9	0	0	0	112.6	K418 Y419 E426	K418-H422 PolarHBondContact O-N 3.21Å; Y419-H422 PolarHBondContact O-N 3Å; H422-E426 IonicContact CE1-OE1 3.09Å; H422-E426 PolarHBondContact CE1-OE1 3.48Å; H422-E426 IonicContact ND1-OE1 3.15Å; H422-E426 PolarHBondContact ND1-OE1 3.16Å; H422-E426 VanDerWaalsContact ND1-OE1 3.15Å; H422-E426 WeakPolarHBondContact O-CG 3.38Å; H422-E426 PolarHBondContact O-N 3.05Å
423	K	74.7	Confident	74.8	Confident	84 Å²	84	102.9 Å²	102.9	37%	0.365	48%	0.48	S	S	.	.	H	α-helix	trans	-71.9	-29.6	174.9	-97.8	-71.9	166.5	-154.2	0	113.8	Y419 L420 Q421 E426 F427	Y419-K423 HydrophobicContact CE1-CG 4.44Å; Y419-K423 PolarHBondContact O-N 3.3Å; L420-K423 PolarHBondContact O-N 2.96Å; Q421-K423 PolarHBondContact O-N 3.18Å; K423-E426 WeakPolarHBondContact CD-OE2 3.39Å; K423-E426 WeakPolarHBondContact CE-OE2 3.04Å; K423-E426 IonicContact NZ-OE2 2.62Å; K423-E426 PolarHBondContact NZ-OE2 2.78Å; K423-F427 VanDerWaalsContact O-CD2 3.29Å; K423-F427 WeakPolarHBondContact O-CD2 3.38Å; K423-F427 PolarHBondContact O-N 3.49Å
424	I	71.5	Confident	74.3	Confident	87 Å²	87	103.7 Å²	103.7	45%	0.446	49%	0.486	S	S	.	.	H	α-helix	trans	-71	-46.6	170.9	-67.3	163.7	0	0	0	109.4	L420 Q421 E426 F427 E428	L420-I424 WeakPolarHBondContact O-CG1 3.42Å; L420-I424 PolarHBondContact O-N 3.31Å; Q421-I424 WeakPolarHBondContact O-CA 3.45Å; Q421-I424 WeakPolarHBondContact O-CB 3.41Å; Q421-I424 PolarHBondContact O-N 3.46Å; I424-E426 VanDerWaalsContact C-N 3.27Å; I424-E426 PolarHBondContact O-N 3.2Å; I424-F427 PolarHBondContact O-N 2.92Å; I424-E428 HydrophobicContact CG2-CG 4.36Å; I424-E428 PolarHBondContact O-N 3.44Å
425	D	74.6	Confident	73.8	Confident	75 Å²	75	105.4 Å²	105.4	40%	0.401	49%	0.489	S	S	.	.	H	α-helix	trans	-58.4	-38.7	179.5	-51.7	-21	0	0	0	111.4	Q421 N429	Q421-D425 PolarHBondContact O-N 3.45Å; D425-N429 PolarHBondContact O-N 2.81Å; D425-N429 PolarHBondContact O-ND2 3.37Å
426	E	74.8	Confident	73.4	Confident	70 Å²	70	103.7 Å²	103.7	33%	0.327	48%	0.484	S	S	.	.	H	α-helix	trans	-61.3	-50.3	171	-77.3	173.1	179.2	0	0	112.5	H422 K423 I424 E428 N429 E430	H422-E426 IonicContact CE1-OE1 3.09Å; H422-E426 PolarHBondContact CE1-OE1 3.48Å; H422-E426 IonicContact ND1-OE1 3.15Å; H422-E426 PolarHBondContact ND1-OE1 3.16Å; H422-E426 VanDerWaalsContact ND1-OE1 3.15Å; H422-E426 WeakPolarHBondContact O-CG 3.38Å; H422-E426 PolarHBondContact O-N 3.05Å; K423-E426 WeakPolarHBondContact CD-OE2 3.39Å; K423-E426 WeakPolarHBondContact CE-OE2 3.04Å; K423-E426 IonicContact NZ-OE2 2.62Å; K423-E426 PolarHBondContact NZ-OE2 2.78Å; I424-E426 VanDerWaalsContact C-N 3.27Å; I424-E426 PolarHBondContact O-N 3.2Å; E426-E428 PolarHBondContact O-N 3.38Å; E426-N429 PolarHBondContact O-N 3.06Å; E426-E430 PolarHBondContact O-N 3.48Å; E426-E430 VanDerWaalsContact O-N 3.09Å
427	F	69.1	Low	73.1	Confident	131 Å²	131	101.5 Å²	101.5	58%	0.575	48%	0.477	S	S	*	.	H	α-helix	trans	-64.3	-35.6	-179.9	-91.2	-59.6	0	0	0	113.4	K423 I424 N429 E430 W431	K423-F427 VanDerWaalsContact O-CD2 3.29Å; K423-F427 WeakPolarHBondContact O-CD2 3.38Å; K423-F427 PolarHBondContact O-N 3.49Å; I424-F427 PolarHBondContact O-N 2.92Å; F427-N429 VanDerWaalsContact C-N 3.32Å; F427-E430 PolarHBondContact O-N 3.27Å; F427-W431 WeakPolarHBondContact O-CB 3.46Å; F427-W431 PolarHBondContact O-N 3.01Å
428	E	70.8	Confident	72.8	Confident	99 Å²	99	102.7 Å²	102.7	46%	0.463	48%	0.482	S	S	.	.	H	α-helix	trans	-65.4	-36.2	174.9	-72.3	-164.1	179.6	0	0	111.7	I424 E426 N432	I424-E428 HydrophobicContact CG2-CG 4.36Å; I424-E428 PolarHBondContact O-N 3.44Å; E426-E428 PolarHBondContact O-N 3.38Å; E428-N432 WeakPolarHBondContact O-CB 2.98Å; E428-N432 PolarHBondContact O-N 2.84Å; E428-N432 PolarHBondContact O-ND2 3Å
429	N	74.2	Confident	72.2	Confident	72 Å²	72	99.3 Å²	99.3	39%	0.385	47%	0.473	S	S	.	.	H	α-helix	trans	-67.7	-45.8	175.1	-80	-79.1	0	0	0	111.9	D425 E426 F427 W431 N432 E433 N530	D425-N429 PolarHBondContact O-N 2.81Å; D425-N429 PolarHBondContact O-ND2 3.37Å; E426-N429 PolarHBondContact O-N 3.06Å; F427-N429 VanDerWaalsContact C-N 3.32Å; N429-W431 VanDerWaalsContact C-N 3.34Å; N429-W431 PolarHBondContact O-N 3.23Å; N429-N432 PolarHBondContact O-N 3.39Å; N429-E433 PolarHBondContact O-N 3.07Å; N429-E433 VanDerWaalsContact O-N 3.16Å; N429-N530 PolarHBondContact OD1-ND2 3.06Å
430	E	72.2	Confident	72	Confident	119 Å²	119	97.1 Å²	97.1	56%	0.556	47%	0.471	S	S	*	.	H	α-helix	trans	-57.2	-46	174.6	-70	-177.4	170.6	0	0	111.6	E426 F427 N432 E433 E434	E426-E430 PolarHBondContact O-N 3.48Å; E426-E430 VanDerWaalsContact O-N 3.09Å; F427-E430 PolarHBondContact O-N 3.27Å; E430-N432 PolarHBondContact O-N 3.37Å; E430-E433 PolarHBondContact O-N 3.32Å; E430-E434 PolarHBondContact O-N 3.17Å
431	W	68.1	Low	71.9	Confident	147 Å²	147	98.6 Å²	98.6	56%	0.557	47%	0.473	S	S	*	.	H	α-helix	trans	-62.3	-39.9	178.4	-177.5	86.5	0	0	0	113	F427 N429 E434 Y435	F427-W431 WeakPolarHBondContact O-CB 3.46Å; F427-W431 PolarHBondContact O-N 3.01Å; N429-W431 VanDerWaalsContact C-N 3.34Å; N429-W431 PolarHBondContact O-N 3.23Å; W431-E434 PolarHBondContact O-N 2.6Å; W431-Y435 HydrophobicContact CH2-CD2 4.12Å; W431-Y435 HydrophobicContact CH2-CG 4.14Å; W431-Y435 HydrophobicContact CZ2-CD2 4.03Å; W431-Y435 HydrophobicContact CZ2-CG 4.36Å; W431-Y435 VanDerWaalsContact O-CB 3.25Å; W431-Y435 WeakPolarHBondContact O-CB 3.15Å; W431-Y435 PolarHBondContact O-N 2.86Å
432	N	73.2	Confident	71.4	Confident	52 Å²	52	97.8 Å²	97.8	28%	0.278	48%	0.475	S	S	.	.	H	α-helix	trans	-67	-34.6	178.2	-81.9	-62.5	0	0	0	112.5	E428 N429 E430 S436	E428-N432 WeakPolarHBondContact O-CB 2.98Å; E428-N432 PolarHBondContact O-N 2.84Å; E428-N432 PolarHBondContact O-ND2 3Å; N429-N432 PolarHBondContact O-N 3.39Å; E430-N432 PolarHBondContact O-N 3.37Å; N432-S436 VanDerWaalsContact O-CB 3.29Å; N432-S436 WeakPolarHBondContact O-CB 3.43Å; N432-S436 PolarHBondContact O-N 3.04Å; N432-S436 PolarHBondContact O-OG 3.44Å
433	E	71.3	Confident	71	Confident	130 Å²	130	97.6 Å²	97.6	61%	0.607	48%	0.475	S	S	*	.	H	α-helix	trans	-71	-42.2	174.3	-71.6	-151.2	139.5	0	0	111.9	N429 E430 T437	N429-E433 PolarHBondContact O-N 3.07Å; N429-E433 VanDerWaalsContact O-N 3.16Å; E430-E433 PolarHBondContact O-N 3.32Å; E433-T437 VanDerWaalsContact O-CB 3.28Å; E433-T437 WeakPolarHBondContact O-CB 3.39Å; E433-T437 PolarHBondContact O-N 3.49Å; E433-T437 PolarHBondContact O-OG1 3.38Å
434	E	68.5	Low	70.9	Confident	142 Å²	142	97.3 Å²	97.3	66%	0.664	48%	0.48	S	S	*	.	H	α-helix	trans	-62.2	-46.1	174.1	-73.8	-147.4	142.2	0	0	111.8	E430 W431 T437 M438	E430-E434 PolarHBondContact O-N 3.17Å; W431-E434 PolarHBondContact O-N 2.6Å; E434-T437 WeakPolarHBondContact O-CB 3.27Å; E434-T437 PolarHBondContact O-N 2.84Å; E434-M438 PolarHBondContact O-N 3.31Å
435	Y	66.9	Low	70.7	Confident	129 Å²	129	98.9 Å²	98.9	51%	0.506	49%	0.489	S	S	.	.	H	α-helix	trans	-62.1	-45.8	179.3	-176.4	-96.6	0	0	0	111.9	W431 T437 M438 C439	W431-Y435 HydrophobicContact CH2-CD2 4.12Å; W431-Y435 HydrophobicContact CH2-CG 4.14Å; W431-Y435 HydrophobicContact CZ2-CD2 4.03Å; W431-Y435 HydrophobicContact CZ2-CG 4.36Å; W431-Y435 VanDerWaalsContact O-CB 3.25Å; W431-Y435 WeakPolarHBondContact O-CB 3.15Å; W431-Y435 PolarHBondContact O-N 2.86Å; Y435-T437 VanDerWaalsContact C-N 3.32Å; Y435-T437 PolarHBondContact O-N 3.22Å; Y435-M438 PolarHBondContact O-N 3.3Å; Y435-M438 VanDerWaalsContact O-N 3.14Å; Y435-C439 PolarHBondContact O-N 3.04Å; Y435-C439 PolarHBondContact O-SG 2.83Å
436	S	72	Confident	70.4	Confident	54 Å²	54	100.2 Å²	100.2	38%	0.378	50%	0.496	S	S	.	.	H	α-helix	trans	-60.4	-42.3	174.5	-60.6	0	0	0	0	111.9	N432 M438 C439 N440	N432-S436 VanDerWaalsContact O-CB 3.29Å; N432-S436 WeakPolarHBondContact O-CB 3.43Å; N432-S436 PolarHBondContact O-N 3.04Å; N432-S436 PolarHBondContact O-OG 3.44Å; S436-M438 VanDerWaalsContact C-N 3.3Å; S436-M438 PolarHBondContact O-N 3.41Å; S436-C439 PolarHBondContact O-N 2.74Å; S436-N440 PolarHBondContact O-N 2.91Å; S436-N440 VanDerWaalsContact O-N 3.15Å; S436-N440 PolarHBondContact O-ND2 2.9Å
437	T	72.6	Confident	70.4	Confident	68 Å²	68	102 Å²	102	42%	0.417	50%	0.504	S	S	.	.	H	α-helix	trans	-63.6	-35.8	175.5	-60.7	0	0	0	0	111.8	E433 E434 Y435 K441	E433-T437 VanDerWaalsContact O-CB 3.28Å; E433-T437 WeakPolarHBondContact O-CB 3.39Å; E433-T437 PolarHBondContact O-N 3.49Å; E433-T437 PolarHBondContact O-OG1 3.38Å; E434-T437 WeakPolarHBondContact O-CB 3.27Å; E434-T437 PolarHBondContact O-N 2.84Å; Y435-T437 VanDerWaalsContact C-N 3.32Å; Y435-T437 PolarHBondContact O-N 3.22Å; T437-K441 WeakPolarHBondContact O-CG 3.49Å; T437-K441 PolarHBondContact O-N 3.01Å
438	M	67.1	Low	70.4	Confident	120 Å²	120	99.2 Å²	99.2	59%	0.591	50%	0.501	S	S	*	.	H	α-helix	trans	-72.7	-42.2	177.5	-163.6	171.9	-61.8	0	0	112.1	E434 Y435 S436 N440 K441 V442	E434-M438 PolarHBondContact O-N 3.31Å; Y435-M438 PolarHBondContact O-N 3.3Å; Y435-M438 VanDerWaalsContact O-N 3.14Å; S436-M438 VanDerWaalsContact C-N 3.3Å; S436-M438 PolarHBondContact O-N 3.41Å; M438-N440 VanDerWaalsContact C-N 3.32Å; M438-N440 PolarHBondContact O-N 2.9Å; M438-K441 WeakPolarHBondContact O-CB 3.37Å; M438-K441 PolarHBondContact O-N 3.36Å; M438-K441 VanDerWaalsContact O-N 3.09Å; M438-V442 WeakPolarHBondContact O-CG2 3.41Å; M438-V442 PolarHBondContact O-N 3Å
439	C	67.8	Low	70.4	Confident	54 Å²	54	98.4 Å²	98.4	37%	0.365	50%	0.499	S	S	.	.	H	α-helix	trans	-56.1	-44.7	173.7	-73.4	0	0	0	0	112	Y435 S436 K441 V442 Q443	Y435-C439 PolarHBondContact O-N 3.04Å; Y435-C439 PolarHBondContact O-SG 2.83Å; S436-C439 PolarHBondContact O-N 2.74Å; C439-K441 VanDerWaalsContact C-N 3.32Å; C439-K441 PolarHBondContact O-N 2.92Å; C439-V442 PolarHBondContact O-N 3.43Å; C439-V442 VanDerWaalsContact O-N 3.17Å; C439-Q443 PolarHBondContact O-N 3Å
440	N	75	Confident	70.5	Confident	95 Å²	95	100.3 Å²	100.3	51%	0.508	51%	0.509	S	S	.	.	H	α-helix	trans	-64	-34.2	176.6	-68.4	-24.2	0	0	0	112.9	S436 M438 T444	S436-N440 PolarHBondContact O-N 2.91Å; S436-N440 VanDerWaalsContact O-N 3.15Å; S436-N440 PolarHBondContact O-ND2 2.9Å; M438-N440 VanDerWaalsContact C-N 3.32Å; M438-N440 PolarHBondContact O-N 2.9Å; N440-T444 PolarHBondContact O-N 3.11Å; N440-T444 VanDerWaalsContact O-N 3.15Å; N440-T444 PolarHBondContact O-OG1 3.4Å
441	K	71.5	Confident	70.6	Confident	127 Å²	127	101.4 Å²	101.4	55%	0.552	51%	0.512	S	S	*	.	H	α-helix	trans	-69	-38.7	172.5	-71.6	167.9	-177.2	169.3	0	112.1	T437 M438 C439 T444 L445	T437-K441 WeakPolarHBondContact O-CG 3.49Å; T437-K441 PolarHBondContact O-N 3.01Å; M438-K441 WeakPolarHBondContact O-CB 3.37Å; M438-K441 PolarHBondContact O-N 3.36Å; M438-K441 VanDerWaalsContact O-N 3.09Å; C439-K441 VanDerWaalsContact C-N 3.32Å; C439-K441 PolarHBondContact O-N 2.92Å; K441-T444 PolarHBondContact O-OG1 3.46Å; K441-L445 WeakPolarHBondContact O-CB 3.42Å; K441-L445 VanDerWaalsContact O-CG 3.29Å; K441-L445 WeakPolarHBondContact O-CG 3.39Å; K441-L445 PolarHBondContact O-N 3.33Å
442	V	65.1	Low	70.5	Confident	83 Å²	83	97.6 Å²	97.6	50%	0.503	51%	0.507	S	S	.	.	H	α-helix	trans	-64.8	-47.3	175.7	172.7	0	0	0	0	110.6	M438 C439 T444 L445 D446	M438-V442 WeakPolarHBondContact O-CG2 3.41Å; M438-V442 PolarHBondContact O-N 3Å; C439-V442 PolarHBondContact O-N 3.43Å; C439-V442 VanDerWaalsContact O-N 3.17Å; V442-T444 PolarHBondContact O-N 2.8Å; V442-L445 WeakPolarHBondContact O-CB 2.95Å; V442-L445 PolarHBondContact O-N 2.98Å; V442-D446 PolarHBondContact O-N 3.08Å
443	Q	69.8	Low	70.2	Confident	112 Å²	112	101 Å²	101	52%	0.523	52%	0.52	S	S	.	.	H	α-helix	trans	-59.8	-46.3	178.4	-174.8	-177.2	-33.8	0	0	112.1	C439 L445 D446 E447	C439-Q443 PolarHBondContact O-N 3Å; Q443-L445 VanDerWaalsContact C-N 3.3Å; Q443-L445 PolarHBondContact O-N 3.04Å; Q443-D446 PolarHBondContact O-N 3.2Å; Q443-D446 VanDerWaalsContact O-N 3.15Å; Q443-E447 PolarHBondContact NE2-OE1 3.04Å; Q443-E447 WeakPolarHBondContact O-CG 3.26Å; Q443-E447 PolarHBondContact O-N 3.34Å
444	T	71.7	Confident	70.4	Confident	78 Å²	78	98 Å²	98	48%	0.479	51%	0.511	S	S	.	.	H	α-helix	trans	-68.5	-26.8	179	46.8	0	0	0	0	113.4	N440 K441 V442 S448	N440-T444 PolarHBondContact O-N 3.11Å; N440-T444 VanDerWaalsContact O-N 3.15Å; N440-T444 PolarHBondContact O-OG1 3.4Å; K441-T444 PolarHBondContact O-OG1 3.46Å; V442-T444 PolarHBondContact O-N 2.8Å; T444-S448 WeakPolarHBondContact O-CB 3.42Å; T444-S448 PolarHBondContact O-N 2.95Å; T444-S448 VanDerWaalsContact O-N 3.14Å; T444-S448 PolarHBondContact O-OG 3.43Å
445	L	67.9	Low	70.5	Confident	120 Å²	120	96.4 Å²	96.4	63%	0.628	50%	0.503	S	S	*	.	H	α-helix	trans	-70.3	-41.2	168.2	-77.7	168.7	0	0	0	112.1	K441 V442 Q443 S448 L449	K441-L445 WeakPolarHBondContact O-CB 3.42Å; K441-L445 VanDerWaalsContact O-CG 3.29Å; K441-L445 WeakPolarHBondContact O-CG 3.39Å; K441-L445 PolarHBondContact O-N 3.33Å; V442-L445 WeakPolarHBondContact O-CB 2.95Å; V442-L445 PolarHBondContact O-N 2.98Å; Q443-L445 VanDerWaalsContact C-N 3.3Å; Q443-L445 PolarHBondContact O-N 3.04Å; L445-S448 WeakPolarHBondContact O-CB 3.41Å; L445-S448 PolarHBondContact O-N 3.31Å; L445-L449 WeakPolarHBondContact O-CB 3.33Å; L445-L449 PolarHBondContact O-N 3.05Å
446	D	68	Low	70.5	Confident	103 Å²	103	97.1 Å²	97.1	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-67.8	-41	177.9	-114.1	-7.8	0	0	0	112	V442 Q443 S448 L449 L450	V442-D446 PolarHBondContact O-N 3.08Å; Q443-D446 PolarHBondContact O-N 3.2Å; Q443-D446 VanDerWaalsContact O-N 3.15Å; D446-S448 VanDerWaalsContact C-N 3.29Å; D446-S448 PolarHBondContact O-N 3.26Å; D446-L449 PolarHBondContact O-N 2.98Å; D446-L450 VanDerWaalsContact O-CB 3.3Å; D446-L450 WeakPolarHBondContact O-CB 3.29Å; D446-L450 PolarHBondContact O-N 3.36Å
447	E	75	Confident	70.5	Confident	106 Å²	106	97.8 Å²	97.8	50%	0.495	51%	0.514	S	S	.	.	H	α-helix	trans	-59.8	-40.3	170.9	-72.9	175.9	-158.8	0	0	111.5	Q443 K451	Q443-E447 PolarHBondContact NE2-OE1 3.04Å; Q443-E447 WeakPolarHBondContact O-CG 3.26Å; Q443-E447 PolarHBondContact O-N 3.34Å; E447-K451 VanDerWaalsContact O-CB 3.28Å; E447-K451 WeakPolarHBondContact O-CB 3.32Å; E447-K451 PolarHBondContact O-N 2.87Å
448	S	70.1	Confident	70.4	Confident	73 Å²	73	100.4 Å²	100.4	51%	0.51	52%	0.521	S	S	.	.	H	α-helix	trans	-68.1	-40.6	175.9	-62.4	0	0	0	0	112.4	T444 L445 D446 K451 S452	T444-S448 WeakPolarHBondContact O-CB 3.42Å; T444-S448 PolarHBondContact O-N 2.95Å; T444-S448 VanDerWaalsContact O-N 3.14Å; T444-S448 PolarHBondContact O-OG 3.43Å; L445-S448 WeakPolarHBondContact O-CB 3.41Å; L445-S448 PolarHBondContact O-N 3.31Å; D446-S448 VanDerWaalsContact C-N 3.29Å; D446-S448 PolarHBondContact O-N 3.26Å; S448-K451 PolarHBondContact O-N 3.18Å; S448-S452 WeakPolarHBondContact O-CB 3.3Å; S448-S452 PolarHBondContact O-N 3.06Å
449	L	71.2	Confident	70.6	Confident	83 Å²	83	100 Å²	100	44%	0.435	52%	0.521	S	S	.	.	H	α-helix	trans	-66	-41.7	175.8	178.3	61.8	0	0	0	111.5	L445 D446 S452 K453	L445-L449 WeakPolarHBondContact O-CB 3.33Å; L445-L449 PolarHBondContact O-N 3.05Å; D446-L449 PolarHBondContact O-N 2.98Å; L449-S452 PolarHBondContact O-N 3.41Å; L449-K453 WeakPolarHBondContact O-CG 3.31Å; L449-K453 PolarHBondContact O-N 3.28Å
450	L	76.2	Confident	70.8	Confident	112 Å²	112	102.8 Å²	102.8	59%	0.586	53%	0.527	S	S	*	.	H	α-helix	trans	-63	-46.4	175	-175.3	64.2	0	0	0	110.7	D446 S452 K453 T454	D446-L450 VanDerWaalsContact O-CB 3.3Å; D446-L450 WeakPolarHBondContact O-CB 3.29Å; D446-L450 PolarHBondContact O-N 3.36Å; L450-S452 VanDerWaalsContact C-N 3.32Å; L450-S452 PolarHBondContact O-N 3.19Å; L450-K453 WeakPolarHBondContact O-CB 3.38Å; L450-K453 PolarHBondContact O-N 3.37Å; L450-T454 PolarHBondContact O-N 3.12Å; L450-T454 PolarHBondContact O-OG1 3.39Å; L450-T454 VanDerWaalsContact O-OG1 3.12Å
451	K	72.6	Confident	70.8	Confident	142 Å²	142	102.7 Å²	102.7	62%	0.617	53%	0.53	S	S	*	.	H	α-helix	trans	-61.3	-39.3	175.9	-167.6	171.9	-173.3	172.4	0	112.3	E447 S448 T454 Q455	E447-K451 VanDerWaalsContact O-CB 3.28Å; E447-K451 WeakPolarHBondContact O-CB 3.32Å; E447-K451 PolarHBondContact O-N 2.87Å; S448-K451 PolarHBondContact O-N 3.18Å; K451-T454 PolarHBondContact O-N 2.81Å; K451-Q455 WeakPolarHBondContact O-CG 3.38Å; K451-Q455 PolarHBondContact O-N 2.78Å
452	S	66.5	Low	70.7	Confident	66 Å²	66	105.1 Å²	105.1	46%	0.462	54%	0.536	S	S	.	.	H	α-helix	trans	-65.6	-41.2	173.5	-173.1	0	0	0	0	112.3	S448 L449 L450 T454 Q455 F456	S448-S452 WeakPolarHBondContact O-CB 3.3Å; S448-S452 PolarHBondContact O-N 3.06Å; L449-S452 PolarHBondContact O-N 3.41Å; L450-S452 VanDerWaalsContact C-N 3.32Å; L450-S452 PolarHBondContact O-N 3.19Å; S452-T454 PolarHBondContact O-N 3.38Å; S452-Q455 PolarHBondContact O-N 2.84Å; S452-F456 WeakPolarHBondContact O-CB 3.24Å; S452-F456 PolarHBondContact O-N 2.94Å
453	K	68.2	Low	70.9	Confident	123 Å²	123	106.1 Å²	106.1	54%	0.535	54%	0.538	S	S	.	.	H	α-helix	trans	-60.8	-41.1	171.6	-75.2	170.4	179.4	169.7	0	111.9	L449 L450 F456 S457	L449-K453 WeakPolarHBondContact O-CG 3.31Å; L449-K453 PolarHBondContact O-N 3.28Å; L450-K453 WeakPolarHBondContact O-CB 3.38Å; L450-K453 PolarHBondContact O-N 3.37Å; K453-F456 PolarHBondContact O-N 3.06Å; K453-S457 WeakPolarHBondContact O-CB 3.33Å; K453-S457 PolarHBondContact O-N 3.43Å; K453-S457 PolarHBondContact O-OG 3.25Å
454	T	75	Confident	71	Confident	68 Å²	68	105 Å²	105	42%	0.417	53%	0.532	S	S	.	.	H	α-helix	trans	-63.2	-47.7	175	-55.2	0	0	0	0	111.2	L450 K451 S452 F456 S457 E458	L450-T454 PolarHBondContact O-N 3.12Å; L450-T454 PolarHBondContact O-OG1 3.39Å; L450-T454 VanDerWaalsContact O-OG1 3.12Å; K451-T454 PolarHBondContact O-N 2.81Å; S452-T454 PolarHBondContact O-N 3.38Å; T454-F456 PolarHBondContact O-N 3.44Å; T454-S457 WeakPolarHBondContact O-CA 3.31Å; T454-S457 WeakPolarHBondContact O-CB 3.46Å; T454-S457 PolarHBondContact O-N 2.92Å; T454-S457 VanDerWaalsContact O-N 3.1Å; T454-E458 WeakPolarHBondContact O-CG 3.42Å; T454-E458 PolarHBondContact O-N 3.23Å
455	Q	69.2	Low	71.1	Confident	108 Å²	108	103 Å²	103	51%	0.505	53%	0.527	S	S	.	.	H	α-helix	trans	-61.8	-40.1	176.2	-73.8	179.6	-23.9	0	0	112.7	K451 S452 S457 E458 L459	K451-Q455 WeakPolarHBondContact O-CG 3.38Å; K451-Q455 PolarHBondContact O-N 2.78Å; S452-Q455 PolarHBondContact O-N 2.84Å; Q455-S457 VanDerWaalsContact C-N 3.31Å; Q455-S457 PolarHBondContact O-N 2.97Å; Q455-E458 PolarHBondContact O-N 3.14Å; Q455-L459 WeakPolarHBondContact O-CB 3.45Å; Q455-L459 VanDerWaalsContact O-CG 3.26Å; Q455-L459 WeakPolarHBondContact O-CG 3.45Å; Q455-L459 PolarHBondContact O-N 2.9Å
456	F	68.7	Low	71.1	Confident	145 Å²	145	102.2 Å²	102.2	64%	0.636	52%	0.521	S	S	*	.	H	α-helix	trans	-64.8	-36.6	173.9	-170.9	-91.8	0	0	0	111.9	S452 K453 T454 L459 K460	S452-F456 WeakPolarHBondContact O-CB 3.24Å; S452-F456 PolarHBondContact O-N 2.94Å; K453-F456 PolarHBondContact O-N 3.06Å; T454-F456 PolarHBondContact O-N 3.44Å; F456-L459 PolarHBondContact O-N 3.43Å; F456-K460 WeakPolarHBondContact O-CB 3.22Å; F456-K460 PolarHBondContact O-N 3.24Å
457	S	70.4	Confident	71.2	Confident	67 Å²	67	100.3 Å²	100.3	47%	0.469	51%	0.513	S	S	.	.	H	α-helix	trans	-66	-47.2	174.9	-56.1	0	0	0	0	111.4	K453 T454 Q455 L459 K460 T461	K453-S457 WeakPolarHBondContact O-CB 3.33Å; K453-S457 PolarHBondContact O-N 3.43Å; K453-S457 PolarHBondContact O-OG 3.25Å; T454-S457 WeakPolarHBondContact O-CA 3.31Å; T454-S457 WeakPolarHBondContact O-CB 3.46Å; T454-S457 PolarHBondContact O-N 2.92Å; T454-S457 VanDerWaalsContact O-N 3.1Å; Q455-S457 VanDerWaalsContact C-N 3.31Å; Q455-S457 PolarHBondContact O-N 2.97Å; S457-L459 VanDerWaalsContact C-N 3.35Å; S457-L459 PolarHBondContact O-N 3.35Å; S457-K460 PolarHBondContact O-N 3.02Å; S457-T461 PolarHBondContact O-N 2.84Å; S457-T461 PolarHBondContact O-OG1 2.86Å
458	E	72.1	Confident	71.2	Confident	124 Å²	124	100.5 Å²	100.5	58%	0.579	52%	0.518	S	S	*	.	H	α-helix	trans	-58.2	-45.3	173.5	-72.1	175.1	-171.6	0	0	111.7	T454 Q455 T461 R462	T454-E458 WeakPolarHBondContact O-CG 3.42Å; T454-E458 PolarHBondContact O-N 3.23Å; Q455-E458 PolarHBondContact O-N 3.14Å; E458-T461 PolarHBondContact O-N 3.39Å; E458-R462 WeakPolarHBondContact O-CB 3.34Å; E458-R462 PolarHBondContact O-N 3.39Å
459	L	70	Confident	71.1	Confident	112 Å²	112	102.5 Å²	102.5	59%	0.586	52%	0.519	S	S	*	.	H	α-helix	trans	-64.7	-37.7	176.6	-74.4	170	0	0	0	112.3	Q455 F456 S457 R462 L463	Q455-L459 WeakPolarHBondContact O-CB 3.45Å; Q455-L459 VanDerWaalsContact O-CG 3.26Å; Q455-L459 WeakPolarHBondContact O-CG 3.45Å; Q455-L459 PolarHBondContact O-N 2.9Å; F456-L459 PolarHBondContact O-N 3.43Å; S457-L459 VanDerWaalsContact C-N 3.35Å; S457-L459 PolarHBondContact O-N 3.35Å; L459-R462 PolarHBondContact O-N 3.38Å; L459-L463 VanDerWaalsContact O-CB 3.29Å; L459-L463 WeakPolarHBondContact O-CB 3.34Å; L459-L463 PolarHBondContact O-N 3.14Å
460	K	72.5	Confident	71	Confident	111 Å²	111	104.5 Å²	104.5	48%	0.483	52%	0.524	S	S	.	.	H	α-helix	trans	-65.7	-50.5	174.5	-171.9	-178.1	-175.1	-96	0	111.3	F456 S457 R462 L463 E464	F456-K460 WeakPolarHBondContact O-CB 3.22Å; F456-K460 PolarHBondContact O-N 3.24Å; S457-K460 PolarHBondContact O-N 3.02Å; K460-R462 PolarHBondContact O-N 3.37Å; K460-L463 WeakPolarHBondContact O-CB 3.39Å; K460-L463 PolarHBondContact O-N 3.45Å; K460-E464 WeakPolarHBondContact CE-OE1 3.49Å; K460-E464 IonicContact NZ-OE1 2.67Å; K460-E464 PolarHBondContact NZ-OE1 3.22Å; K460-E464 WeakPolarHBondContact O-CG 3.43Å; K460-E464 PolarHBondContact O-N 2.88Å
461	T	74.6	Confident	70.8	Confident	94 Å²	94	103.4 Å²	103.4	58%	0.577	52%	0.519	S	S	*	.	H	α-helix	trans	-59.7	-36	176.3	-53.8	0	0	0	0	111.3	S457 E458 G465	S457-T461 PolarHBondContact O-N 2.84Å; S457-T461 PolarHBondContact O-OG1 2.86Å; E458-T461 PolarHBondContact O-N 3.39Å; T461-G465 PolarHBondContact O-N 2.81Å
462	R	69.9	Low	70.8	Confident	178 Å²	178	101.9 Å²	101.9	67%	0.672	51%	0.512	S	S	*	.	H	α-helix	trans	-73.6	-31.9	175.3	-166.1	172.4	-172.1	162.6	2.1	112.8	E458 L459 K460 M466	E458-R462 WeakPolarHBondContact O-CB 3.34Å; E458-R462 PolarHBondContact O-N 3.39Å; L459-R462 PolarHBondContact O-N 3.38Å; K460-R462 PolarHBondContact O-N 3.37Å; R462-M466 HydrophobicContact CG-CE 4.47Å; R462-M466 WeakPolarHBondContact O-CB 3.4Å; R462-M466 VanDerWaalsContact O-CG 3.25Å; R462-M466 WeakPolarHBondContact O-CG 3.48Å; R462-M466 PolarHBondContact O-N 3.03Å
463	L	69.8	Low	70.8	Confident	104 Å²	104	103.2 Å²	103.2	55%	0.545	51%	0.514	S	S	.	.	H	α-helix	trans	-71.7	-40.9	172.6	-176.3	66.5	0	0	0	111.5	L459 K460 M466 T467	L459-L463 VanDerWaalsContact O-CB 3.29Å; L459-L463 WeakPolarHBondContact O-CB 3.34Å; L459-L463 PolarHBondContact O-N 3.14Å; K460-L463 WeakPolarHBondContact O-CB 3.39Å; K460-L463 PolarHBondContact O-N 3.45Å; L463-M466 HydrophobicContact CD1-CE 4.29Å; L463-M466 PolarHBondContact O-N 2.85Å; L463-T467 VanDerWaalsContact O-CB 3.27Å; L463-T467 WeakPolarHBondContact O-CB 3.47Å; L463-T467 PolarHBondContact O-N 3.05Å; L463-T467 PolarHBondContact O-OG1 2.93Å
464	E	71.9	Confident	70.5	Confident	89 Å²	89	101.6 Å²	101.6	42%	0.416	51%	0.508	S	S	.	.	H	α-helix	trans	-63.1	-44.2	171	-72.2	171.8	-173.8	0	0	110.4	K460 T467 N468	K460-E464 WeakPolarHBondContact CE-OE1 3.49Å; K460-E464 IonicContact NZ-OE1 2.67Å; K460-E464 PolarHBondContact NZ-OE1 3.22Å; K460-E464 WeakPolarHBondContact O-CG 3.43Å; K460-E464 PolarHBondContact O-N 2.88Å; E464-T467 PolarHBondContact O-N 2.95Å; E464-T467 VanDerWaalsContact O-N 3.16Å; E464-N468 WeakPolarHBondContact O-CB 3.41Å; E464-N468 VanDerWaalsContact O-CG 3.31Å; E464-N468 PolarHBondContact O-N 3.15Å; E464-N468 PolarHBondContact O-ND2 3.03Å
465	G	73	Confident	70.1	Confident	35 Å²	35	103.1 Å²	103.1	36%	0.361	51%	0.511	S	S	.	.	H	α-helix	trans	-56.4	-50.9	170.9	0	0	0	0	0	112.8	T461 T467 N468 E469	T461-G465 PolarHBondContact O-N 2.81Å; G465-T467 VanDerWaalsContact C-N 3.28Å; G465-T467 PolarHBondContact O-N 3.26Å; G465-N468 PolarHBondContact O-N 2.73Å; G465-E469 VanDerWaalsContact O-CB 3.26Å; G465-E469 WeakPolarHBondContact O-CB 3.4Å; G465-E469 PolarHBondContact O-N 2.94Å
466	M	68.9	Low	69.9	Low	104 Å²	104	102.8 Å²	102.8	51%	0.512	51%	0.508	S	S	.	.	H	α-helix	trans	-66.9	-24.6	175.5	-73.2	-175.6	-57.1	0	0	113.3	R462 L463 K470	R462-M466 HydrophobicContact CG-CE 4.47Å; R462-M466 WeakPolarHBondContact O-CB 3.4Å; R462-M466 VanDerWaalsContact O-CG 3.25Å; R462-M466 WeakPolarHBondContact O-CG 3.48Å; R462-M466 PolarHBondContact O-N 3.03Å; L463-M466 HydrophobicContact CD1-CE 4.29Å; L463-M466 PolarHBondContact O-N 2.85Å; M466-K470 WeakPolarHBondContact O-CA 3.38Å; M466-K470 WeakPolarHBondContact O-CB 3.49Å; M466-K470 PolarHBondContact O-N 3.14Å
467	T	69.2	Low	69.5	Low	62 Å²	62	101.5 Å²	101.5	38%	0.38	50%	0.503	S	S	.	.	H	α-helix	trans	-78.6	-42.6	176	-60.4	0	0	0	0	110.6	L463 E464 G465 K470 N471	L463-T467 VanDerWaalsContact O-CB 3.27Å; L463-T467 WeakPolarHBondContact O-CB 3.47Å; L463-T467 PolarHBondContact O-N 3.05Å; L463-T467 PolarHBondContact O-OG1 2.93Å; E464-T467 PolarHBondContact O-N 2.95Å; E464-T467 VanDerWaalsContact O-N 3.16Å; G465-T467 VanDerWaalsContact C-N 3.28Å; G465-T467 PolarHBondContact O-N 3.26Å; T467-K470 PolarHBondContact O-N 2.96Å; T467-N471 WeakPolarHBondContact O-CB 3.41Å; T467-N471 PolarHBondContact O-N 3.09Å; T467-N471 PolarHBondContact O-ND2 3.03Å; T467-N471 PolarHBondContact O-OD1 3.44Å
468	N	74.5	Confident	69	Low	110 Å²	110	102.9 Å²	102.9	59%	0.588	51%	0.506	S	S	*	.	H	α-helix	trans	-65	-42.3	172.1	-70.5	-24	0	0	0	111	E464 G465 N471 F472	E464-N468 WeakPolarHBondContact O-CB 3.41Å; E464-N468 VanDerWaalsContact O-CG 3.31Å; E464-N468 PolarHBondContact O-N 3.15Å; E464-N468 PolarHBondContact O-ND2 3.03Å; G465-N468 PolarHBondContact O-N 2.73Å; N468-N471 PolarHBondContact O-N 3.15Å; N468-F472 VanDerWaalsContact O-CB 3.25Å; N468-F472 WeakPolarHBondContact O-CB 3.42Å; N468-F472 PolarHBondContact O-N 3.17Å
469	E	68.5	Low	68.5	Low	116 Å²	116	102.8 Å²	102.8	54%	0.542	50%	0.503	S	S	.	.	H	α-helix	trans	-69.6	-36.3	174.7	-171.6	166.5	-157.2	0	0	111.8	G465 L473	G465-E469 VanDerWaalsContact O-CB 3.26Å; G465-E469 WeakPolarHBondContact O-CB 3.4Å; G465-E469 PolarHBondContact O-N 2.94Å; E469-L473 HydrophobicContact CG-CD1 3.84Å; E469-L473 HydrophobicContact CG-CG 4.09Å; E469-L473 WeakPolarHBondContact O-CA 3.25Å; E469-L473 WeakPolarHBondContact O-CB 3.43Å; E469-L473 WeakPolarHBondContact O-CG 3.38Å; E469-L473 PolarHBondContact O-N 2.89Å
470	K	70.3	Confident	67.8	Low	124 Å²	124	101.8 Å²	101.8	54%	0.539	50%	0.498	S	S	.	.	H	α-helix	trans	-60.4	-48.4	169.1	178.1	-166.1	171.2	-166.8	0	110.9	M466 T467 L473 Q474	M466-K470 WeakPolarHBondContact O-CA 3.38Å; M466-K470 WeakPolarHBondContact O-CB 3.49Å; M466-K470 PolarHBondContact O-N 3.14Å; T467-K470 PolarHBondContact O-N 2.96Å; K470-L473 CarbonylContact O-C 3.41Å; K470-L473 PolarHBondContact O-N 3.11Å; K470-Q474 WeakPolarHBondContact O-CB 3.44Å; K470-Q474 PolarHBondContact O-N 2.62Å
471	N	71.5	Confident	66.8	Low	89 Å²	89	103.6 Å²	103.6	48%	0.476	51%	0.506	S	S	.	.	H	α-helix	trans	-63	-46.1	-179.5	-70.2	-15.4	0	0	0	110.6	T467 N468 Q474 E475	T467-N471 WeakPolarHBondContact O-CB 3.41Å; T467-N471 PolarHBondContact O-N 3.09Å; T467-N471 PolarHBondContact O-ND2 3.03Å; T467-N471 PolarHBondContact O-OD1 3.44Å; N468-N471 PolarHBondContact O-N 3.15Å; N471-Q474 PolarHBondContact O-N 2.98Å; N471-E475 WeakPolarHBondContact O-CB 3.37Å; N471-E475 PolarHBondContact O-N 3.47Å
472	F	72.2	Confident	65.8	Low	110 Å²	110	105.5 Å²	105.5	48%	0.482	51%	0.512	S	S	.	.	H	α-helix	trans	-61.4	-42.4	173.6	176.8	-108.9	0	0	0	112.4	N468 Q474 K476	N468-F472 VanDerWaalsContact O-CB 3.25Å; N468-F472 WeakPolarHBondContact O-CB 3.42Å; N468-F472 PolarHBondContact O-N 3.17Å; F472-Q474 VanDerWaalsContact C-N 3.35Å; F472-K476 HydrophobicContact CD1-CD 4.42Å; F472-K476 HydrophobicContact CE1-CD 3.79Å; F472-K476 HydrophobicContact CZ-CD 3.91Å; F472-K476 HydrophobicContact CZ-CG 4.39Å; F472-K476 WeakPolarHBondContact O-CB 3.34Å; F472-K476 PolarHBondContact O-N 3.2Å
473	L	65.7	Low	64.9	Low	94 Å²	94	99.7 Å²	99.7	49%	0.492	50%	0.499	S	S	.	.	H	α-helix	trans	-70.3	-28.6	176.2	-76.4	174.1	0	0	0	112.5	E469 K470 K476 Q477	E469-L473 HydrophobicContact CG-CD1 3.84Å; E469-L473 HydrophobicContact CG-CG 4.09Å; E469-L473 WeakPolarHBondContact O-CA 3.25Å; E469-L473 WeakPolarHBondContact O-CB 3.43Å; E469-L473 WeakPolarHBondContact O-CG 3.38Å; E469-L473 PolarHBondContact O-N 2.89Å; K470-L473 CarbonylContact O-C 3.41Å; K470-L473 PolarHBondContact O-N 3.11Å; L473-K476 CarbonylContact O-C 3.55Å; L473-Q477 WeakPolarHBondContact O-CA 3.43Å; L473-Q477 WeakPolarHBondContact O-CB 3.38Å; L473-Q477 PolarHBondContact O-N 3.09Å
474	Q	63.5	Low	63.7	Low	89 Å²	89	99.6 Å²	99.6	42%	0.416	50%	0.498	S	S	.	.	H	α-helix	trans	-83.9	-33.4	178.8	-167	160.3	-3.7	0	0	111.2	K470 N471 F472 Q477 N478	K470-Q474 WeakPolarHBondContact O-CB 3.44Å; K470-Q474 PolarHBondContact O-N 2.62Å; N471-Q474 PolarHBondContact O-N 2.98Å; F472-Q474 VanDerWaalsContact C-N 3.35Å; Q474-Q477 PolarHBondContact O-N 3.29Å; Q474-N478 PolarHBondContact O-N 3.3Å; Q474-N478 PolarHBondContact O-ND2 3.21Å
475	E	65.4	Low	62.5	Low	100 Å²	100	102.5 Å²	102.5	47%	0.467	52%	0.516	S	S	.	.	H	α-helix	trans	-67.8	-45	165.5	-159.5	-153	141.7	0	0	111	N471 Q477 N478 K479	N471-E475 WeakPolarHBondContact O-CB 3.37Å; N471-E475 PolarHBondContact O-N 3.47Å; E475-Q477 VanDerWaalsContact C-N 3.25Å; E475-Q477 PolarHBondContact O-N 3.05Å; E475-N478 PolarHBondContact O-N 3.45Å; E475-K479 PolarHBondContact O-N 3.45Å; E475-K479 VanDerWaalsContact OE1-CE 3.31Å; E475-K479 WeakPolarHBondContact OE1-CE 3.36Å; E475-K479 IonicContact OE1-NZ 2.62Å; E475-K479 PolarHBondContact OE1-NZ 3.05Å
476	K	65.2	Low	61.2	Low	102 Å²	102	104.5 Å²	104.5	44%	0.443	53%	0.529	S	S	.	.	H	α-helix	trans	-58.7	-36.5	167.9	-100.3	-171.8	173	177.6	0	111.3	F472 L473 L480	F472-K476 HydrophobicContact CD1-CD 4.42Å; F472-K476 HydrophobicContact CE1-CD 3.79Å; F472-K476 HydrophobicContact CZ-CD 3.91Å; F472-K476 HydrophobicContact CZ-CG 4.39Å; F472-K476 WeakPolarHBondContact O-CB 3.34Å; F472-K476 PolarHBondContact O-N 3.2Å; L473-K476 CarbonylContact O-C 3.55Å; K476-L480 WeakPolarHBondContact O-CA 3.44Å; K476-L480 WeakPolarHBondContact O-CB 3.45Å; K476-L480 PolarHBondContact O-N 3.17Å
477	Q	59.7	Low	59.9	Low	117 Å²	117	104.3 Å²	104.3	55%	0.547	53%	0.53	S	S	.	.	H	α-helix	trans	-69.1	-40.3	178.1	-175.7	-177.4	32.6	0	0	110.5	L473 Q474 E475 L480 K481	L473-Q477 WeakPolarHBondContact O-CA 3.43Å; L473-Q477 WeakPolarHBondContact O-CB 3.38Å; L473-Q477 PolarHBondContact O-N 3.09Å; Q474-Q477 PolarHBondContact O-N 3.29Å; E475-Q477 VanDerWaalsContact C-N 3.25Å; E475-Q477 PolarHBondContact O-N 3.05Å; Q477-L480 CarbonylContact O-C 3.57Å; Q477-L480 PolarHBondContact O-N 2.77Å; Q477-K481 WeakPolarHBondContact O-CB 3.17Å; Q477-K481 PolarHBondContact O-N 3.18Å
478	N	60.1	Low	58.8	Low	96 Å²	96	110 Å²	110	51%	0.513	55%	0.554	S	S	.	*	H	α-helix	trans	-65	-45	175.2	-72.4	-21.6	0	0	0	111	Q474 E475 K481 L482	Q474-N478 PolarHBondContact O-N 3.3Å; Q474-N478 PolarHBondContact O-ND2 3.21Å; E475-N478 PolarHBondContact O-N 3.45Å; N478-K481 PolarHBondContact O-N 3.22Å; N478-L482 PolarHBondContact O-N 3.05Å
479	K	62.9	Low	57.4	Low	123 Å²	123	112.7 Å²	112.7	54%	0.535	56%	0.56	S	S	.	*	H	α-helix	trans	-61.1	-46.5	171.6	-74.8	171.1	172.3	170	0	111.5	E475 K481 L482 S483	E475-K479 PolarHBondContact O-N 3.45Å; E475-K479 VanDerWaalsContact OE1-CE 3.31Å; E475-K479 WeakPolarHBondContact OE1-CE 3.36Å; E475-K479 IonicContact OE1-NZ 2.62Å; E475-K479 PolarHBondContact OE1-NZ 3.05Å; K479-K481 VanDerWaalsContact C-N 3.31Å; K479-K481 PolarHBondContact O-N 3.49Å; K479-L482 PolarHBondContact O-N 3.02Å; K479-S483 WeakPolarHBondContact O-CB 3.39Å; K479-S483 PolarHBondContact O-N 2.79Å; K479-S483 PolarHBondContact O-OG 3.13Å
480	L	54.8	Low	55.7	Low	91 Å²	91	113.9 Å²	113.9	48%	0.476	58%	0.575	S	S	.	*	H	α-helix	trans	-68.3	-21.7	175	-104.6	70.3	0	0	0	113.4	K476 Q477 S483 L484	K476-L480 WeakPolarHBondContact O-CA 3.44Å; K476-L480 WeakPolarHBondContact O-CB 3.45Å; K476-L480 PolarHBondContact O-N 3.17Å; Q477-L480 CarbonylContact O-C 3.57Å; Q477-L480 PolarHBondContact O-N 2.77Å; L480-S483 CarbonylContact O-C 3.57Å; L480-S483 PolarHBondContact O-N 3.19Å; L480-L484 HydrophobicContact CB-CD1 4.02Å; L480-L484 HydrophobicContact CD2-CD1 3.97Å; L480-L484 HydrophobicContact CG-CD1 3.84Å; L480-L484 WeakPolarHBondContact O-CA 3.21Å; L480-L484 WeakPolarHBondContact O-CB 3.38Å; L480-L484 WeakPolarHBondContact O-CD1 3.33Å; L480-L484 PolarHBondContact O-N 3.14Å
481	K	51.8	Low	53.8	Low	149 Å²	149	116.9 Å²	116.9	65%	0.648	59%	0.588	S	S	*	*	H	α-helix	trans	-75.7	-39.6	176.9	-164.5	172.8	-175.7	-177.2	0	109.7	Q477 N478 K479 L485	Q477-K481 WeakPolarHBondContact O-CB 3.17Å; Q477-K481 PolarHBondContact O-N 3.18Å; N478-K481 PolarHBondContact O-N 3.22Å; K479-K481 VanDerWaalsContact C-N 3.31Å; K479-K481 PolarHBondContact O-N 3.49Å; K481-L485 WeakPolarHBondContact O-CG 3.09Å; K481-L485 PolarHBondContact O-N 2.9Å
482	L	53.1	Low	51.8	Low	133 Å²	133	119.8 Å²	119.8	70%	0.696	60%	0.603	S	S	*	*	H	α-helix	trans	-65.4	-41.8	166.3	-69.5	161.2	0	0	0	111.4	N478 K479 A486	N478-L482 PolarHBondContact O-N 3.05Å; K479-L482 PolarHBondContact O-N 3.02Å; L482-A486 PolarHBondContact O-N 3.35Å
483	S	50.7	Low	49.8	Very low	57 Å²	57	126.3 Å²	126.3	40%	0.399	62%	0.624	S	S	.	*	H	α-helix	trans	-79.7	-23.3	-179.6	-53.6	0	0	0	0	115.4	K479 L480 A486 L487	K479-S483 WeakPolarHBondContact O-CB 3.39Å; K479-S483 PolarHBondContact O-N 2.79Å; K479-S483 PolarHBondContact O-OG 3.13Å; L480-S483 CarbonylContact O-C 3.57Å; L480-S483 PolarHBondContact O-N 3.19Å; S483-A486 CarbonylContact O-C 3.49Å; S483-A486 PolarHBondContact O-N 2.81Å; S483-L487 WeakPolarHBondContact O-CA 3.3Å; S483-L487 VanDerWaalsContact O-CB 3.31Å; S483-L487 WeakPolarHBondContact O-CB 3.45Å; S483-L487 PolarHBondContact O-N 3.47Å
484	L	45	Very low	48.1	Very low	101 Å²	101	124.7 Å²	124.7	53%	0.529	63%	0.631	S	S	.	*	H	α-helix	trans	-77.9	-31.1	172.6	-99.3	69.3	0	0	0	111.1	L480 A486 L487	L480-L484 HydrophobicContact CB-CD1 4.02Å; L480-L484 HydrophobicContact CD2-CD1 3.97Å; L480-L484 HydrophobicContact CG-CD1 3.84Å; L480-L484 WeakPolarHBondContact O-CA 3.21Å; L480-L484 WeakPolarHBondContact O-CB 3.38Å; L480-L484 WeakPolarHBondContact O-CD1 3.33Å; L480-L484 PolarHBondContact O-N 3.14Å; L484-A486 PolarHBondContact O-N 3.03Å; L484-L487 CarbonylContact O-C 3.26Å; L484-L487 PolarHBondContact O-N 3.47Å
485	L	46.3	Very low	46.7	Very low	151 Å²	151	127 Å²	127	79%	0.791	65%	0.651	S	S	*	*	H	α-helix	trans	-62.4	-30.8	166.8	-81.1	166.3	0	0	0	111.6	K481	K481-L485 WeakPolarHBondContact O-CG 3.09Å; K481-L485 PolarHBondContact O-N 2.9Å
486	A	45.1	Very low	45.2	Very low	77 Å²	77	128.6 Å²	128.6	64%	0.636	67%	0.668	S	S	*	*	H	α-helix	trans	-88.4	-31.7	174.9	0	0	0	0	0	114.3	L482 S483 L484	L482-A486 PolarHBondContact O-N 3.35Å; S483-A486 CarbonylContact O-C 3.49Å; S483-A486 PolarHBondContact O-N 2.81Å; L484-A486 PolarHBondContact O-N 3.03Å
487	L	42.4	Very low	43.7	Very low	100 Å²	100	132.3 Å²	132.3	52%	0.524	68%	0.684	S	S	.	*			trans	-138.4	80.9	-169.4	-66.8	171.3	0	0	0	111.4	S483 L484 K489	S483-L487 WeakPolarHBondContact O-CA 3.3Å; S483-L487 VanDerWaalsContact O-CB 3.31Å; S483-L487 WeakPolarHBondContact O-CB 3.45Å; S483-L487 PolarHBondContact O-N 3.47Å; L484-L487 CarbonylContact O-C 3.26Å; L484-L487 PolarHBondContact O-N 3.47Å; L487-K489 HydrophobicContact CD2-CD 4.05Å; L487-K489 PolarHBondContact O-N 3.45Å
488	M	46.9	Very low	42.6	Very low	181 Å²	181	134.7 Å²	134.7	89%	0.892	70%	0.7	S	S	*	*			trans	-68.9	44.3	158.9	-65.3	167.3	57.8	0	0	111.7
489	K	43.8	Very low	42.1	Very low	167 Å²	167	134.7 Å²	134.7	73%	0.726	71%	0.707	S	S	*	*			trans	-133	79.6	-169.2	-67.5	-175.6	177.5	177.4	0	112.8	L487	L487-K489 HydrophobicContact CD2-CD 4.05Å; L487-K489 PolarHBondContact O-N 3.45Å
490	V	34.2	Very low	41.2	Very low	140 Å²	140	137.8 Å²	137.8	85%	0.848	72%	0.723	S	S	*	*			trans	66.7	129.1	165.3	-172.3	0	0	0	0	116.9
491	K	30.2	Very low	40.8	Very low	187 Å²	187	141 Å²	141	81%	0.813	74%	0.74	S	S	*	*			cis	108.3	142.5	1.1	-155.1	-178.5	-176.4	-179.3	0	116.3
492	L	29.7	Very low	40.6	Very low	151 Å²	151	145.5 Å²	145.5	79%	0.791	75%	0.753	S	S	*	*			trans	94.1	-170.3	173.1	-56.5	-175.4	0	0	0	119.1
493	R	29.3	Very low	40.4	Very low	246 Å²	246	143.9 Å²	143.9	93%	0.928	75%	0.752	S	S	*	*				-162.5	156.3	-125.4	-104.4	178.1	170.6	-170.3	-2.7	116.7
494	G	29.8	Very low	40.8	Very low	61 Å²	61	145 Å²	145	63%	0.629	76%	0.756	S	S	*	*			trans	171.6	130.4	155.2	0	0	0	0	0	112.2
495	T	33.8	Very low	41.5	Very low	136 Å²	136	145.3 Å²	145.3	83%	0.834	76%	0.762	S	S	*	*			cis	80.9	134.2	49	61.4	0	0	0	0	114.2
496	T	34.2	Very low	42.5	Very low	134 Å²	134	141.6 Å²	141.6	82%	0.822	75%	0.754	S	S	*	*			cis	-132.5	-131.1	12.6	-26.2	0	0	0	0	111.3
497	K	33.4	Very low	43.4	Very low	180 Å²	180	142.2 Å²	142.2	78%	0.783	75%	0.746	S	S	*	*			cis	-159.5	155.2	-0.7	-151.5	172.8	-175.4	176.8	0	109.4
498	L	37.9	Very low	44.5	Very low	168 Å²	168	143 Å²	143	88%	0.88	75%	0.75	S	S	*	*			trans	-156.7	98.3	-179.5	-176.9	128.3	0	0	0	111.9
499	S	49.6	Very low	45.7	Very low	96 Å²	96	138.9 Å²	138.9	67%	0.671	74%	0.735	S	S	*	*			trans	-162.2	46	-165.6	68	0	0	0	0	118.5
500	Q	43.7	Very low	47.3	Very low	187 Å²	187	138.4 Å²	138.4	87%	0.874	73%	0.733	S	S	*	*			trans	-119.3	6	-175.8	-75.9	172.3	-56.3	0	0	116.2	R502	Q500-R502 PolarHBondContact O-N 3.12Å
501	L	46.8	Very low	49.2	Very low	158 Å²	158	135.2 Å²	135.2	83%	0.827	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	25.4	-162.9	-98.4	164.6	0	0	0	117.3
502	R	47.1	Very low	51.4	Low	244 Å²	244	131.3 Å²	131.3	92%	0.921	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.3	-0.7	-169.6	-101	-174.9	179.2	179.2	-0.2	118.7	Q500	Q500-R502 PolarHBondContact O-N 3.12Å
503	C	48.6	Very low	53.7	Low	99 Å²	99	132.3 Å²	132.3	67%	0.669	70%	0.7	S	S	*	*	S	Bend	trans	-88.6	-17.4	-177.5	-60.7	0	0	0	0	115.3	V505	C503-V505 PolarHBondContact O-N 3.05Å; C503-V505 VanDerWaalsContact O-N 3.13Å
504	T	59.1	Low	56.1	Low	81 Å²	81	123.7 Å²	123.7	50%	0.497	68%	0.675	S	S	.	*	H	α-helix	trans	-67.6	-17.8	-157.3	41	0	0	0	0	117.7	L508	T504-L508 WeakPolarHBondContact O-CG 3.43Å; T504-L508 PolarHBondContact O-N 3.43Å
505	V	58.5	Low	58.3	Low	107 Å²	107	124.7 Å²	124.7	65%	0.648	67%	0.666	S	S	*	*	H	α-helix	trans	-79	-35.3	-173.2	-178	0	0	0	0	112.6	C503 T509	C503-V505 PolarHBondContact O-N 3.05Å; C503-V505 VanDerWaalsContact O-N 3.13Å; V505-T509 PolarHBondContact O-N 3.43Å; V505-T509 PolarHBondContact O-OG1 3.29Å; V505-T509 VanDerWaalsContact O-OG1 3.09Å
506	A	67.3	Low	60.3	Low	74 Å²	74	122 Å²	122	61%	0.612	65%	0.648	S	S	*	*	H	α-helix	trans	-68	-40.1	174.7	0	0	0	0	0	111.1	T509 K510	A506-T509 PolarHBondContact O-N 3.17Å; A506-K510 PolarHBondContact O-N 3.24Å
507	D	65.4	Low	62.5	Low	90 Å²	90	118.4 Å²	118.4	48%	0.481	63%	0.629	S	S	.	*	H	α-helix	trans	-59.1	-50.6	176.1	-62.2	-41.4	0	0	0	111.1	T509 K510 T511	D507-T509 PolarHBondContact O-N 3.03Å; D507-K510 WeakPolarHBondContact O-CA 3.35Å; D507-K510 WeakPolarHBondContact O-CB 3.29Å; D507-K510 PolarHBondContact O-N 2.95Å; D507-T511 PolarHBondContact O-N 3.38Å; D507-T511 PolarHBondContact O-OG1 3.38Å; D507-T511 VanDerWaalsContact O-OG1 3.04Å
508	L	65.6	Low	64.6	Low	116 Å²	116	114.2 Å²	114.2	61%	0.607	61%	0.612	S	S	*	*	H	α-helix	trans	-53.2	-39.6	176.7	-77.8	166.5	0	0	0	113.3	T504 K510 T511 N512	T504-L508 WeakPolarHBondContact O-CG 3.43Å; T504-L508 PolarHBondContact O-N 3.43Å; L508-K510 VanDerWaalsContact C-N 3.34Å; L508-T511 PolarHBondContact O-N 3.07Å; L508-N512 PolarHBondContact O-N 2.84Å
509	T	72	Confident	66.6	Low	95 Å²	95	110.4 Å²	110.4	58%	0.583	59%	0.592	S	S	*	*	H	α-helix	trans	-68.9	-34.8	179.3	-52.5	0	0	0	0	111.8	V505 A506 D507	V505-T509 PolarHBondContact O-N 3.43Å; V505-T509 PolarHBondContact O-OG1 3.29Å; V505-T509 VanDerWaalsContact O-OG1 3.09Å; A506-T509 PolarHBondContact O-N 3.17Å; D507-T509 PolarHBondContact O-N 3.03Å
510	K	76	Confident	67.9	Low	157 Å²	157	109.9 Å²	109.9	68%	0.683	58%	0.581	S	S	*	*	H	α-helix	trans	-69.6	-46.2	173.4	-171.8	-178.3	177.8	-174.2	0	110.9	A506 D507 L508 N512 K513 T514	A506-K510 PolarHBondContact O-N 3.24Å; D507-K510 WeakPolarHBondContact O-CA 3.35Å; D507-K510 WeakPolarHBondContact O-CB 3.29Å; D507-K510 PolarHBondContact O-N 2.95Å; L508-K510 VanDerWaalsContact C-N 3.34Å; K510-N512 VanDerWaalsContact C-N 3.29Å; K510-N512 PolarHBondContact O-N 3.03Å; K510-K513 PolarHBondContact O-N 3.33Å; K510-T514 PolarHBondContact O-N 3.04Å; K510-T514 PolarHBondContact O-OG1 2.67Å
511	T	75.6	Confident	69.6	Low	72 Å²	72	105 Å²	105	44%	0.442	56%	0.56	S	S	.	*	H	α-helix	trans	-56.4	-41.1	177	-50.9	0	0	0	0	112.1	D507 L508 K513 T514 L515	D507-T511 PolarHBondContact O-N 3.38Å; D507-T511 PolarHBondContact O-OG1 3.38Å; D507-T511 VanDerWaalsContact O-OG1 3.04Å; L508-T511 PolarHBondContact O-N 3.07Å; T511-K513 VanDerWaalsContact C-N 3.31Å; T511-K513 PolarHBondContact O-N 3.03Å; T511-T514 WeakPolarHBondContact O-CB 3.49Å; T511-T514 PolarHBondContact O-N 3.1Å; T511-T514 VanDerWaalsContact O-N 3.09Å; T511-L515 HydrophobicContact CG2-CD1 4.18Å; T511-L515 HydrophobicContact CG2-CG 4.42Å; T511-L515 WeakPolarHBondContact O-CG 3.44Å; T511-L515 PolarHBondContact O-N 2.63Å
512	N	75.2	Confident	71	Confident	106 Å²	106	101.6 Å²	101.6	57%	0.567	54%	0.543	S	S	*	.	H	α-helix	trans	-64	-32.8	-179.2	-161.8	37.4	0	0	0	113.3	L508 K510 V516	L508-N512 PolarHBondContact O-N 2.84Å; K510-N512 VanDerWaalsContact C-N 3.29Å; K510-N512 PolarHBondContact O-N 3.03Å; N512-V516 WeakPolarHBondContact O-CG2 3.49Å; N512-V516 PolarHBondContact O-N 3.34Å
513	K	79.1	Confident	72.3	Confident	172 Å²	172	96.6 Å²	96.6	75%	0.748	53%	0.528	S	S	*	.	H	α-helix	trans	-69.6	-37.4	172.2	-78	-169.2	172.7	-173.5	0	112.4	K510 T511 V516 S517	K510-K513 PolarHBondContact O-N 3.33Å; T511-K513 VanDerWaalsContact C-N 3.31Å; T511-K513 PolarHBondContact O-N 3.03Å; K513-V516 PolarHBondContact O-N 3.42Å; K513-S517 PolarHBondContact O-N 3.43Å; K513-S517 PolarHBondContact O-OG 3.26Å
514	T	79.4	Confident	73.7	Confident	65 Å²	65	99.5 Å²	99.5	40%	0.399	53%	0.525	S	S	.	.	H	α-helix	trans	-62.9	-47.3	175.5	-56.9	0	0	0	0	111	K510 T511 V516 S517 E518	K510-T514 PolarHBondContact O-N 3.04Å; K510-T514 PolarHBondContact O-OG1 2.67Å; T511-T514 WeakPolarHBondContact O-CB 3.49Å; T511-T514 PolarHBondContact O-N 3.1Å; T511-T514 VanDerWaalsContact O-N 3.09Å; T514-V516 VanDerWaalsContact C-N 3.32Å; T514-V516 PolarHBondContact O-N 3.29Å; T514-S517 PolarHBondContact O-N 3.06Å; T514-S517 PolarHBondContact O-OG 2.88Å; T514-E518 HydrophobicContact CG2-CG 4.45Å; T514-E518 WeakPolarHBondContact CG2-OE1 3.32Å; T514-E518 WeakPolarHBondContact O-CG 3.42Å; T514-E518 PolarHBondContact O-N 2.75Å
515	L	75.7	Confident	74.6	Confident	82 Å²	82	100.7 Å²	100.7	43%	0.429	53%	0.525	S	S	.	.	H	α-helix	trans	-57.3	-40.2	177.6	-72.4	167.7	0	0	0	113	T511 E518 I519	T511-L515 HydrophobicContact CG2-CD1 4.18Å; T511-L515 HydrophobicContact CG2-CG 4.42Å; T511-L515 WeakPolarHBondContact O-CG 3.44Å; T511-L515 PolarHBondContact O-N 2.63Å; L515-E518 PolarHBondContact O-N 3.05Å; L515-I519 VanDerWaalsContact O-CG1 3.3Å; L515-I519 WeakPolarHBondContact O-CG1 3.41Å; L515-I519 PolarHBondContact O-N 3.07Å
516	V	77	Confident	75.4	Confident	78 Å²	78	98 Å²	98	47%	0.473	51%	0.508	S	S	.	.	H	α-helix	trans	-63.4	-44	175	173.3	0	0	0	0	111.4	N512 K513 T514 E518 I519 D520	N512-V516 WeakPolarHBondContact O-CG2 3.49Å; N512-V516 PolarHBondContact O-N 3.34Å; K513-V516 PolarHBondContact O-N 3.42Å; T514-V516 VanDerWaalsContact C-N 3.32Å; T514-V516 PolarHBondContact O-N 3.29Å; V516-E518 VanDerWaalsContact C-N 3.29Å; V516-E518 PolarHBondContact O-N 2.91Å; V516-I519 PolarHBondContact O-N 3.48Å; V516-D520 PolarHBondContact O-N 2.91Å
517	S	79.3	Confident	75.8	Confident	60 Å²	60	100 Å²	100	42%	0.42	51%	0.505	S	S	.	.	H	α-helix	trans	-66.9	-28.7	176.4	57.1	0	0	0	0	113.7	K513 T514 I521	K513-S517 PolarHBondContact O-N 3.43Å; K513-S517 PolarHBondContact O-OG 3.26Å; T514-S517 PolarHBondContact O-N 3.06Å; T514-S517 PolarHBondContact O-OG 2.88Å; S517-I521 WeakPolarHBondContact O-CD1 3.46Å; S517-I521 WeakPolarHBondContact O-CG1 3.33Å; S517-I521 PolarHBondContact O-N 3.16Å
518	E	78.6	Confident	76.4	Confident	92 Å²	92	101.6 Å²	101.6	43%	0.43	51%	0.51	S	S	.	.	H	α-helix	trans	-71.6	-39.6	173.2	-71.4	166.4	168.4	0	0	111.2	T514 L515 V516 D520 I521 L522	T514-E518 HydrophobicContact CG2-CG 4.45Å; T514-E518 WeakPolarHBondContact CG2-OE1 3.32Å; T514-E518 WeakPolarHBondContact O-CG 3.42Å; T514-E518 PolarHBondContact O-N 2.75Å; L515-E518 PolarHBondContact O-N 3.05Å; V516-E518 VanDerWaalsContact C-N 3.29Å; V516-E518 PolarHBondContact O-N 2.91Å; E518-D520 PolarHBondContact O-N 3.02Å; E518-I521 WeakPolarHBondContact O-CB 3.47Å; E518-I521 PolarHBondContact O-N 3.16Å; E518-I521 VanDerWaalsContact O-N 3.1Å; E518-L522 WeakPolarHBondContact O-CG 3.47Å; E518-L522 PolarHBondContact O-N 3.02Å
519	I	78.2	Confident	76.9	Confident	88 Å²	88	100.9 Å²	100.9	45%	0.451	50%	0.504	S	S	.	.	H	α-helix	trans	-62.2	-40.5	173.1	-69.6	163.5	0	0	0	111.6	L515 V516 I521 L522 K523	L515-I519 VanDerWaalsContact O-CG1 3.3Å; L515-I519 WeakPolarHBondContact O-CG1 3.41Å; L515-I519 PolarHBondContact O-N 3.07Å; V516-I519 PolarHBondContact O-N 3.48Å; I519-I521 PolarHBondContact O-N 2.97Å; I519-L522 PolarHBondContact O-N 2.89Å; I519-K523 PolarHBondContact O-N 3.16Å
520	D	77.1	Confident	77	Confident	84 Å²	84	98.7 Å²	98.7	45%	0.449	49%	0.489	S	S	.	.	H	α-helix	trans	-71.1	-14.5	175.1	-77.7	-17.9	0	0	0	113.8	V516 E518 R524	V516-D520 PolarHBondContact O-N 2.91Å; E518-D520 PolarHBondContact O-N 3.02Å; D520-R524 PolarHBondContact O-NE 2.88Å; D520-R524 PolarHBondContact O-NH2 3.33Å
521	I	79.8	Confident	77.1	Confident	84 Å²	84	96.9 Å²	96.9	43%	0.431	48%	0.483	S	S	.	.	H	α-helix	trans	-85	-47.7	168.4	-70.7	164.5	0	0	0	109.4	S517 E518 I519 K523 R524 Q525	S517-I521 WeakPolarHBondContact O-CD1 3.46Å; S517-I521 WeakPolarHBondContact O-CG1 3.33Å; S517-I521 PolarHBondContact O-N 3.16Å; E518-I521 WeakPolarHBondContact O-CB 3.47Å; E518-I521 PolarHBondContact O-N 3.16Å; E518-I521 VanDerWaalsContact O-N 3.1Å; I519-I521 PolarHBondContact O-N 2.97Å; I521-K523 PolarHBondContact O-N 3.06Å; I521-R524 PolarHBondContact O-N 3.38Å; I521-R524 VanDerWaalsContact O-N 3.09Å; I521-Q525 HydrophobicContact CG2-CG 4.5Å; I521-Q525 PolarHBondContact O-N 3.41Å
522	L	75.5	Confident	77.2	Confident	88 Å²	88	98.2 Å²	98.2	46%	0.461	49%	0.487	S	S	.	.	H	α-helix	trans	-56.2	-45.6	177.7	-72.7	167.3	0	0	0	111.9	E518 I519 R524 Q525 T526	E518-L522 WeakPolarHBondContact O-CG 3.47Å; E518-L522 PolarHBondContact O-N 3.02Å; I519-L522 PolarHBondContact O-N 2.89Å; L522-R524 VanDerWaalsContact C-N 3.31Å; L522-R524 PolarHBondContact O-N 3.48Å; L522-Q525 CarbonylContact O-C 3.59Å; L522-Q525 WeakPolarHBondContact O-CA 3.39Å; L522-Q525 WeakPolarHBondContact O-CB 3.46Å; L522-Q525 PolarHBondContact O-N 3.25Å; L522-T526 PolarHBondContact O-N 2.69Å; L522-T526 PolarHBondContact O-OG1 2.97Å
523	K	76.1	Confident	77.2	Confident	139 Å²	139	96.1 Å²	96.1	60%	0.604	47%	0.474	S	S	*	.	H	α-helix	trans	-57.8	-40.3	175.6	-76.7	-174	172	-171	0	113.3	I519 I521 Q525 T526 E527	I519-K523 PolarHBondContact O-N 3.16Å; I521-K523 PolarHBondContact O-N 3.06Å; K523-Q525 VanDerWaalsContact C-N 3.33Å; K523-T526 PolarHBondContact O-N 3.1Å; K523-E527 PolarHBondContact O-N 2.96Å
524	R	77.5	Confident	76.9	Confident	160 Å²	160	92 Å²	92	60%	0.604	46%	0.463	S	S	*	.	H	α-helix	trans	-70.9	-28	175.4	-82.7	178.4	-75.5	178.8	-6.2	112.7	D520 I521 L522 Q528	D520-R524 PolarHBondContact O-NE 2.88Å; D520-R524 PolarHBondContact O-NH2 3.33Å; I521-R524 PolarHBondContact O-N 3.38Å; I521-R524 VanDerWaalsContact O-N 3.09Å; L522-R524 VanDerWaalsContact C-N 3.31Å; L522-R524 PolarHBondContact O-N 3.48Å; R524-Q528 WeakPolarHBondContact O-CG 3.43Å; R524-Q528 PolarHBondContact O-N 3.03Å
525	Q	78.5	Confident	76.9	Confident	106 Å²	106	95.3 Å²	95.3	50%	0.495	47%	0.472	S	S	.	.	H	α-helix	trans	-72	-40.2	171.4	-69.8	174.6	-32.6	0	0	111.4	I521 L522 K523 Q528 M529	I521-Q525 HydrophobicContact CG2-CG 4.5Å; I521-Q525 PolarHBondContact O-N 3.41Å; L522-Q525 CarbonylContact O-C 3.59Å; L522-Q525 WeakPolarHBondContact O-CA 3.39Å; L522-Q525 WeakPolarHBondContact O-CB 3.46Å; L522-Q525 PolarHBondContact O-N 3.25Å; K523-Q525 VanDerWaalsContact C-N 3.33Å; Q525-Q528 PolarHBondContact O-N 3.27Å; Q525-M529 VanDerWaalsContact O-CB 3.28Å; Q525-M529 WeakPolarHBondContact O-CB 3.48Å; Q525-M529 PolarHBondContact O-N 3.42Å
526	T	75.2	Confident	76.8	Confident	50 Å²	50	98.9 Å²	98.9	31%	0.307	48%	0.48	S	S	.	.	H	α-helix	trans	-60.9	-46.6	172.7	-53	0	0	0	0	111.8	L522 K523 Q528 M529 N530	L522-T526 PolarHBondContact O-N 2.69Å; L522-T526 PolarHBondContact O-OG1 2.97Å; K523-T526 PolarHBondContact O-N 3.1Å; T526-Q528 VanDerWaalsContact C-N 3.34Å; T526-Q528 PolarHBondContact O-N 3.19Å; T526-M529 WeakPolarHBondContact O-CA 3.41Å; T526-M529 WeakPolarHBondContact O-CB 3.2Å; T526-M529 PolarHBondContact O-N 2.88Å; T526-N530 PolarHBondContact O-N 3.43Å
527	E	75.1	Confident	76.7	Confident	116 Å²	116	99.5 Å²	99.5	54%	0.542	48%	0.477	S	S	.	.	H	α-helix	trans	-55.5	-46.5	175.1	-176	68	-135.6	0	0	112	K523 M529 N530 Q531	K523-E527 PolarHBondContact O-N 2.96Å; E527-M529 VanDerWaalsContact C-N 3.34Å; E527-M529 PolarHBondContact O-N 3.18Å; E527-N530 PolarHBondContact O-N 2.91Å; E527-Q531 WeakPolarHBondContact O-CG 3.31Å; E527-Q531 PolarHBondContact O-N 3.36Å; E527-Q531 VanDerWaalsContact O-N 3.12Å; E527-Q531 PolarHBondContact OE1-NE2 3.35Å
528	Q	77.4	Confident	76.6	Confident	124 Å²	124	101.9 Å²	101.9	58%	0.579	49%	0.485	S	S	*	.	H	α-helix	trans	-66.8	-33.8	175.4	-73.4	178.9	-9.4	0	0	113	R524 Q525 T526 Q531 L532	R524-Q528 WeakPolarHBondContact O-CG 3.43Å; R524-Q528 PolarHBondContact O-N 3.03Å; Q525-Q528 PolarHBondContact O-N 3.27Å; T526-Q528 VanDerWaalsContact C-N 3.34Å; T526-Q528 PolarHBondContact O-N 3.19Å; Q528-Q531 PolarHBondContact O-N 3.5Å; Q528-L532 WeakPolarHBondContact O-CB 3.38Å; Q528-L532 VanDerWaalsContact O-CG 3.32Å; Q528-L532 WeakPolarHBondContact O-CG 3.39Å; Q528-L532 PolarHBondContact O-N 3.4Å
529	M	77	Confident	76.5	Confident	101 Å²	101	103 Å²	103	50%	0.498	49%	0.49	S	S	.	.	H	α-helix	trans	-68.1	-41.7	177.8	-172.3	157.4	54.8	0	0	111.3	Q525 T526 E527 L532 Q533	Q525-M529 VanDerWaalsContact O-CB 3.28Å; Q525-M529 WeakPolarHBondContact O-CB 3.48Å; Q525-M529 PolarHBondContact O-N 3.42Å; T526-M529 WeakPolarHBondContact O-CA 3.41Å; T526-M529 WeakPolarHBondContact O-CB 3.2Å; T526-M529 PolarHBondContact O-N 2.88Å; E527-M529 VanDerWaalsContact C-N 3.34Å; E527-M529 PolarHBondContact O-N 3.18Å; M529-L532 WeakPolarHBondContact O-CB 3.35Å; M529-L532 PolarHBondContact O-N 3.36Å; M529-Q533 WeakPolarHBondContact O-CB 3.22Å; M529-Q533 PolarHBondContact O-N 3.5Å
530	N	74.2	Confident	76.2	Confident	49 Å²	49	103.6 Å²	103.6	26%	0.262	49%	0.494	S	S	.	.	H	α-helix	trans	-63.6	-44	173.5	-75.4	12.9	0	0	0	111.6	N429 T526 E527 L532 Q533 T534	N429-N530 PolarHBondContact OD1-ND2 3.06Å; T526-N530 PolarHBondContact O-N 3.43Å; E527-N530 PolarHBondContact O-N 2.91Å; N530-L532 VanDerWaalsContact C-N 3.28Å; N530-L532 PolarHBondContact O-N 2.87Å; N530-Q533 WeakPolarHBondContact O-CA 3.39Å; N530-Q533 WeakPolarHBondContact O-CB 3.39Å; N530-Q533 PolarHBondContact O-N 3.33Å; N530-T534 PolarHBondContact O-N 3.13Å; N530-T534 PolarHBondContact O-OG1 2.91Å
531	Q	78.1	Confident	76	Confident	119 Å²	119	101.9 Å²	101.9	56%	0.556	49%	0.489	S	S	*	.	H	α-helix	trans	-62.5	-33.5	174.8	-68.3	175.2	21	0	0	112.9	E527 Q528 K535	E527-Q531 WeakPolarHBondContact O-CG 3.31Å; E527-Q531 PolarHBondContact O-N 3.36Å; E527-Q531 VanDerWaalsContact O-N 3.12Å; E527-Q531 PolarHBondContact OE1-NE2 3.35Å; Q528-Q531 PolarHBondContact O-N 3.5Å; Q531-K535 WeakPolarHBondContact O-CB 3.41Å; Q531-K535 PolarHBondContact O-N 2.91Å
532	L	77.9	Confident	75.9	Confident	100 Å²	100	101.9 Å²	101.9	52%	0.524	49%	0.489	S	S	.	.	H	α-helix	trans	-71.2	-32.6	171.7	-75.4	167.9	0	0	0	112.4	Q528 M529 N530 K535 R536	Q528-L532 WeakPolarHBondContact O-CB 3.38Å; Q528-L532 VanDerWaalsContact O-CG 3.32Å; Q528-L532 WeakPolarHBondContact O-CG 3.39Å; Q528-L532 PolarHBondContact O-N 3.4Å; M529-L532 WeakPolarHBondContact O-CB 3.35Å; M529-L532 PolarHBondContact O-N 3.36Å; N530-L532 VanDerWaalsContact C-N 3.28Å; N530-L532 PolarHBondContact O-N 2.87Å; L532-K535 PolarHBondContact O-N 3.36Å; L532-R536 WeakPolarHBondContact O-CG 3.43Å; L532-R536 PolarHBondContact O-N 3.49Å
533	Q	74.3	Confident	75.9	Confident	61 Å²	61	103.1 Å²	103.1	29%	0.285	50%	0.496	S	S	.	.	H	α-helix	trans	-67.4	-51.2	176.5	-178.4	138.6	-37	0	0	111.3	M529 N530 K535 R536 E537	M529-Q533 WeakPolarHBondContact O-CB 3.22Å; M529-Q533 PolarHBondContact O-N 3.5Å; N530-Q533 WeakPolarHBondContact O-CA 3.39Å; N530-Q533 WeakPolarHBondContact O-CB 3.39Å; N530-Q533 PolarHBondContact O-N 3.33Å; Q533-K535 PolarHBondContact O-N 3.21Å; Q533-K535 VanDerWaalsContact O-N 3.16Å; Q533-R536 CarbonylContact O-C 3.54Å; Q533-R536 WeakPolarHBondContact O-CA 3.36Å; Q533-R536 WeakPolarHBondContact O-CB 3.44Å; Q533-R536 PolarHBondContact O-N 3.08Å; Q533-E537 WeakPolarHBondContact CG-OE1 3.5Å; Q533-E537 PolarHBondContact O-N 2.86Å
534	T	73.8	Confident	75.7	Confident	87 Å²	87	101 Å²	101	53%	0.534	49%	0.489	S	S	.	.	H	α-helix	trans	-59	-33.1	174.5	-39	0	0	0	0	112.4	N530 E537 L538	N530-T534 PolarHBondContact O-N 3.13Å; N530-T534 PolarHBondContact O-OG1 2.91Å; T534-E537 WeakPolarHBondContact CA-OE2 3.33Å; T534-E537 PolarHBondContact O-N 2.89Å; T534-L538 PolarHBondContact O-N 2.94Å
535	K	78.6	Confident	75.6	Confident	134 Å²	134	99.4 Å²	99.4	58%	0.583	49%	0.487	S	S	*	.	H	α-helix	trans	-69.1	-35	173.7	-170.9	174.2	-179.3	177.7	0	112.8	Q531 L532 Q533 Q539	Q531-K535 WeakPolarHBondContact O-CB 3.41Å; Q531-K535 PolarHBondContact O-N 2.91Å; L532-K535 PolarHBondContact O-N 3.36Å; Q533-K535 PolarHBondContact O-N 3.21Å; Q533-K535 VanDerWaalsContact O-N 3.16Å; K535-Q539 WeakPolarHBondContact O-CG 3.05Å; K535-Q539 PolarHBondContact O-N 3.43Å
536	R	74	Confident	75.3	Confident	157 Å²	157	96.8 Å²	96.8	59%	0.592	48%	0.483	S	S	*	.	H	α-helix	trans	-69.1	-41.4	172.2	-73.4	168.7	176	171.5	-0.4	111.5	L532 Q533 L538 Q539 L540	L532-R536 WeakPolarHBondContact O-CG 3.43Å; L532-R536 PolarHBondContact O-N 3.49Å; Q533-R536 CarbonylContact O-C 3.54Å; Q533-R536 WeakPolarHBondContact O-CA 3.36Å; Q533-R536 WeakPolarHBondContact O-CB 3.44Å; Q533-R536 PolarHBondContact O-N 3.08Å; R536-L538 VanDerWaalsContact C-N 3.33Å; R536-L538 PolarHBondContact O-N 3.24Å; R536-Q539 CarbonylContact O-C 3.57Å; R536-Q539 WeakPolarHBondContact O-CA 3.42Å; R536-Q539 WeakPolarHBondContact O-CB 3.49Å; R536-Q539 PolarHBondContact O-N 3.14Å; R536-Q539 VanDerWaalsContact O-N 3.13Å; R536-L540 WeakPolarHBondContact O-CG 3.5Å; R536-L540 PolarHBondContact O-N 3.42Å
537	E	74.5	Confident	75.3	Confident	90 Å²	90	100.2 Å²	100.2	42%	0.421	49%	0.491	S	S	.	.	H	α-helix	trans	-59.6	-42.5	174.7	-71.8	147	-142.1	0	0	111.9	Q533 T534 Q539 L540 S541	Q533-E537 WeakPolarHBondContact CG-OE1 3.5Å; Q533-E537 PolarHBondContact O-N 2.86Å; T534-E537 WeakPolarHBondContact CA-OE2 3.33Å; T534-E537 PolarHBondContact O-N 2.89Å; E537-Q539 VanDerWaalsContact C-N 3.32Å; E537-Q539 PolarHBondContact O-N 2.85Å; E537-L540 WeakPolarHBondContact O-CB 3.23Å; E537-L540 PolarHBondContact O-N 2.75Å; E537-S541 WeakPolarHBondContact O-CB 3.44Å; E537-S541 PolarHBondContact O-N 3.09Å
538	L	77.8	Confident	75.3	Confident	110 Å²	110	98.3 Å²	98.3	58%	0.576	48%	0.484	S	S	*	.	H	α-helix	trans	-64.4	-37.1	174.7	-170.6	67.1	0	0	0	112.1	T534 R536 N542	T534-L538 PolarHBondContact O-N 2.94Å; R536-L538 VanDerWaalsContact C-N 3.33Å; R536-L538 PolarHBondContact O-N 3.24Å; L538-N542 PolarHBondContact O-N 2.95Å; L538-N542 VanDerWaalsContact O-N 3.14Å; L538-N542 PolarHBondContact O-ND2 3.44Å
539	Q	75.9	Confident	75.3	Confident	115 Å²	115	98.6 Å²	98.6	54%	0.537	49%	0.489	S	S	.	.	H	α-helix	trans	-66.4	-41.8	171.9	-73.6	179.7	-41.9	0	0	111.8	K535 R536 E537 N542 L543	K535-Q539 WeakPolarHBondContact O-CG 3.05Å; K535-Q539 PolarHBondContact O-N 3.43Å; R536-Q539 CarbonylContact O-C 3.57Å; R536-Q539 WeakPolarHBondContact O-CA 3.42Å; R536-Q539 WeakPolarHBondContact O-CB 3.49Å; R536-Q539 PolarHBondContact O-N 3.14Å; R536-Q539 VanDerWaalsContact O-N 3.13Å; E537-Q539 VanDerWaalsContact C-N 3.32Å; E537-Q539 PolarHBondContact O-N 2.85Å; Q539-N542 PolarHBondContact O-N 3.38Å; Q539-L543 WeakPolarHBondContact O-CB 3.29Å; Q539-L543 WeakPolarHBondContact O-CG 3.42Å; Q539-L543 PolarHBondContact O-N 3.44Å
540	L	71.5	Confident	75.2	Confident	102 Å²	102	98 Å²	98	53%	0.534	49%	0.491	S	S	.	.	H	α-helix	trans	-62.1	-43.8	174.7	-76.9	162.4	0	0	0	111.7	R536 E537 N542 L543 M544	R536-L540 WeakPolarHBondContact O-CG 3.5Å; R536-L540 PolarHBondContact O-N 3.42Å; E537-L540 WeakPolarHBondContact O-CB 3.23Å; E537-L540 PolarHBondContact O-N 2.75Å; L540-N542 VanDerWaalsContact C-N 3.31Å; L540-N542 PolarHBondContact O-N 2.92Å; L540-L543 CarbonylContact O-C 3.57Å; L540-L543 PolarHBondContact O-N 3.41Å; L540-M544 WeakPolarHBondContact O-CG 3.49Å; L540-M544 PolarHBondContact O-N 3.03Å
541	S	74.3	Confident	75.2	Confident	48 Å²	48	100 Å²	100	34%	0.336	50%	0.501	S	S	.	.	H	α-helix	trans	-58.6	-41.5	174.2	-175.8	0	0	0	0	112.2	E537 M544 K545	E537-S541 WeakPolarHBondContact O-CB 3.44Å; E537-S541 PolarHBondContact O-N 3.09Å; S541-M544 PolarHBondContact O-N 3.06Å; S541-K545 WeakPolarHBondContact O-CG 3.39Å; S541-K545 PolarHBondContact O-N 3.12Å
542	N	77.6	Confident	75.1	Confident	84 Å²	84	101.5 Å²	101.5	45%	0.449	51%	0.505	S	S	.	.	H	α-helix	trans	-72.4	-35.6	176.6	-70.3	-30.1	0	0	0	112.4	L538 Q539 L540 K545 A546	L538-N542 PolarHBondContact O-N 2.95Å; L538-N542 VanDerWaalsContact O-N 3.14Å; L538-N542 PolarHBondContact O-ND2 3.44Å; Q539-N542 PolarHBondContact O-N 3.38Å; L540-N542 VanDerWaalsContact C-N 3.31Å; L540-N542 PolarHBondContact O-N 2.92Å; N542-K545 PolarHBondContact O-N 3.49Å; N542-A546 WeakPolarHBondContact O-CB 3.45Å; N542-A546 PolarHBondContact O-N 2.92Å
543	L	73.6	Confident	75	Confident	113 Å²	113	103.3 Å²	103.3	59%	0.592	51%	0.509	S	S	*	.	H	α-helix	trans	-65.2	-36.3	170.7	-74.7	167.2	0	0	0	112	Q539 L540 A546 R547	Q539-L543 WeakPolarHBondContact O-CB 3.29Å; Q539-L543 WeakPolarHBondContact O-CG 3.42Å; Q539-L543 PolarHBondContact O-N 3.44Å; L540-L543 CarbonylContact O-C 3.57Å; L540-L543 PolarHBondContact O-N 3.41Å; L543-A546 PolarHBondContact O-N 2.75Å; L543-R547 VanDerWaalsContact O-CB 3.25Å; L543-R547 WeakPolarHBondContact O-CB 3.5Å; L543-R547 PolarHBondContact O-N 3.48Å
544	M	72.5	Confident	74.9	Confident	96 Å²	96	104.4 Å²	104.4	47%	0.473	52%	0.516	S	S	.	.	H	α-helix	trans	-65.3	-43	173	-73	175.5	70.3	0	0	111.3	L540 S541 A546 R547 D548	L540-M544 WeakPolarHBondContact O-CG 3.49Å; L540-M544 PolarHBondContact O-N 3.03Å; S541-M544 PolarHBondContact O-N 3.06Å; M544-A546 VanDerWaalsContact C-N 3.34Å; M544-A546 PolarHBondContact O-N 2.89Å; M544-R547 WeakPolarHBondContact O-CB 3.35Å; M544-R547 PolarHBondContact O-N 3.37Å; M544-D548 WeakPolarHBondContact O-CB 3.36Å; M544-D548 PolarHBondContact O-N 3.26Å
545	K	76.5	Confident	74.9	Confident	125 Å²	125	104.4 Å²	104.4	54%	0.543	51%	0.509	S	S	.	.	H	α-helix	trans	-62.8	-39.6	173.5	-69	166.4	-170.9	162.6	0	112.4	S541 N542 D548 L549	S541-K545 WeakPolarHBondContact O-CG 3.39Å; S541-K545 PolarHBondContact O-N 3.12Å; N542-K545 PolarHBondContact O-N 3.49Å; K545-D548 PolarHBondContact O-N 3.28Å; K545-L549 PolarHBondContact O-N 3.18Å
546	A	71.4	Confident	74.8	Confident	51 Å²	51	102.2 Å²	102.2	42%	0.421	50%	0.501	S	S	.	.	H	α-helix	trans	-66.5	-43.6	174.8	0	0	0	0	0	111.8	N542 L543 M544 D548 L549 V550	N542-A546 WeakPolarHBondContact O-CB 3.45Å; N542-A546 PolarHBondContact O-N 2.92Å; L543-A546 PolarHBondContact O-N 2.75Å; M544-A546 VanDerWaalsContact C-N 3.34Å; M544-A546 PolarHBondContact O-N 2.89Å; A546-D548 VanDerWaalsContact C-N 3.31Å; A546-D548 PolarHBondContact O-N 3.5Å; A546-L549 WeakPolarHBondContact O-CB 3.45Å; A546-L549 PolarHBondContact O-N 3.2Å; A546-V550 WeakPolarHBondContact O-CG2 3.41Å; A546-V550 PolarHBondContact O-N 3.49Å
547	R	76.1	Confident	74.8	Confident	123 Å²	123	97.8 Å²	97.8	46%	0.464	49%	0.489	S	S	.	.	H	α-helix	trans	-56.4	-44.6	171.1	179.3	-154.7	69	-175.8	-0.6	110.8	L543 M544 L549 V550 L551	L543-R547 VanDerWaalsContact O-CB 3.25Å; L543-R547 WeakPolarHBondContact O-CB 3.5Å; L543-R547 PolarHBondContact O-N 3.48Å; M544-R547 WeakPolarHBondContact O-CB 3.35Å; M544-R547 PolarHBondContact O-N 3.37Å; R547-L549 VanDerWaalsContact C-N 3.34Å; R547-L549 PolarHBondContact O-N 3.24Å; R547-V550 CarbonylContact O-C 3.58Å; R547-V550 PolarHBondContact O-N 3Å; R547-V550 VanDerWaalsContact O-N 3.16Å; R547-L551 HydrophobicContact CG-CD1 3.9Å; R547-L551 HydrophobicContact CG-CG 4.24Å; R547-L551 WeakPolarHBondContact O-CB 3.41Å; R547-L551 VanDerWaalsContact O-CG 3.29Å; R547-L551 WeakPolarHBondContact O-CG 3.45Å; R547-L551 PolarHBondContact O-N 2.93Å
548	D	74.1	Confident	74.7	Confident	75 Å²	75	97.4 Å²	97.4	40%	0.401	49%	0.489	S	S	.	.	H	α-helix	trans	-70.3	-32.3	-178.3	-64.9	-10.5	0	0	0	111.9	M544 K545 A546 K552	M544-D548 WeakPolarHBondContact O-CB 3.36Å; M544-D548 PolarHBondContact O-N 3.26Å; K545-D548 PolarHBondContact O-N 3.28Å; A546-D548 VanDerWaalsContact C-N 3.31Å; A546-D548 PolarHBondContact O-N 3.5Å; D548-K552 VanDerWaalsContact O-CB 3.3Å; D548-K552 WeakPolarHBondContact O-CB 3.46Å; D548-K552 PolarHBondContact O-N 3.24Å
549	L	77.8	Confident	74.4	Confident	131 Å²	131	97.6 Å²	97.6	69%	0.686	49%	0.486	S	S	*	.	H	α-helix	trans	-64.6	-43.5	168.4	-159	87.6	0	0	0	111.5	K545 A546 R547 K552 K553	K545-L549 PolarHBondContact O-N 3.18Å; A546-L549 WeakPolarHBondContact O-CB 3.45Å; A546-L549 PolarHBondContact O-N 3.2Å; R547-L549 VanDerWaalsContact C-N 3.34Å; R547-L549 PolarHBondContact O-N 3.24Å; L549-K552 PolarHBondContact O-N 3.28Å; L549-K553 PolarHBondContact O-N 2.99Å
550	V	74.2	Confident	74.2	Confident	88 Å²	88	99.2 Å²	99.2	53%	0.533	49%	0.493	S	S	.	.	H	α-helix	trans	-66.8	-40.2	175.9	169.6	0	0	0	0	111.4	A546 R547 K552 K553 L554	A546-V550 WeakPolarHBondContact O-CG2 3.41Å; A546-V550 PolarHBondContact O-N 3.49Å; R547-V550 CarbonylContact O-C 3.58Å; R547-V550 PolarHBondContact O-N 3Å; R547-V550 VanDerWaalsContact O-N 3.16Å; V550-K552 VanDerWaalsContact C-N 3.31Å; V550-K552 PolarHBondContact O-N 2.98Å; V550-K553 PolarHBondContact O-N 3.39Å; V550-L554 HydrophobicContact CG1-CD1 4.09Å; V550-L554 VanDerWaalsContact O-CB 3.31Å; V550-L554 WeakPolarHBondContact O-CB 3.37Å; V550-L554 PolarHBondContact O-N 2.84Å
551	L	73.6	Confident	74.2	Confident	90 Å²	90	97.7 Å²	97.7	47%	0.471	48%	0.482	S	S	.	.	H	α-helix	trans	-65.8	-33	173.6	-74.5	171.4	0	0	0	111.7	R547 K555	R547-L551 HydrophobicContact CG-CD1 3.9Å; R547-L551 HydrophobicContact CG-CG 4.24Å; R547-L551 WeakPolarHBondContact O-CB 3.41Å; R547-L551 VanDerWaalsContact O-CG 3.29Å; R547-L551 WeakPolarHBondContact O-CG 3.45Å; R547-L551 PolarHBondContact O-N 2.93Å; L551-K555 WeakPolarHBondContact O-CB 3.25Å; L551-K555 PolarHBondContact O-N 3.13Å
552	K	76.9	Confident	74.1	Confident	151 Å²	151	99.4 Å²	99.4	66%	0.657	49%	0.487	S	S	*	.	H	α-helix	trans	-70.4	-39.8	173.1	-169.6	175.5	-176.8	179.2	0	111.6	D548 L549 V550 K555 E556	D548-K552 VanDerWaalsContact O-CB 3.3Å; D548-K552 WeakPolarHBondContact O-CB 3.46Å; D548-K552 PolarHBondContact O-N 3.24Å; L549-K552 PolarHBondContact O-N 3.28Å; V550-K552 VanDerWaalsContact C-N 3.31Å; V550-K552 PolarHBondContact O-N 2.98Å; K552-K555 PolarHBondContact O-N 2.93Å; K552-E556 PolarHBondContact O-N 3.33Å
553	K	76.3	Confident	73.7	Confident	139 Å²	139	98.7 Å²	98.7	60%	0.604	49%	0.489	S	S	*	.	H	α-helix	trans	-64.5	-52	170.6	-169	-173.8	173.2	-169.8	0	110.6	L549 V550 K555 E556 D557	L549-K553 PolarHBondContact O-N 2.99Å; V550-K553 PolarHBondContact O-N 3.39Å; K553-K555 PolarHBondContact O-N 2.94Å; K553-K555 VanDerWaalsContact O-N 3.11Å; K553-E556 PolarHBondContact O-N 3Å; K553-D557 PolarHBondContact O-N 3.42Å
554	L	72.4	Confident	73.6	Confident	83 Å²	83	98.1 Å²	98.1	44%	0.435	49%	0.486	S	S	.	.	H	α-helix	trans	-54.4	-29	173.5	-88.9	167.6	0	0	0	112.8	V550 L558	V550-L554 HydrophobicContact CG1-CD1 4.09Å; V550-L554 VanDerWaalsContact O-CB 3.31Å; V550-L554 WeakPolarHBondContact O-CB 3.37Å; V550-L554 PolarHBondContact O-N 2.84Å; L554-L558 WeakPolarHBondContact O-CA 3.33Å; L554-L558 WeakPolarHBondContact O-CB 3.47Å; L554-L558 WeakPolarHBondContact O-CD1 3.42Å; L554-L558 WeakPolarHBondContact O-CG 3.35Å; L554-L558 PolarHBondContact O-N 3.21Å
555	K	74.3	Confident	73.3	Confident	88 Å²	88	96.2 Å²	96.2	38%	0.383	48%	0.478	S	S	.	.	H	α-helix	trans	-70.3	-41.5	174	178.7	-179.9	174.6	-179.7	0	112.4	L551 K552 K553 L558 K559	L551-K555 WeakPolarHBondContact O-CB 3.25Å; L551-K555 PolarHBondContact O-N 3.13Å; K552-K555 PolarHBondContact O-N 2.93Å; K553-K555 PolarHBondContact O-N 2.94Å; K553-K555 VanDerWaalsContact O-N 3.11Å; K555-L558 CarbonylContact O-C 3.58Å; K555-K559 VanDerWaalsContact O-CB 3.23Å; K555-K559 WeakPolarHBondContact O-CB 3.46Å; K555-K559 PolarHBondContact O-N 3.48Å
556	E	76.3	Confident	72.9	Confident	88 Å²	88	93.1 Å²	93.1	41%	0.411	47%	0.467	S	S	.	.	H	α-helix	trans	-76.4	-38	176	-62.3	-56.8	136.8	0	0	110.9	K552 K553 L558 K559 E560	K552-E556 PolarHBondContact O-N 3.33Å; K553-E556 PolarHBondContact O-N 3Å; E556-L558 VanDerWaalsContact C-N 3.31Å; E556-L558 PolarHBondContact O-N 3.3Å; E556-K559 CarbonylContact O-C 3.55Å; E556-K559 WeakPolarHBondContact O-CA 3.5Å; E556-K559 PolarHBondContact O-N 3.34Å; E556-K559 IonicContact OE1-NZ 2.81Å; E556-K559 IonicContact OE2-NZ 2.77Å; E556-K559 PolarHBondContact OE2-NZ 2.85Å; E556-E560 PolarHBondContact O-N 3.36Å
557	D	72.4	Confident	72.8	Confident	64 Å²	64	94.5 Å²	94.5	34%	0.342	47%	0.47	S	S	.	.	H	α-helix	trans	-59.2	-42.3	168.8	-63	-4.9	0	0	0	109.7	K553 K559 K561	K553-D557 PolarHBondContact O-N 3.42Å; D557-K559 PolarHBondContact O-N 2.67Å; D557-K561 VanDerWaalsContact O-CA 3.24Å; D557-K561 WeakPolarHBondContact O-CA 3.48Å; D557-K561 WeakPolarHBondContact O-CB 3.44Å; D557-K561 WeakPolarHBondContact O-CG 3.4Å; D557-K561 PolarHBondContact O-N 3.49Å
558	L	72.5	Confident	72.4	Confident	82 Å²	82	92.5 Å²	92.5	43%	0.429	47%	0.468	S	S	.	.	H	α-helix	trans	-68.9	-1.5	170.5	-93.8	155.2	0	0	0	114.4	V31 L554 K555 E556 K561 L562	V31-L558 HydrophobicContact CG1-CD2 3.32Å; V31-L558 HydrophobicContact CG1-CG 3.91Å; L554-L558 WeakPolarHBondContact O-CA 3.33Å; L554-L558 WeakPolarHBondContact O-CB 3.47Å; L554-L558 WeakPolarHBondContact O-CD1 3.42Å; L554-L558 WeakPolarHBondContact O-CG 3.35Å; L554-L558 PolarHBondContact O-N 3.21Å; K555-L558 CarbonylContact O-C 3.58Å; E556-L558 VanDerWaalsContact C-N 3.31Å; E556-L558 PolarHBondContact O-N 3.3Å; L558-K561 VanDerWaalsContact C-C 3.41Å; L558-K561 CarbonylContact O-C 3.57Å; L558-L562 VanDerWaalsContact O-CB 3.26Å; L558-L562 WeakPolarHBondContact O-CB 3.39Å; L558-L562 PolarHBondContact O-N 3.41Å
559	K	72.7	Confident	71.9	Confident	114 Å²	114	89 Å²	89	50%	0.496	45%	0.45	S	S	.	.	H	α-helix	trans	-118.3	-36.1	-175.6	177.8	-177.3	146	-141	0	113	K555 E556 D557 L562	K555-K559 VanDerWaalsContact O-CB 3.23Å; K555-K559 WeakPolarHBondContact O-CB 3.46Å; K555-K559 PolarHBondContact O-N 3.48Å; E556-K559 CarbonylContact O-C 3.55Å; E556-K559 WeakPolarHBondContact O-CA 3.5Å; E556-K559 PolarHBondContact O-N 3.34Å; E556-K559 IonicContact OE1-NZ 2.81Å; E556-K559 IonicContact OE2-NZ 2.77Å; E556-K559 PolarHBondContact OE2-NZ 2.85Å; D557-K559 PolarHBondContact O-N 2.67Å; K559-L562 VanDerWaalsContact C-N 3.28Å; K559-L562 CarbonylContact O-C 3.58Å; K559-L562 VanDerWaalsContact O-C 3.26Å; K559-L562 WeakPolarHBondContact O-CA 3.31Å; K559-L562 PolarHBondContact O-N 2.8Å
560	E	71.4	Confident	71.5	Confident	148 Å²	148	85.8 Å²	85.8	69%	0.692	43%	0.433	S	S	*	.	H	α-helix	trans	-57.8	-37.7	147.7	177.7	176.8	-144.5	0	0	108.9	N32 E556 L562 S563	N32-E560 PolarHBondContact ND2-O 2.85Å; N32-E560 PolarHBondContact OD1-O 3.31Å; E556-E560 PolarHBondContact O-N 3.36Å; E560-L562 PolarHBondContact O-N 3.27Å; E560-S563 WeakPolarHBondContact O-CB 3.49Å; E560-S563 PolarHBondContact O-N 2.94Å
561	K	70.9	Confident	71.3	Confident	70 Å²	70	87 Å²	87	30%	0.304	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	25.5	168.4	-43.8	-144.2	-74.1	152.5	0	115.4	V31 N32 D33 D557 L558	V31-K561 HydrophobicContact CB-CB 3.63Å; V31-K561 HydrophobicContact CB-CD 4.08Å; V31-K561 HydrophobicContact CB-CG 4.35Å; V31-K561 HydrophobicContact CG1-CB 3.56Å; V31-K561 WeakPolarHBondContact O-CD 3.39Å; V31-K561 PolarHBondContact O-NZ 3.39Å; N32-K561 CarbonylContact C-O 3.18Å; N32-K561 VanDerWaalsContact CA-O 3.23Å; N32-K561 WeakPolarHBondContact CA-O 3.36Å; N32-K561 HydrophobicContact CB-CB 3.66Å; N32-K561 HydrophobicContact CB-CD 4.07Å; N32-K561 HydrophobicContact CB-CG 4.11Å; N32-K561 WeakPolarHBondContact ND2-CA 3.35Å; N32-K561 VanDerWaalsContact OD1-CA 3.22Å; N32-K561 WeakPolarHBondContact OD1-CA 3.29Å; N32-K561 PolarHBondContact OD1-O 2.8Å; D33-K561 PolarHBondContact N-O 3.22Å; D557-K561 VanDerWaalsContact O-CA 3.24Å; D557-K561 WeakPolarHBondContact O-CA 3.48Å; D557-K561 WeakPolarHBondContact O-CB 3.44Å; D557-K561 WeakPolarHBondContact O-CG 3.4Å; D557-K561 PolarHBondContact O-N 3.49Å; L558-K561 VanDerWaalsContact C-C 3.41Å; L558-K561 CarbonylContact O-C 3.57Å
562	L	72	Confident	70.9	Confident	84 Å²	84	85.7 Å²	85.7	44%	0.44	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.7	46.2	155.2	-154	76.1	0	0	0	108.8	N32 D33 I35 L558 K559 E560	N32-L562 PolarHBondContact OD1-N 2.95Å; D33-L562 HydrophobicContact CB-CD1 4.35Å; D33-L562 VanDerWaalsContact CG-CA 3.41Å; D33-L562 WeakPolarHBondContact OD1-CD1 3.47Å; D33-L562 VanDerWaalsContact OD1-CG 3.27Å; D33-L562 WeakPolarHBondContact OD1-CG 3.38Å; I35-L562 HydrophobicContact CD1-CD1 4.11Å; I35-L562 HydrophobicContact CD1-CD2 4.35Å; L558-L562 VanDerWaalsContact O-CB 3.26Å; L558-L562 WeakPolarHBondContact O-CB 3.39Å; L558-L562 PolarHBondContact O-N 3.41Å; K559-L562 VanDerWaalsContact C-N 3.28Å; K559-L562 CarbonylContact O-C 3.58Å; K559-L562 VanDerWaalsContact O-C 3.26Å; K559-L562 WeakPolarHBondContact O-CA 3.31Å; K559-L562 PolarHBondContact O-N 2.8Å; E560-L562 PolarHBondContact O-N 3.27Å
563	S	69.6	Low	70.3	Confident	69 Å²	69	80.8 Å²	80.8	48%	0.483	40%	0.403	S	S	.	.	S	Bend	trans	-134.3	-26	178.9	-158.7	0	0	0	0	116.6	N32 D33 E560	N32-S563 PolarHBondContact OD1-N 2.91Å; D33-S563 VanDerWaalsContact CG-N 3.25Å; D33-S563 WeakPolarHBondContact OD2-CA 3.33Å; D33-S563 PolarHBondContact OD2-N 3.49Å; E560-S563 WeakPolarHBondContact O-CB 3.49Å; E560-S563 PolarHBondContact O-N 2.94Å
564	L	71.9	Confident	70	Confident	102 Å²	102	80.7 Å²	80.7	53%	0.534	40%	0.402	S	S	.	.	H	α-helix	trans	-101.3	-48.7	-165.3	-169	76	0	0	0	114.7	N32 D33 L566 T567 L568	N32-L564 HydrophobicContact CB-CB 4.01Å; N32-L564 WeakPolarHBondContact ND2-CB 3.44Å; N32-L564 WeakPolarHBondContact OD1-CB 3.4Å; N32-L564 PolarHBondContact OD1-N 2.88Å; D33-L564 PolarHBondContact OD2-N 3.13Å; L564-L566 PolarHBondContact O-N 2.89Å; L564-T567 CarbonylContact O-C 3.47Å; L564-T567 VanDerWaalsContact O-CA 3.25Å; L564-T567 WeakPolarHBondContact O-CA 3.47Å; L564-T567 WeakPolarHBondContact O-CB 3.44Å; L564-T567 PolarHBondContact O-N 3.25Å; L564-L568 PolarHBondContact O-N 3.25Å
565	N	67	Low	69.7	Low	56 Å²	56	81 Å²	81	30%	0.299	40%	0.402	S	S	.	.	H	α-helix	trans	-72	-7.5	168.6	-170.5	56.1	0	0	0	111.3	N32 D33 R34 L568 S569	N32-N565 VanDerWaalsContact O-CA 3.23Å; N32-N565 WeakPolarHBondContact O-CA 3.28Å; N32-N565 WeakPolarHBondContact O-CB 3.47Å; N32-N565 PolarHBondContact O-N 2.91Å; D33-N565 HydrophobicContact CB-CB 3.94Å; D33-N565 PolarHBondContact O-ND2 2.79Å; R34-N565 WeakPolarHBondContact CB-O 3.5Å; R34-N565 PolarHBondContact O-ND2 3.13Å; N565-L568 HydrophobicContact CB-CB 4.25Å; N565-L568 HydrophobicContact CB-CD1 4.05Å; N565-L568 HydrophobicContact CB-CG 4.46Å; N565-L568 PolarHBondContact O-N 3.15Å; N565-L568 VanDerWaalsContact OD1-CB 3.27Å; N565-L568 WeakPolarHBondContact OD1-CB 3.29Å; N565-S569 WeakPolarHBondContact O-CB 3.28Å; N565-S569 PolarHBondContact O-N 3.05Å
566	L	67.9	Low	69.2	Low	60 Å²	60	80.2 Å²	80.2	31%	0.314	40%	0.4	S	S	.	.	H	α-helix	trans	-50.3	-67.4	151.4	-84.8	149.5	0	0	0	104.8	D33 R34 L564 L568 S569 D570	D33-L566 VanDerWaalsContact CG-CG 3.5Å; D33-L566 WeakPolarHBondContact OD1-CG 3.4Å; D33-L566 VanDerWaalsContact OD2-CA 3.24Å; D33-L566 WeakPolarHBondContact OD2-CA 3.49Å; D33-L566 WeakPolarHBondContact OD2-CB 3.22Å; D33-L566 WeakPolarHBondContact OD2-CD1 3.38Å; D33-L566 WeakPolarHBondContact OD2-CG 3.5Å; D33-L566 PolarHBondContact OD2-N 3.11Å; R34-L566 VanDerWaalsContact CD-CA 3.41Å; R34-L566 VanDerWaalsContact CD-O 3.32Å; R34-L566 WeakPolarHBondContact CD-O 3.47Å; R34-L566 VanDerWaalsContact CG-CA 3.41Å; R34-L566 HydrophobicContact CG-CB 3.9Å; R34-L566 HydrophobicContact CG-CD2 3.59Å; R34-L566 HydrophobicContact CG-CG 3.71Å; R34-L566 VanDerWaalsContact CZ-CD2 3.45Å; R34-L566 PolarHBondContact NH1-O 2.85Å; L564-L566 PolarHBondContact O-N 2.89Å; L566-L568 PolarHBondContact O-N 2.92Å; L566-S569 PolarHBondContact O-N 3.4Å; L566-S569 VanDerWaalsContact O-N 3.08Å; L566-D570 PolarHBondContact O-N 3.17Å
567	T	69.2	Low	68.9	Low	80 Å²	80	81.1 Å²	81.1	49%	0.491	40%	0.404	S	S	.	.	H	α-helix	trans	-53.4	-31	180	-45.4	0	0	0	0	114.3	L564 Q571	L564-T567 CarbonylContact O-C 3.47Å; L564-T567 VanDerWaalsContact O-CA 3.25Å; L564-T567 WeakPolarHBondContact O-CA 3.47Å; L564-T567 WeakPolarHBondContact O-CB 3.44Å; L564-T567 PolarHBondContact O-N 3.25Å; T567-Q571 WeakPolarHBondContact O-CG 3.46Å; T567-Q571 PolarHBondContact O-NE2 3.15Å
568	L	67.3	Low	68.8	Low	80 Å²	80	84 Å²	84	42%	0.419	42%	0.415	S	S	.	.	H	α-helix	trans	-80.8	-36.2	175.5	-56.4	171.3	0	0	0	114.6	L564 N565 L566 D570 Q571 Y572	L564-L568 PolarHBondContact O-N 3.25Å; N565-L568 HydrophobicContact CB-CB 4.25Å; N565-L568 HydrophobicContact CB-CD1 4.05Å; N565-L568 HydrophobicContact CB-CG 4.46Å; N565-L568 PolarHBondContact O-N 3.15Å; N565-L568 VanDerWaalsContact OD1-CB 3.27Å; N565-L568 WeakPolarHBondContact OD1-CB 3.29Å; L566-L568 PolarHBondContact O-N 2.92Å; L568-D570 VanDerWaalsContact C-N 3.29Å; L568-D570 PolarHBondContact O-N 3.21Å; L568-Q571 WeakPolarHBondContact O-CB 3.49Å; L568-Q571 PolarHBondContact O-N 3.21Å; L568-Y572 PolarHBondContact O-N 3.15Å
569	S	63.8	Low	68.4	Low	3 Å²	3	83.7 Å²	83.7	2%	0.021	41%	0.412	C	S	.	.	H	α-helix	trans	-63.4	-37.3	-179.2	-174.8	0	0	0	0	110.9	K37 N565 L566 Q571 Y572 I573	K37-S569 VanDerWaalsContact CD-OG 3.3Å; K37-S569 WeakPolarHBondContact CD-OG 3.32Å; N565-S569 WeakPolarHBondContact O-CB 3.28Å; N565-S569 PolarHBondContact O-N 3.05Å; L566-S569 PolarHBondContact O-N 3.4Å; L566-S569 VanDerWaalsContact O-N 3.08Å; S569-Q571 VanDerWaalsContact C-N 3.28Å; S569-Q571 PolarHBondContact O-N 2.94Å; S569-Y572 CarbonylContact O-C 3.55Å; S569-Y572 WeakPolarHBondContact O-CA 3.42Å; S569-Y572 PolarHBondContact O-N 3.44Å; S569-I573 WeakPolarHBondContact O-CG1 3.29Å; S569-I573 PolarHBondContact O-N 3.37Å
570	D	69	Low	68.1	Low	62 Å²	62	81.7 Å²	81.7	33%	0.332	41%	0.413	S	S	.	.	H	α-helix	trans	-59.9	-37.7	172.7	-74	5.3	0	0	0	112.4	R34 L566 L568 Y572 I573 K574	R34-D570 IonicContact CZ-OD1 3.27Å; R34-D570 VanDerWaalsContact CZ-OD1 3.22Å; R34-D570 IonicContact CZ-OD2 2.82Å; R34-D570 IonicContact NE-OD1 3.91Å; R34-D570 IonicContact NH1-OD1 2.7Å; R34-D570 PolarHBondContact NH1-OD1 3.39Å; R34-D570 IonicContact NH1-OD2 3.93Å; R34-D570 PolarHBondContact NH1-OD2 2.81Å; R34-D570 IonicContact NH2-OD1 2.77Å; R34-D570 IonicContact NH2-OD2 3.62Å; L566-D570 PolarHBondContact O-N 3.17Å; L568-D570 VanDerWaalsContact C-N 3.29Å; L568-D570 PolarHBondContact O-N 3.21Å; D570-Y572 VanDerWaalsContact C-N 3.32Å; D570-I573 PolarHBondContact O-N 2.87Å; D570-K574 PolarHBondContact O-N 2.86Å
571	Q	69.2	Low	68.1	Low	115 Å²	115	80.8 Å²	80.8	54%	0.537	41%	0.406	S	S	.	.	H	α-helix	trans	-65.5	-41.4	174.7	-60.7	171.5	13.8	0	0	109.7	T567 L568 S569 I573 K574 M575	T567-Q571 WeakPolarHBondContact O-CG 3.46Å; T567-Q571 PolarHBondContact O-NE2 3.15Å; L568-Q571 WeakPolarHBondContact O-CB 3.49Å; L568-Q571 PolarHBondContact O-N 3.21Å; S569-Q571 VanDerWaalsContact C-N 3.28Å; S569-Q571 PolarHBondContact O-N 2.94Å; Q571-I573 PolarHBondContact O-N 3.2Å; Q571-K574 PolarHBondContact O-N 3.17Å; Q571-M575 PolarHBondContact O-N 2.81Å
572	Y	65.2	Low	67.8	Low	62 Å²	62	82 Å²	82	24%	0.243	42%	0.415	C	S	.	.	H	α-helix	trans	-70.5	-26	175	-173.9	-147.3	0	0	0	113.2	K37 T40 L568 S569 D570 M575 Q576	K37-Y572 HydrophobicContact CB-CD1 3.64Å; K37-Y572 HydrophobicContact CB-CE1 3.77Å; K37-Y572 HydrophobicContact CD-CD1 3.49Å; K37-Y572 VanDerWaalsContact CD-CD1 3.49Å; K37-Y572 HydrophobicContact CD-CE1 4.1Å; K37-Y572 HydrophobicContact CD-CG 4.04Å; K37-Y572 VanDerWaalsContact CE-C 3.48Å; K37-Y572 HydrophobicContact CG-CD1 3.56Å; K37-Y572 HydrophobicContact CG-CE1 3.67Å; K37-Y572 PolarHBondContact NZ-O 3.32Å; T40-Y572 PolarHBondContact OG1-OH 3.01Å; T40-Y572 VanDerWaalsContact OG1-OH 3.12Å; L568-Y572 PolarHBondContact O-N 3.15Å; S569-Y572 CarbonylContact O-C 3.55Å; S569-Y572 WeakPolarHBondContact O-CA 3.42Å; S569-Y572 PolarHBondContact O-N 3.44Å; D570-Y572 VanDerWaalsContact C-N 3.32Å; Y572-M575 HydrophobicContact CD2-CB 4.45Å; Y572-M575 HydrophobicContact CD2-CE 3.79Å; Y572-M575 HydrophobicContact CE2-CE 3.73Å; Y572-Q576 HydrophobicContact CD2-CG 4.47Å; Y572-Q576 HydrophobicContact CE2-CG 4.04Å; Y572-Q576 PolarHBondContact O-N 3.2Å; Y572-Q576 PolarHBondContact OH-NE2 3.48Å
573	I	65.5	Low	67.3	Low	48 Å²	48	81 Å²	81	25%	0.246	41%	0.411	C	S	.	.	H	α-helix	trans	-62.4	-53.4	173.3	-69.6	171.6	0	0	0	108.9	E36 K37 S569 D570 Q571 M575 Q576 E577	E36-I573 WeakPolarHBondContact OE2-CD1 3.41Å; K37-I573 HydrophobicContact CD-CG1 3.92Å; K37-I573 VanDerWaalsContact CE-N 3.3Å; S569-I573 WeakPolarHBondContact O-CG1 3.29Å; S569-I573 PolarHBondContact O-N 3.37Å; D570-I573 PolarHBondContact O-N 2.87Å; Q571-I573 PolarHBondContact O-N 3.2Å; I573-M575 VanDerWaalsContact C-N 3.26Å; I573-M575 PolarHBondContact O-N 3.01Å; I573-Q576 WeakPolarHBondContact O-CA 3.38Å; I573-Q576 WeakPolarHBondContact O-CB 3.47Å; I573-Q576 PolarHBondContact O-N 3.32Å; I573-E577 PolarHBondContact O-N 3.35Å; I573-E577 VanDerWaalsContact O-N 3.11Å
574	K	70.4	Confident	67.2	Low	137 Å²	137	81.5 Å²	81.5	60%	0.596	41%	0.414	S	S	*	.	H	α-helix	trans	-55.2	-40.7	178.8	-65.5	171.2	-175.4	177.6	0	112.1	D570 Q571 Q576 E577 E578	D570-K574 PolarHBondContact O-N 2.86Å; Q571-K574 PolarHBondContact O-N 3.17Å; K574-Q576 VanDerWaalsContact C-N 3.33Å; K574-Q576 PolarHBondContact O-N 2.86Å; K574-E577 WeakPolarHBondContact O-CB 3.12Å; K574-E577 PolarHBondContact O-N 3.07Å; K574-E578 PolarHBondContact O-N 2.92Å
575	M	65.2	Low	67.1	Low	88 Å²	88	81.7 Å²	81.7	43%	0.433	42%	0.415	S	S	.	.	H	α-helix	trans	-66.4	-30	175.8	-161.7	179.2	82.2	0	0	113.6	Q571 Y572 I573 Q579	Q571-M575 PolarHBondContact O-N 2.81Å; Y572-M575 HydrophobicContact CD2-CB 4.45Å; Y572-M575 HydrophobicContact CD2-CE 3.79Å; Y572-M575 HydrophobicContact CE2-CE 3.73Å; I573-M575 VanDerWaalsContact C-N 3.26Å; I573-M575 PolarHBondContact O-N 3.01Å; M575-Q579 WeakPolarHBondContact O-CG 3.45Å; M575-Q579 PolarHBondContact O-N 2.93Å; M575-Q579 VanDerWaalsContact O-N 3.1Å
576	Q	63.9	Low	66.8	Low	72 Å²	72	80.9 Å²	80.9	34%	0.336	41%	0.409	S	S	.	.	H	α-helix	trans	-73.9	-33.6	173.6	-79	-67.1	-4.7	0	0	112.5	K37 Y572 I573 K574 E578 Q579 S580	K37-Q576 VanDerWaalsContact NZ-CG 3.27Å; Y572-Q576 HydrophobicContact CD2-CG 4.47Å; Y572-Q576 HydrophobicContact CE2-CG 4.04Å; Y572-Q576 PolarHBondContact O-N 3.2Å; Y572-Q576 PolarHBondContact OH-NE2 3.48Å; I573-Q576 WeakPolarHBondContact O-CA 3.38Å; I573-Q576 WeakPolarHBondContact O-CB 3.47Å; I573-Q576 PolarHBondContact O-N 3.32Å; K574-Q576 VanDerWaalsContact C-N 3.33Å; K574-Q576 PolarHBondContact O-N 2.86Å; Q576-E578 VanDerWaalsContact C-N 3.29Å; Q576-E578 PolarHBondContact O-N 2.98Å; Q576-Q579 PolarHBondContact O-N 3.05Å; Q576-S580 WeakPolarHBondContact O-CB 3.22Å; Q576-S580 PolarHBondContact O-N 3.29Å
577	E	70	Confident	66.7	Low	108 Å²	108	85 Å²	85	51%	0.505	42%	0.421	S	S	.	.	H	α-helix	trans	-61.6	-38.3	172.9	-61.8	177	165.1	0	0	111.7	I573 K574 S580 K581	I573-E577 PolarHBondContact O-N 3.35Å; I573-E577 VanDerWaalsContact O-N 3.11Å; K574-E577 WeakPolarHBondContact O-CB 3.12Å; K574-E577 PolarHBondContact O-N 3.07Å; E577-S580 PolarHBondContact O-N 2.92Å; E577-K581 WeakPolarHBondContact O-CG 3.32Å; E577-K581 PolarHBondContact O-N 3.06Å
578	E	69.9	Low	66.9	Low	123 Å²	123	86.4 Å²	86.4	58%	0.575	43%	0.425	S	S	*	.	H	α-helix	trans	-66.7	-44.8	172.4	-66.1	-176.7	149.1	0	0	112.2	K574 Q576 S580 K581 L582	K574-E578 PolarHBondContact O-N 2.92Å; Q576-E578 VanDerWaalsContact C-N 3.29Å; Q576-E578 PolarHBondContact O-N 2.98Å; E578-S580 VanDerWaalsContact C-N 3.26Å; E578-S580 PolarHBondContact O-N 3.34Å; E578-K581 PolarHBondContact O-N 2.84Å; E578-L582 PolarHBondContact O-N 2.9Å
579	Q	65.1	Low	66.8	Low	76 Å²	76	83.2 Å²	83.2	36%	0.355	41%	0.41	S	S	.	.	H	α-helix	trans	-63.7	-29.8	175.6	-73.1	-168.5	14.8	0	0	113.3	M575 Q576 L582 L583 K666	M575-Q579 WeakPolarHBondContact O-CG 3.45Å; M575-Q579 PolarHBondContact O-N 2.93Å; M575-Q579 VanDerWaalsContact O-N 3.1Å; Q576-Q579 PolarHBondContact O-N 3.05Å; Q579-L582 PolarHBondContact O-N 3.44Å; Q579-L583 PolarHBondContact O-N 3.28Å; Q579-K666 PolarHBondContact O-NZ 3.47Å
580	S	64.8	Low	66.7	Low	73 Å²	73	84.9 Å²	84.9	51%	0.51	42%	0.42	S	S	.	.	H	α-helix	trans	-67.4	-43.6	175	-173.4	0	0	0	0	111.7	Q576 E577 E578 L582 L583 S584	Q576-S580 WeakPolarHBondContact O-CB 3.22Å; Q576-S580 PolarHBondContact O-N 3.29Å; E577-S580 PolarHBondContact O-N 2.92Å; E578-S580 VanDerWaalsContact C-N 3.26Å; E578-S580 PolarHBondContact O-N 3.34Å; S580-L582 VanDerWaalsContact C-N 3.27Å; S580-L582 PolarHBondContact O-N 2.81Å; S580-L583 WeakPolarHBondContact O-CA 3.44Å; S580-L583 WeakPolarHBondContact O-CB 3.46Å; S580-L583 PolarHBondContact O-N 2.73Å; S580-S584 PolarHBondContact O-N 3.26Å
581	K	72.5	Confident	66.6	Low	128 Å²	128	86.2 Å²	86.2	56%	0.557	43%	0.43	S	S	*	.	H	α-helix	trans	-58.5	-37.2	174.8	-65.3	161.3	-168.1	163.1	0	112.3	E577 E578 L583 S584 L585	E577-K581 WeakPolarHBondContact O-CG 3.32Å; E577-K581 PolarHBondContact O-N 3.06Å; E578-K581 PolarHBondContact O-N 2.84Å; K581-L583 VanDerWaalsContact C-N 3.33Å; K581-S584 PolarHBondContact O-OG 3.42Å; K581-L585 WeakPolarHBondContact O-CG 3.38Å; K581-L585 PolarHBondContact O-N 3.14Å
582	L	64.7	Low	66.6	Low	95 Å²	95	84.4 Å²	84.4	50%	0.497	42%	0.424	S	S	.	.	H	α-helix	trans	-68.9	-26.4	172.4	-86.6	148.5	0	0	0	113.6	E578 Q579 S580 F586 K666	E578-L582 PolarHBondContact O-N 2.9Å; Q579-L582 PolarHBondContact O-N 3.44Å; S580-L582 VanDerWaalsContact C-N 3.27Å; S580-L582 PolarHBondContact O-N 2.81Å; L582-F586 PolarHBondContact O-N 2.9Å; L582-K666 HydrophobicContact CB-CD 4.01Å
583	L	61.9	Low	66.5	Low	65 Å²	65	81.7 Å²	81.7	34%	0.34	42%	0.415	S	S	.	.	H	α-helix	trans	-83.7	-35.6	177.4	-173.2	66.1	0	0	0	112.5	Q579 S580 K581 L585 F586 Y587 K666	Q579-L583 PolarHBondContact O-N 3.28Å; S580-L583 WeakPolarHBondContact O-CA 3.44Å; S580-L583 WeakPolarHBondContact O-CB 3.46Å; S580-L583 PolarHBondContact O-N 2.73Å; K581-L583 VanDerWaalsContact C-N 3.33Å; L583-L585 VanDerWaalsContact C-N 3.29Å; L583-F586 HydrophobicContact CD1-CB 4.25Å; L583-F586 HydrophobicContact CD1-CD1 4.17Å; L583-F586 WeakPolarHBondContact O-CA 3.44Å; L583-F586 VanDerWaalsContact O-CB 3.32Å; L583-F586 WeakPolarHBondContact O-CB 3.29Å; L583-F586 PolarHBondContact O-N 2.87Å; L583-Y587 HydrophobicContact CD1-CD2 4.39Å; L583-Y587 HydrophobicContact CD1-CE2 3.93Å; L583-Y587 HydrophobicContact CD2-CE2 4.26Å; L583-Y587 HydrophobicContact CG-CD2 4.17Å; L583-Y587 HydrophobicContact CG-CE2 3.86Å; L583-Y587 WeakPolarHBondContact O-CD2 3.49Å; L583-Y587 PolarHBondContact O-N 2.97Å; L583-Y587 VanDerWaalsContact O-N 3.11Å; L583-K666 HydrophobicContact CB-CD 4.29Å; L583-K666 HydrophobicContact CD1-CD 4.43Å; L583-K666 HydrophobicContact CD1-CG 4.27Å
584	S	66.4	Low	66.3	Low	79 Å²	79	82.4 Å²	82.4	55%	0.552	42%	0.421	S	S	*	.	H	α-helix	trans	-65.4	-36.2	171.4	55.9	0	0	0	0	111.5	S580 K581 F586 L588	S580-S584 PolarHBondContact O-N 3.26Å; K581-S584 PolarHBondContact O-OG 3.42Å; S584-F586 VanDerWaalsContact C-N 3.31Å; S584-F586 PolarHBondContact O-N 3.1Å; S584-L588 PolarHBondContact O-N 3.09Å
585	L	70.3	Confident	66.2	Low	106 Å²	106	81 Å²	81	56%	0.555	42%	0.42	S	S	*	.	H	α-helix	trans	-58.2	-41.9	166.1	-74.1	170.5	0	0	0	111.6	K581 L583 L588 P668	K581-L585 WeakPolarHBondContact O-CG 3.38Å; K581-L585 PolarHBondContact O-N 3.14Å; L583-L585 VanDerWaalsContact C-N 3.29Å; L585-L588 WeakPolarHBondContact O-CB 3.42Å; L585-L588 PolarHBondContact O-N 3.39Å; L585-P668 WeakPolarHBondContact O-CG 3.39Å
586	F	61.3	Low	66.3	Low	38 Å²	38	78.1 Å²	78.1	17%	0.167	41%	0.406	C	S	.	.	H	α-helix	trans	-59.9	-47	178	-175.9	-115.9	0	0	0	114.4	L582 L583 S584 L588 V590 V665 K666 L667 P668	L582-F586 PolarHBondContact O-N 2.9Å; L583-F586 HydrophobicContact CD1-CB 4.25Å; L583-F586 HydrophobicContact CD1-CD1 4.17Å; L583-F586 WeakPolarHBondContact O-CA 3.44Å; L583-F586 VanDerWaalsContact O-CB 3.32Å; L583-F586 WeakPolarHBondContact O-CB 3.29Å; L583-F586 PolarHBondContact O-N 2.87Å; S584-F586 VanDerWaalsContact C-N 3.31Å; S584-F586 PolarHBondContact O-N 3.1Å; F586-L588 PolarHBondContact O-N 2.89Å; F586-V590 HydrophobicContact CE1-CG2 4.24Å; F586-V590 HydrophobicContact CE2-CG2 4.08Å; F586-V590 HydrophobicContact CZ-CG2 3.93Å; F586-V665 WeakPolarHBondContact CE2-O 3.29Å; F586-K666 HydrophobicContact CB-CB 4.25Å; F586-K666 HydrophobicContact CB-CG 4.48Å; F586-L667 VanDerWaalsContact CD2-N 3.29Å; F586-P668 HydrophobicContact CD2-CB 3.97Å; F586-P668 HydrophobicContact CD2-CG 4.26Å; F586-P668 HydrophobicContact CE2-CB 4.34Å; F586-P668 WeakPolarHBondContact O-CB 3.13Å; F586-P668 VanDerWaalsContact O-CG 3.27Å; F586-P668 WeakPolarHBondContact O-CG 3.38Å
587	Y	65.5	Low	66.4	Low	147 Å²	147	77.2 Å²	77.2	58%	0.576	40%	0.402	S	S	*	.	H	α-helix	trans	-66.7	-26.8	-179.8	-78.1	-74.5	0	0	0	113.4	L583 A589 T591	L583-Y587 HydrophobicContact CD1-CD2 4.39Å; L583-Y587 HydrophobicContact CD1-CE2 3.93Å; L583-Y587 HydrophobicContact CD2-CE2 4.26Å; L583-Y587 HydrophobicContact CG-CD2 4.17Å; L583-Y587 HydrophobicContact CG-CE2 3.86Å; L583-Y587 WeakPolarHBondContact O-CD2 3.49Å; L583-Y587 PolarHBondContact O-N 2.97Å; L583-Y587 VanDerWaalsContact O-N 3.11Å; Y587-A589 PolarHBondContact O-N 3.18Å; Y587-T591 PolarHBondContact O-N 2.82Å; Y587-T591 VanDerWaalsContact O-N 3.07Å; Y587-T591 PolarHBondContact O-OG1 3.49Å
588	L	74	Confident	66.2	Low	110 Å²	110	76.1 Å²	76.1	58%	0.576	40%	0.399	S	S	*	.	H	α-helix	trans	-59.3	-50.8	-173.2	-171	65	0	0	0	113	S584 L585 F586 T591 N592	S584-L588 PolarHBondContact O-N 3.09Å; L585-L588 WeakPolarHBondContact O-CB 3.42Å; L585-L588 PolarHBondContact O-N 3.39Å; F586-L588 PolarHBondContact O-N 2.89Å; L588-T591 VanDerWaalsContact O-CB 3.31Å; L588-T591 WeakPolarHBondContact O-CB 3.45Å; L588-T591 PolarHBondContact O-N 2.88Å; L588-N592 PolarHBondContact O-N 2.9Å
589	A	63.3	Low	66.2	Low	12 Å²	12	75.9 Å²	75.9	10%	0.099	40%	0.398	C	S	.	.	H	α-helix	trans	-97.5	-2.9	-178.4	0	0	0	0	0	115.4	Y587 T591 N592 S593 P668	Y587-A589 PolarHBondContact O-N 3.18Å; A589-T591 VanDerWaalsContact C-N 3.3Å; A589-N592 HydrophobicContact CB-CB 4.2Å; A589-N592 PolarHBondContact O-N 3.26Å; A589-S593 PolarHBondContact O-N 3.4Å; A589-P668 HydrophobicContact CB-CB 3.77Å; A589-P668 HydrophobicContact CB-CG 3.88Å; A589-P668 WeakPolarHBondContact CB-O 3.34Å
590	V	61.7	Low	66.1	Low	38 Å²	38	76.4 Å²	76.4	23%	0.23	40%	0.403	C	S	.	.	H	α-helix	trans	-66.9	-38.9	155.3	175.4	0	0	0	0	109.1	F586 N592 S593 V594 P668	F586-V590 HydrophobicContact CE1-CG2 4.24Å; F586-V590 HydrophobicContact CE2-CG2 4.08Å; F586-V590 HydrophobicContact CZ-CG2 3.93Å; V590-N592 VanDerWaalsContact C-N 3.33Å; V590-N592 PolarHBondContact O-N 2.95Å; V590-S593 VanDerWaalsContact O-CB 3.22Å; V590-S593 WeakPolarHBondContact O-CB 3.4Å; V590-S593 PolarHBondContact O-N 3.3Å; V590-S593 VanDerWaalsContact O-N 3.13Å; V590-V594 PolarHBondContact O-N 3.05Å; V590-V594 VanDerWaalsContact O-N 3.07Å; V590-P668 HydrophobicContact CG2-CB 4.09Å
591	T	68	Low	65.9	Low	90 Å²	90	78.1 Å²	78.1	55%	0.552	40%	0.402	S	S	*	.	H	α-helix	trans	-60.3	-43.1	171.9	-49.6	0	0	0	0	111.2	Y587 L588 A589 S593 V594 L595	Y587-T591 PolarHBondContact O-N 2.82Å; Y587-T591 VanDerWaalsContact O-N 3.07Å; Y587-T591 PolarHBondContact O-OG1 3.49Å; L588-T591 VanDerWaalsContact O-CB 3.31Å; L588-T591 WeakPolarHBondContact O-CB 3.45Å; L588-T591 PolarHBondContact O-N 2.88Å; A589-T591 VanDerWaalsContact C-N 3.3Å; T591-S593 VanDerWaalsContact C-N 3.35Å; T591-S593 PolarHBondContact O-N 2.93Å; T591-V594 PolarHBondContact O-N 3.27Å; T591-L595 WeakPolarHBondContact O-CB 3.45Å; T591-L595 PolarHBondContact O-N 3.33Å
592	N	69.7	Low	65.7	Low	77 Å²	77	76.7 Å²	76.7	41%	0.412	40%	0.4	S	S	.	.	H	α-helix	trans	-61.6	-39.6	173.2	-61.1	-17.7	0	0	0	112.5	L588 A589 V590 V594 L595 D596	L588-N592 PolarHBondContact O-N 2.9Å; A589-N592 HydrophobicContact CB-CB 4.2Å; A589-N592 PolarHBondContact O-N 3.26Å; V590-N592 VanDerWaalsContact C-N 3.33Å; V590-N592 PolarHBondContact O-N 2.95Å; N592-V594 PolarHBondContact O-N 3.31Å; N592-L595 PolarHBondContact O-N 3.47Å; N592-D596 WeakPolarHBondContact O-CB 3.3Å; N592-D596 PolarHBondContact O-N 3.41Å; N592-D596 VanDerWaalsContact O-N 3.1Å
593	S	63	Low	65.7	Low	5 Å²	5	74.8 Å²	74.8	4%	0.035	40%	0.398	C	S	.	.	H	α-helix	trans	-56.6	-46.5	175.2	-175.3	0	0	0	0	112.5	A589 V590 T591 D596 Q597 K671	A589-S593 PolarHBondContact O-N 3.4Å; V590-S593 VanDerWaalsContact O-CB 3.22Å; V590-S593 WeakPolarHBondContact O-CB 3.4Å; V590-S593 PolarHBondContact O-N 3.3Å; V590-S593 VanDerWaalsContact O-N 3.13Å; T591-S593 VanDerWaalsContact C-N 3.35Å; T591-S593 PolarHBondContact O-N 2.93Å; S593-D596 WeakPolarHBondContact O-CB 3.36Å; S593-D596 PolarHBondContact O-N 3.38Å; S593-Q597 PolarHBondContact O-N 3.34Å; S593-Q597 VanDerWaalsContact O-N 3.13Å; S593-K671 PolarHBondContact OG-N 3.23Å
594	V	61.3	Low	65.7	Low	63 Å²	63	76 Å²	76	38%	0.382	40%	0.402	S	S	.	.	H	α-helix	trans	-73.7	-37.5	-179.6	176	0	0	0	0	112	V590 T591 N592 D596 Q597 N598	V590-V594 PolarHBondContact O-N 3.05Å; V590-V594 VanDerWaalsContact O-N 3.07Å; T591-V594 PolarHBondContact O-N 3.27Å; N592-V594 PolarHBondContact O-N 3.31Å; V594-D596 PolarHBondContact O-N 3.48Å; V594-Q597 PolarHBondContact O-N 2.84Å; V594-N598 PolarHBondContact O-N 3.47Å; V594-N598 VanDerWaalsContact O-N 3.16Å; V594-N598 PolarHBondContact O-ND2 3.1Å
595	L	68.7	Low	65.5	Low	108 Å²	108	75.5 Å²	75.5	57%	0.565	39%	0.391	S	S	*	.	H	α-helix	trans	-56.3	-40.6	173.9	-162.9	83.2	0	0	0	111	T591 N592 Q599	T591-L595 WeakPolarHBondContact O-CB 3.45Å; T591-L595 PolarHBondContact O-N 3.33Å; N592-L595 PolarHBondContact O-N 3.47Å; L595-Q599 PolarHBondContact O-N 3.44Å
596	D	66.9	Low	65.4	Low	28 Å²	28	73.6 Å²	73.6	15%	0.15	39%	0.386	C	S	.	.	H	α-helix	trans	-72.1	-37.4	179	-87	-28.2	0	0	0	114.1	N592 S593 V594 N598 Q599 K671	N592-D596 WeakPolarHBondContact O-CB 3.3Å; N592-D596 PolarHBondContact O-N 3.41Å; N592-D596 VanDerWaalsContact O-N 3.1Å; S593-D596 WeakPolarHBondContact O-CB 3.36Å; S593-D596 PolarHBondContact O-N 3.38Å; V594-D596 PolarHBondContact O-N 3.48Å; D596-N598 VanDerWaalsContact C-N 3.34Å; D596-Q599 PolarHBondContact O-N 3.42Å; D596-K671 HydrophobicContact CB-CB 4.07Å; D596-K671 HydrophobicContact CB-CD 3.86Å; D596-K671 HydrophobicContact CB-CG 3.73Å; D596-K671 VanDerWaalsContact CG-CE 3.43Å; D596-K671 IonicContact OD1-NZ 2.75Å; D596-K671 PolarHBondContact OD1-NZ 3.46Å; D596-K671 VanDerWaalsContact OD2-CD 3.3Å; D596-K671 WeakPolarHBondContact OD2-CD 3.42Å; D596-K671 WeakPolarHBondContact OD2-CE 3.14Å; D596-K671 IonicContact OD2-NZ 3.97Å; D596-K671 PolarHBondContact OD2-NZ 2.8Å
597	Q	64.5	Low	65.3	Low	53 Å²	53	80 Å²	80	25%	0.248	41%	0.41	C	S	.	.	H	α-helix	trans	-60.1	-43.9	171.8	-72.8	175.1	-44.5	0	0	111.6	S593 V594 Q599 L600 F601 I672	S593-Q597 PolarHBondContact O-N 3.34Å; S593-Q597 VanDerWaalsContact O-N 3.13Å; V594-Q597 PolarHBondContact O-N 2.84Å; Q597-Q599 VanDerWaalsContact C-N 3.28Å; Q597-Q599 PolarHBondContact O-N 2.95Å; Q597-L600 WeakPolarHBondContact O-CA 3.46Å; Q597-L600 VanDerWaalsContact O-CB 3.23Å; Q597-L600 WeakPolarHBondContact O-CB 3.33Å; Q597-L600 PolarHBondContact O-N 2.95Å; Q597-F601 PolarHBondContact O-N 2.72Å; Q597-F601 VanDerWaalsContact O-N 3.14Å; Q597-I672 WeakPolarHBondContact CG-O 3.36Å; Q597-I672 PolarHBondContact NE2-O 2.85Å
598	N	67	Low	64.9	Low	84 Å²	84	75 Å²	75	45%	0.449	39%	0.392	S	S	.	.	H	α-helix	trans	-63.5	-32.1	-177	-78.5	-54.2	0	0	0	113	V594 D596 L600 N602	V594-N598 PolarHBondContact O-N 3.47Å; V594-N598 VanDerWaalsContact O-N 3.16Å; V594-N598 PolarHBondContact O-ND2 3.1Å; D596-N598 VanDerWaalsContact C-N 3.34Å; N598-L600 VanDerWaalsContact C-N 3.26Å; N598-L600 PolarHBondContact O-N 2.9Å; N598-N602 PolarHBondContact O-N 3.12Å; N598-N602 PolarHBondContact O-ND2 2.67Å
599	Q	69	Low	64.4	Low	118 Å²	118	76 Å²	76	55%	0.551	39%	0.394	S	S	*	.	H	α-helix	trans	-63.2	-35.8	172.8	-66.2	175.3	23.1	0	0	111.8	L595 D596 Q597 A603	L595-Q599 PolarHBondContact O-N 3.44Å; D596-Q599 PolarHBondContact O-N 3.42Å; Q597-Q599 VanDerWaalsContact C-N 3.28Å; Q597-Q599 PolarHBondContact O-N 2.95Å; Q599-A603 PolarHBondContact O-N 3.41Å
600	L	63	Low	64.1	Low	88 Å²	88	83.8 Å²	83.8	46%	0.461	42%	0.42	S	S	.	.	H	α-helix	trans	-70.3	-48.5	-179.6	-131.1	155.6	0	0	0	111.2	Q597 N598 N602 A603 E604 A673	Q597-L600 WeakPolarHBondContact O-CA 3.46Å; Q597-L600 VanDerWaalsContact O-CB 3.23Å; Q597-L600 WeakPolarHBondContact O-CB 3.33Å; Q597-L600 PolarHBondContact O-N 2.95Å; N598-L600 VanDerWaalsContact C-N 3.26Å; N598-L600 PolarHBondContact O-N 2.9Å; L600-N602 PolarHBondContact O-N 2.91Å; L600-A603 WeakPolarHBondContact O-CB 3.45Å; L600-A603 PolarHBondContact O-N 3.04Å; L600-A603 VanDerWaalsContact O-N 3.09Å; L600-E604 PolarHBondContact O-N 3.33Å; L600-A673 HydrophobicContact CD1-CB 4.43Å
601	F	60.4	Low	63.7	Low	109 Å²	109	87.8 Å²	87.8	48%	0.478	44%	0.435	S	S	.	.	H	α-helix	trans	-57.6	-43.2	176.8	177.9	-102.8	0	0	0	113.1	Q597 A603 E604 Q605	Q597-F601 PolarHBondContact O-N 2.72Å; Q597-F601 VanDerWaalsContact O-N 3.14Å; F601-A603 PolarHBondContact O-N 3.19Å; F601-E604 PolarHBondContact O-N 3.3Å; F601-E604 VanDerWaalsContact O-N 3.07Å; F601-Q605 HydrophobicContact CD1-CG 4.34Å; F601-Q605 HydrophobicContact CE1-CG 3.82Å; F601-Q605 HydrophobicContact CE2-CG 4.39Å; F601-Q605 HydrophobicContact CZ-CG 3.85Å; F601-Q605 PolarHBondContact O-N 3.33Å; F601-Q605 VanDerWaalsContact O-N 3.11Å
602	N	68.7	Low	63	Low	98 Å²	98	88.4 Å²	88.4	52%	0.524	43%	0.427	S	S	.	.	H	α-helix	trans	-63.1	-29.4	178	-75	-39.6	0	0	0	113	N598 L600 S606	N598-N602 PolarHBondContact O-N 3.12Å; N598-N602 PolarHBondContact O-ND2 2.67Å; L600-N602 PolarHBondContact O-N 2.91Å; N602-S606 WeakPolarHBondContact O-CB 3.38Å; N602-S606 PolarHBondContact O-N 2.95Å; N602-S606 PolarHBondContact O-OG 2.7Å
603	A	65	Low	62.6	Low	55 Å²	55	90.2 Å²	90.2	46%	0.455	44%	0.441	S	S	.	.	H	α-helix	trans	-71.3	-30.5	174.5	0	0	0	0	0	112.5	Q599 L600 F601 R607	Q599-A603 PolarHBondContact O-N 3.41Å; L600-A603 WeakPolarHBondContact O-CB 3.45Å; L600-A603 PolarHBondContact O-N 3.04Å; L600-A603 VanDerWaalsContact O-N 3.09Å; F601-A603 PolarHBondContact O-N 3.19Å; A603-R607 PolarHBondContact O-N 3.47Å
604	E	61.5	Low	62.1	Low	89 Å²	89	97.8 Å²	97.8	42%	0.416	47%	0.473	S	S	.	.	H	α-helix	trans	-78.8	-44.9	178.9	-59	-152.6	114.6	0	0	112.5	L600 F601 S606 R607 L608	L600-E604 PolarHBondContact O-N 3.33Å; F601-E604 PolarHBondContact O-N 3.3Å; F601-E604 VanDerWaalsContact O-N 3.07Å; E604-S606 PolarHBondContact O-N 3.48Å; E604-S606 VanDerWaalsContact O-N 3.15Å; E604-R607 WeakPolarHBondContact O-CA 3.46Å; E604-R607 WeakPolarHBondContact O-CB 3.38Å; E604-R607 PolarHBondContact O-N 3.43Å; E604-L608 WeakPolarHBondContact O-CD1 3.3Å; E604-L608 PolarHBondContact O-N 2.89Å; E604-L608 VanDerWaalsContact O-N 3.07Å
605	Q	62.7	Low	61.4	Low	70 Å²	70	100.8 Å²	100.8	33%	0.327	48%	0.481	S	S	.	.	H	α-helix	trans	-49.9	-40.9	168.6	-75.1	-66.6	-29.8	0	0	111.4	F601 R607 L608 H609	F601-Q605 HydrophobicContact CD1-CG 4.34Å; F601-Q605 HydrophobicContact CE1-CG 3.82Å; F601-Q605 HydrophobicContact CE2-CG 4.39Å; F601-Q605 HydrophobicContact CZ-CG 3.85Å; F601-Q605 PolarHBondContact O-N 3.33Å; F601-Q605 VanDerWaalsContact O-N 3.11Å; Q605-R607 VanDerWaalsContact C-N 3.26Å; Q605-R607 PolarHBondContact O-N 3.49Å; Q605-L608 PolarHBondContact O-N 2.7Å; Q605-H609 PolarHBondContact O-N 2.8Å; Q605-H609 VanDerWaalsContact O-N 3.08Å
606	S	68.1	Low	60	Low	66 Å²	66	99 Å²	99	46%	0.462	49%	0.489	S	S	.	.	H	α-helix	trans	-69.3	-13.1	176	-59.4	0	0	0	0	114.9	N602 E604 R610	N602-S606 WeakPolarHBondContact O-CB 3.38Å; N602-S606 PolarHBondContact O-N 2.95Å; N602-S606 PolarHBondContact O-OG 2.7Å; E604-S606 PolarHBondContact O-N 3.48Å; E604-S606 VanDerWaalsContact O-N 3.15Å; S606-R610 VanDerWaalsContact O-CZ 3.29Å; S606-R610 PolarHBondContact O-NE 3.09Å; S606-R610 PolarHBondContact O-NH2 3.32Å
607	R	60.2	Low	58.7	Low	173 Å²	173	101.1 Å²	101.1	65%	0.653	50%	0.503	S	S	*	.	H	α-helix	trans	-87.7	-45.8	167.8	-71.5	173.1	163.9	171.4	-5.6	111	A603 E604 Q605 H609 R610 F611	A603-R607 PolarHBondContact O-N 3.47Å; E604-R607 WeakPolarHBondContact O-CA 3.46Å; E604-R607 WeakPolarHBondContact O-CB 3.38Å; E604-R607 PolarHBondContact O-N 3.43Å; Q605-R607 VanDerWaalsContact C-N 3.26Å; Q605-R607 PolarHBondContact O-N 3.49Å; R607-H609 PolarHBondContact O-N 3.06Å; R607-R610 WeakPolarHBondContact O-CB 3.48Å; R607-R610 PolarHBondContact O-N 2.81Å; R607-R610 VanDerWaalsContact O-N 3.12Å; R607-F611 PolarHBondContact O-N 3.29Å
608	L	56.5	Low	57.7	Low	40 Å²	40	105.2 Å²	105.2	21%	0.209	52%	0.52	C	S	.	.	H	α-helix	trans	-63.1	-39.9	-175.9	-66.8	146.6	0	0	0	112.3	E604 Q605 R610 F611 R612 I694 L695	E604-L608 WeakPolarHBondContact O-CD1 3.3Å; E604-L608 PolarHBondContact O-N 2.89Å; E604-L608 VanDerWaalsContact O-N 3.07Å; Q605-L608 PolarHBondContact O-N 2.7Å; L608-R610 VanDerWaalsContact C-N 3.27Å; L608-R610 PolarHBondContact O-N 2.82Å; L608-F611 WeakPolarHBondContact O-CB 3.43Å; L608-F611 PolarHBondContact O-N 3.41Å; L608-R612 PolarHBondContact O-N 3.44Å; L608-I694 HydrophobicContact CB-CD1 4.26Å; L608-I694 HydrophobicContact CB-CG2 4.28Å; L608-I694 HydrophobicContact CD2-CD1 4.12Å; L608-I694 HydrophobicContact CD2-CG1 3.87Å; L608-I694 HydrophobicContact CD2-CG2 4.33Å; L608-L695 WeakPolarHBondContact CD1-O 3.47Å; L608-L695 VanDerWaalsContact CD2-O 3.25Å; L608-L695 WeakPolarHBondContact CD2-O 3.49Å
609	H	62.4	Low	56.7	Low	132 Å²	132	102 Å²	102	61%	0.611	50%	0.503	S	S	*	.	H	α-helix	trans	-59.5	-37.4	175.4	-166.8	-4.5	0	0	0	112.3	Q605 R607 F611 R612 V613	Q605-H609 PolarHBondContact O-N 2.8Å; Q605-H609 VanDerWaalsContact O-N 3.08Å; R607-H609 PolarHBondContact O-N 3.06Å; H609-F611 VanDerWaalsContact C-N 3.34Å; H609-R612 PolarHBondContact O-N 2.86Å; H609-V613 WeakPolarHBondContact O-CG2 3.33Å; H609-V613 PolarHBondContact O-N 3.23Å
610	R	58.8	Low	55.7	Low	175 Å²	175	99.7 Å²	99.7	66%	0.66	49%	0.494	S	S	*	.	H	α-helix	trans	-69.2	-28.8	175	-77.5	178.7	-82	-173.7	-7.2	112.9	S606 R607 L608	S606-R610 VanDerWaalsContact O-CZ 3.29Å; S606-R610 PolarHBondContact O-NE 3.09Å; S606-R610 PolarHBondContact O-NH2 3.32Å; R607-R610 WeakPolarHBondContact O-CB 3.48Å; R607-R610 PolarHBondContact O-N 2.81Å; R607-R610 VanDerWaalsContact O-N 3.12Å; L608-R610 VanDerWaalsContact C-N 3.27Å; L608-R610 PolarHBondContact O-N 2.82Å
611	F	52	Low	54.6	Low	123 Å²	123	99.3 Å²	99.3	54%	0.539	49%	0.492	S	S	.	.	H	α-helix	trans	-71.3	-45.3	174.6	-154.5	-84.4	0	0	0	111.3	R607 L608 H609 V613 K614 F615	R607-F611 PolarHBondContact O-N 3.29Å; L608-F611 WeakPolarHBondContact O-CB 3.43Å; L608-F611 PolarHBondContact O-N 3.41Å; H609-F611 VanDerWaalsContact C-N 3.34Å; F611-V613 VanDerWaalsContact C-N 3.31Å; F611-V613 PolarHBondContact O-N 3.46Å; F611-K614 PolarHBondContact O-N 3.01Å; F611-F615 AromaticContact CD1-CD2 3.76Å; F611-F615 HydrophobicContact CD1-CD2 3.76Å; F611-F615 HydrophobicContact CD1-CE2 4.18Å; F611-F615 HydrophobicContact CD2-CE2 4.42Å; F611-F615 AromaticContact CE1-CD2 3.46Å; F611-F615 HydrophobicContact CE1-CD2 3.46Å; F611-F615 VanDerWaalsContact CE1-CD2 3.46Å; F611-F615 AromaticContact CE1-CE2 3.67Å; F611-F615 HydrophobicContact CE1-CE2 3.67Å; F611-F615 HydrophobicContact CE1-CG 4.4Å; F611-F615 HydrophobicContact CE2-CD2 4.49Å; F611-F615 AromaticContact CE2-CE2 3.94Å; F611-F615 HydrophobicContact CE2-CE2 3.94Å; F611-F615 HydrophobicContact CG-CD2 4.39Å; F611-F615 AromaticContact CZ-CD2 3.87Å; F611-F615 HydrophobicContact CZ-CD2 3.87Å; F611-F615 AromaticContact CZ-CE2 3.54Å; F611-F615 HydrophobicContact CZ-CE2 3.54Å; F611-F615 HydrophobicContact CZ-CZ 4.41Å
612	R	53.5	Low	53.9	Low	103 Å²	103	101 Å²	101	39%	0.389	50%	0.499	S	S	.	.	H	α-helix	trans	-58.2	-39	179.9	-168	178.2	-175.6	156.5	9.1	113.1	L608 H609 K614 G616 I619	L608-R612 PolarHBondContact O-N 3.44Å; H609-R612 PolarHBondContact O-N 2.86Å; R612-K614 PolarHBondContact O-N 2.86Å; R612-G616 PolarHBondContact O-N 2.83Å; R612-I619 PolarHBondContact NH1-O 3.48Å; R612-I619 PolarHBondContact NH2-O 2.9Å
613	V	60.6	Low	52.6	Low	115 Å²	115	99 Å²	99	70%	0.697	50%	0.497	S	S	*	.	H	α-helix	trans	-65.4	-25.6	176.4	172	0	0	0	0	112.6	H609 F611	H609-V613 WeakPolarHBondContact O-CG2 3.33Å; H609-V613 PolarHBondContact O-N 3.23Å; F611-V613 VanDerWaalsContact C-N 3.31Å; F611-V613 PolarHBondContact O-N 3.46Å
614	K	53	Low	51.4	Low	164 Å²	164	101.1 Å²	101.1	71%	0.713	50%	0.499	S	S	*	.	H	α-helix	trans	-91.3	-18.7	-170.2	-155.6	176.3	-175.9	-176.3	0	114.9	F611 R612	F611-K614 PolarHBondContact O-N 3.01Å; R612-K614 PolarHBondContact O-N 2.86Å
615	F	47.5	Very low	50.5	Low	125 Å²	125	99.3 Å²	99.3	55%	0.548	50%	0.496	S	S	.	.	H	α-helix	trans	-128.5	-4.5	-172	-67.7	-76.1	0	0	0	115.6	F611 V617	F611-F615 AromaticContact CD1-CD2 3.76Å; F611-F615 HydrophobicContact CD1-CD2 3.76Å; F611-F615 HydrophobicContact CD1-CE2 4.18Å; F611-F615 HydrophobicContact CD2-CE2 4.42Å; F611-F615 AromaticContact CE1-CD2 3.46Å; F611-F615 HydrophobicContact CE1-CD2 3.46Å; F611-F615 VanDerWaalsContact CE1-CD2 3.46Å; F611-F615 AromaticContact CE1-CE2 3.67Å; F611-F615 HydrophobicContact CE1-CE2 3.67Å; F611-F615 HydrophobicContact CE1-CG 4.4Å; F611-F615 HydrophobicContact CE2-CD2 4.49Å; F611-F615 AromaticContact CE2-CE2 3.94Å; F611-F615 HydrophobicContact CE2-CE2 3.94Å; F611-F615 HydrophobicContact CG-CD2 4.39Å; F611-F615 AromaticContact CZ-CD2 3.87Å; F611-F615 HydrophobicContact CZ-CD2 3.87Å; F611-F615 AromaticContact CZ-CE2 3.54Å; F611-F615 HydrophobicContact CZ-CE2 3.54Å; F611-F615 HydrophobicContact CZ-CZ 4.41Å; F615-V617 HydrophobicContact CB-CG2 3.96Å; F615-V617 WeakPolarHBondContact O-CG2 3.4Å; F615-V617 PolarHBondContact O-N 3.09Å
616	G	37.9	Very low	49.4	Very low	71 Å²	71	101.2 Å²	101.2	73%	0.732	51%	0.509	S	S	*	.			trans	70.1	-4.8	173	0	0	0	0	0	116.9	R612	R612-G616 PolarHBondContact O-N 2.83Å
617	V	41.3	Very low	48.3	Very low	72 Å²	72	102.7 Å²	102.7	44%	0.436	51%	0.511	S	S	.	.			trans	-72.9	136.1	-178.9	-132.6	0	0	0	0	111.4	F615 I619	F615-V617 HydrophobicContact CB-CG2 3.96Å; F615-V617 WeakPolarHBondContact O-CG2 3.4Å; F615-V617 PolarHBondContact O-N 3.09Å; V617-I619 HydrophobicContact CB-CG1 4.45Å; V617-I619 PolarHBondContact O-N 3.13Å; V617-I619 VanDerWaalsContact O-N 3.15Å
618	K	43.7	Very low	47.6	Very low	140 Å²	140	98.3 Å²	98.3	61%	0.609	50%	0.501	S	S	*	.			trans	-92.9	77	-164.9	-164.7	179.2	-177	-179.6	0	112.7
619	I	45.5	Very low	47.1	Very low	17 Å²	17	101.6 Å²	101.6	9%	0.087	52%	0.518	C	S	.	.			trans	-85	126.4	-170.5	-46.1	157.4	0	0	0	113.3	R612 V617 Q692 L693 I694	R612-I619 PolarHBondContact NH1-O 3.48Å; R612-I619 PolarHBondContact NH2-O 2.9Å; V617-I619 HydrophobicContact CB-CG1 4.45Å; V617-I619 PolarHBondContact O-N 3.13Å; V617-I619 VanDerWaalsContact O-N 3.15Å; I619-Q692 HydrophobicContact CB-CG 4.34Å; I619-Q692 HydrophobicContact CG1-CG 3.98Å; I619-Q692 VanDerWaalsContact CG1-OE1 3.23Å; I619-Q692 HydrophobicContact CG2-CB 4.31Å; I619-Q692 HydrophobicContact CG2-CG 4.01Å; I619-L693 VanDerWaalsContact CG2-O 3.22Å; I619-L693 WeakPolarHBondContact CG2-O 3.43Å; I619-I694 HydrophobicContact CB-CB 4.12Å; I619-I694 HydrophobicContact CB-CD1 4.2Å; I619-I694 HydrophobicContact CB-CG1 4.25Å; I619-I694 HydrophobicContact CD1-CD1 3.39Å; I619-I694 HydrophobicContact CD1-CG1 3.87Å; I619-I694 HydrophobicContact CG1-CD1 4.36Å; I619-I694 HydrophobicContact CG2-CB 3.4Å; I619-I694 VanDerWaalsContact CG2-CB 3.4Å; I619-I694 HydrophobicContact CG2-CD1 4.27Å; I619-I694 HydrophobicContact CG2-CG1 3.76Å
620	N	47.1	Very low	46.4	Very low	68 Å²	68	97.8 Å²	97.8	36%	0.364	50%	0.504	S	S	.	.			trans	-124	86.8	-174.1	-70.8	-5.7	0	0	0	112	F622 Q692 L693	N620-F622 PolarHBondContact O-N 3.2Å; N620-Q692 CarbonylContact C-O 3.5Å; N620-Q692 VanDerWaalsContact CA-O 3.22Å; N620-Q692 WeakPolarHBondContact CA-O 3.28Å; N620-Q692 WeakPolarHBondContact CB-O 3.36Å; N620-Q692 PolarHBondContact N-O 3.2Å; N620-L693 WeakPolarHBondContact O-CD1 3.31Å; N620-L693 VanDerWaalsContact O-CG 3.25Å; N620-L693 WeakPolarHBondContact O-CG 3.49Å
621	L	41	Very low	45.7	Very low	80 Å²	80	94.1 Å²	94.1	42%	0.419	50%	0.501	S	S	.	.			trans	-57.5	130.3	177	-169.7	67.5	0	0	0	111.6	I643 L693 I694	L621-I643 HydrophobicContact CD1-CG2 4.15Å; L621-L693 HydrophobicContact CD1-CB 4.06Å; L621-L693 HydrophobicContact CD1-CD2 3.81Å; L621-L693 HydrophobicContact CD1-CG 4.17Å; L621-I694 VanDerWaalsContact CB-O 3.28Å; L621-I694 WeakPolarHBondContact CB-O 3.4Å; L621-I694 WeakPolarHBondContact CD1-O 3.37Å; L621-I694 WeakPolarHBondContact CD2-O 3.41Å; L621-I694 WeakPolarHBondContact CG-O 3.34Å
622	F	44.1	Very low	45.8	Very low	144 Å²	144	90.6 Å²	90.6	63%	0.632	49%	0.488	S	S	*	.			trans	-151.7	108.6	-171.4	-142	-75.1	0	0	0	112	N620 L693	N620-F622 PolarHBondContact O-N 3.2Å; F622-L693 HydrophobicContact CB-CD1 4.12Å; F622-L693 HydrophobicContact CB-CD2 4.41Å; F622-L693 HydrophobicContact CB-CG 4.25Å; F622-L693 VanDerWaalsContact N-CG 3.35Å; F622-L693 VanDerWaalsContact O-CD2 3.29Å; F622-L693 WeakPolarHBondContact O-CD2 3.44Å
623	A	42.9	Very low	45.4	Very low	57 Å²	57	95.2 Å²	95.2	47%	0.471	51%	0.514	S	S	.	.			trans	59.3	107.6	176.7	0	0	0	0	0	117.1
624	I	40.2	Very low	44.7	Very low	99 Å²	99	96.4 Å²	96.4	51%	0.508	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	129.2	135.6	-68.5	159.6	0	0	0	107.1	Y641 I643	I624-Y641 HydrophobicContact CG2-CD1 3.46Å; I624-Y641 VanDerWaalsContact CG2-CD1 3.46Å; I624-Y641 HydrophobicContact CG2-CE1 3.93Å; I624-I643 HydrophobicContact CB-CG1 4.21Å; I624-I643 HydrophobicContact CD1-CD1 4.46Å; I624-I643 HydrophobicContact CG1-CD1 3.64Å; I624-I643 HydrophobicContact CG1-CG1 3.5Å; I624-I643 VanDerWaalsContact CG1-CG1 3.5Å
625	S	41.2	Very low	44	Very low	51 Å²	51	90.8 Å²	90.8	36%	0.357	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	128.8	-179.4	61.2	0	0	0	0	110.8	N642	S625-N642 PolarHBondContact N-O 3.27Å
626	N	39.9	Very low	43.9	Very low	110 Å²	110	89.7 Å²	89.7	59%	0.588	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	68.2	106.2	-166.4	-53.6	-13.3	0	0	0	113	N642	N626-N642 PolarHBondContact O-N 3.16Å
627	L	45.5	Very low	44.1	Very low	97 Å²	97	91.1 Å²	91.1	51%	0.508	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	124.4	142.6	-80.7	77.9	0	0	0	106.5	I639 I640 Y641	L627-I639 HydrophobicContact CD2-CG2 3.79Å; L627-I639 HydrophobicContact CG-CG2 3.96Å; L627-I640 WeakPolarHBondContact CA-O 3.26Å; L627-Y641 HydrophobicContact CD1-CD1 4.01Å; L627-Y641 HydrophobicContact CD1-CE1 3.55Å; L627-Y641 HydrophobicContact CD2-CE1 4.42Å; L627-Y641 HydrophobicContact CG-CD1 4.08Å; L627-Y641 HydrophobicContact CG-CE1 3.78Å
628	N	45.5	Very low	44.2	Very low	82 Å²	82	89.9 Å²	89.9	44%	0.439	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	117.2	157.6	-77.9	-10	0	0	0	107.5	T630 I640	N628-T630 HydrophobicContact CB-CG2 4.43Å; N628-I640 HydrophobicContact CB-CB 4.31Å; N628-I640 PolarHBondContact N-O 3.37Å; N628-I640 PolarHBondContact O-N 3.36Å
629	L	45.1	Very low	44.4	Very low	108 Å²	108	85.2 Å²	85.2	57%	0.565	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	122	162.3	-82.4	160.6	0	0	0	107.7	E637 I639	L629-E637 HydrophobicContact CD2-CB 4.08Å; L629-E637 HydrophobicContact CD2-CG 4.43Å; L629-I639 HydrophobicContact CD2-CG1 4.13Å
630	T	48.4	Very low	44.4	Very low	53 Å²	53	86.4 Å²	86.4	33%	0.325	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	123.2	174.5	55.9	0	0	0	0	108.6	N628 I638 I640	N628-T630 HydrophobicContact CB-CG2 4.43Å; T630-I638 PolarHBondContact N-O 2.8Å; T630-I638 WeakPolarHBondContact O-CA 3.49Å; T630-I638 WeakPolarHBondContact O-CB 3.29Å; T630-I638 PolarHBondContact O-N 3.28Å; T630-I640 HydrophobicContact CG2-CD1 3.92Å; T630-I640 WeakPolarHBondContact OG1-CD1 3.48Å
631	T	43.8	Very low	44.3	Very low	98 Å²	98	85.9 Å²	85.9	60%	0.601	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	140.8	170.2	38.2	0	0	0	0	110.7	E636 E637	T631-E636 CarbonylContact C-O 3.2Å; T631-E636 WeakPolarHBondContact CA-O 3.27Å; T631-E637 HydrophobicContact CG2-CG 4.42Å
632	D	54.7	Low	44.5	Very low	48 Å²	48	84.2 Å²	84.2	26%	0.257	45%	0.451	S	S	.	.			trans	-78.1	-175.6	170.4	100.2	-49	0	0	0	111.4	N634 G635 E636 I638	D632-N634 VanDerWaalsContact CG-N 3.3Å; D632-N634 PolarHBondContact O-N 3.04Å; D632-N634 VanDerWaalsContact OD1-CA 3.3Å; D632-N634 WeakPolarHBondContact OD1-CA 3.34Å; D632-N634 WeakPolarHBondContact OD1-CB 3.42Å; D632-N634 PolarHBondContact OD1-N 2.99Å; D632-N634 PolarHBondContact OD2-N 3.49Å; D632-N634 PolarHBondContact OD2-ND2 3.36Å; D632-G635 PolarHBondContact O-N 2.89Å; D632-G635 PolarHBondContact OD1-N 3.2Å; D632-E636 PolarHBondContact N-O 2.75Å; D632-E636 PolarHBondContact OD1-N 2.84Å; D632-I638 HydrophobicContact CB-CD1 3.61Å; D632-I638 HydrophobicContact CB-CG1 4.1Å
633	Q	44.5	Very low	44.7	Very low	201 Å²	201	77.6 Å²	77.6	94%	0.939	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-10.9	179.3	-65.7	-175.3	-11.4	0	0	114.2
634	N	46.1	Very low	44.7	Very low	140 Å²	140	78.4 Å²	78.4	75%	0.749	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-4.2	175.7	-54.4	-77.3	0	0	0	112.6	D632	D632-N634 VanDerWaalsContact CG-N 3.3Å; D632-N634 PolarHBondContact O-N 3.04Å; D632-N634 VanDerWaalsContact OD1-CA 3.3Å; D632-N634 WeakPolarHBondContact OD1-CA 3.34Å; D632-N634 WeakPolarHBondContact OD1-CB 3.42Å; D632-N634 PolarHBondContact OD1-N 2.99Å; D632-N634 PolarHBondContact OD2-N 3.49Å; D632-N634 PolarHBondContact OD2-ND2 3.36Å
635	G	37.8	Very low	45	Very low	45 Å²	45	75 Å²	75	46%	0.464	40%	0.401	S	S	.	.	S	Bend	trans	85.4	11	-174.7	0	0	0	0	0	114.5	D632	D632-G635 PolarHBondContact O-N 2.89Å; D632-G635 PolarHBondContact OD1-N 3.2Å
636	E	45.3	Very low	45.1	Very low	102 Å²	102	75.2 Å²	75.2	48%	0.477	40%	0.397	S	S	.	.			trans	-76.7	133.5	174.1	-61.3	-154	156.1	0	0	111	T631 D632 I638 M662	T631-E636 CarbonylContact C-O 3.2Å; T631-E636 WeakPolarHBondContact CA-O 3.27Å; D632-E636 PolarHBondContact N-O 2.75Å; D632-E636 PolarHBondContact OD1-N 2.84Å; E636-I638 PolarHBondContact O-N 3.38Å; E636-M662 HydrophobicContact CB-CG 3.77Å; E636-M662 HydrophobicContact CG-CG 3.83Å
637	E	42.2	Very low	45.5	Very low	102 Å²	102	71.8 Å²	71.8	48%	0.477	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	108.1	177.7	-69.2	-172.6	139.3	0	0	110.9	L629 T631 M662	L629-E637 HydrophobicContact CD2-CB 4.08Å; L629-E637 HydrophobicContact CD2-CG 4.43Å; T631-E637 HydrophobicContact CG2-CG 4.42Å; E637-M662 HydrophobicContact CB-CE 4.04Å; E637-M662 HydrophobicContact CG-CE 3.89Å
638	I	44.7	Very low	45.5	Very low	46 Å²	46	69.6 Å²	69.6	24%	0.236	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	131.8	168.7	-57.9	176.4	0	0	0	108.5	T630 D632 E636 I640 L658	T630-I638 PolarHBondContact N-O 2.8Å; T630-I638 WeakPolarHBondContact O-CA 3.49Å; T630-I638 WeakPolarHBondContact O-CB 3.29Å; T630-I638 PolarHBondContact O-N 3.28Å; D632-I638 HydrophobicContact CB-CD1 3.61Å; D632-I638 HydrophobicContact CB-CG1 4.1Å; E636-I638 PolarHBondContact O-N 3.38Å; I638-I640 HydrophobicContact CG2-CG1 4.11Å; I638-L658 HydrophobicContact CG2-CD2 3.42Å; I638-L658 VanDerWaalsContact CG2-CD2 3.42Å
639	I	46.8	Very low	45.3	Very low	41 Å²	41	66 Å²	66	21%	0.21	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	110.3	170.1	-59.1	176.5	0	0	0	108.4	L627 L629 Y641 L659	L627-I639 HydrophobicContact CD2-CG2 3.79Å; L627-I639 HydrophobicContact CG-CG2 3.96Å; L629-I639 HydrophobicContact CD2-CG1 4.13Å; I639-Y641 HydrophobicContact CB-CE2 4.48Å; I639-Y641 HydrophobicContact CG2-CD2 3.67Å; I639-Y641 HydrophobicContact CG2-CE2 3.48Å; I639-Y641 VanDerWaalsContact CG2-CE2 3.48Å; I639-Y641 HydrophobicContact CG2-CG 4.33Å; I639-L659 HydrophobicContact CB-CB 4.44Å; I639-L659 PolarHBondContact N-O 2.7Å; I639-L659 PolarHBondContact O-N 2.79Å
640	I	45.1	Very low	45.1	Very low	42 Å²	42	66.1 Å²	66.1	22%	0.215	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	127.8	170.5	-61.1	-176.8	0	0	0	108.7	L627 N628 T630 I638 V656 L658	L627-I640 WeakPolarHBondContact CA-O 3.26Å; N628-I640 HydrophobicContact CB-CB 4.31Å; N628-I640 PolarHBondContact N-O 3.37Å; N628-I640 PolarHBondContact O-N 3.36Å; T630-I640 HydrophobicContact CG2-CD1 3.92Å; T630-I640 WeakPolarHBondContact OG1-CD1 3.48Å; I638-I640 HydrophobicContact CG2-CG1 4.11Å; I640-V656 HydrophobicContact CG2-CG1 3.97Å; I640-L658 HydrophobicContact CG1-CD2 4.09Å
641	Y	46.1	Very low	44.8	Very low	58 Å²	58	65.2 Å²	65.2	23%	0.227	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	119.7	-177.5	-86.7	-75.3	0	0	0	110.3	I624 L627 I639 V655 F657 L659	I624-Y641 HydrophobicContact CG2-CD1 3.46Å; I624-Y641 VanDerWaalsContact CG2-CD1 3.46Å; I624-Y641 HydrophobicContact CG2-CE1 3.93Å; L627-Y641 HydrophobicContact CD1-CD1 4.01Å; L627-Y641 HydrophobicContact CD1-CE1 3.55Å; L627-Y641 HydrophobicContact CD2-CE1 4.42Å; L627-Y641 HydrophobicContact CG-CD1 4.08Å; L627-Y641 HydrophobicContact CG-CE1 3.78Å; I639-Y641 HydrophobicContact CB-CE2 4.48Å; I639-Y641 HydrophobicContact CG2-CD2 3.67Å; I639-Y641 HydrophobicContact CG2-CE2 3.48Å; I639-Y641 VanDerWaalsContact CG2-CE2 3.48Å; I639-Y641 HydrophobicContact CG2-CG 4.33Å; Y641-V655 WeakPolarHBondContact O-CG1 3.36Å; Y641-F657 HydrophobicContact CD2-CB 4.29Å; Y641-F657 HydrophobicContact CG-CB 4.22Å; Y641-F657 PolarHBondContact N-O 3.25Å; Y641-F657 PolarHBondContact O-N 3.38Å; Y641-L659 HydrophobicContact CD2-CD1 4.44Å; Y641-L659 HydrophobicContact CE2-CB 4.44Å; Y641-L659 HydrophobicContact CE2-CD1 3.78Å
642	N	45.2	Very low	44.6	Very low	44 Å²	44	63.6 Å²	63.6	24%	0.235	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	142.6	172.5	-69.7	7.2	0	0	0	111.5	S625 N626 V655	S625-N642 PolarHBondContact N-O 3.27Å; N626-N642 PolarHBondContact O-N 3.16Å; N642-V655 WeakPolarHBondContact CA-O 3.15Å; N642-V655 PolarHBondContact OD1-O 3.37Å
643	I	47.2	Very low	44	Very low	5 Å²	5	62.1 Å²	62.1	3%	0.026	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	135.9	173.2	-60.3	171.4	0	0	0	106.9	L621 I624 S654 V655 F657 I678 L693 L695	L621-I643 HydrophobicContact CD1-CG2 4.15Å; I624-I643 HydrophobicContact CB-CG1 4.21Å; I624-I643 HydrophobicContact CD1-CD1 4.46Å; I624-I643 HydrophobicContact CG1-CD1 3.64Å; I624-I643 HydrophobicContact CG1-CG1 3.5Å; I624-I643 VanDerWaalsContact CG1-CG1 3.5Å; I643-S654 CarbonylContact O-C 3.59Å; I643-V655 HydrophobicContact CB-CB 3.79Å; I643-V655 HydrophobicContact CB-CG1 3.57Å; I643-V655 HydrophobicContact CD1-CG1 4.07Å; I643-V655 HydrophobicContact CG1-CB 4.48Å; I643-V655 HydrophobicContact CG1-CG1 3.72Å; I643-V655 WeakPolarHBondContact O-CB 3.48Å; I643-V655 PolarHBondContact O-N 2.83Å; I643-F657 HydrophobicContact CD1-CD2 3.59Å; I643-F657 HydrophobicContact CD1-CE2 3.7Å; I643-I678 HydrophobicContact CG2-CD1 4.5Å; I643-L693 HydrophobicContact CG2-CD2 3.74Å; I643-L695 HydrophobicContact CB-CD2 4.23Å; I643-L695 HydrophobicContact CD1-CD2 3.46Å; I643-L695 VanDerWaalsContact CD1-CD2 3.46Å; I643-L695 HydrophobicContact CG1-CD2 4.43Å; I643-L695 HydrophobicContact CG2-CD2 4.04Å
644	L	43.5	Very low	43.7	Very low	75 Å²	75	54.9 Å²	54.9	39%	0.393	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	101.5	-173.5	-147.5	79.5	0	0	0	111.6	H646 F653 L693	L644-H646 PolarHBondContact O-N 3.38Å; L644-F653 CarbonylContact C-O 3.58Å; L644-F653 VanDerWaalsContact CA-O 3.27Å; L644-F653 WeakPolarHBondContact CA-O 3.35Å; L644-L693 WeakPolarHBondContact O-CD1 3.39Å; L644-L693 WeakPolarHBondContact O-CD2 3.36Å
645	I	47.3	Very low	43.6	Very low	26 Å²	26	48.2 Å²	48.2	13%	0.133	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	81.9	167.4	-90.2	173.9	0	0	0	108.8	V647 F653 I678 L693	I645-V647 HydrophobicContact CG2-CG2 3.26Å; I645-V647 PolarHBondContact O-N 3.25Å; I645-F653 HydrophobicContact CB-CB 4.05Å; I645-F653 HydrophobicContact CG2-CB 3.99Å; I645-F653 HydrophobicContact CG2-CD2 3.69Å; I645-F653 HydrophobicContact CG2-CG 4.28Å; I645-F653 PolarHBondContact N-O 3.4Å; I645-F653 PolarHBondContact O-N 2.62Å; I645-I678 HydrophobicContact CB-CD1 3.67Å; I645-I678 HydrophobicContact CB-CG1 4.06Å; I645-I678 HydrophobicContact CD1-CB 4.27Å; I645-I678 HydrophobicContact CD1-CD1 3.5Å; I645-I678 VanDerWaalsContact CD1-CD1 3.5Å; I645-I678 HydrophobicContact CD1-CG1 4.09Å; I645-I678 HydrophobicContact CD1-CG2 4.03Å; I645-I678 HydrophobicContact CG1-CD1 3.41Å; I645-I678 VanDerWaalsContact CG1-CD1 3.41Å; I645-I678 HydrophobicContact CG1-CG1 4.21Å; I645-L693 HydrophobicContact CB-CB 4.26Å; I645-L693 HydrophobicContact CD1-CB 4.37Å; I645-L693 VanDerWaalsContact CD1-O 3.32Å; I645-L693 WeakPolarHBondContact CD1-O 3.22Å; I645-L693 HydrophobicContact CG1-CB 3.35Å; I645-L693 HydrophobicContact CG1-CG 4.46Å
646	H	42.6	Very low	43.5	Very low	57 Å²	57	49.4 Å²	49.4	26%	0.264	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)		-10.9	112.9	129.5	-79.6	-97.3	0	0	0	116.7	L644 V651 S652 Y690 L691 Q692	L644-H646 PolarHBondContact O-N 3.38Å; H646-V651 PolarHBondContact CE1-O 3.23Å; H646-V651 PolarHBondContact ND1-O 2.82Å; H646-S652 PolarHBondContact CD2-OG 2.83Å; H646-S652 PolarHBondContact CE1-OG 3.48Å; H646-S652 VanDerWaalsContact CE1-OG 3.25Å; H646-S652 WeakPolarHBondContact NE2-CB 3.46Å; H646-S652 PolarHBondContact NE2-OG 2.89Å; H646-Y690 PolarHBondContact ND1-O 3.35Å; H646-L691 HydrophobicContact CB-CB 4.01Å; H646-L691 HydrophobicContact CB-CD1 3.91Å; H646-L691 HydrophobicContact CB-CG 4.48Å; H646-L691 CarbonylContact O-C 3.5Å; H646-Q692 WeakPolarHBondContact O-CA 3.46Å; H646-Q692 PolarHBondContact O-N 2.83Å
647	V	47.3	Very low	43.3	Very low	38 Å²	38	46.5 Å²	46.5	23%	0.23	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	121.8	172	179.4	0	0	0	0	114.9	I645 G649 H650 V651 F653 Y690 L691	I645-V647 HydrophobicContact CG2-CG2 3.26Å; I645-V647 PolarHBondContact O-N 3.25Å; V647-G649 PolarHBondContact O-N 3.38Å; V647-H650 PolarHBondContact O-N 2.83Å; V647-V651 CarbonylContact C-O 3.55Å; V647-V651 WeakPolarHBondContact CA-O 3.25Å; V647-V651 HydrophobicContact CB-CB 4.14Å; V647-V651 WeakPolarHBondContact CB-O 3.17Å; V647-V651 HydrophobicContact CG1-CB 4.47Å; V647-V651 PolarHBondContact N-O 2.77Å; V647-V651 PolarHBondContact O-N 2.73Å; V647-V651 VanDerWaalsContact O-N 3.13Å; V647-V651 VanDerWaalsContact O-O 3.09Å; V647-F653 HydrophobicContact CB-CD2 4.44Å; V647-F653 HydrophobicContact CB-CE2 4.19Å; V647-F653 HydrophobicContact CG1-CE2 4.44Å; V647-F653 HydrophobicContact CG2-CD2 3.53Å; V647-F653 HydrophobicContact CG2-CE2 3.6Å; V647-Y690 CarbonylContact C-O 3.58Å; V647-L691 CarbonylContact C-O 3.58Å; V647-L691 VanDerWaalsContact CA-O 3.31Å; V647-L691 WeakPolarHBondContact CA-O 3.18Å
648	G	45.6	Very low	42.8	Very low	50 Å²	50	46.2 Å²	46.2	52%	0.515	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	-13.7	145.5	0	0	0	0	0	117.7	Y690 L691	G648-Y690 PolarHBondContact N-O 2.73Å; G648-L691 PolarHBondContact N-O 3.29Å
649	G	41.4	Very low	42.6	Very low	7 Å²	7	45.5 Å²	45.5	7%	0.072	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	101	26.5	-176.1	0	0	0	0	0	116.3	V647 N688 Y690	V647-G649 PolarHBondContact O-N 3.38Å; G649-N688 CarbonylContact C-O 3.58Å; G649-N688 WeakPolarHBondContact CA-O 3.48Å; G649-N688 CarbonylContact O-C 3.58Å; G649-N688 PolarHBondContact O-N 3.45Å; G649-Y690 PolarHBondContact N-O 2.7Å
650	H	42.6	Very low	42	Very low	110 Å²	110	46.8 Å²	46.8	51%	0.509	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-159.6	-2.7	158.3	-97.1	-45.7	0	0	0	115.4	V647 G686 N687 N688	V647-H650 PolarHBondContact O-N 2.83Å; H650-G686 WeakPolarHBondContact CE1-CA 3.46Å; H650-G686 PolarHBondContact CE1-O 2.68Å; H650-G686 PolarHBondContact NE2-O 3.25Å; H650-N687 VanDerWaalsContact CE1-C 3.46Å; H650-N687 PolarHBondContact CE1-N 3.37Å; H650-N687 WeakPolarHBondContact NE2-CA 3.21Å; H650-N687 PolarHBondContact NE2-N 3.49Å; H650-N688 PolarHBondContact NE2-N 3.34Å
651	V	41.1	Very low	41.6	Very low	35 Å²	35	49.5 Å²	49.5	21%	0.212	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	136.3	-160	-153.6	0	0	0	0	111.1	H646 V647 F653	H646-V651 PolarHBondContact CE1-O 3.23Å; H646-V651 PolarHBondContact ND1-O 2.82Å; V647-V651 CarbonylContact C-O 3.55Å; V647-V651 WeakPolarHBondContact CA-O 3.25Å; V647-V651 HydrophobicContact CB-CB 4.14Å; V647-V651 WeakPolarHBondContact CB-O 3.17Å; V647-V651 HydrophobicContact CG1-CB 4.47Å; V647-V651 PolarHBondContact N-O 2.77Å; V647-V651 PolarHBondContact O-N 2.73Å; V647-V651 VanDerWaalsContact O-N 3.13Å; V647-V651 VanDerWaalsContact O-O 3.09Å; V651-F653 HydrophobicContact CB-CE1 4.31Å; V651-F653 HydrophobicContact CB-CZ 4.2Å; V651-F653 HydrophobicContact CG1-CD1 3.97Å; V651-F653 HydrophobicContact CG1-CE1 3.15Å; V651-F653 HydrophobicContact CG1-CE2 4.3Å; V651-F653 HydrophobicContact CG1-CZ 3.35Å
652	S	40.6	Very low	41	Very low	64 Å²	64	50.7 Å²	50.7	45%	0.448	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.6	-179	-31.9	0	0	0	0	108.4	H646	H646-S652 PolarHBondContact CD2-OG 2.83Å; H646-S652 PolarHBondContact CE1-OG 3.48Å; H646-S652 VanDerWaalsContact CE1-OG 3.25Å; H646-S652 WeakPolarHBondContact NE2-CB 3.46Å; H646-S652 PolarHBondContact NE2-OG 2.89Å
653	F	42.3	Very low	40.5	Very low	16 Å²	16	54 Å²	54	7%	0.07	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	153.4	-179.9	-57.2	-36.8	0	0	0	110.9	L644 I645 V647 V651 I678 M679 E680	L644-F653 CarbonylContact C-O 3.58Å; L644-F653 VanDerWaalsContact CA-O 3.27Å; L644-F653 WeakPolarHBondContact CA-O 3.35Å; I645-F653 HydrophobicContact CB-CB 4.05Å; I645-F653 HydrophobicContact CG2-CB 3.99Å; I645-F653 HydrophobicContact CG2-CD2 3.69Å; I645-F653 HydrophobicContact CG2-CG 4.28Å; I645-F653 PolarHBondContact N-O 3.4Å; I645-F653 PolarHBondContact O-N 2.62Å; V647-F653 HydrophobicContact CB-CD2 4.44Å; V647-F653 HydrophobicContact CB-CE2 4.19Å; V647-F653 HydrophobicContact CG1-CE2 4.44Å; V647-F653 HydrophobicContact CG2-CD2 3.53Å; V647-F653 HydrophobicContact CG2-CE2 3.6Å; V651-F653 HydrophobicContact CB-CE1 4.31Å; V651-F653 HydrophobicContact CB-CZ 4.2Å; V651-F653 HydrophobicContact CG1-CD1 3.97Å; V651-F653 HydrophobicContact CG1-CE1 3.15Å; V651-F653 HydrophobicContact CG1-CE2 4.3Å; V651-F653 HydrophobicContact CG1-CZ 3.35Å; F653-I678 HydrophobicContact CB-CG2 4.4Å; F653-M679 WeakPolarHBondContact CB-O 3.08Å; F653-E680 HydrophobicContact CD1-CB 3.59Å; F653-E680 HydrophobicContact CD1-CG 3.79Å; F653-E680 HydrophobicContact CD2-CB 4.31Å; F653-E680 HydrophobicContact CD2-CG 3.57Å; F653-E680 HydrophobicContact CE1-CB 3.36Å; F653-E680 HydrophobicContact CE1-CG 3.68Å; F653-E680 HydrophobicContact CE2-CB 4.16Å; F653-E680 HydrophobicContact CE2-CG 3.5Å; F653-E680 WeakPolarHBondContact CE2-OE1 3.43Å; F653-E680 HydrophobicContact CG-CB 4.06Å; F653-E680 HydrophobicContact CG-CG 3.74Å; F653-E680 HydrophobicContact CZ-CB 3.68Å; F653-E680 HydrophobicContact CZ-CG 3.54Å; F653-E680 WeakPolarHBondContact CZ-OE2 3.19Å
654	S	38.1	Very low	39.8	Very low	50 Å²	50	60.8 Å²	60.8	35%	0.35	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138.2	-170.6	-169.8	0	0	0	0	113	I643 I678 M679	I643-S654 CarbonylContact O-C 3.59Å; S654-I678 VanDerWaalsContact C-CG1 3.49Å; S654-I678 WeakPolarHBondContact O-CA 3.49Å; S654-M679 PolarHBondContact N-O 3.38Å; S654-M679 PolarHBondContact O-N 3.37Å
655	V	42.6	Very low	39.4	Very low	0 Å²	0	62.6 Å²	62.6	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	158.4	177.3	117.3	0	0	0	0	111.1	Y641 N642 I643 F657 V677 I678 L695	Y641-V655 WeakPolarHBondContact O-CG1 3.36Å; N642-V655 WeakPolarHBondContact CA-O 3.15Å; N642-V655 PolarHBondContact OD1-O 3.37Å; I643-V655 HydrophobicContact CB-CB 3.79Å; I643-V655 HydrophobicContact CB-CG1 3.57Å; I643-V655 HydrophobicContact CD1-CG1 4.07Å; I643-V655 HydrophobicContact CG1-CB 4.48Å; I643-V655 HydrophobicContact CG1-CG1 3.72Å; I643-V655 WeakPolarHBondContact O-CB 3.48Å; I643-V655 PolarHBondContact O-N 2.83Å; V655-F657 HydrophobicContact CG1-CD2 4.47Å; V655-V677 CarbonylContact C-O 3.19Å; V655-V677 VanDerWaalsContact CA-O 3.23Å; V655-V677 WeakPolarHBondContact CA-O 3.19Å; V655-V677 WeakPolarHBondContact CG2-O 3.36Å; V655-I678 HydrophobicContact CB-CB 4.5Å; V655-I678 HydrophobicContact CB-CD1 3.66Å; V655-I678 HydrophobicContact CB-CG1 3.82Å; V655-I678 HydrophobicContact CG2-CB 3.85Å; V655-I678 HydrophobicContact CG2-CD1 3.49Å; V655-I678 VanDerWaalsContact CG2-CD1 3.49Å; V655-I678 HydrophobicContact CG2-CG1 3.66Å; V655-I678 VanDerWaalsContact CG2-N 3.34Å; V655-L695 HydrophobicContact CG2-CD1 3.92Å; V655-L695 HydrophobicContact CG2-CD2 4Å
656	V	36.6	Very low	38.7	Very low	69 Å²	69	65 Å²	65	42%	0.418	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	113.8	152.1	-176.7	0	0	0	0	108.9	I640 L658 S676 V677	I640-V656 HydrophobicContact CG2-CG1 3.97Å; V656-L658 HydrophobicContact CG1-CG 4.41Å; V656-S676 WeakPolarHBondContact O-CA 3.26Å; V656-S676 VanDerWaalsContact O-CB 3.28Å; V656-S676 WeakPolarHBondContact O-CB 3.1Å; V656-V677 PolarHBondContact N-O 2.91Å; V656-V677 PolarHBondContact O-N 3.23Å; V656-V677 VanDerWaalsContact O-N 3.11Å
657	F	39.9	Very low	38.3	Very low	41 Å²	41	68.8 Å²	68.8	18%	0.18	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	136.3	161.3	-113	-71.3	0	0	0	106.8	Y641 I643 V655 A674 H675 S676	Y641-F657 HydrophobicContact CD2-CB 4.29Å; Y641-F657 HydrophobicContact CG-CB 4.22Å; Y641-F657 PolarHBondContact N-O 3.25Å; Y641-F657 PolarHBondContact O-N 3.38Å; I643-F657 HydrophobicContact CD1-CD2 3.59Å; I643-F657 HydrophobicContact CD1-CE2 3.7Å; V655-F657 HydrophobicContact CG1-CD2 4.47Å; F657-A674 HydrophobicContact CD1-CB 3.72Å; F657-A674 HydrophobicContact CE1-CB 3.62Å; F657-H675 CarbonylContact C-O 3.4Å; F657-H675 WeakPolarHBondContact CA-O 3.25Å; F657-H675 WeakPolarHBondContact CD1-O 3.41Å; F657-S676 VanDerWaalsContact CA-CB 3.49Å; F657-S676 WeakPolarHBondContact CD2-OG 3.47Å; F657-S676 WeakPolarHBondContact CE2-OG 3.43Å; F657-S676 WeakPolarHBondContact CZ-OG 3.31Å
658	L	33.3	Very low	37.4	Very low	97 Å²	97	68.2 Å²	68.2	51%	0.508	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	132.4	171.3	-87.2	165.1	0	0	0	110.5	I638 I640 V656 H675	I638-L658 HydrophobicContact CG2-CD2 3.42Å; I638-L658 VanDerWaalsContact CG2-CD2 3.42Å; I640-L658 HydrophobicContact CG1-CD2 4.09Å; V656-L658 HydrophobicContact CG1-CG 4.41Å; L658-H675 PolarHBondContact N-O 2.99Å
659	L	39.5	Very low	36.9	Very low	31 Å²	31	71.2 Å²	71.2	16%	0.162	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	126.7	172.9	-110	171.9	0	0	0	109.4	I639 Y641 A674	I639-L659 HydrophobicContact CB-CB 4.44Å; I639-L659 PolarHBondContact N-O 2.7Å; I639-L659 PolarHBondContact O-N 2.79Å; Y641-L659 HydrophobicContact CD2-CD1 4.44Å; Y641-L659 HydrophobicContact CE2-CB 4.44Å; Y641-L659 HydrophobicContact CE2-CD1 3.78Å; L659-A674 HydrophobicContact CD1-CB 3.61Å; L659-A674 HydrophobicContact CD2-CB 4.11Å; L659-A674 HydrophobicContact CG-CB 3.56Å
660	A	33.9	Very low	36.4	Very low	67 Å²	67	74.5 Å²	74.5	55%	0.554	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	128.3	171.6	0	0	0	0	0	109.2
661	Y	36.4	Very low	35.7	Very low	99 Å²	99	74.1 Å²	74.1	39%	0.388	41%	0.408	S	S	.	.			trans	-156.3	78.9	177.8	-151.2	-81.1	0	0	0	111.4	I663	Y661-I663 HydrophobicContact CD1-CD1 4.3Å; Y661-I663 HydrophobicContact CD1-CG1 3.86Å; Y661-I663 HydrophobicContact CE1-CG1 4.15Å
662	M	34.2	Very low	35.2	Very low	84 Å²	84	78.1 Å²	78.1	41%	0.414	43%	0.427	S	S	.	.			trans	-79.3	124.6	179	-119.4	-66.5	148.4	0	0	111.2	E636 E637	E636-M662 HydrophobicContact CB-CG 3.77Å; E636-M662 HydrophobicContact CG-CG 3.83Å; E637-M662 HydrophobicContact CB-CE 4.04Å; E637-M662 HydrophobicContact CG-CE 3.89Å
663	I	33.9	Very low	34.8	Very low	114 Å²	114	77 Å²	77	59%	0.585	42%	0.422	S	S	*	.			trans	-104.1	102.1	-174	-59.3	177.8	0	0	0	110.3	Y661	Y661-I663 HydrophobicContact CD1-CD1 4.3Å; Y661-I663 HydrophobicContact CD1-CG1 3.86Å; Y661-I663 HydrophobicContact CE1-CG1 4.15Å
664	N	32.5	Very low	34.2	Very low	147 Å²	147	77.9 Å²	77.9	79%	0.786	43%	0.432	S	S	*	.			trans	-155.1	156	160.8	-108.7	-53	0	0	0	111.9
665	V	36.3	Very low	33.8	Very low	112 Å²	112	82.9 Å²	82.9	68%	0.679	45%	0.45	S	S	*	.	S	Bend	trans	71	135.7	-175.9	-171.9	0	0	0	0	115.6	F586 L667	F586-V665 WeakPolarHBondContact CE2-O 3.29Å; V665-L667 PolarHBondContact O-N 2.67Å
666	K	31.5	Very low	33.3	Very low	76 Å²	76	84.5 Å²	84.5	33%	0.33	46%	0.461	S	S	.	.	S	Bend	trans	-77.1	78	177.2	-64.6	176	-177.2	175.3	0	111.7	Q579 L582 L583 F586	Q579-K666 PolarHBondContact O-NZ 3.47Å; L582-K666 HydrophobicContact CB-CD 4.01Å; L583-K666 HydrophobicContact CB-CD 4.29Å; L583-K666 HydrophobicContact CD1-CD 4.43Å; L583-K666 HydrophobicContact CD1-CG 4.27Å; F586-K666 HydrophobicContact CB-CB 4.25Å; F586-K666 HydrophobicContact CB-CG 4.48Å
667	L	34	Very low	33.1	Very low	138 Å²	138	85.7 Å²	85.7	72%	0.723	47%	0.468	S	S	*	.			trans	-149.7	114.9	169.2	-116.7	167.2	0	0	0	110.7	F586 V665	F586-L667 VanDerWaalsContact CD2-N 3.29Å; V665-L667 PolarHBondContact O-N 2.67Å
668	P	30.2	Very low	32.6	Very low	26 Å²	26	85.4 Å²	85.4	17%	0.169	47%	0.468	C	S	.	.			trans	-111.8	129.6	179.9	41.3	-33.6	0	0	0	112.4	L585 F586 A589 V590	L585-P668 WeakPolarHBondContact O-CG 3.39Å; F586-P668 HydrophobicContact CD2-CB 3.97Å; F586-P668 HydrophobicContact CD2-CG 4.26Å; F586-P668 HydrophobicContact CE2-CB 4.34Å; F586-P668 WeakPolarHBondContact O-CB 3.13Å; F586-P668 VanDerWaalsContact O-CG 3.27Å; F586-P668 WeakPolarHBondContact O-CG 3.38Å; A589-P668 HydrophobicContact CB-CB 3.77Å; A589-P668 HydrophobicContact CB-CG 3.88Å; A589-P668 WeakPolarHBondContact CB-O 3.34Å; V590-P668 HydrophobicContact CG2-CB 4.09Å
669	T	33.5	Very low	32.5	Very low	113 Å²	113	87.5 Å²	87.5	69%	0.693	48%	0.477	S	S	*	.			trans	-155.9	113.9	158.2	15.7	0	0	0	0	107.9
670	T	30.6	Very low	32.1	Very low	76 Å²	76	92.1 Å²	92.1	47%	0.466	50%	0.498	S	S	.	.			trans	53.3	113.2	146.2	56.4	0	0	0	0	120.4
671	K	28.5	Very low	31.9	Very low	102 Å²	102	95.4 Å²	95.4	44%	0.443	50%	0.502	S	S	.	.				82.1	85.7	114.5	-173.3	-179.1	-144.1	137.5	0	117.8	S593 D596	S593-K671 PolarHBondContact OG-N 3.23Å; D596-K671 HydrophobicContact CB-CB 4.07Å; D596-K671 HydrophobicContact CB-CD 3.86Å; D596-K671 HydrophobicContact CB-CG 3.73Å; D596-K671 VanDerWaalsContact CG-CE 3.43Å; D596-K671 IonicContact OD1-NZ 2.75Å; D596-K671 PolarHBondContact OD1-NZ 3.46Å; D596-K671 VanDerWaalsContact OD2-CD 3.3Å; D596-K671 WeakPolarHBondContact OD2-CD 3.42Å; D596-K671 WeakPolarHBondContact OD2-CE 3.14Å; D596-K671 IonicContact OD2-NZ 3.97Å; D596-K671 PolarHBondContact OD2-NZ 2.8Å
672	I	30.4	Very low	31.9	Very low	118 Å²	118	98 Å²	98	61%	0.605	52%	0.515	S	S	*	.			trans	-137.5	142.2	166	-59.2	-176.8	0	0	0	110.2	Q597	Q597-I672 WeakPolarHBondContact CG-O 3.36Å; Q597-I672 PolarHBondContact NE2-O 2.85Å
673	A	31.9	Very low	31.9	Very low	41 Å²	41	100.1 Å²	100.1	34%	0.339	53%	0.527	S	S	.	.			trans	-121.2	-177.7	-168.1	0	0	0	0	0	114.7	L600	L600-A673 HydrophobicContact CD1-CB 4.43Å
674	A	30.6	Very low	32	Very low	34 Å²	34	102.7 Å²	102.7	28%	0.281	54%	0.537	S	S	.	.			trans	-109.6	156.7	-171.2	0	0	0	0	0	114.1	F657 L659	F657-A674 HydrophobicContact CD1-CB 3.72Å; F657-A674 HydrophobicContact CE1-CB 3.62Å; L659-A674 HydrophobicContact CD1-CB 3.61Å; L659-A674 HydrophobicContact CD2-CB 4.11Å; L659-A674 HydrophobicContact CG-CB 3.56Å
675	H	30.1	Very low	32.1	Very low	155 Å²	155	103.9 Å²	103.9	72%	0.718	54%	0.537	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.2	145.4	174	-77.6	77.8	0	0	0	113.6	F657 L658	F657-H675 CarbonylContact C-O 3.4Å; F657-H675 WeakPolarHBondContact CA-O 3.25Å; F657-H675 WeakPolarHBondContact CD1-O 3.41Å; L658-H675 PolarHBondContact N-O 2.99Å
676	S	32.3	Very low	31.8	Very low	34 Å²	34	101.4 Å²	101.4	24%	0.238	53%	0.534	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	165.7	172.5	59.7	0	0	0	0	118.5	V656 F657	V656-S676 WeakPolarHBondContact O-CA 3.26Å; V656-S676 VanDerWaalsContact O-CB 3.28Å; V656-S676 WeakPolarHBondContact O-CB 3.1Å; F657-S676 VanDerWaalsContact CA-CB 3.49Å; F657-S676 WeakPolarHBondContact CD2-OG 3.47Å; F657-S676 WeakPolarHBondContact CE2-OG 3.43Å; F657-S676 WeakPolarHBondContact CZ-OG 3.31Å
677	V	31	Very low	31.9	Very low	94 Å²	94	104.2 Å²	104.2	57%	0.57	55%	0.553	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-137.7	120	-179	178.7	0	0	0	0	110.1	V655 V656	V655-V677 CarbonylContact C-O 3.19Å; V655-V677 VanDerWaalsContact CA-O 3.23Å; V655-V677 WeakPolarHBondContact CA-O 3.19Å; V655-V677 WeakPolarHBondContact CG2-O 3.36Å; V656-V677 PolarHBondContact N-O 2.91Å; V656-V677 PolarHBondContact O-N 3.23Å; V656-V677 VanDerWaalsContact O-N 3.11Å
678	I	30.4	Very low	31.8	Very low	36 Å²	36	103.1 Å²	103.1	19%	0.185	55%	0.548	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	142.5	167.3	-119.3	123.7	0	0	0	109.1	I643 I645 F653 S654 V655 L695	I643-I678 HydrophobicContact CG2-CD1 4.5Å; I645-I678 HydrophobicContact CB-CD1 3.67Å; I645-I678 HydrophobicContact CB-CG1 4.06Å; I645-I678 HydrophobicContact CD1-CB 4.27Å; I645-I678 HydrophobicContact CD1-CD1 3.5Å; I645-I678 VanDerWaalsContact CD1-CD1 3.5Å; I645-I678 HydrophobicContact CD1-CG1 4.09Å; I645-I678 HydrophobicContact CD1-CG2 4.03Å; I645-I678 HydrophobicContact CG1-CD1 3.41Å; I645-I678 VanDerWaalsContact CG1-CD1 3.41Å; I645-I678 HydrophobicContact CG1-CG1 4.21Å; F653-I678 HydrophobicContact CB-CG2 4.4Å; S654-I678 VanDerWaalsContact C-CG1 3.49Å; S654-I678 WeakPolarHBondContact O-CA 3.49Å; V655-I678 HydrophobicContact CB-CB 4.5Å; V655-I678 HydrophobicContact CB-CD1 3.66Å; V655-I678 HydrophobicContact CB-CG1 3.82Å; V655-I678 HydrophobicContact CG2-CB 3.85Å; V655-I678 HydrophobicContact CG2-CD1 3.49Å; V655-I678 VanDerWaalsContact CG2-CD1 3.49Å; V655-I678 HydrophobicContact CG2-CG1 3.66Å; V655-I678 VanDerWaalsContact CG2-N 3.34Å; I678-L695 HydrophobicContact CD1-CD1 4.35Å; I678-L695 HydrophobicContact CD1-CD2 4.26Å; I678-L695 HydrophobicContact CD1-CG 4.5Å
679	M	31	Very low	32	Very low	141 Å²	141	108.4 Å²	108.4	70%	0.695	57%	0.57	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-128.2	151.1	168.7	-86.9	-69.2	-174.4	0	0	112.1	F653 S654	F653-M679 WeakPolarHBondContact CB-O 3.08Å; S654-M679 PolarHBondContact N-O 3.38Å; S654-M679 PolarHBondContact O-N 3.37Å
680	E	30	Very low	32	Very low	127 Å²	127	108.5 Å²	108.5	59%	0.593	56%	0.559	S	S	*	*			trans	-107.4	150.4	-174.3	-54.4	-162.8	166.2	0	0	111.5	F653	F653-E680 HydrophobicContact CD1-CB 3.59Å; F653-E680 HydrophobicContact CD1-CG 3.79Å; F653-E680 HydrophobicContact CD2-CB 4.31Å; F653-E680 HydrophobicContact CD2-CG 3.57Å; F653-E680 HydrophobicContact CE1-CB 3.36Å; F653-E680 HydrophobicContact CE1-CG 3.68Å; F653-E680 HydrophobicContact CE2-CB 4.16Å; F653-E680 HydrophobicContact CE2-CG 3.5Å; F653-E680 WeakPolarHBondContact CE2-OE1 3.43Å; F653-E680 HydrophobicContact CG-CB 4.06Å; F653-E680 HydrophobicContact CG-CG 3.74Å; F653-E680 HydrophobicContact CZ-CB 3.68Å; F653-E680 HydrophobicContact CZ-CG 3.54Å; F653-E680 WeakPolarHBondContact CZ-OE2 3.19Å
681	E	31.7	Very low	31.8	Very low	137 Å²	137	107.7 Å²	107.7	64%	0.64	55%	0.551	S	S	*	*				-174.3	130.9	127.9	-103.4	-172.6	159.5	0	0	115.1
682	K	35.7	Very low	32.2	Very low	154 Å²	154	105.3 Å²	105.3	67%	0.67	54%	0.542	S	S	*	.			trans	42.1	149.1	134	-64	165.7	-171.7	165.7	0	122.1
683	L	32.9	Very low	32.1	Very low	128 Å²	128	100.1 Å²	100.1	67%	0.67	52%	0.515	S	S	*	.			cis	171.4	131.4	-29	-123.1	166.4	0	0	0	107.6
684	Q	36.6	Very low	32.3	Very low	167 Å²	167	99.7 Å²	99.7	78%	0.78	51%	0.507	S	S	*	.			trans	169.7	130.6	131.9	-94.7	171.4	19.5	0	0	114
685	H	34	Very low	32.4	Very low	172 Å²	172	101 Å²	101	80%	0.796	51%	0.508	S	S	*	.			trans	69.5	128.8	160.7	-65.3	14.8	0	0	0	119.8
686	G	31.2	Very low	32.5	Very low	60 Å²	60	98.3 Å²	98.3	62%	0.619	50%	0.498	S	S	*	.			trans	125.3	48.3	148.9	0	0	0	0	0	120.5	H650	H650-G686 WeakPolarHBondContact CE1-CA 3.46Å; H650-G686 PolarHBondContact CE1-O 2.68Å; H650-G686 PolarHBondContact NE2-O 3.25Å
687	N	34	Very low	32.5	Very low	135 Å²	135	101.6 Å²	101.6	72%	0.722	51%	0.512	S	S	*	.			trans	31.3	111	174.6	-63.5	-11.1	0	0	0	122.1	H650	H650-N687 VanDerWaalsContact CE1-C 3.46Å; H650-N687 PolarHBondContact CE1-N 3.37Å; H650-N687 WeakPolarHBondContact NE2-CA 3.21Å; H650-N687 PolarHBondContact NE2-N 3.49Å
688	N	30.7	Very low	32.6	Very low	116 Å²	116	102.1 Å²	102.1	62%	0.62	51%	0.509	S	S	*	.				131.1	150.1	127.2	-73.1	-32.2	0	0	0	118.8	G649 H650	G649-N688 CarbonylContact C-O 3.58Å; G649-N688 WeakPolarHBondContact CA-O 3.48Å; G649-N688 CarbonylContact O-C 3.58Å; G649-N688 PolarHBondContact O-N 3.45Å; H650-N688 PolarHBondContact NE2-N 3.34Å
689	H	35.4	Very low	32.7	Very low	136 Å²	136	105.9 Å²	105.9	63%	0.63	53%	0.528	S	S	*	.			trans	-12.4	142.3	173.7	-59.2	-61.8	0	0	0	119.6
690	Y	32.9	Very low	32.8	Very low	115 Å²	115	103.8 Å²	103.8	45%	0.451	52%	0.517	S	S	.	.			cis	-148.2	-143.4	8.6	-134	-35.2	0	0	0	110.1	H646 V647 G648 G649	H646-Y690 PolarHBondContact ND1-O 3.35Å; V647-Y690 CarbonylContact C-O 3.58Å; G648-Y690 PolarHBondContact N-O 2.73Å; G649-Y690 PolarHBondContact N-O 2.7Å
691	L	27.8	Very low	33	Very low	59 Å²	59	102.2 Å²	102.2	31%	0.309	51%	0.512	S	S	.	.	B	Isolated β-bridge	cis	-123.7	-132.6	0.3	-71.2	73.5	0	0	0	108.6	H646 V647 G648	H646-L691 HydrophobicContact CB-CB 4.01Å; H646-L691 HydrophobicContact CB-CD1 3.91Å; H646-L691 HydrophobicContact CB-CG 4.48Å; H646-L691 CarbonylContact O-C 3.5Å; V647-L691 CarbonylContact C-O 3.58Å; V647-L691 VanDerWaalsContact CA-O 3.31Å; V647-L691 WeakPolarHBondContact CA-O 3.18Å; G648-L691 PolarHBondContact N-O 3.29Å
692	Q	35.9	Very low	33.1	Very low	52 Å²	52	99.7 Å²	99.7	24%	0.243	50%	0.503	C	S	.	.			trans	-168.5	146.2	164.4	-159.6	-178.4	16.7	0	0	105.5	I619 N620 H646	I619-Q692 HydrophobicContact CB-CG 4.34Å; I619-Q692 HydrophobicContact CG1-CG 3.98Å; I619-Q692 VanDerWaalsContact CG1-OE1 3.23Å; I619-Q692 HydrophobicContact CG2-CB 4.31Å; I619-Q692 HydrophobicContact CG2-CG 4.01Å; N620-Q692 CarbonylContact C-O 3.5Å; N620-Q692 VanDerWaalsContact CA-O 3.22Å; N620-Q692 WeakPolarHBondContact CA-O 3.28Å; N620-Q692 WeakPolarHBondContact CB-O 3.36Å; N620-Q692 PolarHBondContact N-O 3.2Å; H646-Q692 WeakPolarHBondContact O-CA 3.46Å; H646-Q692 PolarHBondContact O-N 2.83Å
693	L	27.4	Very low	32.9	Very low	10 Å²	10	95.5 Å²	95.5	5%	0.052	49%	0.49	C	S	.	.			trans	-133.6	144	-178	-92.3	76.9	0	0	0	111.2	I619 N620 L621 F622 I643 L644 I645	I619-L693 VanDerWaalsContact CG2-O 3.22Å; I619-L693 WeakPolarHBondContact CG2-O 3.43Å; N620-L693 WeakPolarHBondContact O-CD1 3.31Å; N620-L693 VanDerWaalsContact O-CG 3.25Å; N620-L693 WeakPolarHBondContact O-CG 3.49Å; L621-L693 HydrophobicContact CD1-CB 4.06Å; L621-L693 HydrophobicContact CD1-CD2 3.81Å; L621-L693 HydrophobicContact CD1-CG 4.17Å; F622-L693 HydrophobicContact CB-CD1 4.12Å; F622-L693 HydrophobicContact CB-CD2 4.41Å; F622-L693 HydrophobicContact CB-CG 4.25Å; F622-L693 VanDerWaalsContact N-CG 3.35Å; F622-L693 VanDerWaalsContact O-CD2 3.29Å; F622-L693 WeakPolarHBondContact O-CD2 3.44Å; I643-L693 HydrophobicContact CG2-CD2 3.74Å; L644-L693 WeakPolarHBondContact O-CD1 3.39Å; L644-L693 WeakPolarHBondContact O-CD2 3.36Å; I645-L693 HydrophobicContact CB-CB 4.26Å; I645-L693 HydrophobicContact CD1-CB 4.37Å; I645-L693 VanDerWaalsContact CD1-O 3.32Å; I645-L693 WeakPolarHBondContact CD1-O 3.22Å; I645-L693 HydrophobicContact CG1-CB 3.35Å; I645-L693 HydrophobicContact CG1-CG 4.46Å
694	I	36.3	Very low	32.9	Very low	31 Å²	31	92.8 Å²	92.8	16%	0.159	48%	0.475	C	S	.	.			trans	-119.3	112.1	-179.2	-127.8	175	0	0	0	108.3	L608 I619 L621	L608-I694 HydrophobicContact CB-CD1 4.26Å; L608-I694 HydrophobicContact CB-CG2 4.28Å; L608-I694 HydrophobicContact CD2-CD1 4.12Å; L608-I694 HydrophobicContact CD2-CG1 3.87Å; L608-I694 HydrophobicContact CD2-CG2 4.33Å; I619-I694 HydrophobicContact CB-CB 4.12Å; I619-I694 HydrophobicContact CB-CD1 4.2Å; I619-I694 HydrophobicContact CB-CG1 4.25Å; I619-I694 HydrophobicContact CD1-CD1 3.39Å; I619-I694 HydrophobicContact CD1-CG1 3.87Å; I619-I694 HydrophobicContact CG1-CD1 4.36Å; I619-I694 HydrophobicContact CG2-CB 3.4Å; I619-I694 VanDerWaalsContact CG2-CB 3.4Å; I619-I694 HydrophobicContact CG2-CD1 4.27Å; I619-I694 HydrophobicContact CG2-CG1 3.76Å; L621-I694 VanDerWaalsContact CB-O 3.28Å; L621-I694 WeakPolarHBondContact CB-O 3.4Å; L621-I694 WeakPolarHBondContact CD1-O 3.37Å; L621-I694 WeakPolarHBondContact CD2-O 3.41Å; L621-I694 WeakPolarHBondContact CG-O 3.34Å
695	L	33.2	Very low	32.6	Very low	61 Å²	61	86.1 Å²	86.1	32%	0.319	45%	0.447	S	S	.	.			trans	-62.8	0	-179.8	-66.8	168.7	0	0	0	110.5	L608 I643 V655 I678	L608-L695 WeakPolarHBondContact CD1-O 3.47Å; L608-L695 VanDerWaalsContact CD2-O 3.25Å; L608-L695 WeakPolarHBondContact CD2-O 3.49Å; I643-L695 HydrophobicContact CB-CD2 4.23Å; I643-L695 HydrophobicContact CD1-CD2 3.46Å; I643-L695 VanDerWaalsContact CD1-CD2 3.46Å; I643-L695 HydrophobicContact CG1-CD2 4.43Å; I643-L695 HydrophobicContact CG2-CD2 4.04Å; V655-L695 HydrophobicContact CG2-CD1 3.92Å; V655-L695 HydrophobicContact CG2-CD2 4Å; I678-L695 HydrophobicContact CD1-CD1 4.35Å; I678-L695 HydrophobicContact CD1-CD2 4.26Å; I678-L695 HydrophobicContact CD1-CG 4.5Å

Retrieved 695 of 695 residues in 149.5 ms (Link to these results)

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