A0A5K4F256_SCHMA Loading...

Decaprenyl-diphosphate synthase subunit 1

AlphaFold DB , UniProt , Accession A0A5K4F256, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 380 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	23.8	Very low	20.9	Very low	232 Å²	232	165.5 Å²	165.5	100%	1.143	80%	0.802	S	S	*	*				0	86.2	0	-157.7	178.3	101.9	0	0	107.7
2	V	22.8	Very low	21.1	Very low	112 Å²	112	162.3 Å²	162.3	68%	0.679	79%	0.79	S	S	*	*			trans	-133.1	102.2	172	-177.3	0	0	0	0	105.7	F4	V2-F4 HydrophobicContact CB-CE2 4.37Å; V2-F4 HydrophobicContact CG1-CD2 3.79Å; V2-F4 HydrophobicContact CG1-CE2 3.35Å; V2-F4 HydrophobicContact CG1-CZ 3.85Å
3	V	19.6	Very low	21.2	Very low	124 Å²	124	164.2 Å²	164.2	75%	0.752	79%	0.792	S	S	*	*			trans	-85.9	104.5	179.8	175.5	0	0	0	0	106.5	H5	V3-H5 PolarHBondContact O-N 3.42Å
4	F	21.5	Very low	21.4	Very low	172 Å²	172	163.6 Å²	163.6	75%	0.754	80%	0.795	S	S	*	*			trans	-86.8	106.2	171.7	-81.5	-76.3	0	0	0	109.7	V2	V2-F4 HydrophobicContact CB-CE2 4.37Å; V2-F4 HydrophobicContact CG1-CD2 3.79Å; V2-F4 HydrophobicContact CG1-CE2 3.35Å; V2-F4 HydrophobicContact CG1-CZ 3.85Å
5	H	18.2	Very low	21.7	Very low	167 Å²	167	159 Å²	159	77%	0.773	79%	0.794	S	S	*	*			trans	-85.1	103.7	172.7	-149.3	79.6	0	0	0	108	V3	V3-H5 PolarHBondContact O-N 3.42Å
6	W	19	Very low	21.7	Very low	209 Å²	209	154.3 Å²	154.3	79%	0.792	80%	0.799	S	S	*	*			trans	-123.8	84.4	169.4	-92.6	56.8	0	0	0	109.3	L8	W6-L8 HydrophobicContact CD2-CD1 4.3Å; W6-L8 HydrophobicContact CE3-CD1 3.81Å; W6-L8 HydrophobicContact CH2-CD1 4.32Å; W6-L8 HydrophobicContact CZ3-CD1 3.82Å
7	A	19	Very low	22.1	Very low	81 Å²	81	152.2 Å²	152.2	67%	0.669	79%	0.794	S	S	*	*			trans	-99.5	79.4	157.7	0	0	0	0	0	107.2	T9	A7-T9 PolarHBondContact O-N 3.15Å; A7-T9 VanDerWaalsContact O-N 3.11Å
8	L	21.7	Very low	22.2	Very low	140 Å²	140	155.3 Å²	155.3	73%	0.733	80%	0.8	S	S	*	*			trans	-79.3	96.3	171.6	-128.4	106	0	0	0	108.2	W6	W6-L8 HydrophobicContact CD2-CD1 4.3Å; W6-L8 HydrophobicContact CE3-CD1 3.81Å; W6-L8 HydrophobicContact CH2-CD1 4.32Å; W6-L8 HydrophobicContact CZ3-CD1 3.82Å
9	T	22.2	Very low	22.4	Very low	121 Å²	121	159.8 Å²	159.8	74%	0.742	81%	0.806	S	S	*	*			trans	-62.9	135.1	168.9	16.5	0	0	0	0	109.7	A7 R11	A7-T9 PolarHBondContact O-N 3.15Å; A7-T9 VanDerWaalsContact O-N 3.11Å; T9-R11 PolarHBondContact O-N 2.85Å; T9-R11 VanDerWaalsContact O-N 3.11Å
10	Y	20.9	Very low	22.9	Very low	219 Å²	219	159 Å²	159	86%	0.859	80%	0.803	S	S	*	*			trans	-38.9	111	169.5	-78.7	-98.3	0	0	0	112.6
11	R	21.4	Very low	23.1	Very low	244 Å²	244	156.9 Å²	156.9	92%	0.921	80%	0.799	S	S	*	*			trans	-124.7	97.6	150.3	-75	-167.2	-168.6	-168.3	4.5	108.4	T9	T9-R11 PolarHBondContact O-N 2.85Å; T9-R11 VanDerWaalsContact O-N 3.11Å
12	L	22.7	Very low	23.5	Very low	127 Å²	127	152.9 Å²	152.9	67%	0.665	78%	0.777	S	S	*	*			trans	-54.9	132.3	153.9	-68.7	157.7	0	0	0	107.4
13	F	23.2	Very low	23.9	Very low	186 Å²	186	151.9 Å²	151.9	82%	0.816	78%	0.775	S	S	*	*			trans	136.7	123.5	153.7	-78.9	-74.2	0	0	0	114.1
14	D	23.1	Very low	24.9	Very low	156 Å²	156	146.6 Å²	146.6	83%	0.834	74%	0.743	S	S	*	*			trans	64.9	100.8	156.9	-71.2	-21.9	0	0	0	120.9
15	A	26.2	Very low	25.6	Very low	95 Å²	95	141 Å²	141	79%	0.785	72%	0.723	S	S	*	*			trans	-153.6	130.6	131.5	0	0	0	0	0	110	V17	A15-V17 PolarHBondContact O-N 3.06Å
16	G	22.3	Very low	26.5	Very low	84 Å²	84	140.8 Å²	140.8	87%	0.866	72%	0.717	S	S	*	*			trans	-72.4	120.9	-169.3	0	0	0	0	0	114.8
17	V	27.8	Very low	27.4	Very low	118 Å²	118	136.5 Å²	136.5	72%	0.715	71%	0.709	S	S	*	*			trans	-124	136.9	158.4	-179.5	0	0	0	0	108.7	A15 R19	A15-V17 PolarHBondContact O-N 3.06Å; V17-R19 PolarHBondContact O-N 3.02Å
18	K	25.1	Very low	28.5	Very low	209 Å²	209	133.6 Å²	133.6	91%	0.909	68%	0.684	S	S	*	*			trans	-46.7	127.8	-169.6	-75.6	175.2	175.4	174.6	0	113.1	L20	K18-L20 PolarHBondContact O-N 3.26Å
19	R	25.1	Very low	29.4	Very low	240 Å²	240	135.8 Å²	135.8	91%	0.906	68%	0.682	S	S	*	*			trans	-63.3	112.7	-176.4	-63.4	177	-171.6	-170	1.3	111.3	V17	V17-R19 PolarHBondContact O-N 3.02Å
20	L	31.8	Very low	30.6	Very low	143 Å²	143	136.4 Å²	136.4	75%	0.749	68%	0.68	S	S	*	*			trans	-76.1	120.6	153.9	-77.1	167.7	0	0	0	108.3	K18	K18-L20 PolarHBondContact O-N 3.26Å
21	T	28.8	Very low	32.1	Very low	116 Å²	116	127.5 Å²	127.5	71%	0.712	65%	0.649	S	S	*	*			trans	-72.9	113.5	166.4	47.1	0	0	0	0	108.3
22	H	32	Very low	34	Very low	148 Å²	148	118.6 Å²	118.6	69%	0.685	62%	0.62	S	S	*	*			trans	-170	145	146	-94.9	-64	0	0	0	110.3	S24	H22-S24 PolarHBondContact O-N 3.18Å
23	S	29.9	Very low	35.8	Very low	90 Å²	90	119.6 Å²	119.6	63%	0.629	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-63.5	-8.1	-157.8	-29.1	0	0	0	0	116.7	V25 Y26	S23-V25 VanDerWaalsContact C-N 3.31Å; S23-V25 PolarHBondContact O-N 2.93Å; S23-Y26 PolarHBondContact O-N 2.65Å
24	S	40.2	Very low	37.8	Very low	13 Å²	13	114.9 Å²	114.9	9%	0.091	60%	0.604	C	S	.	*	G	3₁₀ helix	trans	-69	-27.7	-177.4	58.7	0	0	0	0	113.5	H22 Y26 E346	H22-S24 PolarHBondContact O-N 3.18Å; S24-Y26 VanDerWaalsContact C-N 3.27Å; S24-Y26 PolarHBondContact O-N 3.33Å; S24-E346 WeakPolarHBondContact CB-OE1 3.4Å; S24-E346 PolarHBondContact OG-OE1 3.49Å
25	V	38	Very low	40.3	Very low	56 Å²	56	107.6 Å²	107.6	34%	0.339	57%	0.565	S	S	.	*	G	3₁₀ helix	trans	-70.3	-22.1	177.4	-177	0	0	0	0	112	S23 L27 S28	S23-V25 VanDerWaalsContact C-N 3.31Å; S23-V25 PolarHBondContact O-N 2.93Å; V25-L27 VanDerWaalsContact C-N 3.27Å; V25-L27 PolarHBondContact O-N 3.36Å; V25-S28 PolarHBondContact O-N 3.16Å; V25-S28 PolarHBondContact O-OG 2.78Å
26	Y	35.7	Very low	43.1	Very low	162 Å²	162	108.5 Å²	108.5	64%	0.635	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-67.7	-24.4	-175.6	-92.5	-87.1	0	0	0	113.8	S23 S24	S23-Y26 PolarHBondContact O-N 2.65Å; S24-Y26 VanDerWaalsContact C-N 3.27Å; S24-Y26 PolarHBondContact O-N 3.33Å
27	L	37.7	Very low	46.2	Very low	119 Å²	119	109.3 Å²	109.3	62%	0.623	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-92.1	-8.2	-178.7	-75.4	162.1	0	0	0	114.1	V25 R29 F357	V25-L27 VanDerWaalsContact C-N 3.27Å; V25-L27 PolarHBondContact O-N 3.36Å; L27-R29 VanDerWaalsContact C-N 3.34Å; L27-F357 HydrophobicContact CD1-CE2 4.27Å; L27-F357 HydrophobicContact CD1-CZ 3.69Å
28	S	43	Very low	49.2	Very low	20 Å²	20	104.1 Å²	104.1	14%	0.14	50%	0.501	C	S	.	.	G	3₁₀ helix	trans	-92.4	12.7	173.6	72.1	0	0	0	0	113.5	V25 L30	V25-S28 PolarHBondContact O-N 3.16Å; V25-S28 PolarHBondContact O-OG 2.78Å; S28-L30 PolarHBondContact O-N 3.3Å
29	R	39.9	Very low	52.3	Low	185 Å²	185	95.4 Å²	95.4	70%	0.698	46%	0.464	S	S	*	.	S	Bend	trans	-53.1	138.7	170.8	-78.1	-174	178.3	-176.2	-0.2	108.8	L27	L27-R29 VanDerWaalsContact C-N 3.34Å
30	L	48.7	Very low	55.5	Low	134 Å²	134	88.5 Å²	88.5	70%	0.702	44%	0.442	S	S	*	.			trans	-22.5	132.9	-173	-66.8	161.7	0	0	0	113.6	S28 D32	S28-L30 PolarHBondContact O-N 3.3Å; L30-D32 PolarHBondContact O-N 3.41Å
31	P	51.2	Low	58.3	Low	33 Å²	33	82.6 Å²	82.6	21%	0.214	41%	0.411	C	S	.	.			trans	-50	133.9	176.7	19.5	-28.8	0	0	0	108.8	S35 K36 H370	P31-S35 VanDerWaalsContact CA-OG 3.31Å; P31-S35 WeakPolarHBondContact CA-OG 3.36Å; P31-S35 WeakPolarHBondContact CB-OG 3.31Å; P31-K36 HydrophobicContact CB-CB 4.34Å; P31-K36 HydrophobicContact CG-CB 4.28Å; P31-H370 VanDerWaalsContact CD-CE1 3.48Å; P31-H370 WeakPolarHBondContact CD-CE1 3.29Å
32	D	61.3	Low	61.4	Low	57 Å²	57	77.1 Å²	77.1	31%	0.305	38%	0.378	S	S	.	.			trans	-53.7	156.6	165.5	56	26.3	0	0	0	109	L30 D34 S35 K36 K366	L30-D32 PolarHBondContact O-N 3.41Å; D32-D34 PolarHBondContact O-N 3.04Å; D32-S35 PolarHBondContact N-OG 3.13Å; D32-S35 VanDerWaalsContact N-OG 3.1Å; D32-S35 PolarHBondContact O-N 3.1Å; D32-S35 VanDerWaalsContact O-N 3.11Å; D32-S35 PolarHBondContact O-OG 3.42Å; D32-S35 WeakPolarHBondContact OD1-CB 3.48Å; D32-S35 PolarHBondContact OD1-N 3.09Å; D32-S35 PolarHBondContact OD1-OG 2.57Å; D32-K36 PolarHBondContact O-N 3.03Å; D32-K36 VanDerWaalsContact O-N 3.09Å; D32-K366 WeakPolarHBondContact OD2-CD 3.34Å; D32-K366 IonicContact OD2-NZ 3.88Å; D32-K366 PolarHBondContact OD2-NZ 3.04Å
33	H	61.6	Low	64.2	Low	148 Å²	148	73.2 Å²	73.2	69%	0.685	36%	0.361	S	S	*	.	H	α-helix	trans	-49.9	-38.4	-173.3	-179.5	-83.4	0	0	0	112	K36 E37	H33-K36 WeakPolarHBondContact O-CB 3.43Å; H33-K36 PolarHBondContact O-N 3.01Å; H33-E37 PolarHBondContact O-N 2.99Å
34	D	64.1	Low	67.1	Low	87 Å²	87	73.9 Å²	73.9	47%	0.465	35%	0.353	S	S	.	.	H	α-helix	trans	-77.7	-36	-175.6	-52.2	-25	0	0	0	112.8	D32 K36 E37 L38 L363	D32-D34 PolarHBondContact O-N 3.04Å; D34-K36 VanDerWaalsContact C-N 3.26Å; D34-K36 PolarHBondContact O-N 2.87Å; D34-E37 PolarHBondContact O-N 2.86Å; D34-L38 PolarHBondContact O-N 3.26Å; D34-L38 VanDerWaalsContact O-N 3.09Å; D34-L363 HydrophobicContact CB-CD1 3.49Å; D34-L363 VanDerWaalsContact CB-CD1 3.49Å; D34-L363 HydrophobicContact CB-CD2 3.73Å; D34-L363 HydrophobicContact CB-CG 4.24Å
35	S	76.5	Confident	69.5	Low	2 Å²	2	73.3 Å²	73.3	1%	0.014	35%	0.349	C	S	.	.	H	α-helix	trans	-69.2	-25.7	171.9	57.3	0	0	0	0	112.5	P31 D32 L39	P31-S35 VanDerWaalsContact CA-OG 3.31Å; P31-S35 WeakPolarHBondContact CA-OG 3.36Å; P31-S35 WeakPolarHBondContact CB-OG 3.31Å; D32-S35 PolarHBondContact N-OG 3.13Å; D32-S35 VanDerWaalsContact N-OG 3.1Å; D32-S35 PolarHBondContact O-N 3.1Å; D32-S35 VanDerWaalsContact O-N 3.11Å; D32-S35 PolarHBondContact O-OG 3.42Å; D32-S35 WeakPolarHBondContact OD1-CB 3.48Å; D32-S35 PolarHBondContact OD1-N 3.09Å; D32-S35 PolarHBondContact OD1-OG 2.57Å; S35-L39 WeakPolarHBondContact O-CB 3.39Å; S35-L39 PolarHBondContact O-N 3.39Å
36	K	83.6	Confident	71.9	Confident	114 Å²	114	71.1 Å²	71.1	50%	0.496	34%	0.335	S	S	.	.	H	α-helix	trans	-67.3	-42.6	171.8	-173.1	-177.3	177.6	-175.6	0	111.6	P31 D32 H33 D34 L39 Q40	P31-K36 HydrophobicContact CB-CB 4.34Å; P31-K36 HydrophobicContact CG-CB 4.28Å; D32-K36 PolarHBondContact O-N 3.03Å; D32-K36 VanDerWaalsContact O-N 3.09Å; H33-K36 WeakPolarHBondContact O-CB 3.43Å; H33-K36 PolarHBondContact O-N 3.01Å; D34-K36 VanDerWaalsContact C-N 3.26Å; D34-K36 PolarHBondContact O-N 2.87Å; K36-L39 PolarHBondContact O-N 3.11Å; K36-Q40 WeakPolarHBondContact O-CG 3.06Å; K36-Q40 PolarHBondContact O-N 3.09Å
37	E	88.1	Confident	74.3	Confident	102 Å²	102	69.8 Å²	69.8	48%	0.477	34%	0.335	S	S	.	.	H	α-helix	trans	-64	-45.7	175.8	-174.9	177.9	173.8	0	0	111.4	H33 D34 L39 Q40 N41	H33-E37 PolarHBondContact O-N 2.99Å; D34-E37 PolarHBondContact O-N 2.86Å; E37-L39 VanDerWaalsContact C-N 3.3Å; E37-L39 PolarHBondContact O-N 3.09Å; E37-Q40 WeakPolarHBondContact O-CB 3.37Å; E37-Q40 PolarHBondContact O-N 3.14Å; E37-Q40 VanDerWaalsContact O-N 3.14Å; E37-N41 PolarHBondContact O-N 3.32Å
38	L	90.7	Very high	76.6	Confident	8 Å²	8	65.8 Å²	65.8	4%	0.042	31%	0.314	C	S	.	.	H	α-helix	trans	-57	-44.7	175.2	-172.5	155.9	0	0	0	111.4	D34 N41 A42 L86 L116 L119 L363 A367	D34-L38 PolarHBondContact O-N 3.26Å; D34-L38 VanDerWaalsContact O-N 3.09Å; L38-N41 PolarHBondContact O-N 2.94Å; L38-A42 PolarHBondContact O-N 3.34Å; L38-L86 HydrophobicContact CD2-CD2 3.37Å; L38-L116 HydrophobicContact CG-CD2 4.35Å; L38-L119 HydrophobicContact CD1-CD2 4.01Å; L38-L363 HydrophobicContact CD1-CB 4.04Å; L38-A367 HydrophobicContact CD2-CB 3.79Å
39	L	90.8	Very high	78.8	Confident	26 Å²	26	64.8 Å²	64.8	14%	0.136	31%	0.307	C	S	.	.	H	α-helix	trans	-63.7	-40.5	176.9	-179.2	59.5	0	0	0	112.2	S35 K36 E37 N41 A42 L43 L82 L86 V371	S35-L39 WeakPolarHBondContact O-CB 3.39Å; S35-L39 PolarHBondContact O-N 3.39Å; K36-L39 PolarHBondContact O-N 3.11Å; E37-L39 VanDerWaalsContact C-N 3.3Å; E37-L39 PolarHBondContact O-N 3.09Å; L39-N41 VanDerWaalsContact C-N 3.32Å; L39-N41 PolarHBondContact O-N 2.97Å; L39-A42 PolarHBondContact O-N 2.97Å; L39-L43 HydrophobicContact CD1-CG 4.46Å; L39-L43 HydrophobicContact CG-CD1 4.29Å; L39-L43 VanDerWaalsContact O-CG 3.27Å; L39-L43 WeakPolarHBondContact O-CG 3.08Å; L39-L43 PolarHBondContact O-N 3.4Å; L39-L82 HydrophobicContact CD1-CD1 4.21Å; L39-L82 HydrophobicContact CD1-CD2 4.41Å; L39-L86 HydrophobicContact CD1-CD1 4.3Å; L39-V371 HydrophobicContact CD1-CG2 3.49Å; L39-V371 VanDerWaalsContact CD1-CG2 3.49Å; L39-V371 HydrophobicContact CD2-CG2 4.36Å
40	Q	91.5	Very high	81	Confident	95 Å²	95	56.9 Å²	56.9	44%	0.444	28%	0.279	S	S	.	.	H	α-helix	trans	-62.3	-41.2	175.1	-74.5	175.7	-7.2	0	0	111.8	K36 E37 L43 K44	K36-Q40 WeakPolarHBondContact O-CG 3.06Å; K36-Q40 PolarHBondContact O-N 3.09Å; E37-Q40 WeakPolarHBondContact O-CB 3.37Å; E37-Q40 PolarHBondContact O-N 3.14Å; E37-Q40 VanDerWaalsContact O-N 3.14Å; Q40-L43 PolarHBondContact O-N 3.36Å; Q40-K44 WeakPolarHBondContact O-CG 3.34Å; Q40-K44 PolarHBondContact O-N 3.28Å
41	N	92.1	Very high	82.8	Confident	20 Å²	20	54 Å²	54	11%	0.107	27%	0.27	C	S	.	.	H	α-helix	trans	-67.7	-39.6	176.5	-72.3	-19.9	0	0	0	111.9	E37 L38 L39 L43 K44 D45 N115 L116	E37-N41 PolarHBondContact O-N 3.32Å; L38-N41 PolarHBondContact O-N 2.94Å; L39-N41 VanDerWaalsContact C-N 3.32Å; L39-N41 PolarHBondContact O-N 2.97Å; N41-L43 VanDerWaalsContact C-N 3.31Å; N41-L43 PolarHBondContact O-N 2.87Å; N41-K44 PolarHBondContact O-N 2.93Å; N41-K44 PolarHBondContact OD1-NZ 3Å; N41-D45 PolarHBondContact O-N 2.81Å; N41-N115 HydrophobicContact CB-CB 3.65Å; N41-L116 HydrophobicContact CB-CD2 3.98Å; N41-L116 HydrophobicContact CB-CG 4.33Å
42	A	93.1	Very high	84.7	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.008	27%	0.269	C	S	.	.	H	α-helix	trans	-59.9	-41.2	172	0	0	0	0	0	112.1	L38 L39 D45 L46 L82 L86 L116	L38-A42 PolarHBondContact O-N 3.34Å; L39-A42 PolarHBondContact O-N 2.97Å; A42-D45 PolarHBondContact O-N 3.29Å; A42-L46 WeakPolarHBondContact O-CB 3.48Å; A42-L46 PolarHBondContact O-N 3.33Å; A42-L82 HydrophobicContact CB-CD1 3.71Å; A42-L86 HydrophobicContact CB-CD2 4.04Å; A42-L116 HydrophobicContact CB-CD1 3.73Å
43	L	91.1	Very high	86	Confident	65 Å²	65	51.6 Å²	51.6	34%	0.34	25%	0.254	S	S	.	.	H	α-helix	trans	-67.9	-34.3	177	-71.7	169.5	0	0	0	112.6	L39 Q40 N41 L46 H47 L82	L39-L43 HydrophobicContact CD1-CG 4.46Å; L39-L43 HydrophobicContact CG-CD1 4.29Å; L39-L43 VanDerWaalsContact O-CG 3.27Å; L39-L43 WeakPolarHBondContact O-CG 3.08Å; L39-L43 PolarHBondContact O-N 3.4Å; Q40-L43 PolarHBondContact O-N 3.36Å; N41-L43 VanDerWaalsContact C-N 3.31Å; N41-L43 PolarHBondContact O-N 2.87Å; L43-L46 HydrophobicContact CD2-CD2 4.14Å; L43-L46 VanDerWaalsContact O-CB 3.27Å; L43-L46 WeakPolarHBondContact O-CB 3.31Å; L43-L46 PolarHBondContact O-N 2.87Å; L43-H47 PolarHBondContact O-CD2 3.47Å; L43-L82 HydrophobicContact CD2-CD1 4.44Å; L43-L82 HydrophobicContact CD2-CD2 4.05Å
44	K	90.3	Very high	87.2	Confident	105 Å²	105	47.7 Å²	47.7	46%	0.457	24%	0.235	S	C	.	.	H	α-helix	trans	-64.9	-46.3	172.5	-70.7	172.1	-173.5	166.8	0	111.3	Q40 N41 L46 H47 L48 N115	Q40-K44 WeakPolarHBondContact O-CG 3.34Å; Q40-K44 PolarHBondContact O-N 3.28Å; N41-K44 PolarHBondContact O-N 2.93Å; N41-K44 PolarHBondContact OD1-NZ 3Å; K44-L46 PolarHBondContact O-N 3.3Å; K44-H47 WeakPolarHBondContact O-CB 3.16Å; K44-H47 PolarHBondContact O-N 3.16Å; K44-H47 VanDerWaalsContact O-N 3.08Å; K44-L48 PolarHBondContact O-N 2.75Å; K44-N115 WeakPolarHBondContact CB-ND2 3.47Å
45	D	90.9	Very high	88.2	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-64	-28.3	178.6	-70.3	2.2	0	0	0	112.1	N41 A42 H47 L48 I49 N115 L116	N41-D45 PolarHBondContact O-N 2.81Å; A42-D45 PolarHBondContact O-N 3.29Å; D45-H47 VanDerWaalsContact C-N 3.3Å; D45-H47 PolarHBondContact O-N 3.2Å; D45-L48 WeakPolarHBondContact O-CB 3.14Å; D45-L48 PolarHBondContact O-N 3.37Å; D45-L48 VanDerWaalsContact O-N 3.1Å; D45-I49 PolarHBondContact O-N 3.01Å; D45-N115 VanDerWaalsContact CG-N 3.35Å; D45-N115 WeakPolarHBondContact OD1-CB 3.45Å; D45-N115 PolarHBondContact OD1-N 3.47Å; D45-N115 PolarHBondContact OD1-ND2 3.33Å; D45-N115 PolarHBondContact OD2-N 2.99Å; D45-L116 WeakPolarHBondContact OD2-CB 3.27Å; D45-L116 PolarHBondContact OD2-N 3.33Å
46	L	88.1	Confident	88.5	Confident	10 Å²	10	52.2 Å²	52.2	5%	0.052	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-35.9	174	-161.9	57.3	0	0	0	113.2	A42 L43 K44 L48 I49 L78 P81 L82	A42-L46 WeakPolarHBondContact O-CB 3.48Å; A42-L46 PolarHBondContact O-N 3.33Å; L43-L46 HydrophobicContact CD2-CD2 4.14Å; L43-L46 VanDerWaalsContact O-CB 3.27Å; L43-L46 WeakPolarHBondContact O-CB 3.31Å; L43-L46 PolarHBondContact O-N 2.87Å; K44-L46 PolarHBondContact O-N 3.3Å; L46-L48 VanDerWaalsContact C-N 3.31Å; L46-I49 HydrophobicContact CD1-CD1 4.26Å; L46-I49 PolarHBondContact O-N 3.22Å; L46-L78 HydrophobicContact CD1-CB 3.8Å; L46-L78 HydrophobicContact CD1-CD1 4.45Å; L46-L78 HydrophobicContact CD2-CB 3.47Å; L46-L78 VanDerWaalsContact CD2-CB 3.47Å; L46-L78 HydrophobicContact CD2-CD1 4.22Å; L46-L78 HydrophobicContact CD2-CG 4.49Å; L46-L78 HydrophobicContact CG-CB 3.6Å; L46-L78 HydrophobicContact CG-CD1 3.76Å; L46-L78 HydrophobicContact CG-CG 4.29Å; L46-P81 HydrophobicContact CD1-CB 3.51Å; L46-P81 HydrophobicContact CD1-CG 3.53Å; L46-L82 HydrophobicContact CD2-CB 4.11Å
47	H	85.1	Confident	88.6	Confident	133 Å²	133	47.1 Å²	47.1	62%	0.616	24%	0.235	S	C	*	.	H	α-helix	trans	-69.1	-32.2	174	-69.2	-65.7	0	0	0	111.8	L43 K44 D45 S51	L43-H47 PolarHBondContact O-CD2 3.47Å; K44-H47 WeakPolarHBondContact O-CB 3.16Å; K44-H47 PolarHBondContact O-N 3.16Å; K44-H47 VanDerWaalsContact O-N 3.08Å; D45-H47 VanDerWaalsContact C-N 3.3Å; D45-H47 PolarHBondContact O-N 3.2Å; H47-S51 PolarHBondContact O-N 2.71Å; H47-S51 PolarHBondContact O-OG 3.07Å
48	L	87.2	Confident	88.3	Confident	35 Å²	35	46.8 Å²	46.8	18%	0.183	24%	0.242	C	C	.	.	H	α-helix	trans	-66.5	-43.8	173.3	-61.8	175.7	0	0	0	111.2	K44 D45 L46 V50 S51 E52 R114	K44-L48 PolarHBondContact O-N 2.75Å; D45-L48 WeakPolarHBondContact O-CB 3.14Å; D45-L48 PolarHBondContact O-N 3.37Å; D45-L48 VanDerWaalsContact O-N 3.1Å; L46-L48 VanDerWaalsContact C-N 3.31Å; L48-V50 VanDerWaalsContact C-N 3.28Å; L48-V50 PolarHBondContact O-N 3.42Å; L48-S51 CarbonylContact O-C 3.55Å; L48-S51 WeakPolarHBondContact O-CB 3.42Å; L48-S51 PolarHBondContact O-N 3.05Å; L48-E52 WeakPolarHBondContact O-CB 3.39Å; L48-E52 VanDerWaalsContact O-CG 3.3Å; L48-E52 WeakPolarHBondContact O-CG 3.37Å; L48-E52 PolarHBondContact O-N 3.18Å; L48-R114 HydrophobicContact CD1-CG 4.24Å
49	I	89.3	Confident	87.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-51	-46.8	177.7	-73.8	175.5	0	0	0	111.7	D45 L46 S51 E52 I53 P81 H125 A128 K129	D45-I49 PolarHBondContact O-N 3.01Å; L46-I49 HydrophobicContact CD1-CD1 4.26Å; L46-I49 PolarHBondContact O-N 3.22Å; I49-S51 PolarHBondContact O-N 2.97Å; I49-E52 PolarHBondContact O-N 3.06Å; I49-I53 HydrophobicContact CG2-CD1 3.68Å; I49-I53 HydrophobicContact CG2-CG1 4.42Å; I49-I53 WeakPolarHBondContact O-CB 3.26Å; I49-I53 WeakPolarHBondContact O-CD1 3.26Å; I49-I53 WeakPolarHBondContact O-CG1 3.41Å; I49-I53 PolarHBondContact O-N 3.32Å; I49-P81 HydrophobicContact CD1-CB 3.91Å; I49-P81 HydrophobicContact CG2-CB 4.48Å; I49-H125 WeakPolarHBondContact CG1-CE1 3.49Å; I49-A128 HydrophobicContact CD1-CB 3.8Å; I49-K129 HydrophobicContact CB-CG 4.38Å; I49-K129 HydrophobicContact CG1-CG 4.19Å; I49-K129 HydrophobicContact CG2-CG 3.88Å
50	V	86.4	Confident	87.5	Confident	19 Å²	19	49.7 Å²	49.7	12%	0.115	27%	0.271	C	S	.	.	H	α-helix	trans	-64.5	-42.6	-179.7	175.4	0	0	0	0	111.4	L48 K54 F72 L78	L48-V50 VanDerWaalsContact C-N 3.28Å; L48-V50 PolarHBondContact O-N 3.42Å; V50-K54 HydrophobicContact CG1-CD 4.28Å; V50-K54 VanDerWaalsContact O-CG 3.3Å; V50-K54 WeakPolarHBondContact O-CG 3.44Å; V50-K54 PolarHBondContact O-N 2.98Å; V50-K54 VanDerWaalsContact O-N 3.08Å; V50-F72 HydrophobicContact CG1-CB 4.36Å; V50-F72 WeakPolarHBondContact CG1-O 3.35Å; V50-L78 HydrophobicContact CG2-CD1 3.55Å; V50-L78 HydrophobicContact CG2-CD2 3.7Å; V50-L78 HydrophobicContact CG2-CG 4.29Å
51	S	86.4	Confident	87.2	Confident	73 Å²	73	51.8 Å²	51.8	51%	0.51	28%	0.279	S	S	.	.	H	α-helix	trans	-65.5	-43.6	177.7	-61.8	0	0	0	0	111.8	H47 L48 I49 K54 H55	H47-S51 PolarHBondContact O-N 2.71Å; H47-S51 PolarHBondContact O-OG 3.07Å; L48-S51 CarbonylContact O-C 3.55Å; L48-S51 WeakPolarHBondContact O-CB 3.42Å; L48-S51 PolarHBondContact O-N 3.05Å; I49-S51 PolarHBondContact O-N 2.97Å; S51-K54 PolarHBondContact O-N 2.66Å; S51-H55 WeakPolarHBondContact O-CB 3.47Å; S51-H55 PolarHBondContact O-N 2.73Å
52	E	89.9	Confident	87.1	Confident	39 Å²	39	55 Å²	55	18%	0.182	30%	0.3	C	S	.	.	H	α-helix	trans	-64.2	-40.9	177.2	-71.3	170	167.8	0	0	112.1	L48 I49 H55 S56 H125 K129	L48-E52 WeakPolarHBondContact O-CB 3.39Å; L48-E52 VanDerWaalsContact O-CG 3.3Å; L48-E52 WeakPolarHBondContact O-CG 3.37Å; L48-E52 PolarHBondContact O-N 3.18Å; I49-E52 PolarHBondContact O-N 3.06Å; E52-H55 PolarHBondContact O-N 3.24Å; E52-S56 VanDerWaalsContact O-CB 3.22Å; E52-S56 WeakPolarHBondContact O-CB 3.48Å; E52-S56 PolarHBondContact O-N 3.4Å; E52-S56 PolarHBondContact O-OG 3.16Å; E52-H125 IonicContact OE1-NE2 3.44Å; E52-H125 PolarHBondContact OE1-NE2 2.8Å; E52-H125 IonicContact OE2-CD2 3.65Å; E52-H125 IonicContact OE2-CE1 3.61Å; E52-H125 IonicContact OE2-NE2 2.66Å; E52-H125 PolarHBondContact OE2-NE2 3.21Å; E52-K129 HydrophobicContact CB-CD 4.46Å; E52-K129 WeakPolarHBondContact OE2-CD 3.39Å
53	I	89.7	Confident	86.8	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61.4	-48.7	174.2	-70.9	165.3	0	0	0	109.7	I49 H55 S56 L57 F72 K129 E132 M133	I49-I53 HydrophobicContact CG2-CD1 3.68Å; I49-I53 HydrophobicContact CG2-CG1 4.42Å; I49-I53 WeakPolarHBondContact O-CB 3.26Å; I49-I53 WeakPolarHBondContact O-CD1 3.26Å; I49-I53 WeakPolarHBondContact O-CG1 3.41Å; I49-I53 PolarHBondContact O-N 3.32Å; I53-H55 VanDerWaalsContact C-N 3.3Å; I53-H55 PolarHBondContact O-N 3.09Å; I53-S56 PolarHBondContact O-N 3.44Å; I53-S56 VanDerWaalsContact O-N 3.14Å; I53-L57 HydrophobicContact CG2-CD1 3.58Å; I53-L57 HydrophobicContact CG2-CG 4.2Å; I53-L57 WeakPolarHBondContact O-CB 3.42Å; I53-L57 VanDerWaalsContact O-CG 3.29Å; I53-L57 WeakPolarHBondContact O-CG 3.45Å; I53-L57 PolarHBondContact O-N 3.24Å; I53-F72 HydrophobicContact CD1-CE1 4.25Å; I53-F72 HydrophobicContact CG2-CD1 4.1Å; I53-F72 HydrophobicContact CG2-CD2 4.17Å; I53-F72 HydrophobicContact CG2-CE1 3.66Å; I53-F72 HydrophobicContact CG2-CE2 3.76Å; I53-F72 HydrophobicContact CG2-CG 4.35Å; I53-F72 HydrophobicContact CG2-CZ 3.49Å; I53-F72 VanDerWaalsContact CG2-CZ 3.49Å; I53-K129 HydrophobicContact CD1-CB 4.33Å; I53-K129 HydrophobicContact CD1-CG 4.48Å; I53-K129 HydrophobicContact CG1-CB 4.14Å; I53-K129 HydrophobicContact CG1-CG 4.16Å; I53-E132 HydrophobicContact CD1-CB 4.19Å; I53-E132 HydrophobicContact CD1-CG 4.33Å; I53-M133 HydrophobicContact CD1-CG 3.95Å; I53-M133 HydrophobicContact CG1-CG 3.99Å; I53-M133 HydrophobicContact CG1-SD 4.15Å; I53-M133 HydrophobicContact CG2-CG 3.92Å; I53-M133 HydrophobicContact CG2-SD 4.39Å
54	K	86	Confident	86.8	Confident	66 Å²	66	56.1 Å²	56.1	29%	0.287	31%	0.307	S	S	.	.	H	α-helix	trans	-60	-39.9	178.2	-73	173.3	-176.5	178.7	0	112.3	V50 S51 F72	V50-K54 HydrophobicContact CG1-CD 4.28Å; V50-K54 VanDerWaalsContact O-CG 3.3Å; V50-K54 WeakPolarHBondContact O-CG 3.44Å; V50-K54 PolarHBondContact O-N 2.98Å; V50-K54 VanDerWaalsContact O-N 3.08Å; S51-K54 PolarHBondContact O-N 2.66Å; K54-F72 HydrophobicContact CD-CB 4.35Å; K54-F72 WeakPolarHBondContact CE-O 3.48Å; K54-F72 HydrophobicContact CG-CB 4.01Å; K54-F72 PolarHBondContact NZ-O 2.77Å
55	H	85.2	Confident	86.6	Confident	154 Å²	154	56.2 Å²	56.2	71%	0.713	31%	0.305	S	S	*	.	H	α-helix	trans	-70.5	-35.1	176.3	-175.9	-89.1	0	0	0	112.2	S51 E52 I53 L57 C58	S51-H55 WeakPolarHBondContact O-CB 3.47Å; S51-H55 PolarHBondContact O-N 2.73Å; E52-H55 PolarHBondContact O-N 3.24Å; I53-H55 VanDerWaalsContact C-N 3.3Å; I53-H55 PolarHBondContact O-N 3.09Å; H55-L57 VanDerWaalsContact C-N 3.33Å; H55-C58 PolarHBondContact O-SG 3.33Å
56	S	83.7	Confident	86.6	Confident	31 Å²	31	59.9 Å²	59.9	22%	0.217	33%	0.325	C	S	.	.	H	α-helix	trans	-73.2	-27	178.6	-60.9	0	0	0	0	112.8	E52 I53 C58 H176	E52-S56 VanDerWaalsContact O-CB 3.22Å; E52-S56 WeakPolarHBondContact O-CB 3.48Å; E52-S56 PolarHBondContact O-N 3.4Å; E52-S56 PolarHBondContact O-OG 3.16Å; I53-S56 PolarHBondContact O-N 3.44Å; I53-S56 VanDerWaalsContact O-N 3.14Å; S56-C58 PolarHBondContact O-N 2.97Å; S56-H176 PolarHBondContact O-CE1 3.14Å; S56-H176 PolarHBondContact O-ND1 3.34Å
57	L	86.1	Confident	86.6	Confident	7 Å²	7	59.4 Å²	59.4	4%	0.037	32%	0.322	C	S	.	.			trans	-92	86	179.7	-70.5	177.5	0	0	0	110.8	I53 H55 P59 L68 F72 M133 F172 I173 H176	I53-L57 HydrophobicContact CG2-CD1 3.58Å; I53-L57 HydrophobicContact CG2-CG 4.2Å; I53-L57 WeakPolarHBondContact O-CB 3.42Å; I53-L57 VanDerWaalsContact O-CG 3.29Å; I53-L57 WeakPolarHBondContact O-CG 3.45Å; I53-L57 PolarHBondContact O-N 3.24Å; H55-L57 VanDerWaalsContact C-N 3.33Å; L57-P59 VanDerWaalsContact C-CD 3.44Å; L57-P59 WeakPolarHBondContact O-CD 3.34Å; L57-L68 HydrophobicContact CB-CD1 3.96Å; L57-L68 HydrophobicContact CD1-CD1 4.31Å; L57-L68 HydrophobicContact CD1-CD2 4.26Å; L57-F72 HydrophobicContact CD1-CD2 4.18Å; L57-F72 HydrophobicContact CD1-CE2 3.44Å; L57-F72 VanDerWaalsContact CD1-CE2 3.44Å; L57-F72 HydrophobicContact CD1-CZ 4.09Å; L57-M133 HydrophobicContact CD2-CE 4.08Å; L57-F172 HydrophobicContact CB-CE1 4.4Å; L57-F172 HydrophobicContact CD2-CD1 4.08Å; L57-F172 HydrophobicContact CD2-CE1 3.81Å; L57-I173 HydrophobicContact CD1-CG1 4.24Å; L57-H176 HydrophobicContact CD2-CB 3.65Å
58	C	81.9	Confident	86.8	Confident	94 Å²	94	53.4 Å²	53.4	64%	0.635	29%	0.294	S	S	*	.			trans	-109.6	76.1	178.7	-76.8	0	0	0	0	111.6	H55 S56	H55-C58 PolarHBondContact O-SG 3.33Å; S56-C58 PolarHBondContact O-N 2.97Å
59	P	80.4	Confident	86.7	Confident	6 Å²	6	57.2 Å²	57.2	4%	0.039	31%	0.306	C	S	.	.			trans	-66.8	145.9	175.6	30	-35.2	0	0	0	110.7	L57 F61 F64 R65 L68 F172	L57-P59 VanDerWaalsContact C-CD 3.44Å; L57-P59 WeakPolarHBondContact O-CD 3.34Å; P59-F61 VanDerWaalsContact C-N 3.32Å; P59-F61 PolarHBondContact O-N 2.92Å; P59-F64 HydrophobicContact CB-CB 3.62Å; P59-F64 HydrophobicContact CG-CB 3.7Å; P59-R65 HydrophobicContact CG-CB 3.99Å; P59-R65 VanDerWaalsContact CG-N 3.34Å; P59-L68 HydrophobicContact CG-CD1 3.84Å; P59-F172 HydrophobicContact CB-CE1 4.02Å; P59-F172 HydrophobicContact CB-CE2 4.37Å; P59-F172 HydrophobicContact CB-CZ 3.89Å; P59-F172 HydrophobicContact CG-CE1 4.41Å
60	A	82.6	Confident	86.6	Confident	90 Å²	90	59.7 Å²	59.7	74%	0.744	32%	0.316	S	S	*	.	S	Bend	trans	-63.7	-37.6	179.9	0	0	0	0	0	112.3
61	F	87	Confident	86.5	Confident	139 Å²	139	59.2 Å²	59.2	61%	0.61	31%	0.313	S	S	*	.	S	Bend	trans	-92.8	134.1	-177	-54.7	-83.6	0	0	0	111.9	P59 V63 F64 R65	P59-F61 VanDerWaalsContact C-N 3.32Å; P59-F61 PolarHBondContact O-N 2.92Å; F61-V63 VanDerWaalsContact C-N 3.32Å; F61-V63 HydrophobicContact CB-CG1 4.37Å; F61-V63 PolarHBondContact O-N 3.43Å; F61-F64 HydrophobicContact CB-CD2 4.01Å; F61-F64 HydrophobicContact CD2-CD2 4.35Å; F61-F64 HydrophobicContact CD2-CE2 4.44Å; F61-F64 PolarHBondContact O-N 3.34Å; F61-R65 PolarHBondContact O-N 2.67Å
62	P	88.6	Confident	86.4	Confident	86 Å²	86	56.4 Å²	56.4	56%	0.558	29%	0.291	S	S	*	.	H	α-helix	trans	-55.3	-39.5	-178.3	-28.4	35.3	0	0	0	114.8	F64 R65 D66	P62-F64 VanDerWaalsContact C-N 3.28Å; P62-F64 PolarHBondContact O-N 2.81Å; P62-R65 WeakPolarHBondContact O-CA 3.36Å; P62-R65 VanDerWaalsContact O-CB 3.25Å; P62-R65 WeakPolarHBondContact O-CB 3.43Å; P62-R65 PolarHBondContact O-N 3.43Å; P62-D66 PolarHBondContact O-N 3.33Å
63	V	88	Confident	86	Confident	58 Å²	58	59.6 Å²	59.6	35%	0.352	31%	0.306	S	S	.	.	H	α-helix	trans	-56.5	-40.7	-178.7	65.7	0	0	0	0	112.6	F61 D66 L67 F161 E165	F61-V63 VanDerWaalsContact C-N 3.32Å; F61-V63 HydrophobicContact CB-CG1 4.37Å; F61-V63 PolarHBondContact O-N 3.43Å; V63-D66 PolarHBondContact O-N 2.89Å; V63-L67 WeakPolarHBondContact O-CB 3.29Å; V63-L67 PolarHBondContact O-N 3.39Å; V63-F161 HydrophobicContact CG2-CD1 4.32Å; V63-E165 HydrophobicContact CG2-CG 4.13Å
64	F	89.2	Confident	84.8	Confident	33 Å²	33	60.1 Å²	60.1	15%	0.145	31%	0.31	C	S	.	.	H	α-helix	trans	-72.1	-33	176.8	-69	-66.3	0	0	0	111.5	P59 F61 P62 D66 L67 L68 E165 L168	P59-F64 HydrophobicContact CB-CB 3.62Å; P59-F64 HydrophobicContact CG-CB 3.7Å; F61-F64 HydrophobicContact CB-CD2 4.01Å; F61-F64 HydrophobicContact CD2-CD2 4.35Å; F61-F64 HydrophobicContact CD2-CE2 4.44Å; F61-F64 PolarHBondContact O-N 3.34Å; P62-F64 VanDerWaalsContact C-N 3.28Å; P62-F64 PolarHBondContact O-N 2.81Å; F64-D66 VanDerWaalsContact C-N 3.29Å; F64-D66 PolarHBondContact O-N 3.5Å; F64-L67 PolarHBondContact O-N 2.9Å; F64-L68 WeakPolarHBondContact O-CB 3.48Å; F64-L68 WeakPolarHBondContact O-CG 3.35Å; F64-L68 PolarHBondContact O-N 2.98Å; F64-E165 HydrophobicContact CE1-CB 4.44Å; F64-L168 HydrophobicContact CE1-CB 3.54Å; F64-L168 HydrophobicContact CE1-CD1 4.44Å; F64-L168 HydrophobicContact CZ-CB 3.68Å; F64-L168 HydrophobicContact CZ-CD1 3.77Å; F64-L168 HydrophobicContact CZ-CG 4.4Å
65	R	88	Confident	83.6	Confident	106 Å²	106	66 Å²	66	40%	0.4	34%	0.338	S	S	.	.	H	α-helix	trans	-62	-42.1	175.3	-166.7	-175.3	-61.4	175.8	-0.4	110.8	P59 F61 P62 R69	P59-R65 HydrophobicContact CG-CB 3.99Å; P59-R65 VanDerWaalsContact CG-N 3.34Å; F61-R65 PolarHBondContact O-N 2.67Å; P62-R65 WeakPolarHBondContact O-CA 3.36Å; P62-R65 VanDerWaalsContact O-CB 3.25Å; P62-R65 WeakPolarHBondContact O-CB 3.43Å; P62-R65 PolarHBondContact O-N 3.43Å; R65-R69 VanDerWaalsContact CD-CZ 3.49Å; R65-R69 VanDerWaalsContact CD-NH1 3.33Å; R65-R69 WeakPolarHBondContact O-CB 3.31Å; R65-R69 VanDerWaalsContact O-CG 3.29Å; R65-R69 WeakPolarHBondContact O-CG 3.5Å; R65-R69 PolarHBondContact O-N 3.25Å
66	D	89.5	Confident	82.7	Confident	79 Å²	79	59.6 Å²	59.6	42%	0.422	31%	0.314	S	S	.	.	H	α-helix	trans	-71.2	-39.9	179.2	-63.9	-22.4	0	0	0	111.6	P62 V63 F64 R69 Y70 F161	P62-D66 PolarHBondContact O-N 3.33Å; V63-D66 PolarHBondContact O-N 2.89Å; F64-D66 VanDerWaalsContact C-N 3.29Å; F64-D66 PolarHBondContact O-N 3.5Å; D66-R69 PolarHBondContact O-N 3.42Å; D66-R69 IonicContact OD1-NH1 2.71Å; D66-Y70 WeakPolarHBondContact O-CB 3.26Å; D66-Y70 PolarHBondContact O-N 2.83Å; D66-F161 HydrophobicContact CB-CE1 3.96Å; D66-F161 HydrophobicContact CB-CZ 4.48Å
67	L	89.3	Confident	82.3	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-58.8	-48.4	172.5	-175.8	158.4	0	0	0	111.9	V63 F64 Y70 Q71 I140 F161 E165	V63-L67 WeakPolarHBondContact O-CB 3.29Å; V63-L67 PolarHBondContact O-N 3.39Å; F64-L67 PolarHBondContact O-N 2.9Å; L67-Y70 WeakPolarHBondContact O-CB 3.27Å; L67-Y70 PolarHBondContact O-N 2.88Å; L67-Q71 HydrophobicContact CD2-CG 4.22Å; L67-Q71 WeakPolarHBondContact O-CG 3.39Å; L67-Q71 PolarHBondContact O-N 3.46Å; L67-I140 HydrophobicContact CD2-CD1 4.3Å; L67-F161 HydrophobicContact CB-CD1 4.08Å; L67-F161 HydrophobicContact CB-CD2 4.08Å; L67-F161 HydrophobicContact CB-CE1 4.18Å; L67-F161 HydrophobicContact CB-CE2 4.2Å; L67-F161 HydrophobicContact CB-CG 4.04Å; L67-F161 HydrophobicContact CB-CZ 4.25Å; L67-F161 HydrophobicContact CD1-CB 3.98Å; L67-F161 HydrophobicContact CD1-CD2 4.2Å; L67-F161 HydrophobicContact CD1-CG 4.08Å; L67-F161 HydrophobicContact CG-CD2 3.98Å; L67-F161 HydrophobicContact CG-CE2 4.36Å; L67-F161 HydrophobicContact CG-CG 4.2Å; L67-E165 HydrophobicContact CD1-CB 4.01Å; L67-E165 VanDerWaalsContact CD1-O 3.27Å; L67-E165 WeakPolarHBondContact CD1-O 3.42Å
68	L	87.8	Confident	82.2	Confident	6 Å²	6	66.2 Å²	66.2	3%	0.031	34%	0.34	C	S	.	.	H	α-helix	trans	-65.7	-43.8	-178.9	-66.3	173.6	0	0	0	111.3	L57 P59 F64 Y70 Q71 F72 F172 I173	L57-L68 HydrophobicContact CB-CD1 3.96Å; L57-L68 HydrophobicContact CD1-CD1 4.31Å; L57-L68 HydrophobicContact CD1-CD2 4.26Å; P59-L68 HydrophobicContact CG-CD1 3.84Å; F64-L68 WeakPolarHBondContact O-CB 3.48Å; F64-L68 WeakPolarHBondContact O-CG 3.35Å; F64-L68 PolarHBondContact O-N 2.98Å; L68-Y70 VanDerWaalsContact C-N 3.34Å; L68-Y70 PolarHBondContact O-N 2.94Å; L68-Q71 PolarHBondContact O-N 3.42Å; L68-F72 VanDerWaalsContact O-CD2 3.26Å; L68-F72 WeakPolarHBondContact O-CD2 3.42Å; L68-F72 PolarHBondContact O-N 2.8Å; L68-F172 HydrophobicContact CD1-CD1 3.66Å; L68-F172 HydrophobicContact CD1-CE1 3.73Å; L68-I173 HydrophobicContact CD2-CD1 3.54Å; L68-I173 HydrophobicContact CD2-CG1 3.44Å; L68-I173 VanDerWaalsContact CD2-CG1 3.44Å
69	R	86.4	Confident	82.5	Confident	115 Å²	115	62.9 Å²	62.9	43%	0.434	32%	0.316	S	S	.	.	H	α-helix	trans	-57.8	-48.7	172.5	-76.5	173.3	179	154.2	-8.6	111.2	R65 D66 Q71 F72 E73	R65-R69 VanDerWaalsContact CD-CZ 3.49Å; R65-R69 VanDerWaalsContact CD-NH1 3.33Å; R65-R69 WeakPolarHBondContact O-CB 3.31Å; R65-R69 VanDerWaalsContact O-CG 3.29Å; R65-R69 WeakPolarHBondContact O-CG 3.5Å; R65-R69 PolarHBondContact O-N 3.25Å; D66-R69 PolarHBondContact O-N 3.42Å; D66-R69 IonicContact OD1-NH1 2.71Å; R69-Q71 VanDerWaalsContact C-N 3.26Å; R69-Q71 PolarHBondContact O-N 2.98Å; R69-F72 PolarHBondContact O-N 2.72Å; R69-E73 WeakPolarHBondContact O-CB 3.45Å; R69-E73 WeakPolarHBondContact O-CG 3.45Å; R69-E73 PolarHBondContact O-N 2.89Å
70	Y	86	Confident	83.1	Confident	53 Å²	53	64.1 Å²	64.1	21%	0.208	32%	0.32	C	S	.	.	H	α-helix	trans	-53.7	-44.1	178.9	-177.8	-95.6	0	0	0	112.4	D66 L67 L68 S74 T155 F161	D66-Y70 WeakPolarHBondContact O-CB 3.26Å; D66-Y70 PolarHBondContact O-N 2.83Å; L67-Y70 WeakPolarHBondContact O-CB 3.27Å; L67-Y70 PolarHBondContact O-N 2.88Å; L68-Y70 VanDerWaalsContact C-N 3.34Å; L68-Y70 PolarHBondContact O-N 2.94Å; Y70-S74 PolarHBondContact O-N 3.35Å; Y70-T155 WeakPolarHBondContact CE1-O 3.26Å; Y70-T155 PolarHBondContact OH-N 3.27Å; Y70-T155 PolarHBondContact OH-O 3.04Å; Y70-F161 AromaticContact CD1-CE2 3.83Å; Y70-F161 HydrophobicContact CD1-CE2 3.83Å; Y70-F161 HydrophobicContact CD2-CE2 4.3Å; Y70-F161 HydrophobicContact CD2-CZ 4.43Å; Y70-F161 HydrophobicContact CE1-CE2 4.47Å; Y70-F161 AromaticContact CG-CE2 3.72Å; Y70-F161 HydrophobicContact CG-CE2 3.72Å; Y70-F161 HydrophobicContact CG-CZ 4.07Å
71	Q	86	Confident	83.7	Confident	9 Å²	9	59.8 Å²	59.8	4%	0.042	29%	0.285	C	S	.	.	H	α-helix	trans	-69.3	-49.8	-179.9	-71.6	-63.9	-21.9	0	0	112.6	L67 L68 R69 E73 S74 T136 I140	L67-Q71 HydrophobicContact CD2-CG 4.22Å; L67-Q71 WeakPolarHBondContact O-CG 3.39Å; L67-Q71 PolarHBondContact O-N 3.46Å; L68-Q71 PolarHBondContact O-N 3.42Å; R69-Q71 VanDerWaalsContact C-N 3.26Å; R69-Q71 PolarHBondContact O-N 2.98Å; Q71-E73 VanDerWaalsContact C-N 3.3Å; Q71-E73 PolarHBondContact O-N 2.95Å; Q71-S74 WeakPolarHBondContact O-CB 3.21Å; Q71-S74 PolarHBondContact O-N 2.97Å; Q71-S74 PolarHBondContact O-OG 3.05Å; Q71-T136 HydrophobicContact CB-CG2 4.1Å; Q71-I140 HydrophobicContact CB-CD1 4.42Å; Q71-I140 HydrophobicContact CG-CD1 3.78Å; Q71-I140 HydrophobicContact CG-CG1 3.89Å
72	F	83.9	Confident	84	Confident	14 Å²	14	54 Å²	54	6%	0.061	26%	0.26	C	S	.	.	H	α-helix	trans	-79	-8.3	-179.7	-70	-73.9	0	0	0	114.1	V50 I53 K54 L57 L68 R69 E132 M133 T136 I173	V50-F72 HydrophobicContact CG1-CB 4.36Å; V50-F72 WeakPolarHBondContact CG1-O 3.35Å; I53-F72 HydrophobicContact CD1-CE1 4.25Å; I53-F72 HydrophobicContact CG2-CD1 4.1Å; I53-F72 HydrophobicContact CG2-CD2 4.17Å; I53-F72 HydrophobicContact CG2-CE1 3.66Å; I53-F72 HydrophobicContact CG2-CE2 3.76Å; I53-F72 HydrophobicContact CG2-CG 4.35Å; I53-F72 HydrophobicContact CG2-CZ 3.49Å; I53-F72 VanDerWaalsContact CG2-CZ 3.49Å; K54-F72 HydrophobicContact CD-CB 4.35Å; K54-F72 WeakPolarHBondContact CE-O 3.48Å; K54-F72 HydrophobicContact CG-CB 4.01Å; K54-F72 PolarHBondContact NZ-O 2.77Å; L57-F72 HydrophobicContact CD1-CD2 4.18Å; L57-F72 HydrophobicContact CD1-CE2 3.44Å; L57-F72 VanDerWaalsContact CD1-CE2 3.44Å; L57-F72 HydrophobicContact CD1-CZ 4.09Å; L68-F72 VanDerWaalsContact O-CD2 3.26Å; L68-F72 WeakPolarHBondContact O-CD2 3.42Å; L68-F72 PolarHBondContact O-N 2.8Å; R69-F72 PolarHBondContact O-N 2.72Å; F72-E132 HydrophobicContact CE1-CG 4.48Å; F72-M133 HydrophobicContact CZ-CG 4.48Å; F72-T136 HydrophobicContact CD1-CG2 4.45Å; F72-T136 HydrophobicContact CE1-CG2 3.92Å; F72-T136 WeakPolarHBondContact CE1-OG1 3.42Å; F72-T136 HydrophobicContact CE2-CG2 4.16Å; F72-T136 HydrophobicContact CZ-CG2 3.74Å; F72-I173 HydrophobicContact CE2-CD1 4.08Å; F72-I173 HydrophobicContact CE2-CG1 4.47Å; F72-I173 HydrophobicContact CZ-CD1 4.34Å
73	E	80.4	Confident	84.4	Confident	106 Å²	106	49.9 Å²	49.9	50%	0.495	23%	0.233	S	C	.	.	H	α-helix	trans	-93	-13.3	168.5	-72.3	173.9	-173.8	0	0	113	R69 Q71 Q75 K154	R69-E73 WeakPolarHBondContact O-CB 3.45Å; R69-E73 WeakPolarHBondContact O-CG 3.45Å; R69-E73 PolarHBondContact O-N 2.89Å; Q71-E73 VanDerWaalsContact C-N 3.3Å; Q71-E73 PolarHBondContact O-N 2.95Å; E73-Q75 PolarHBondContact O-N 3.23Å; E73-K154 PolarHBondContact O-NZ 3.49Å
74	S	64.6	Low	84.9	Confident	11 Å²	11	47.2 Å²	47.2	8%	0.077	22%	0.217	C	C	.	.	S	Bend	trans	-61.2	122.8	165.5	77.7	0	0	0	0	107.7	Y70 Q71 G76 R152	Y70-S74 PolarHBondContact O-N 3.35Å; Q71-S74 WeakPolarHBondContact O-CB 3.21Å; Q71-S74 PolarHBondContact O-N 2.97Å; Q71-S74 PolarHBondContact O-OG 3.05Å; S74-G76 VanDerWaalsContact C-N 3.27Å; S74-G76 PolarHBondContact O-N 3.42Å; S74-R152 PolarHBondContact OG-NH1 3.29Å
75	Q	60.5	Low	85.3	Confident	189 Å²	189	45.9 Å²	45.9	88%	0.883	21%	0.212	S	C	*	.			trans	-65.1	89.4	-179.1	-73.9	-165.9	-6.8	0	0	109.6	E73	E73-Q75 PolarHBondContact O-N 3.23Å
76	G	66.5	Low	85.7	Confident	20 Å²	20	40.8 Å²	40.8	21%	0.206	19%	0.192	C	C	.	.			trans	-74.7	152.8	163.4	0	0	0	0	0	109.9	S74 L78	S74-G76 VanDerWaalsContact C-N 3.27Å; S74-G76 PolarHBondContact O-N 3.42Å; G76-L78 PolarHBondContact O-N 3.04Å
77	K	75.3	Confident	86.2	Confident	149 Å²	149	37 Å²	37	65%	0.648	17%	0.172	S	C	*	.			trans	-74.1	-1.7	172.9	-64.3	-178.9	-178.5	176.6	0	112.8	V79	K77-V79 HydrophobicContact CB-CG2 3.69Å; K77-V79 WeakPolarHBondContact O-CG2 3.31Å; K77-V79 PolarHBondContact O-N 3.26Å
78	L	85.4	Confident	86.6	Confident	28 Å²	28	37 Å²	37	15%	0.147	17%	0.172	C	C	.	.			trans	45.9	37.4	177.8	-64.1	172.3	0	0	0	113.3	L46 V50 G76 P81 L82 E132	L46-L78 HydrophobicContact CD1-CB 3.8Å; L46-L78 HydrophobicContact CD1-CD1 4.45Å; L46-L78 HydrophobicContact CD2-CB 3.47Å; L46-L78 VanDerWaalsContact CD2-CB 3.47Å; L46-L78 HydrophobicContact CD2-CD1 4.22Å; L46-L78 HydrophobicContact CD2-CG 4.49Å; L46-L78 HydrophobicContact CG-CB 3.6Å; L46-L78 HydrophobicContact CG-CD1 3.76Å; L46-L78 HydrophobicContact CG-CG 4.29Å; V50-L78 HydrophobicContact CG2-CD1 3.55Å; V50-L78 HydrophobicContact CG2-CD2 3.7Å; V50-L78 HydrophobicContact CG2-CG 4.29Å; G76-L78 PolarHBondContact O-N 3.04Å; L78-P81 HydrophobicContact CB-CG 4.11Å; L78-P81 HydrophobicContact CD2-CG 4.3Å; L78-P81 WeakPolarHBondContact O-CD 3.43Å; L78-P81 WeakPolarHBondContact O-CG 3.37Å; L78-L82 WeakPolarHBondContact O-CB 3.47Å; L78-L82 PolarHBondContact O-N 3.1Å; L78-E132 HydrophobicContact CD2-CG 4.11Å
79	V	88.2	Confident	87	Confident	23 Å²	23	36.8 Å²	36.8	14%	0.139	17%	0.171	C	C	.	.	H	α-helix	trans	-71.6	-40.4	-170.5	178.9	0	0	0	0	111.8	K77 L82 L83 F375	K77-V79 HydrophobicContact CB-CG2 3.69Å; K77-V79 WeakPolarHBondContact O-CG2 3.31Å; K77-V79 PolarHBondContact O-N 3.26Å; V79-L82 PolarHBondContact O-N 3.02Å; V79-L83 HydrophobicContact CG1-CD1 3.73Å; V79-L83 HydrophobicContact CG1-CG 4.04Å; V79-L83 WeakPolarHBondContact O-CB 3.5Å; V79-L83 WeakPolarHBondContact O-CG 3.39Å; V79-L83 PolarHBondContact O-N 3.18Å; V79-F375 HydrophobicContact CB-CD2 4.45Å; V79-F375 HydrophobicContact CB-CE2 3.9Å; V79-F375 HydrophobicContact CB-CZ 4.08Å; V79-F375 HydrophobicContact CG1-CD1 4.12Å; V79-F375 HydrophobicContact CG1-CD2 3.76Å; V79-F375 HydrophobicContact CG1-CE1 3.86Å; V79-F375 HydrophobicContact CG1-CE2 3.51Å; V79-F375 HydrophobicContact CG1-CG 4.06Å; V79-F375 HydrophobicContact CG1-CZ 3.54Å; V79-F375 HydrophobicContact CG2-CD2 4.05Å; V79-F375 HydrophobicContact CG2-CE2 3.63Å; V79-F375 HydrophobicContact CG2-CZ 4.3Å
80	R	91.9	Very high	87.5	Confident	32 Å²	32	31.3 Å²	31.3	12%	0.121	15%	0.15	C	C	.	.	H	α-helix	trans	-59	-55.9	179.2	-72	172.1	172.3	77.5	4.8	111.4	L82 L83 V84 H135 I234	R80-L82 VanDerWaalsContact C-N 3.29Å; R80-L82 PolarHBondContact O-N 3.41Å; R80-L83 PolarHBondContact O-N 3.48Å; R80-V84 VanDerWaalsContact O-CG2 3.26Å; R80-V84 WeakPolarHBondContact O-CG2 3.41Å; R80-V84 PolarHBondContact O-N 3.08Å; R80-H135 PolarHBondContact NH1-CE1 3.44Å; R80-H135 VanDerWaalsContact NH1-CE1 3.26Å; R80-H135 PolarHBondContact NH1-NE2 3.43Å; R80-I234 HydrophobicContact CG-CG1 4.34Å
81	P	94.4	Very high	88	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.1	-37.5	177.2	16.1	-27.3	0	0	0	112.8	L46 I49 L78 V84 T85 A128 E132	L46-P81 HydrophobicContact CD1-CB 3.51Å; L46-P81 HydrophobicContact CD1-CG 3.53Å; I49-P81 HydrophobicContact CD1-CB 3.91Å; I49-P81 HydrophobicContact CG2-CB 4.48Å; L78-P81 HydrophobicContact CB-CG 4.11Å; L78-P81 HydrophobicContact CD2-CG 4.3Å; L78-P81 WeakPolarHBondContact O-CD 3.43Å; L78-P81 WeakPolarHBondContact O-CG 3.37Å; P81-V84 PolarHBondContact O-N 3.42Å; P81-T85 WeakPolarHBondContact O-CB 3.26Å; P81-T85 PolarHBondContact O-N 3.11Å; P81-T85 PolarHBondContact O-OG1 3.17Å; P81-A128 HydrophobicContact CB-CB 4.2Å; P81-E132 WeakPolarHBondContact CD-OE2 3.28Å; P81-E132 HydrophobicContact CG-CB 3.98Å; P81-E132 HydrophobicContact CG-CG 4.24Å
82	L	95.1	Very high	88.5	Confident	16 Å²	16	29 Å²	29	8%	0.084	14%	0.142	C	C	.	.	H	α-helix	trans	-61	-47.5	174.7	179.6	60.7	0	0	0	112.6	L39 A42 L43 L46 L78 V79 R80 V84 T85 L86 V371	L39-L82 HydrophobicContact CD1-CD1 4.21Å; L39-L82 HydrophobicContact CD1-CD2 4.41Å; A42-L82 HydrophobicContact CB-CD1 3.71Å; L43-L82 HydrophobicContact CD2-CD1 4.44Å; L43-L82 HydrophobicContact CD2-CD2 4.05Å; L46-L82 HydrophobicContact CD2-CB 4.11Å; L78-L82 WeakPolarHBondContact O-CB 3.47Å; L78-L82 PolarHBondContact O-N 3.1Å; V79-L82 PolarHBondContact O-N 3.02Å; R80-L82 VanDerWaalsContact C-N 3.29Å; R80-L82 PolarHBondContact O-N 3.41Å; L82-V84 VanDerWaalsContact C-N 3.34Å; L82-V84 PolarHBondContact O-N 3.04Å; L82-T85 PolarHBondContact O-N 3.11Å; L82-L86 HydrophobicContact CD1-CD1 3.93Å; L82-L86 HydrophobicContact CD1-CG 4.2Å; L82-L86 HydrophobicContact CG-CD1 4.11Å; L82-L86 WeakPolarHBondContact O-CB 3.28Å; L82-L86 WeakPolarHBondContact O-CG 3.44Å; L82-L86 PolarHBondContact O-N 3.2Å; L82-V371 HydrophobicContact CD2-CG1 3.88Å; L82-V371 HydrophobicContact CD2-CG2 4.15Å; L82-V371 HydrophobicContact CG-CG1 4.28Å
83	L	96.4	Very high	89	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.7	-43.2	177.8	-73.8	172	0	0	0	111.5	V79 R80 L86 A87 I234 L264 L368 V371	V79-L83 HydrophobicContact CG1-CD1 3.73Å; V79-L83 HydrophobicContact CG1-CG 4.04Å; V79-L83 WeakPolarHBondContact O-CB 3.5Å; V79-L83 WeakPolarHBondContact O-CG 3.39Å; V79-L83 PolarHBondContact O-N 3.18Å; R80-L83 PolarHBondContact O-N 3.48Å; L83-L86 PolarHBondContact O-N 3.26Å; L83-A87 VanDerWaalsContact O-CB 3.26Å; L83-A87 WeakPolarHBondContact O-CB 3.29Å; L83-A87 PolarHBondContact O-N 3.46Å; L83-I234 HydrophobicContact CD1-CG2 4.43Å; L83-L264 HydrophobicContact CD1-CD2 3.8Å; L83-L264 HydrophobicContact CD2-CD2 3.69Å; L83-L264 HydrophobicContact CG-CD2 4.39Å; L83-L368 HydrophobicContact CD2-CD1 3.94Å; L83-V371 HydrophobicContact CD2-CG1 3.83Å; L83-V371 HydrophobicContact CG-CG1 4.49Å
84	V	98	Very high	89.7	Confident	2 Å²	2	24.5 Å²	24.5	1%	0.012	12%	0.122	C	C	.	.	H	α-helix	trans	-65.8	-44.1	179.9	173.8	0	0	0	0	111.3	R80 P81 L82 L86 A87 A88 I127 A128 A131 S237 V241	R80-V84 VanDerWaalsContact O-CG2 3.26Å; R80-V84 WeakPolarHBondContact O-CG2 3.41Å; R80-V84 PolarHBondContact O-N 3.08Å; P81-V84 PolarHBondContact O-N 3.42Å; L82-V84 VanDerWaalsContact C-N 3.34Å; L82-V84 PolarHBondContact O-N 3.04Å; V84-L86 PolarHBondContact O-N 3.05Å; V84-A87 PolarHBondContact O-N 2.85Å; V84-A88 PolarHBondContact O-N 3.29Å; V84-I127 HydrophobicContact CG1-CB 4.46Å; V84-I127 HydrophobicContact CG1-CG2 3.94Å; V84-A128 HydrophobicContact CB-CB 4.22Å; V84-A128 HydrophobicContact CG1-CB 3.92Å; V84-A131 HydrophobicContact CG2-CB 4.32Å; V84-S237 VanDerWaalsContact CG2-CB 3.41Å; V84-V241 HydrophobicContact CG1-CG1 3.56Å
85	T	97.6	Very high	90.8	Very high	5 Å²	5	24.8 Å²	24.8	3%	0.031	12%	0.123	C	C	.	.	H	α-helix	trans	-61.2	-43.8	175.4	-64.2	0	0	0	0	111.6	P81 L82 A88 A89 L116 V120	P81-T85 WeakPolarHBondContact O-CB 3.26Å; P81-T85 PolarHBondContact O-N 3.11Å; P81-T85 PolarHBondContact O-OG1 3.17Å; L82-T85 PolarHBondContact O-N 3.11Å; T85-A88 WeakPolarHBondContact O-CB 3.38Å; T85-A88 PolarHBondContact O-N 3.42Å; T85-A89 WeakPolarHBondContact O-CB 3.45Å; T85-A89 PolarHBondContact O-N 2.97Å; T85-L116 HydrophobicContact CG2-CD1 3.85Å; T85-V120 HydrophobicContact CG2-CG2 4.16Å
86	L	97.4	Very high	91.5	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-71.6	-32	177.9	-69.3	176.4	0	0	0	112.7	L38 L39 A42 L82 L83 V84 A89 C90 A367 L368 V371	L38-L86 HydrophobicContact CD2-CD2 3.37Å; L39-L86 HydrophobicContact CD1-CD1 4.3Å; A42-L86 HydrophobicContact CB-CD2 4.04Å; L82-L86 HydrophobicContact CD1-CD1 3.93Å; L82-L86 HydrophobicContact CD1-CG 4.2Å; L82-L86 HydrophobicContact CG-CD1 4.11Å; L82-L86 WeakPolarHBondContact O-CB 3.28Å; L82-L86 WeakPolarHBondContact O-CG 3.44Å; L82-L86 PolarHBondContact O-N 3.2Å; L83-L86 PolarHBondContact O-N 3.26Å; V84-L86 PolarHBondContact O-N 3.05Å; L86-A89 PolarHBondContact O-N 3.44Å; L86-C90 VanDerWaalsContact O-CB 3.29Å; L86-C90 WeakPolarHBondContact O-CB 3.46Å; L86-C90 PolarHBondContact O-N 3.38Å; L86-A367 HydrophobicContact CD2-CB 4.14Å; L86-L368 HydrophobicContact CB-CB 4.08Å; L86-L368 HydrophobicContact CB-CD1 3.77Å; L86-L368 HydrophobicContact CB-CG 4.44Å; L86-V371 HydrophobicContact CD1-CB 4.09Å; L86-V371 HydrophobicContact CD1-CG2 3.6Å
87	A	98.4	Very high	91.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64.5	-43	171.2	0	0	0	0	0	111.5	L83 V84 C90 A91 C238 V241 M257 L368	L83-A87 VanDerWaalsContact O-CB 3.26Å; L83-A87 WeakPolarHBondContact O-CB 3.29Å; L83-A87 PolarHBondContact O-N 3.46Å; V84-A87 PolarHBondContact O-N 2.85Å; A87-C90 WeakPolarHBondContact O-CB 3.26Å; A87-C90 PolarHBondContact O-N 3.37Å; A87-A91 WeakPolarHBondContact O-CB 3.33Å; A87-A91 PolarHBondContact O-N 3.23Å; A87-C238 HydrophobicContact CB-CB 4.26Å; A87-V241 HydrophobicContact CB-CG2 3.98Å; A87-M257 HydrophobicContact CB-CE 4.31Å; A87-M257 HydrophobicContact CB-SD 3.83Å; A87-M257 WeakPolarHBondContact O-CE 3.37Å; A87-L368 HydrophobicContact CB-CD2 4.27Å
88	A	98	Very high	90.2	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60	-48.4	173.2	0	0	0	0	0	111.5	V84 T85 C90 A91 N92 V120 Q124 V241	V84-A88 PolarHBondContact O-N 3.29Å; T85-A88 WeakPolarHBondContact O-CB 3.38Å; T85-A88 PolarHBondContact O-N 3.42Å; A88-C90 VanDerWaalsContact C-N 3.31Å; A88-C90 PolarHBondContact O-N 3.27Å; A88-A91 PolarHBondContact O-N 3.36Å; A88-N92 PolarHBondContact O-N 3.38Å; A88-V120 HydrophobicContact CB-CG1 3.9Å; A88-V120 HydrophobicContact CB-CG2 4.22Å; A88-Q124 HydrophobicContact CB-CB 3.82Å; A88-Q124 HydrophobicContact CB-CG 4.06Å; A88-V241 HydrophobicContact CB-CB 3.78Å; A88-V241 HydrophobicContact CB-CG1 4.13Å; A88-V241 HydrophobicContact CB-CG2 4.05Å
89	A	96.3	Very high	88.5	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-59.6	-41.7	177.1	0	0	0	0	0	112.1	T85 L86 S93 L119 V120 S364	T85-A89 WeakPolarHBondContact O-CB 3.45Å; T85-A89 PolarHBondContact O-N 2.97Å; L86-A89 PolarHBondContact O-N 3.44Å; A89-S93 VanDerWaalsContact O-CB 3.29Å; A89-S93 WeakPolarHBondContact O-CB 3.47Å; A89-S93 PolarHBondContact O-N 2.95Å; A89-S93 PolarHBondContact O-OG 2.88Å; A89-L119 HydrophobicContact CB-CD2 3.72Å; A89-L119 HydrophobicContact CB-CG 3.81Å; A89-V120 HydrophobicContact CB-CG2 3.95Å; A89-S364 VanDerWaalsContact C-CB 3.48Å; A89-S364 PolarHBondContact O-OG 3.35Å
90	C	96.8	Very high	86.2	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.4	-46.2	175.7	-176.6	0	0	0	0	111.8	L86 A87 A88 S93 H94 M257 L368	L86-C90 VanDerWaalsContact O-CB 3.29Å; L86-C90 WeakPolarHBondContact O-CB 3.46Å; L86-C90 PolarHBondContact O-N 3.38Å; A87-C90 WeakPolarHBondContact O-CB 3.26Å; A87-C90 PolarHBondContact O-N 3.37Å; A88-C90 VanDerWaalsContact C-N 3.31Å; A88-C90 PolarHBondContact O-N 3.27Å; C90-S93 PolarHBondContact O-N 3.4Å; C90-H94 PolarHBondContact O-N 2.88Å; C90-M257 HydrophobicContact CB-CE 4.35Å; C90-L368 HydrophobicContact CB-CD2 4.2Å
91	A	97.6	Very high	83.9	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.1	-45.8	177.9	0	0	0	0	0	112.1	A87 A88 H94 A242 T245 L249 M257	A87-A91 WeakPolarHBondContact O-CB 3.33Å; A87-A91 PolarHBondContact O-N 3.23Å; A88-A91 PolarHBondContact O-N 3.36Å; A91-H94 WeakPolarHBondContact O-CB 3.31Å; A91-H94 PolarHBondContact O-N 3.42Å; A91-A242 HydrophobicContact CB-CB 4.43Å; A91-T245 WeakPolarHBondContact CB-OG1 3.3Å; A91-L249 HydrophobicContact CB-CD1 3.77Å; A91-M257 HydrophobicContact CB-CE 4.26Å
92	N	95.8	Very high	81.5	Confident	14 Å²	14	35.6 Å²	35.6	8%	0.075	20%	0.2	C	C	.	.	H	α-helix	trans	-68.4	-42.4	177.8	-65.8	-12.7	0	0	0	111.9	A88 H94 I95 E96 L119 Q124 T245	A88-N92 PolarHBondContact O-N 3.38Å; N92-H94 PolarHBondContact O-N 3.41Å; N92-I95 PolarHBondContact O-N 3.33Å; N92-E96 PolarHBondContact O-N 3.45Å; N92-L119 HydrophobicContact CB-CD1 4.48Å; N92-L119 PolarHBondContact ND2-O 3.28Å; N92-Q124 PolarHBondContact ND2-OE1 2.92Å; N92-Q124 PolarHBondContact OD1-NE2 3.23Å; N92-T245 WeakPolarHBondContact OD1-CG2 3.3Å
93	S	93.9	Very high	79.2	Confident	10 Å²	10	39.2 Å²	39.2	7%	0.07	22%	0.223	C	C	.	.	H	α-helix	trans	-60.1	-33	177.1	-57.4	0	0	0	0	112.3	A89 C90 I95 S364	A89-S93 VanDerWaalsContact O-CB 3.29Å; A89-S93 WeakPolarHBondContact O-CB 3.47Å; A89-S93 PolarHBondContact O-N 2.95Å; A89-S93 PolarHBondContact O-OG 2.88Å; C90-S93 PolarHBondContact O-N 3.4Å; S93-I95 VanDerWaalsContact C-N 3.26Å; S93-I95 PolarHBondContact O-N 3.43Å; S93-S364 WeakPolarHBondContact OG-CB 3.25Å; S93-S364 PolarHBondContact OG-OG 3.42Å
94	H	94.7	Very high	77	Confident	15 Å²	15	47.4 Å²	47.4	7%	0.069	25%	0.254	C	S	.	.	H	α-helix	trans	-61.8	-36.2	175.5	179.3	99.8	0	0	0	112.1	C90 A91 N92 H253 F359 R360	C90-H94 PolarHBondContact O-N 2.88Å; A91-H94 WeakPolarHBondContact O-CB 3.31Å; A91-H94 PolarHBondContact O-N 3.42Å; N92-H94 PolarHBondContact O-N 3.41Å; H94-H253 AromaticContact CE1-CD2 3.74Å; H94-H253 AromaticContact CE1-CE1 3.46Å; H94-H253 PolarHBondContact CE1-CE1 3.14Å; H94-H253 VanDerWaalsContact CE1-CE1 3.46Å; H94-H253 AromaticContact CE1-NE2 3.05Å; H94-H253 PolarHBondContact CE1-NE2 3.45Å; H94-H253 AromaticContact ND1-NE2 3.91Å; H94-H253 AromaticContact NE2-CE1 3.32Å; H94-H253 PolarHBondContact NE2-CE1 2.96Å; H94-H253 VanDerWaalsContact NE2-CE1 3.32Å; H94-H253 AromaticContact NE2-ND1 3.93Å; H94-H253 AromaticContact NE2-NE2 3.42Å; H94-H253 PolarHBondContact NE2-NE2 3.39Å; H94-F359 HydrophobicContact CB-CD1 3.92Å; H94-F359 WeakPolarHBondContact ND1-CA 3.32Å; H94-F359 AromaticContact ND1-CD1 3.87Å; H94-R360 PolarHBondContact ND1-N 3.26Å; H94-R360 VanDerWaalsContact ND1-N 3.18Å
95	I	89.3	Confident	75	Confident	18 Å²	18	50.2 Å²	50.2	9%	0.092	26%	0.264	C	S	.	.	H	α-helix	trans	-84.1	-36.9	-179	-68.7	-62.9	0	0	0	112.7	N92 S93 C97 N98 S99 T245 P247 L249	N92-I95 PolarHBondContact O-N 3.33Å; S93-I95 VanDerWaalsContact C-N 3.26Å; S93-I95 PolarHBondContact O-N 3.43Å; I95-C97 PolarHBondContact O-N 2.91Å; I95-C97 VanDerWaalsContact O-N 3.13Å; I95-N98 WeakPolarHBondContact O-CA 3.49Å; I95-N98 WeakPolarHBondContact O-CB 3.36Å; I95-N98 PolarHBondContact O-N 3.4Å; I95-S99 PolarHBondContact O-N 3.27Å; I95-T245 HydrophobicContact CB-CG2 4.33Å; I95-T245 HydrophobicContact CG1-CG2 3.66Å; I95-P247 VanDerWaalsContact CG2-CD 3.43Å; I95-P247 HydrophobicContact CG2-CG 3.65Å; I95-L249 HydrophobicContact CD1-CD2 3.66Å; I95-L249 HydrophobicContact CD1-CG 4.38Å; I95-L249 HydrophobicContact CG1-CD2 3.74Å; I95-L249 HydrophobicContact CG1-CG 4.24Å
96	E	75.4	Confident	72.6	Confident	93 Å²	93	58.6 Å²	58.6	44%	0.435	30%	0.303	S	S	.	.	H	α-helix	trans	-54.9	-34.2	179	-75.3	-175.9	173.5	0	0	112.3	N92 N98 S99	N92-E96 PolarHBondContact O-N 3.45Å; E96-N98 PolarHBondContact O-N 2.92Å; E96-N98 VanDerWaalsContact O-N 3.16Å; E96-S99 CarbonylContact O-C 3.58Å; E96-S99 PolarHBondContact O-N 2.92Å
97	C	60	Low	70.2	Confident	74 Å²	74	61 Å²	61	50%	0.5	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-7.3	174.7	-58	0	0	0	0	114.5	I95 R360	I95-C97 PolarHBondContact O-N 2.91Å; I95-C97 VanDerWaalsContact O-N 3.13Å; C97-R360 VanDerWaalsContact C-NH1 3.29Å; C97-R360 PolarHBondContact O-NH1 3.45Å
98	N	53.9	Low	67.6	Low	96 Å²	96	64.5 Å²	64.5	51%	0.513	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-19.6	175.6	-78.7	-30.2	0	0	0	113.5	I95 E96 R360	I95-N98 WeakPolarHBondContact O-CA 3.49Å; I95-N98 WeakPolarHBondContact O-CB 3.36Å; I95-N98 PolarHBondContact O-N 3.4Å; E96-N98 PolarHBondContact O-N 2.92Å; E96-N98 VanDerWaalsContact O-N 3.16Å; N98-R360 PolarHBondContact OD1-NH1 2.85Å; N98-R360 PolarHBondContact OD1-NH2 3.44Å
99	S	48.8	Very low	65.1	Low	38 Å²	38	74.6 Å²	74.6	27%	0.266	39%	0.39	S	S	.	.			trans	-149.5	108.9	-176.2	-177.2	0	0	0	0	110.5	I95 E96 L101	I95-S99 PolarHBondContact O-N 3.27Å; E96-S99 CarbonylContact O-C 3.58Å; E96-S99 PolarHBondContact O-N 2.92Å; S99-L101 PolarHBondContact O-N 2.92Å; S99-L101 VanDerWaalsContact O-N 3.15Å; S99-L101 PolarHBondContact OG-N 3.31Å
100	P	40.6	Very low	62.8	Low	120 Å²	120	78.6 Å²	78.6	78%	0.779	42%	0.415	S	S	*	.			trans	-72.5	5.9	171.6	28.8	-31.8	0	0	0	113.2	I102	P100-I102 PolarHBondContact O-N 3.39Å
101	L	43.1	Very low	60.6	Low	149 Å²	149	86.7 Å²	86.7	78%	0.78	46%	0.458	S	S	*	.			trans	-73.9	78	167.4	-69.2	168.4	0	0	0	108.7	S99 V103	S99-L101 PolarHBondContact O-N 2.92Å; S99-L101 VanDerWaalsContact O-N 3.15Å; S99-L101 PolarHBondContact OG-N 3.31Å; L101-V103 PolarHBondContact O-N 2.82Å
102	I	44.9	Very low	58.7	Low	98 Å²	98	91.4 Å²	91.4	50%	0.503	48%	0.483	S	S	.	.			trans	-56.8	104.3	176.2	-70.7	168.4	0	0	0	108.8	P100 R104	P100-I102 PolarHBondContact O-N 3.39Å; I102-R104 HydrophobicContact CG2-CB 3.45Å; I102-R104 VanDerWaalsContact CG2-CB 3.45Å; I102-R104 VanDerWaalsContact CG2-CD 3.45Å; I102-R104 HydrophobicContact CG2-CG 3.18Å; I102-R104 PolarHBondContact O-N 3.49Å
103	V	47.1	Very low	57.9	Low	91 Å²	91	95 Å²	95	55%	0.552	51%	0.505	S	S	*	.			trans	-76.8	76	148.9	-175.1	0	0	0	0	105.4	L101 Y105	L101-V103 PolarHBondContact O-N 2.82Å; V103-Y105 HydrophobicContact CG1-CD1 4.19Å; V103-Y105 HydrophobicContact CG1-CE1 3.99Å; V103-Y105 PolarHBondContact O-N 3Å; V103-Y105 VanDerWaalsContact O-N 3.09Å
104	R	50.7	Low	57.7	Low	173 Å²	173	95.6 Å²	95.6	65%	0.653	51%	0.506	S	S	*	.			trans	-65.5	110.4	158.9	-100	160.8	-157.9	-144.8	6.5	102.6	I102 E106	I102-R104 HydrophobicContact CG2-CB 3.45Å; I102-R104 VanDerWaalsContact CG2-CB 3.45Å; I102-R104 VanDerWaalsContact CG2-CD 3.45Å; I102-R104 HydrophobicContact CG2-CG 3.18Å; I102-R104 PolarHBondContact O-N 3.49Å; R104-E106 PolarHBondContact O-N 3.41Å
105	Y	55.4	Low	57.5	Low	60 Å²	60	97.6 Å²	97.6	24%	0.235	52%	0.517	C	S	.	.			trans	-56.6	113.5	168.2	-60.7	-78	0	0	0	105.9	V103 S107 S121	V103-Y105 HydrophobicContact CG1-CD1 4.19Å; V103-Y105 HydrophobicContact CG1-CE1 3.99Å; V103-Y105 PolarHBondContact O-N 3Å; V103-Y105 VanDerWaalsContact O-N 3.09Å; Y105-S107 PolarHBondContact O-N 3.16Å; Y105-S121 VanDerWaalsContact CE2-CA 3.48Å; Y105-S121 VanDerWaalsContact OH-CB 3.26Å; Y105-S121 WeakPolarHBondContact OH-CB 3.19Å
106	E	46.7	Very low	57.6	Low	181 Å²	181	96.7 Å²	96.7	85%	0.846	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-53.7	127.5	169.8	-71.3	179	168.2	0	0	106.4	R104	R104-E106 PolarHBondContact O-N 3.41Å
107	S	47.3	Very low	58.4	Low	50 Å²	50	92.7 Å²	92.7	35%	0.35	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-54.7	128.7	170.3	-175.9	0	0	0	0	106.2	Y105 E109	Y105-S107 PolarHBondContact O-N 3.16Å; S107-E109 PolarHBondContact O-N 3.14Å
108	P	44	Very low	59.7	Low	74 Å²	74	94.4 Å²	94.4	48%	0.481	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-50.7	146.8	166.9	-19.5	29.8	0	0	0	108.4	T110	P108-T110 HydrophobicContact CB-CG2 4.46Å; P108-T110 PolarHBondContact O-N 3.06Å
109	E	44.1	Very low	61.5	Low	212 Å²	212	90.2 Å²	90.2	99%	0.991	47%	0.47	S	S	*	.	S	Bend	trans	-62.9	18	177.2	-63.6	-179.5	157.3	0	0	113.7	S107	S107-E109 PolarHBondContact O-N 3.14Å
110	T	48.4	Very low	63.6	Low	85 Å²	85	88.4 Å²	88.4	52%	0.521	46%	0.457	S	S	.	.	S	Bend	trans	-91.6	140.2	176.5	57.7	0	0	0	0	110.6	P108 D112	P108-T110 HydrophobicContact CB-CG2 4.46Å; P108-T110 PolarHBondContact O-N 3.06Å; T110-D112 PolarHBondContact O-N 2.79Å
111	D	51.4	Low	66.2	Low	170 Å²	170	82.9 Å²	82.9	91%	0.909	42%	0.421	S	S	*	.	S	Bend	trans	-55.3	-16.9	-179.7	-79.6	-34.5	0	0	0	115.3	V113	D111-V113 VanDerWaalsContact C-N 3.34Å; D111-V113 PolarHBondContact O-N 3.46Å
112	D	57.4	Low	68.6	Low	99 Å²	99	78.6 Å²	78.6	53%	0.529	40%	0.403	S	S	.	.			trans	-82.7	74	175.1	-81.9	-35.3	0	0	0	111.8	T110 R114	T110-D112 PolarHBondContact O-N 2.79Å; D112-R114 PolarHBondContact O-N 2.99Å
113	V	78.2	Confident	71	Confident	89 Å²	89	78.9 Å²	78.9	54%	0.539	40%	0.4	S	S	.	.			trans	-74.4	97.7	174.9	-173.2	0	0	0	0	109.4	D111 N115	D111-V113 VanDerWaalsContact C-N 3.34Å; D111-V113 PolarHBondContact O-N 3.46Å; V113-N115 PolarHBondContact O-N 2.9Å
114	R	89.8	Confident	73.4	Confident	23 Å²	23	74.5 Å²	74.5	9%	0.087	37%	0.374	C	S	.	.			trans	-55.3	128.5	168.9	-60.6	-178.6	-61.9	110.5	1.5	109.4	L48 D112 L116 A117 V120 H125	L48-R114 HydrophobicContact CD1-CG 4.24Å; D112-R114 PolarHBondContact O-N 2.99Å; R114-L116 PolarHBondContact O-N 3.23Å; R114-A117 HydrophobicContact CB-CB 4.12Å; R114-A117 WeakPolarHBondContact O-CB 3.4Å; R114-A117 PolarHBondContact O-N 3.38Å; R114-V120 PolarHBondContact NH1-O 3.5Å; R114-V120 PolarHBondContact NH2-O 3.01Å; R114-H125 VanDerWaalsContact CD-CE1 3.42Å; R114-H125 WeakPolarHBondContact CD-CE1 3.43Å; R114-H125 WeakPolarHBondContact CD-ND1 3.44Å
115	N	91.1	Very high	75.5	Confident	56 Å²	56	66.5 Å²	66.5	30%	0.299	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-31.4	-177.5	-62.2	-96.7	0	0	0	111.8	N41 K44 D45 V113 Y118	N41-N115 HydrophobicContact CB-CB 3.65Å; K44-N115 WeakPolarHBondContact CB-ND2 3.47Å; D45-N115 VanDerWaalsContact CG-N 3.35Å; D45-N115 WeakPolarHBondContact OD1-CB 3.45Å; D45-N115 PolarHBondContact OD1-N 3.47Å; D45-N115 PolarHBondContact OD1-ND2 3.33Å; D45-N115 PolarHBondContact OD2-N 2.99Å; V113-N115 PolarHBondContact O-N 2.9Å; N115-Y118 VanDerWaalsContact O-CD1 3.31Å; N115-Y118 WeakPolarHBondContact O-CD1 3.43Å; N115-Y118 WeakPolarHBondContact O-CE1 3.49Å
116	L	92.1	Very high	77.5	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	17.6	174.5	-60.9	-176.7	0	0	0	113	L38 N41 A42 D45 T85 R114 Y118 L119 V120	L38-L116 HydrophobicContact CG-CD2 4.35Å; N41-L116 HydrophobicContact CB-CD2 3.98Å; N41-L116 HydrophobicContact CB-CG 4.33Å; A42-L116 HydrophobicContact CB-CD1 3.73Å; D45-L116 WeakPolarHBondContact OD2-CB 3.27Å; D45-L116 PolarHBondContact OD2-N 3.33Å; T85-L116 HydrophobicContact CG2-CD1 3.85Å; R114-L116 PolarHBondContact O-N 3.23Å; L116-Y118 HydrophobicContact CD2-CE1 4.19Å; L116-Y118 PolarHBondContact O-N 3.08Å; L116-Y118 VanDerWaalsContact O-N 3.16Å; L116-L119 CarbonylContact O-C 3.45Å; L116-L119 PolarHBondContact O-N 3.15Å; L116-V120 HydrophobicContact CB-CG2 4.21Å; L116-V120 PolarHBondContact O-N 3.18Å
117	A	90.6	Very high	79.9	Confident	9 Å²	9	57.2 Å²	57.2	7%	0.074	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-33.3	177.5	0	0	0	0	0	113.2	R114 L119	R114-A117 HydrophobicContact CB-CB 4.12Å; R114-A117 WeakPolarHBondContact O-CB 3.4Å; R114-A117 PolarHBondContact O-N 3.38Å; A117-L119 PolarHBondContact O-N 3.32Å
118	Y	88.2	Confident	82.3	Confident	110 Å²	110	54.9 Å²	54.9	43%	0.431	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-18.4	177.8	72.1	-90.2	0	0	0	113.7	N115 L116	N115-Y118 VanDerWaalsContact O-CD1 3.31Å; N115-Y118 WeakPolarHBondContact O-CD1 3.43Å; N115-Y118 WeakPolarHBondContact O-CE1 3.49Å; L116-Y118 HydrophobicContact CD2-CE1 4.19Å; L116-Y118 PolarHBondContact O-N 3.08Å; L116-Y118 VanDerWaalsContact O-N 3.16Å
119	L	91.3	Very high	84.8	Confident	7 Å²	7	51.8 Å²	51.8	4%	0.037	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	-21.4	-170.5	-174	57.2	0	0	0	113.6	L38 A89 N92 L116 A117	L38-L119 HydrophobicContact CD1-CD2 4.01Å; A89-L119 HydrophobicContact CB-CD2 3.72Å; A89-L119 HydrophobicContact CB-CG 3.81Å; N92-L119 HydrophobicContact CB-CD1 4.48Å; N92-L119 PolarHBondContact ND2-O 3.28Å; L116-L119 CarbonylContact O-C 3.45Å; L116-L119 PolarHBondContact O-N 3.15Å; A117-L119 PolarHBondContact O-N 3.32Å
120	V	94.3	Very high	87.2	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.006	22%	0.218	C	C	.	.	S	Bend	trans	-126.6	118.7	-178.7	179.4	0	0	0	0	108.9	T85 A88 A89 R114 L116 Q124	T85-V120 HydrophobicContact CG2-CG2 4.16Å; A88-V120 HydrophobicContact CB-CG1 3.9Å; A88-V120 HydrophobicContact CB-CG2 4.22Å; A89-V120 HydrophobicContact CB-CG2 3.95Å; R114-V120 PolarHBondContact NH1-O 3.5Å; R114-V120 PolarHBondContact NH2-O 3.01Å; L116-V120 HydrophobicContact CB-CG2 4.21Å; L116-V120 PolarHBondContact O-N 3.18Å; V120-Q124 HydrophobicContact CG1-CB 3.83Å
121	S	93.7	Very high	89.6	Confident	4 Å²	4	37.7 Å²	37.7	3%	0.028	19%	0.193	C	C	.	.			trans	-65.2	155.7	-176	80.3	0	0	0	0	112.2	Y105 K123 Q124 H125	Y105-S121 VanDerWaalsContact CE2-CA 3.48Å; Y105-S121 VanDerWaalsContact OH-CB 3.26Å; Y105-S121 WeakPolarHBondContact OH-CB 3.19Å; S121-K123 PolarHBondContact O-N 3.4Å; S121-Q124 PolarHBondContact O-N 2.93Å; S121-Q124 VanDerWaalsContact O-N 3.14Å; S121-Q124 WeakPolarHBondContact OG-CB 3.3Å; S121-Q124 VanDerWaalsContact OG-CG 3.3Å; S121-Q124 WeakPolarHBondContact OG-CG 3.45Å; S121-Q124 PolarHBondContact OG-N 3.27Å; S121-Q124 PolarHBondContact OG-OE1 2.71Å; S121-H125 PolarHBondContact O-N 2.79Å
122	P	93.4	Very high	91.6	Very high	59 Å²	59	29.9 Å²	29.9	38%	0.383	15%	0.151	S	C	.	.	H	α-helix	trans	-53.6	-41.2	173.2	-27.3	35.3	0	0	0	112.7	H125 E126	P122-H125 WeakPolarHBondContact O-CB 3.41Å; P122-H125 PolarHBondContact O-N 3.32Å; P122-E126 WeakPolarHBondContact O-CG 3.44Å; P122-E126 PolarHBondContact O-N 2.9Å
123	K	96.1	Very high	93.5	Very high	103 Å²	103	25.2 Å²	25.2	45%	0.448	13%	0.126	S	C	.	.	H	α-helix	trans	-66.3	-39.3	178.3	-66.6	-172.1	176.9	-163.3	0	112.6	S121 H125 E126 I127 I184 L244	S121-K123 PolarHBondContact O-N 3.4Å; K123-H125 VanDerWaalsContact C-N 3.35Å; K123-E126 PolarHBondContact O-N 3.49Å; K123-I127 PolarHBondContact O-N 2.89Å; K123-I184 HydrophobicContact CB-CG2 4.35Å; K123-I184 HydrophobicContact CD-CG2 4.16Å; K123-I184 VanDerWaalsContact CE-O 3.31Å; K123-I184 WeakPolarHBondContact CE-O 3.47Å; K123-I184 HydrophobicContact CG-CG2 4.44Å; K123-I184 PolarHBondContact NZ-O 3.32Å; K123-L244 HydrophobicContact CB-CD1 3.99Å; K123-L244 HydrophobicContact CB-CD2 4.4Å; K123-L244 HydrophobicContact CD-CD2 4.26Å
124	Q	97.3	Very high	94.3	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-68.5	-35.8	176	-72.9	165.6	-36.4	0	0	111.8	A88 N92 V120 S121 I127 A128 V241 L244	A88-Q124 HydrophobicContact CB-CB 3.82Å; A88-Q124 HydrophobicContact CB-CG 4.06Å; N92-Q124 PolarHBondContact ND2-OE1 2.92Å; N92-Q124 PolarHBondContact OD1-NE2 3.23Å; V120-Q124 HydrophobicContact CG1-CB 3.83Å; S121-Q124 PolarHBondContact O-N 2.93Å; S121-Q124 VanDerWaalsContact O-N 3.14Å; S121-Q124 WeakPolarHBondContact OG-CB 3.3Å; S121-Q124 VanDerWaalsContact OG-CG 3.3Å; S121-Q124 WeakPolarHBondContact OG-CG 3.45Å; S121-Q124 PolarHBondContact OG-N 3.27Å; S121-Q124 PolarHBondContact OG-OE1 2.71Å; Q124-I127 WeakPolarHBondContact O-CB 3.45Å; Q124-I127 PolarHBondContact O-N 2.7Å; Q124-A128 PolarHBondContact O-N 3.43Å; Q124-V241 HydrophobicContact CB-CB 4.34Å; Q124-V241 HydrophobicContact CB-CG1 4.06Å; Q124-V241 HydrophobicContact CG-CB 3.98Å; Q124-V241 HydrophobicContact CG-CG1 4.19Å; Q124-V241 PolarHBondContact NE2-O 3.04Å; Q124-L244 HydrophobicContact CG-CB 3.9Å; Q124-L244 HydrophobicContact CG-CD1 4.4Å
125	H	95.6	Very high	94.6	Very high	5 Å²	5	21 Å²	21	2%	0.023	10%	0.102	C	C	.	.	H	α-helix	trans	-62.8	-41.3	173.2	-177.3	79.7	0	0	0	112.1	I49 E52 R114 S121 P122 K123 I127 A128 K129	I49-H125 WeakPolarHBondContact CG1-CE1 3.49Å; E52-H125 IonicContact OE1-NE2 3.44Å; E52-H125 PolarHBondContact OE1-NE2 2.8Å; E52-H125 IonicContact OE2-CD2 3.65Å; E52-H125 IonicContact OE2-CE1 3.61Å; E52-H125 IonicContact OE2-NE2 2.66Å; E52-H125 PolarHBondContact OE2-NE2 3.21Å; R114-H125 VanDerWaalsContact CD-CE1 3.42Å; R114-H125 WeakPolarHBondContact CD-CE1 3.43Å; R114-H125 WeakPolarHBondContact CD-ND1 3.44Å; S121-H125 PolarHBondContact O-N 2.79Å; P122-H125 WeakPolarHBondContact O-CB 3.41Å; P122-H125 PolarHBondContact O-N 3.32Å; K123-H125 VanDerWaalsContact C-N 3.35Å; H125-I127 VanDerWaalsContact C-N 3.26Å; H125-I127 PolarHBondContact O-N 3.43Å; H125-A128 WeakPolarHBondContact O-CB 3.29Å; H125-A128 PolarHBondContact O-N 3.45Å; H125-A128 VanDerWaalsContact O-N 3.08Å; H125-K129 PolarHBondContact O-N 3.43Å; H125-K129 VanDerWaalsContact O-N 3.15Å
126	E	96.1	Very high	94.7	Very high	46 Å²	46	18.5 Å²	18.5	22%	0.215	9%	0.088	C	C	.	.	H	α-helix	trans	-58.2	-36.8	172.2	-70.1	-55.5	132.3	0	0	112.3	P122 K123 A128 K129 I130 I184	P122-E126 WeakPolarHBondContact O-CG 3.44Å; P122-E126 PolarHBondContact O-N 2.9Å; K123-E126 PolarHBondContact O-N 3.49Å; E126-A128 VanDerWaalsContact C-N 3.34Å; E126-A128 PolarHBondContact O-N 2.82Å; E126-K129 WeakPolarHBondContact O-CB 3.28Å; E126-K129 PolarHBondContact O-N 3.02Å; E126-K129 IonicContact OE1-NZ 2.7Å; E126-K129 PolarHBondContact OE1-NZ 3.14Å; E126-K129 WeakPolarHBondContact OE2-CE 3.4Å; E126-K129 IonicContact OE2-NZ 3.43Å; E126-K129 PolarHBondContact OE2-NZ 3.01Å; E126-I130 HydrophobicContact CB-CD1 4.44Å; E126-I130 WeakPolarHBondContact O-CB 3.5Å; E126-I130 VanDerWaalsContact O-CD1 3.3Å; E126-I130 WeakPolarHBondContact O-CD1 3.46Å; E126-I130 WeakPolarHBondContact O-CG1 3.01Å; E126-I130 PolarHBondContact O-N 3.29Å; E126-I184 HydrophobicContact CB-CD1 3.85Å; E126-I184 HydrophobicContact CB-CG1 4.11Å
127	I	98.1	Very high	94.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-63.7	-38.8	175.1	-60.9	-64.8	0	0	0	111.9	V84 K123 Q124 H125 K129 I130 A131 L181 I184 V189 L193 A240 V241 L244	V84-I127 HydrophobicContact CG1-CB 4.46Å; V84-I127 HydrophobicContact CG1-CG2 3.94Å; K123-I127 PolarHBondContact O-N 2.89Å; Q124-I127 WeakPolarHBondContact O-CB 3.45Å; Q124-I127 PolarHBondContact O-N 2.7Å; H125-I127 VanDerWaalsContact C-N 3.26Å; H125-I127 PolarHBondContact O-N 3.43Å; I127-K129 VanDerWaalsContact C-N 3.34Å; I127-K129 PolarHBondContact O-N 3.45Å; I127-I130 HydrophobicContact CD1-CD1 4.35Å; I127-I130 PolarHBondContact O-N 2.88Å; I127-A131 WeakPolarHBondContact O-CB 3.39Å; I127-A131 PolarHBondContact O-N 3.33Å; I127-L181 HydrophobicContact CD1-CD2 4.32Å; I127-I184 HydrophobicContact CD1-CD1 3.42Å; I127-I184 VanDerWaalsContact CD1-CD1 3.42Å; I127-I184 HydrophobicContact CG1-CD1 3.96Å; I127-V189 HydrophobicContact CD1-CG1 3.54Å; I127-L193 HydrophobicContact CD1-CD1 3.73Å; I127-L193 HydrophobicContact CG2-CD1 4.33Å; I127-A240 HydrophobicContact CD1-CB 4.15Å; I127-A240 HydrophobicContact CG1-CB 4.37Å; I127-A240 HydrophobicContact CG2-CB 4.04Å; I127-V241 HydrophobicContact CB-CG1 3.75Å; I127-V241 HydrophobicContact CG1-CG1 4.27Å; I127-V241 HydrophobicContact CG2-CG1 3.73Å; I127-L244 HydrophobicContact CD1-CD1 4.35Å; I127-L244 HydrophobicContact CG1-CD1 3.74Å
128	A	97	Very high	95	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63	-41.2	175.8	0	0	0	0	0	111.6	I49 P81 V84 Q124 H125 E126 E132	I49-A128 HydrophobicContact CD1-CB 3.8Å; P81-A128 HydrophobicContact CB-CB 4.2Å; V84-A128 HydrophobicContact CB-CB 4.22Å; V84-A128 HydrophobicContact CG1-CB 3.92Å; Q124-A128 PolarHBondContact O-N 3.43Å; H125-A128 WeakPolarHBondContact O-CB 3.29Å; H125-A128 PolarHBondContact O-N 3.45Å; H125-A128 VanDerWaalsContact O-N 3.08Å; E126-A128 VanDerWaalsContact C-N 3.34Å; E126-A128 PolarHBondContact O-N 2.82Å; A128-E132 PolarHBondContact O-N 3.03Å
129	K	95.5	Very high	95.2	Very high	10 Å²	10	14.3 Å²	14.3	4%	0.043	7%	0.074	C	C	.	.	H	α-helix	trans	-61.1	-52.1	172.2	-72.8	163.9	45.6	174.2	0	111.9	I49 E52 I53 H125 E126 I127 A131 E132 M133	I49-K129 HydrophobicContact CB-CG 4.38Å; I49-K129 HydrophobicContact CG1-CG 4.19Å; I49-K129 HydrophobicContact CG2-CG 3.88Å; E52-K129 HydrophobicContact CB-CD 4.46Å; E52-K129 WeakPolarHBondContact OE2-CD 3.39Å; I53-K129 HydrophobicContact CD1-CB 4.33Å; I53-K129 HydrophobicContact CD1-CG 4.48Å; I53-K129 HydrophobicContact CG1-CB 4.14Å; I53-K129 HydrophobicContact CG1-CG 4.16Å; H125-K129 PolarHBondContact O-N 3.43Å; H125-K129 VanDerWaalsContact O-N 3.15Å; E126-K129 WeakPolarHBondContact O-CB 3.28Å; E126-K129 PolarHBondContact O-N 3.02Å; E126-K129 IonicContact OE1-NZ 2.7Å; E126-K129 PolarHBondContact OE1-NZ 3.14Å; E126-K129 WeakPolarHBondContact OE2-CE 3.4Å; E126-K129 IonicContact OE2-NZ 3.43Å; E126-K129 PolarHBondContact OE2-NZ 3.01Å; I127-K129 VanDerWaalsContact C-N 3.34Å; I127-K129 PolarHBondContact O-N 3.45Å; K129-A131 VanDerWaalsContact C-N 3.26Å; K129-A131 PolarHBondContact O-N 2.93Å; K129-E132 PolarHBondContact O-N 3.36Å; K129-E132 VanDerWaalsContact O-N 3.16Å; K129-M133 VanDerWaalsContact O-CG 3.26Å; K129-M133 WeakPolarHBondContact O-CG 3.32Å; K129-M133 PolarHBondContact O-N 3.12Å
130	I	96.6	Very high	95.2	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-58.1	-40.7	-179.5	-70.2	157.7	0	0	0	110.6	E126 I127 E132 M133 I134 L180 L181 I184 L193	E126-I130 HydrophobicContact CB-CD1 4.44Å; E126-I130 WeakPolarHBondContact O-CB 3.5Å; E126-I130 VanDerWaalsContact O-CD1 3.3Å; E126-I130 WeakPolarHBondContact O-CD1 3.46Å; E126-I130 WeakPolarHBondContact O-CG1 3.01Å; E126-I130 PolarHBondContact O-N 3.29Å; I127-I130 HydrophobicContact CD1-CD1 4.35Å; I127-I130 PolarHBondContact O-N 2.88Å; I130-E132 PolarHBondContact O-N 3.16Å; I130-M133 PolarHBondContact O-N 3.37Å; I130-I134 HydrophobicContact CG2-CD1 3.76Å; I130-I134 HydrophobicContact CG2-CG1 4.32Å; I130-I134 WeakPolarHBondContact O-CG1 3.15Å; I130-I134 PolarHBondContact O-N 2.94Å; I130-L180 HydrophobicContact CD1-CB 3.79Å; I130-L180 HydrophobicContact CG1-CB 3.87Å; I130-L180 HydrophobicContact CG1-CD1 4.16Å; I130-L181 HydrophobicContact CD1-CD2 4.11Å; I130-L181 HydrophobicContact CD1-CG 3.98Å; I130-L181 HydrophobicContact CG2-CD1 4.44Å; I130-L181 HydrophobicContact CG2-CG 4.25Å; I130-I184 HydrophobicContact CD1-CD1 3.72Å; I130-L193 HydrophobicContact CB-CD1 4.49Å; I130-L193 HydrophobicContact CG2-CD1 3.68Å
131	A	97.2	Very high	95.2	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.008	8%	0.08	C	C	.	.	H	α-helix	trans	-62.3	-43.2	177.8	0	0	0	0	0	112.5	V84 I127 K129 H135 L233 S237	V84-A131 HydrophobicContact CG2-CB 4.32Å; I127-A131 WeakPolarHBondContact O-CB 3.39Å; I127-A131 PolarHBondContact O-N 3.33Å; K129-A131 VanDerWaalsContact C-N 3.26Å; K129-A131 PolarHBondContact O-N 2.93Å; A131-H135 WeakPolarHBondContact O-CB 3.17Å; A131-H135 PolarHBondContact O-N 3.02Å; A131-L233 HydrophobicContact CB-CD1 4.19Å; A131-S237 WeakPolarHBondContact CB-OG 3.49Å
132	E	95	Very high	95	Very high	6 Å²	6	17.2 Å²	17.2	3%	0.028	9%	0.087	C	C	.	.	H	α-helix	trans	-69.1	-35	175.8	-173.6	60.3	-164.6	0	0	112	I53 F72 L78 P81 A128 K129 I130 H135 T136	I53-E132 HydrophobicContact CD1-CB 4.19Å; I53-E132 HydrophobicContact CD1-CG 4.33Å; F72-E132 HydrophobicContact CE1-CG 4.48Å; L78-E132 HydrophobicContact CD2-CG 4.11Å; P81-E132 WeakPolarHBondContact CD-OE2 3.28Å; P81-E132 HydrophobicContact CG-CB 3.98Å; P81-E132 HydrophobicContact CG-CG 4.24Å; A128-E132 PolarHBondContact O-N 3.03Å; K129-E132 PolarHBondContact O-N 3.36Å; K129-E132 VanDerWaalsContact O-N 3.16Å; I130-E132 PolarHBondContact O-N 3.16Å; E132-H135 PolarHBondContact O-N 3.14Å; E132-H135 IonicContact OE2-CD2 3.65Å; E132-T136 VanDerWaalsContact O-CB 3.31Å; E132-T136 WeakPolarHBondContact O-CB 3.48Å; E132-T136 PolarHBondContact O-N 3.38Å; E132-T136 PolarHBondContact O-OG1 3.4Å
133	M	95.5	Very high	94.7	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-65	-49.5	175.7	-70.1	170.9	71.6	0	0	111.6	I53 L57 F72 K129 I130 H135 T136 A137 I173 H176 S177 L180	I53-M133 HydrophobicContact CD1-CG 3.95Å; I53-M133 HydrophobicContact CG1-CG 3.99Å; I53-M133 HydrophobicContact CG1-SD 4.15Å; I53-M133 HydrophobicContact CG2-CG 3.92Å; I53-M133 HydrophobicContact CG2-SD 4.39Å; L57-M133 HydrophobicContact CD2-CE 4.08Å; F72-M133 HydrophobicContact CZ-CG 4.48Å; K129-M133 VanDerWaalsContact O-CG 3.26Å; K129-M133 WeakPolarHBondContact O-CG 3.32Å; K129-M133 PolarHBondContact O-N 3.12Å; I130-M133 PolarHBondContact O-N 3.37Å; M133-H135 VanDerWaalsContact C-N 3.31Å; M133-H135 PolarHBondContact O-N 2.92Å; M133-T136 PolarHBondContact O-N 3.24Å; M133-A137 WeakPolarHBondContact O-CB 3.36Å; M133-A137 PolarHBondContact O-N 2.87Å; M133-I173 HydrophobicContact CB-CG2 3.65Å; M133-I173 HydrophobicContact CE-CG2 4.33Å; M133-I173 HydrophobicContact CG-CG2 4.28Å; M133-I173 WeakPolarHBondContact O-CG2 3.41Å; M133-H176 HydrophobicContact CE-CB 3.73Å; M133-S177 WeakPolarHBondContact CB-OG 3.31Å; M133-L180 HydrophobicContact CE-CD1 4.26Å; M133-L180 HydrophobicContact SD-CD1 3.78Å
134	I	96.6	Very high	94.4	Very high	1 Å²	1	11.3 Å²	11.3	1%	0.005	6%	0.057	C	C	.	.	H	α-helix	trans	-59	-44.8	175.7	-68.3	170.2	0	0	0	110.4	I130 T136 A137 S138 L174 V196 L200 L233	I130-I134 HydrophobicContact CG2-CD1 3.76Å; I130-I134 HydrophobicContact CG2-CG1 4.32Å; I130-I134 WeakPolarHBondContact O-CG1 3.15Å; I130-I134 PolarHBondContact O-N 2.94Å; I134-T136 PolarHBondContact O-N 3.15Å; I134-A137 PolarHBondContact O-N 3.33Å; I134-S138 PolarHBondContact O-N 3.03Å; I134-L174 HydrophobicContact CG1-CD2 4.25Å; I134-V196 HydrophobicContact CG2-CG1 4.22Å; I134-L200 HydrophobicContact CG2-CD1 3.66Å; I134-L233 HydrophobicContact CB-CD1 4.38Å; I134-L233 HydrophobicContact CG2-CD1 4.23Å; I134-L233 HydrophobicContact CG2-CD2 4.32Å
135	H	94.6	Very high	94	Very high	23 Å²	23	15.7 Å²	15.7	11%	0.106	8%	0.08	C	C	.	.	H	α-helix	trans	-60.7	-44.8	176.1	178.3	41.4	0	0	0	112.6	R80 A131 E132 M133 S138 L139 L233	R80-H135 PolarHBondContact NH1-CE1 3.44Å; R80-H135 VanDerWaalsContact NH1-CE1 3.26Å; R80-H135 PolarHBondContact NH1-NE2 3.43Å; A131-H135 WeakPolarHBondContact O-CB 3.17Å; A131-H135 PolarHBondContact O-N 3.02Å; E132-H135 PolarHBondContact O-N 3.14Å; E132-H135 IonicContact OE2-CD2 3.65Å; M133-H135 VanDerWaalsContact C-N 3.31Å; M133-H135 PolarHBondContact O-N 2.92Å; H135-S138 PolarHBondContact O-N 3.28Å; H135-S138 PolarHBondContact O-OG 3.46Å; H135-L139 WeakPolarHBondContact O-CG 3.5Å; H135-L139 PolarHBondContact O-N 3.3Å; H135-L233 HydrophobicContact CB-CD2 3.84Å
136	T	93.3	Very high	93.4	Very high	3 Å²	3	19.4 Å²	19.4	2%	0.018	10%	0.1	C	C	.	.	H	α-helix	trans	-66.6	-40.7	-179.3	-59.1	0	0	0	0	111	Q71 F72 E132 M133 I134 L139 I140 I173	Q71-T136 HydrophobicContact CB-CG2 4.1Å; F72-T136 HydrophobicContact CD1-CG2 4.45Å; F72-T136 HydrophobicContact CE1-CG2 3.92Å; F72-T136 WeakPolarHBondContact CE1-OG1 3.42Å; F72-T136 HydrophobicContact CE2-CG2 4.16Å; F72-T136 HydrophobicContact CZ-CG2 3.74Å; E132-T136 VanDerWaalsContact O-CB 3.31Å; E132-T136 WeakPolarHBondContact O-CB 3.48Å; E132-T136 PolarHBondContact O-N 3.38Å; E132-T136 PolarHBondContact O-OG1 3.4Å; M133-T136 PolarHBondContact O-N 3.24Å; I134-T136 PolarHBondContact O-N 3.15Å; T136-L139 PolarHBondContact O-N 2.54Å; T136-I140 HydrophobicContact CG2-CD1 4.31Å; T136-I140 WeakPolarHBondContact O-CG1 3.5Å; T136-I140 PolarHBondContact O-N 3.5Å; T136-I140 VanDerWaalsContact O-N 3.13Å; T136-I173 HydrophobicContact CG2-CD1 4.22Å
137	A	94.8	Very high	92.8	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-59.9	-45.8	174.1	0	0	0	0	0	111.6	M133 I134 L139 I140 H141 I173 L174	M133-A137 WeakPolarHBondContact O-CB 3.36Å; M133-A137 PolarHBondContact O-N 2.87Å; I134-A137 PolarHBondContact O-N 3.33Å; A137-L139 VanDerWaalsContact C-N 3.29Å; A137-L139 PolarHBondContact O-N 3.15Å; A137-I140 PolarHBondContact O-N 3.19Å; A137-I140 VanDerWaalsContact O-N 3.17Å; A137-H141 PolarHBondContact O-N 2.92Å; A137-H141 VanDerWaalsContact O-N 3.08Å; A137-I173 HydrophobicContact CB-CB 4.08Å; A137-I173 HydrophobicContact CB-CG2 4.02Å; A137-L174 HydrophobicContact CB-CD1 4.42Å; A137-L174 HydrophobicContact CB-CD2 3.77Å; A137-L174 HydrophobicContact CB-CG 3.7Å
138	S	94.7	Very high	91.8	Very high	17 Å²	17	22.2 Å²	22.2	12%	0.119	13%	0.126	C	C	.	.	H	α-helix	trans	-60.7	-39.6	178	87.6	0	0	0	0	111.6	I134 H135 I140 H141 D142	I134-S138 PolarHBondContact O-N 3.03Å; H135-S138 PolarHBondContact O-N 3.28Å; H135-S138 PolarHBondContact O-OG 3.46Å; S138-I140 PolarHBondContact O-N 3.46Å; S138-H141 PolarHBondContact O-N 3.31Å; S138-D142 VanDerWaalsContact O-CB 3.27Å; S138-D142 WeakPolarHBondContact O-CB 3.33Å; S138-D142 PolarHBondContact O-N 3.3Å
139	L	91.7	Very high	91	Very high	15 Å²	15	24.9 Å²	24.9	8%	0.079	15%	0.148	C	C	.	.	H	α-helix	trans	-63.7	-39.3	176.4	-71.4	-179.3	0	0	0	113.2	H135 T136 A137 D143	H135-L139 WeakPolarHBondContact O-CG 3.5Å; H135-L139 PolarHBondContact O-N 3.3Å; T136-L139 PolarHBondContact O-N 2.54Å; A137-L139 VanDerWaalsContact C-N 3.29Å; A137-L139 PolarHBondContact O-N 3.15Å; L139-D143 WeakPolarHBondContact O-CB 3.38Å; L139-D143 VanDerWaalsContact O-CG 3.25Å; L139-D143 PolarHBondContact O-N 3.12Å
140	I	91.8	Very high	90.2	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-64.8	-43.3	178	-66.5	163.7	0	0	0	110.4	L67 Q71 T136 A137 S138 L144 A157 A166 I173	L67-I140 HydrophobicContact CD2-CD1 4.3Å; Q71-I140 HydrophobicContact CB-CD1 4.42Å; Q71-I140 HydrophobicContact CG-CD1 3.78Å; Q71-I140 HydrophobicContact CG-CG1 3.89Å; T136-I140 HydrophobicContact CG2-CD1 4.31Å; T136-I140 WeakPolarHBondContact O-CG1 3.5Å; T136-I140 PolarHBondContact O-N 3.5Å; T136-I140 VanDerWaalsContact O-N 3.13Å; A137-I140 PolarHBondContact O-N 3.19Å; A137-I140 VanDerWaalsContact O-N 3.17Å; S138-I140 PolarHBondContact O-N 3.46Å; I140-L144 PolarHBondContact O-N 3.42Å; I140-A157 HydrophobicContact CG2-CB 4.16Å; I140-A166 HydrophobicContact CG2-CB 4.06Å; I140-A166 WeakPolarHBondContact CG2-O 3.38Å; I140-I173 HydrophobicContact CD1-CD1 3.58Å
141	H	93.7	Very high	89.2	Confident	37 Å²	37	33.1 Å²	33.1	17%	0.171	19%	0.189	C	C	.	.	H	α-helix	trans	-70.1	-45.5	178.5	-67.4	161	0	0	0	111.9	A137 S138 D143 L144 I145 V167 G170 D171	A137-H141 PolarHBondContact O-N 2.92Å; A137-H141 VanDerWaalsContact O-N 3.08Å; S138-H141 PolarHBondContact O-N 3.31Å; H141-D143 PolarHBondContact O-N 3.43Å; H141-L144 WeakPolarHBondContact O-CB 3.39Å; H141-L144 PolarHBondContact O-N 3.19Å; H141-L144 VanDerWaalsContact O-N 3.14Å; H141-I145 WeakPolarHBondContact O-CG1 3.3Å; H141-I145 PolarHBondContact O-N 3.29Å; H141-V167 PolarHBondContact NE2-O 3.32Å; H141-V167 VanDerWaalsContact NE2-O 3.16Å; H141-G170 WeakPolarHBondContact NE2-CA 3.36Å; H141-D171 IonicContact CE1-OD1 3.92Å; H141-D171 PolarHBondContact CE1-OD1 3.41Å; H141-D171 VanDerWaalsContact CE1-OD1 3.24Å; H141-D171 IonicContact NE2-OD1 3.8Å; H141-D171 PolarHBondContact NE2-OD1 3.16Å
142	D	90.9	Very high	88	Confident	34 Å²	34	37.6 Å²	37.6	18%	0.182	21%	0.205	C	C	.	.	H	α-helix	trans	-58.3	-48.6	176.7	-76.5	5	0	0	0	111	S138 L144 I145 D146 K229	S138-D142 VanDerWaalsContact O-CB 3.27Å; S138-D142 WeakPolarHBondContact O-CB 3.33Å; S138-D142 PolarHBondContact O-N 3.3Å; D142-L144 PolarHBondContact O-N 3.45Å; D142-L144 VanDerWaalsContact O-N 3.15Å; D142-I145 PolarHBondContact O-N 3.46Å; D142-I145 VanDerWaalsContact O-N 3.1Å; D142-D146 WeakPolarHBondContact O-CB 3.19Å; D142-D146 PolarHBondContact O-N 3.37Å; D142-K229 IonicContact OD1-NZ 3.42Å; D142-K229 IonicContact OD2-NZ 3.82Å; D142-K229 PolarHBondContact OD2-NZ 3.1Å
143	D	87.4	Confident	86.9	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.016	24%	0.241	C	C	.	.	H	α-helix	trans	-56.7	-35.2	178.6	-80	-15.2	0	0	0	112	L139 H141 S147 A148 R151 Y158	L139-D143 WeakPolarHBondContact O-CB 3.38Å; L139-D143 VanDerWaalsContact O-CG 3.25Å; L139-D143 PolarHBondContact O-N 3.12Å; H141-D143 PolarHBondContact O-N 3.43Å; D143-S147 PolarHBondContact O-N 3.35Å; D143-A148 HydrophobicContact CB-CB 4.46Å; D143-A148 PolarHBondContact O-N 2.9Å; D143-R151 WeakPolarHBondContact OD1-CD 3.49Å; D143-R151 IonicContact OD1-CZ 3.71Å; D143-R151 IonicContact OD1-NE 3Å; D143-R151 PolarHBondContact OD1-NE 3.36Å; D143-R151 VanDerWaalsContact OD2-CB 3.26Å; D143-R151 WeakPolarHBondContact OD2-CB 3.44Å; D143-R151 VanDerWaalsContact OD2-CD 3.32Å; D143-R151 WeakPolarHBondContact OD2-CD 3.49Å; D143-R151 IonicContact OD2-NE 2.85Å; D143-Y158 WeakPolarHBondContact O-CD1 3.48Å; D143-Y158 WeakPolarHBondContact O-CE1 3.26Å
144	L	89.8	Confident	86	Confident	35 Å²	35	44.5 Å²	44.5	18%	0.183	26%	0.257	C	S	.	.	H	α-helix	trans	-72.2	-46.6	176.8	173.6	67.9	0	0	0	111.8	I140 H141 D142 S147 Y158 H163 A166 V167	I140-L144 PolarHBondContact O-N 3.42Å; H141-L144 WeakPolarHBondContact O-CB 3.39Å; H141-L144 PolarHBondContact O-N 3.19Å; H141-L144 VanDerWaalsContact O-N 3.14Å; D142-L144 PolarHBondContact O-N 3.45Å; D142-L144 VanDerWaalsContact O-N 3.15Å; L144-S147 PolarHBondContact O-N 3.02Å; L144-Y158 HydrophobicContact CB-CD1 4.44Å; L144-Y158 HydrophobicContact CD1-CD1 4.42Å; L144-Y158 HydrophobicContact CD1-CD2 4.35Å; L144-Y158 HydrophobicContact CD1-CG 3.94Å; L144-H163 HydrophobicContact CD1-CB 4.09Å; L144-H163 WeakPolarHBondContact CD1-CD2 3.33Å; L144-A166 HydrophobicContact CD2-CB 4.44Å; L144-V167 HydrophobicContact CD2-CG2 3.31Å
145	I	87.2	Confident	85.4	Confident	92 Å²	92	47.8 Å²	47.8	47%	0.472	28%	0.277	S	S	.	.	H	α-helix	trans	-63.4	-47.2	-179.5	-67	169	0	0	0	110.1	H141 D142 S147 E204	H141-I145 WeakPolarHBondContact O-CG1 3.3Å; H141-I145 PolarHBondContact O-N 3.29Å; D142-I145 PolarHBondContact O-N 3.46Å; D142-I145 VanDerWaalsContact O-N 3.1Å; I145-S147 PolarHBondContact O-N 3.21Å; I145-E204 HydrophobicContact CD1-CG 3.87Å
146	D	84.3	Confident	84.9	Confident	83 Å²	83	46.7 Å²	46.7	44%	0.444	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-1.6	-178.1	-64.5	-26.4	0	0	0	112.9	D142 A148	D142-D146 WeakPolarHBondContact O-CB 3.19Å; D142-D146 PolarHBondContact O-N 3.37Å; D146-A148 PolarHBondContact O-N 3.39Å; D146-A148 VanDerWaalsContact O-N 3.09Å
147	S	82.9	Confident	84.4	Confident	81 Å²	81	46.5 Å²	46.5	57%	0.566	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	31	-173.5	-61.9	0	0	0	0	113.4	D143 L144 I145 A149 Y158	D143-S147 PolarHBondContact O-N 3.35Å; L144-S147 PolarHBondContact O-N 3.02Å; I145-S147 PolarHBondContact O-N 3.21Å; S147-A149 PolarHBondContact O-N 3.2Å; S147-Y158 WeakPolarHBondContact CA-OH 3.43Å; S147-Y158 PolarHBondContact O-OH 3.35Å
148	A	78.4	Confident	84	Confident	24 Å²	24	47 Å²	47	20%	0.198	27%	0.273	C	S	.	.			trans	-64.2	125.6	-177.1	0	0	0	0	0	111.1	D143 D146 S156 Y158	D143-A148 HydrophobicContact CB-CB 4.46Å; D143-A148 PolarHBondContact O-N 2.9Å; D146-A148 PolarHBondContact O-N 3.39Å; D146-A148 VanDerWaalsContact O-N 3.09Å; A148-S156 WeakPolarHBondContact O-CB 3.42Å; A148-S156 PolarHBondContact O-OG 3.2Å; A148-Y158 WeakPolarHBondContact O-CE1 3.46Å
149	A	80.1	Confident	83.7	Confident	57 Å²	57	52.2 Å²	52.2	47%	0.471	29%	0.293	S	S	.	.	S	Bend	trans	-76.3	-28	-179.3	0	0	0	0	0	113.3	S147 S156	S147-A149 PolarHBondContact O-N 3.2Å; A149-S156 PolarHBondContact O-N 2.95Å
150	V	77.4	Confident	83.6	Confident	88 Å²	88	53.8 Å²	53.8	53%	0.533	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	138	-171.1	179.2	0	0	0	0	110.3	K154	V150-K154 CarbonylContact C-O 3.55Å; V150-K154 VanDerWaalsContact CA-O 3.22Å; V150-K154 WeakPolarHBondContact CA-O 3.42Å; V150-K154 WeakPolarHBondContact CG1-O 3.18Å
151	R	76.6	Confident	83.6	Confident	95 Å²	95	56.2 Å²	56.2	36%	0.358	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	126.8	172.8	178.9	103.4	-49.6	-127.9	-2.9	108.9	D143 G153 K154	D143-R151 WeakPolarHBondContact OD1-CD 3.49Å; D143-R151 IonicContact OD1-CZ 3.71Å; D143-R151 IonicContact OD1-NE 3Å; D143-R151 PolarHBondContact OD1-NE 3.36Å; D143-R151 VanDerWaalsContact OD2-CB 3.26Å; D143-R151 WeakPolarHBondContact OD2-CB 3.44Å; D143-R151 VanDerWaalsContact OD2-CD 3.32Å; D143-R151 WeakPolarHBondContact OD2-CD 3.49Å; D143-R151 IonicContact OD2-NE 2.85Å; R151-G153 PolarHBondContact O-N 2.86Å; R151-K154 PolarHBondContact N-O 3.46Å; R151-K154 PolarHBondContact O-N 2.87Å; R151-K154 VanDerWaalsContact O-O 3.09Å
152	R	71.9	Confident	83.6	Confident	94 Å²	94	55.5 Å²	55.5	36%	0.355	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	39.4	179.7	-61.4	172.8	-179.4	173	-1.1	113.2	S74 K154	S74-R152 PolarHBondContact OG-NH1 3.29Å; R152-K154 PolarHBondContact O-N 3.49Å
153	G	71.7	Confident	83.7	Confident	75 Å²	75	59.5 Å²	59.5	77%	0.773	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	7.5	-178.6	0	0	0	0	0	115.4	R151	R151-G153 PolarHBondContact O-N 2.86Å
154	K	75.6	Confident	84	Confident	77 Å²	77	68.9 Å²	68.9	34%	0.335	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	156.2	175.6	-68.1	-172.4	177.7	-176.4	0	110.5	E73 V150 R151 R152	E73-K154 PolarHBondContact O-NZ 3.49Å; V150-K154 CarbonylContact C-O 3.55Å; V150-K154 VanDerWaalsContact CA-O 3.22Å; V150-K154 WeakPolarHBondContact CA-O 3.42Å; V150-K154 WeakPolarHBondContact CG1-O 3.18Å; R151-K154 PolarHBondContact N-O 3.46Å; R151-K154 PolarHBondContact O-N 2.87Å; R151-K154 VanDerWaalsContact O-O 3.09Å; R152-K154 PolarHBondContact O-N 3.49Å
155	T	84.6	Confident	84.3	Confident	69 Å²	69	70 Å²	70	42%	0.423	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.4	139.8	171.4	-52.6	0	0	0	0	110.9	Y70 K159 A160	Y70-T155 WeakPolarHBondContact CE1-O 3.26Å; Y70-T155 PolarHBondContact OH-N 3.27Å; Y70-T155 PolarHBondContact OH-O 3.04Å; T155-K159 HydrophobicContact CG2-CB 3.41Å; T155-K159 VanDerWaalsContact CG2-CB 3.41Å; T155-K159 HydrophobicContact CG2-CG 4.46Å; T155-A160 HydrophobicContact CG2-CB 4.29Å
156	S	83.9	Confident	84.5	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.356	C	S	.	.			trans	-64	157.3	175.7	61.3	0	0	0	0	112.1	A148 A149 Y158 K159 A160	A148-S156 WeakPolarHBondContact O-CB 3.42Å; A148-S156 PolarHBondContact O-OG 3.2Å; A149-S156 PolarHBondContact O-N 2.95Å; S156-Y158 VanDerWaalsContact C-N 3.3Å; S156-Y158 PolarHBondContact O-N 3.28Å; S156-Y158 VanDerWaalsContact OG-CD1 3.32Å; S156-Y158 WeakPolarHBondContact OG-CD1 3.08Å; S156-Y158 WeakPolarHBondContact OG-CE1 3.47Å; S156-K159 PolarHBondContact O-N 2.92Å; S156-K159 WeakPolarHBondContact OG-CG 3.3Å; S156-A160 PolarHBondContact O-N 3.42Å
157	A	83.4	Confident	85.1	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-56	-45.6	-176.7	0	0	0	0	0	112	I140 K159 A160 F161 A166	I140-A157 HydrophobicContact CG2-CB 4.16Å; A157-K159 VanDerWaalsContact C-N 3.31Å; A157-K159 PolarHBondContact O-N 3.16Å; A157-A160 PolarHBondContact O-N 3.08Å; A157-F161 WeakPolarHBondContact O-CD2 3.29Å; A157-F161 PolarHBondContact O-N 3Å; A157-A166 HydrophobicContact CB-CB 4.45Å
158	Y	85.6	Confident	85.7	Confident	11 Å²	11	65 Å²	65	4%	0.043	35%	0.348	C	S	.	.	H	α-helix	trans	-69.7	-30.5	-175.2	84.9	-97.1	0	0	0	112.4	D143 L144 S147 A148 S156 G162 H163	D143-Y158 WeakPolarHBondContact O-CD1 3.48Å; D143-Y158 WeakPolarHBondContact O-CE1 3.26Å; L144-Y158 HydrophobicContact CB-CD1 4.44Å; L144-Y158 HydrophobicContact CD1-CD1 4.42Å; L144-Y158 HydrophobicContact CD1-CD2 4.35Å; L144-Y158 HydrophobicContact CD1-CG 3.94Å; S147-Y158 WeakPolarHBondContact CA-OH 3.43Å; S147-Y158 PolarHBondContact O-OH 3.35Å; A148-Y158 WeakPolarHBondContact O-CE1 3.46Å; S156-Y158 VanDerWaalsContact C-N 3.3Å; S156-Y158 PolarHBondContact O-N 3.28Å; S156-Y158 VanDerWaalsContact OG-CD1 3.32Å; S156-Y158 WeakPolarHBondContact OG-CD1 3.08Å; S156-Y158 WeakPolarHBondContact OG-CE1 3.47Å; Y158-G162 WeakPolarHBondContact CA-O 3.36Å; Y158-G162 CarbonylContact O-C 3.4Å; Y158-G162 WeakPolarHBondContact O-CA 3.22Å; Y158-G162 PolarHBondContact O-N 3.24Å; Y158-H163 AromaticContact CD2-CD2 3.32Å; Y158-H163 WeakPolarHBondContact CD2-CD2 3.45Å; Y158-H163 AromaticContact CD2-NE2 3.43Å; Y158-H163 WeakPolarHBondContact CD2-NE2 3.49Å; Y158-H163 AromaticContact CE2-NE2 3.66Å
159	K	89.7	Confident	86.5	Confident	126 Å²	126	63.8 Å²	63.8	55%	0.548	34%	0.338	S	S	.	.	H	α-helix	trans	-72.5	-35.7	173.6	-76.1	-60.9	-166.1	-160.4	0	111.7	T155 S156 A157	T155-K159 HydrophobicContact CG2-CB 3.41Å; T155-K159 VanDerWaalsContact CG2-CB 3.41Å; T155-K159 HydrophobicContact CG2-CG 4.46Å; S156-K159 PolarHBondContact O-N 2.92Å; S156-K159 WeakPolarHBondContact OG-CG 3.3Å; A157-K159 VanDerWaalsContact C-N 3.31Å; A157-K159 PolarHBondContact O-N 3.16Å
160	A	89.5	Confident	87.2	Confident	48 Å²	48	61.1 Å²	61.1	40%	0.397	32%	0.316	S	S	.	.	H	α-helix	trans	-78.8	-37	-178.9	0	0	0	0	0	113.3	T155 S156 A157	T155-A160 HydrophobicContact CG2-CB 4.29Å; S156-A160 PolarHBondContact O-N 3.42Å; A157-A160 PolarHBondContact O-N 3.08Å
161	F	91.5	Very high	88.1	Confident	51 Å²	51	60.1 Å²	60.1	22%	0.224	31%	0.307	C	S	.	.	H	α-helix	trans	-119.6	-21.2	-170.8	-62.7	-84.7	0	0	0	114.4	V63 D66 L67 Y70 A157 E165	V63-F161 HydrophobicContact CG2-CD1 4.32Å; D66-F161 HydrophobicContact CB-CE1 3.96Å; D66-F161 HydrophobicContact CB-CZ 4.48Å; L67-F161 HydrophobicContact CB-CD1 4.08Å; L67-F161 HydrophobicContact CB-CD2 4.08Å; L67-F161 HydrophobicContact CB-CE1 4.18Å; L67-F161 HydrophobicContact CB-CE2 4.2Å; L67-F161 HydrophobicContact CB-CG 4.04Å; L67-F161 HydrophobicContact CB-CZ 4.25Å; L67-F161 HydrophobicContact CD1-CB 3.98Å; L67-F161 HydrophobicContact CD1-CD2 4.2Å; L67-F161 HydrophobicContact CD1-CG 4.08Å; L67-F161 HydrophobicContact CG-CD2 3.98Å; L67-F161 HydrophobicContact CG-CE2 4.36Å; L67-F161 HydrophobicContact CG-CG 4.2Å; Y70-F161 AromaticContact CD1-CE2 3.83Å; Y70-F161 HydrophobicContact CD1-CE2 3.83Å; Y70-F161 HydrophobicContact CD2-CE2 4.3Å; Y70-F161 HydrophobicContact CD2-CZ 4.43Å; Y70-F161 HydrophobicContact CE1-CE2 4.47Å; Y70-F161 AromaticContact CG-CE2 3.72Å; Y70-F161 HydrophobicContact CG-CE2 3.72Å; Y70-F161 HydrophobicContact CG-CZ 4.07Å; A157-F161 WeakPolarHBondContact O-CD2 3.29Å; A157-F161 PolarHBondContact O-N 3Å; F161-E165 HydrophobicContact CB-CB 3.89Å; F161-E165 HydrophobicContact CB-CG 4.43Å; F161-E165 VanDerWaalsContact O-CD 3.24Å; F161-E165 WeakPolarHBondContact O-CG 3.15Å
162	G	92.7	Very high	89	Confident	23 Å²	23	58.1 Å²	58.1	24%	0.237	30%	0.302	C	S	.	.			trans	113.6	159.3	-176.3	0	0	0	0	0	113.6	Y158 E165 A166	Y158-G162 WeakPolarHBondContact CA-O 3.36Å; Y158-G162 CarbonylContact O-C 3.4Å; Y158-G162 WeakPolarHBondContact O-CA 3.22Å; Y158-G162 PolarHBondContact O-N 3.24Å; G162-E165 VanDerWaalsContact CA-OE2 3.32Å; G162-E165 WeakPolarHBondContact CA-OE2 3.36Å; G162-A166 PolarHBondContact O-N 3.24Å; G162-A166 VanDerWaalsContact O-N 3.1Å
163	H	93.6	Very high	90.1	Very high	117 Å²	117	53.7 Å²	53.7	54%	0.542	29%	0.285	S	S	.	.	H	α-helix	trans	-62.6	-43.8	-178.7	-62.3	137.3	0	0	0	112.3	L144 Y158 E165 A166 V167	L144-H163 HydrophobicContact CD1-CB 4.09Å; L144-H163 WeakPolarHBondContact CD1-CD2 3.33Å; Y158-H163 AromaticContact CD2-CD2 3.32Å; Y158-H163 WeakPolarHBondContact CD2-CD2 3.45Å; Y158-H163 AromaticContact CD2-NE2 3.43Å; Y158-H163 WeakPolarHBondContact CD2-NE2 3.49Å; Y158-H163 AromaticContact CE2-NE2 3.66Å; H163-E165 VanDerWaalsContact C-N 3.34Å; H163-E165 PolarHBondContact O-N 3.32Å; H163-A166 PolarHBondContact O-N 2.73Å; H163-V167 WeakPolarHBondContact O-CG2 3.16Å; H163-V167 PolarHBondContact O-N 2.83Å; H163-V167 VanDerWaalsContact O-N 3.15Å
164	R	94.8	Very high	91.3	Very high	201 Å²	201	51.8 Å²	51.8	76%	0.758	26%	0.257	S	S	*	.	H	α-helix	trans	-68	-39.5	-176.2	-66.3	-179.7	179.7	179.6	-0	111	V167 L168	R164-V167 PolarHBondContact O-N 3.4Å; R164-L168 WeakPolarHBondContact O-CB 3.29Å; R164-L168 WeakPolarHBondContact O-CG 3.5Å; R164-L168 PolarHBondContact O-N 3.24Å
165	E	94.3	Very high	92.2	Very high	57 Å²	57	52.6 Å²	52.6	27%	0.266	27%	0.268	S	S	.	.	H	α-helix	trans	-65.4	-40	178.6	-66.2	72.3	-163.6	0	0	110.8	V63 F64 L67 F161 G162 H163 G169	V63-E165 HydrophobicContact CG2-CG 4.13Å; F64-E165 HydrophobicContact CE1-CB 4.44Å; L67-E165 HydrophobicContact CD1-CB 4.01Å; L67-E165 VanDerWaalsContact CD1-O 3.27Å; L67-E165 WeakPolarHBondContact CD1-O 3.42Å; F161-E165 HydrophobicContact CB-CB 3.89Å; F161-E165 HydrophobicContact CB-CG 4.43Å; F161-E165 VanDerWaalsContact O-CD 3.24Å; F161-E165 WeakPolarHBondContact O-CG 3.15Å; G162-E165 VanDerWaalsContact CA-OE2 3.32Å; G162-E165 WeakPolarHBondContact CA-OE2 3.36Å; H163-E165 VanDerWaalsContact C-N 3.34Å; H163-E165 PolarHBondContact O-N 3.32Å; E165-G169 WeakPolarHBondContact O-CA 3.34Å; E165-G169 PolarHBondContact O-N 3.23Å
166	A	92.9	Very high	92.7	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.2	-48.4	174.8	0	0	0	0	0	112.3	I140 L144 A157 G162 H163 G169 G170	I140-A166 HydrophobicContact CG2-CB 4.06Å; I140-A166 WeakPolarHBondContact CG2-O 3.38Å; L144-A166 HydrophobicContact CD2-CB 4.44Å; A157-A166 HydrophobicContact CB-CB 4.45Å; G162-A166 PolarHBondContact O-N 3.24Å; G162-A166 VanDerWaalsContact O-N 3.1Å; H163-A166 PolarHBondContact O-N 2.73Å; A166-G169 PolarHBondContact O-N 2.7Å; A166-G170 PolarHBondContact O-N 3.41Å
167	V	96.1	Very high	93.3	Very high	59 Å²	59	50.7 Å²	50.7	36%	0.358	26%	0.255	S	S	.	.	H	α-helix	trans	-56	-57.4	176.3	175.5	0	0	0	0	110.4	H141 L144 H163 R164 G169 G170 D171	H141-V167 PolarHBondContact NE2-O 3.32Å; H141-V167 VanDerWaalsContact NE2-O 3.16Å; L144-V167 HydrophobicContact CD2-CG2 3.31Å; H163-V167 WeakPolarHBondContact O-CG2 3.16Å; H163-V167 PolarHBondContact O-N 2.83Å; H163-V167 VanDerWaalsContact O-N 3.15Å; R164-V167 PolarHBondContact O-N 3.4Å; V167-G169 VanDerWaalsContact C-N 3.28Å; V167-G169 PolarHBondContact O-N 3.47Å; V167-G170 PolarHBondContact O-N 2.8Å; V167-D171 VanDerWaalsContact O-CG 3.28Å; V167-D171 PolarHBondContact O-N 3.14Å
168	L	96	Very high	93.9	Very high	92 Å²	92	53.4 Å²	53.4	48%	0.482	27%	0.274	S	S	.	.	H	α-helix	trans	-65.2	-31.7	-177	-69	173.2	0	0	0	112.3	F64 R164 F172	F64-L168 HydrophobicContact CE1-CB 3.54Å; F64-L168 HydrophobicContact CE1-CD1 4.44Å; F64-L168 HydrophobicContact CZ-CB 3.68Å; F64-L168 HydrophobicContact CZ-CD1 3.77Å; F64-L168 HydrophobicContact CZ-CG 4.4Å; R164-L168 WeakPolarHBondContact O-CB 3.29Å; R164-L168 WeakPolarHBondContact O-CG 3.5Å; R164-L168 PolarHBondContact O-N 3.24Å; L168-F172 VanDerWaalsContact O-CB 3.22Å; L168-F172 WeakPolarHBondContact O-CB 3.48Å; L168-F172 PolarHBondContact O-N 3.41Å
169	G	94.5	Very high	94.3	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.7	-46.6	175.6	0	0	0	0	0	112.3	E165 A166 V167 F172 I173	E165-G169 WeakPolarHBondContact O-CA 3.34Å; E165-G169 PolarHBondContact O-N 3.23Å; A166-G169 PolarHBondContact O-N 2.7Å; V167-G169 VanDerWaalsContact C-N 3.28Å; V167-G169 PolarHBondContact O-N 3.47Å; G169-F172 PolarHBondContact O-N 3.29Å; G169-I173 WeakPolarHBondContact O-CG1 3.46Å; G169-I173 PolarHBondContact O-N 2.87Å
170	G	95.1	Very high	94.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.5	-44.9	173.8	0	0	0	0	0	112.2	H141 A166 V167 F172 I173 L174	H141-G170 WeakPolarHBondContact NE2-CA 3.36Å; A166-G170 PolarHBondContact O-N 3.41Å; V167-G170 PolarHBondContact O-N 2.8Å; G170-F172 VanDerWaalsContact C-N 3.3Å; G170-F172 PolarHBondContact O-N 3.44Å; G170-I173 PolarHBondContact O-N 3.08Å; G170-L174 PolarHBondContact O-N 2.92Å
171	D	96.2	Very high	94.9	Very high	67 Å²	67	50.1 Å²	50.1	36%	0.358	25%	0.248	S	C	.	.	H	α-helix	trans	-62.2	-37.6	178.8	-67.2	-10.1	0	0	0	112.3	H141 V167 L174 T175	H141-D171 IonicContact CE1-OD1 3.92Å; H141-D171 PolarHBondContact CE1-OD1 3.41Å; H141-D171 VanDerWaalsContact CE1-OD1 3.24Å; H141-D171 IonicContact NE2-OD1 3.8Å; H141-D171 PolarHBondContact NE2-OD1 3.16Å; V167-D171 VanDerWaalsContact O-CG 3.28Å; V167-D171 PolarHBondContact O-N 3.14Å; D171-L174 PolarHBondContact O-N 2.82Å; D171-T175 WeakPolarHBondContact O-CB 3.43Å; D171-T175 PolarHBondContact O-N 3.07Å; D171-T175 PolarHBondContact O-OG1 3.37Å
172	F	95.1	Very high	95.1	Very high	54 Å²	54	50.7 Å²	50.7	24%	0.237	26%	0.263	C	S	.	.	H	α-helix	trans	-64.3	-42.4	176.3	-175.9	-100.9	0	0	0	111.8	L57 P59 L68 L168 G169 G170 T175 H176	L57-F172 HydrophobicContact CB-CE1 4.4Å; L57-F172 HydrophobicContact CD2-CD1 4.08Å; L57-F172 HydrophobicContact CD2-CE1 3.81Å; P59-F172 HydrophobicContact CB-CE1 4.02Å; P59-F172 HydrophobicContact CB-CE2 4.37Å; P59-F172 HydrophobicContact CB-CZ 3.89Å; P59-F172 HydrophobicContact CG-CE1 4.41Å; L68-F172 HydrophobicContact CD1-CD1 3.66Å; L68-F172 HydrophobicContact CD1-CE1 3.73Å; L168-F172 VanDerWaalsContact O-CB 3.22Å; L168-F172 WeakPolarHBondContact O-CB 3.48Å; L168-F172 PolarHBondContact O-N 3.41Å; G169-F172 PolarHBondContact O-N 3.29Å; G170-F172 VanDerWaalsContact C-N 3.3Å; G170-F172 PolarHBondContact O-N 3.44Å; F172-T175 PolarHBondContact O-N 2.92Å; F172-H176 AromaticContact CE1-CD2 3.57Å; F172-H176 AromaticContact CE1-NE2 3.78Å; F172-H176 AromaticContact CE2-CD2 3.75Å; F172-H176 AromaticContact CE2-NE2 3.81Å; F172-H176 AromaticContact CZ-CD2 3.36Å; F172-H176 WeakPolarHBondContact CZ-CD2 3.42Å; F172-H176 AromaticContact CZ-NE2 3.23Å; F172-H176 WeakPolarHBondContact CZ-NE2 3.4Å; F172-H176 PolarHBondContact O-N 3.32Å
173	I	95.4	Very high	95.3	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.8	-44.5	175.9	-64.4	166.6	0	0	0	110.7	L57 L68 F72 M133 T136 A137 I140 G169 G170 H176 S177	L57-I173 HydrophobicContact CD1-CG1 4.24Å; L68-I173 HydrophobicContact CD2-CD1 3.54Å; L68-I173 HydrophobicContact CD2-CG1 3.44Å; L68-I173 VanDerWaalsContact CD2-CG1 3.44Å; F72-I173 HydrophobicContact CE2-CD1 4.08Å; F72-I173 HydrophobicContact CE2-CG1 4.47Å; F72-I173 HydrophobicContact CZ-CD1 4.34Å; M133-I173 HydrophobicContact CB-CG2 3.65Å; M133-I173 HydrophobicContact CE-CG2 4.33Å; M133-I173 HydrophobicContact CG-CG2 4.28Å; M133-I173 WeakPolarHBondContact O-CG2 3.41Å; T136-I173 HydrophobicContact CG2-CD1 4.22Å; A137-I173 HydrophobicContact CB-CB 4.08Å; A137-I173 HydrophobicContact CB-CG2 4.02Å; I140-I173 HydrophobicContact CD1-CD1 3.58Å; G169-I173 WeakPolarHBondContact O-CG1 3.46Å; G169-I173 PolarHBondContact O-N 2.87Å; G170-I173 PolarHBondContact O-N 3.08Å; I173-H176 PolarHBondContact O-N 3.15Å; I173-S177 WeakPolarHBondContact O-CB 3.36Å; I173-S177 PolarHBondContact O-N 3.39Å; I173-S177 PolarHBondContact O-OG 2.81Å
174	L	96.4	Very high	95.4	Very high	36 Å²	36	50.1 Å²	50.1	19%	0.188	25%	0.254	C	S	.	.	H	α-helix	trans	-63.3	-42.3	177	-69.3	176.7	0	0	0	111.7	I134 A137 G170 D171 H176 S177 S178 I197	I134-L174 HydrophobicContact CG1-CD2 4.25Å; A137-L174 HydrophobicContact CB-CD1 4.42Å; A137-L174 HydrophobicContact CB-CD2 3.77Å; A137-L174 HydrophobicContact CB-CG 3.7Å; G170-L174 PolarHBondContact O-N 2.92Å; D171-L174 PolarHBondContact O-N 2.82Å; L174-H176 PolarHBondContact O-N 3.47Å; L174-S177 WeakPolarHBondContact O-CB 3.49Å; L174-S177 PolarHBondContact O-N 3.19Å; L174-S178 PolarHBondContact O-N 2.89Å; L174-S178 PolarHBondContact O-OG 3.42Å; L174-I197 HydrophobicContact CD2-CD1 4.5Å
175	T	95.3	Very high	95.3	Very high	94 Å²	94	43.2 Å²	43.2	58%	0.577	25%	0.246	S	C	*	.	H	α-helix	trans	-60.8	-44.5	176.7	-59.9	0	0	0	0	111.4	D171 F172 S178 R179	D171-T175 WeakPolarHBondContact O-CB 3.43Å; D171-T175 PolarHBondContact O-N 3.07Å; D171-T175 PolarHBondContact O-OG1 3.37Å; F172-T175 PolarHBondContact O-N 2.92Å; T175-S178 PolarHBondContact O-N 3.04Å; T175-R179 PolarHBondContact O-N 3.2Å
176	H	94.5	Very high	95.5	Very high	27 Å²	27	43 Å²	43	13%	0.125	25%	0.246	C	C	.	.	H	α-helix	trans	-65.2	-38.7	174.8	-100	-92.9	0	0	0	112.5	S56 L57 M133 F172 I173 L174 S178 R179 L180	S56-H176 PolarHBondContact O-CE1 3.14Å; S56-H176 PolarHBondContact O-ND1 3.34Å; L57-H176 HydrophobicContact CD2-CB 3.65Å; M133-H176 HydrophobicContact CE-CB 3.73Å; F172-H176 AromaticContact CE1-CD2 3.57Å; F172-H176 AromaticContact CE1-NE2 3.78Å; F172-H176 AromaticContact CE2-CD2 3.75Å; F172-H176 AromaticContact CE2-NE2 3.81Å; F172-H176 AromaticContact CZ-CD2 3.36Å; F172-H176 WeakPolarHBondContact CZ-CD2 3.42Å; F172-H176 AromaticContact CZ-NE2 3.23Å; F172-H176 WeakPolarHBondContact CZ-NE2 3.4Å; F172-H176 PolarHBondContact O-N 3.32Å; I173-H176 PolarHBondContact O-N 3.15Å; L174-H176 PolarHBondContact O-N 3.47Å; H176-S178 VanDerWaalsContact C-N 3.33Å; H176-S178 PolarHBondContact O-N 3.17Å; H176-R179 PolarHBondContact CE1-NH2 2.92Å; H176-R179 PolarHBondContact ND1-NH2 3.28Å; H176-R179 WeakPolarHBondContact O-CB 3.41Å; H176-R179 PolarHBondContact O-N 2.87Å; H176-L180 WeakPolarHBondContact O-CG 3.32Å; H176-L180 PolarHBondContact O-N 3.45Å
177	S	96.1	Very high	95.7	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.007	28%	0.281	C	S	.	.	H	α-helix	trans	-59	-45.6	174.5	-56.7	0	0	0	0	111.1	M133 I173 L174 R179 L180 L181	M133-S177 WeakPolarHBondContact CB-OG 3.31Å; I173-S177 WeakPolarHBondContact O-CB 3.36Å; I173-S177 PolarHBondContact O-N 3.39Å; I173-S177 PolarHBondContact O-OG 2.81Å; L174-S177 WeakPolarHBondContact O-CB 3.49Å; L174-S177 PolarHBondContact O-N 3.19Å; S177-R179 VanDerWaalsContact C-N 3.33Å; S177-R179 PolarHBondContact O-N 2.87Å; S177-L180 PolarHBondContact O-N 3.26Å; S177-L181 WeakPolarHBondContact O-CB 3.44Å; S177-L181 PolarHBondContact O-N 2.94Å
178	S	95.9	Very high	95.8	Very high	57 Å²	57	47 Å²	47	40%	0.399	28%	0.276	S	S	.	.	H	α-helix	trans	-61.9	-37.4	175.4	-62.6	0	0	0	0	112.7	L174 T175 H176 L181 A182	L174-S178 PolarHBondContact O-N 2.89Å; L174-S178 PolarHBondContact O-OG 3.42Å; T175-S178 PolarHBondContact O-N 3.04Å; H176-S178 VanDerWaalsContact C-N 3.33Å; H176-S178 PolarHBondContact O-N 3.17Å; S178-L181 WeakPolarHBondContact O-CB 3.49Å; S178-L181 PolarHBondContact O-N 3.29Å; S178-A182 PolarHBondContact O-N 2.9Å
179	R	95.6	Very high	95.9	Very high	103 Å²	103	42.7 Å²	42.7	39%	0.389	25%	0.253	S	S	.	.	H	α-helix	trans	-64.6	-44.3	174.2	-173.7	179.6	63.4	73.5	-4.9	111.9	T175 H176 S177 L181 A182 Q183	T175-R179 PolarHBondContact O-N 3.2Å; H176-R179 PolarHBondContact CE1-NH2 2.92Å; H176-R179 PolarHBondContact ND1-NH2 3.28Å; H176-R179 WeakPolarHBondContact O-CB 3.41Å; H176-R179 PolarHBondContact O-N 2.87Å; S177-R179 VanDerWaalsContact C-N 3.33Å; S177-R179 PolarHBondContact O-N 2.87Å; R179-L181 VanDerWaalsContact C-N 3.35Å; R179-A182 PolarHBondContact O-N 2.95Å; R179-Q183 WeakPolarHBondContact O-CG 3.37Å; R179-Q183 PolarHBondContact O-N 3.43Å; R179-Q183 VanDerWaalsContact O-N 3.1Å
180	L	95	Very high	96	Very high	8 Å²	8	45.2 Å²	45.2	4%	0.042	27%	0.266	C	S	.	.	H	α-helix	trans	-64	-41.3	176.5	-65.6	177.5	0	0	0	111.1	I130 M133 H176 S177 A182 Q183 I184	I130-L180 HydrophobicContact CD1-CB 3.79Å; I130-L180 HydrophobicContact CG1-CB 3.87Å; I130-L180 HydrophobicContact CG1-CD1 4.16Å; M133-L180 HydrophobicContact CE-CD1 4.26Å; M133-L180 HydrophobicContact SD-CD1 3.78Å; H176-L180 WeakPolarHBondContact O-CG 3.32Å; H176-L180 PolarHBondContact O-N 3.45Å; S177-L180 PolarHBondContact O-N 3.26Å; L180-A182 VanDerWaalsContact C-N 3.34Å; L180-A182 PolarHBondContact O-N 3.46Å; L180-Q183 WeakPolarHBondContact O-CB 3.31Å; L180-Q183 PolarHBondContact O-N 3.37Å; L180-Q183 VanDerWaalsContact O-N 3.08Å; L180-I184 PolarHBondContact O-N 3.4Å
181	L	95.8	Very high	96.2	Very high	5 Å²	5	48.2 Å²	48.2	3%	0.026	29%	0.291	C	S	.	.	H	α-helix	trans	-55.4	-46.6	172.6	-89.5	175.6	0	0	0	112.6	I127 I130 S177 S178 R179 Q183 I184 V189 I190 L193	I127-L181 HydrophobicContact CD1-CD2 4.32Å; I130-L181 HydrophobicContact CD1-CD2 4.11Å; I130-L181 HydrophobicContact CD1-CG 3.98Å; I130-L181 HydrophobicContact CG2-CD1 4.44Å; I130-L181 HydrophobicContact CG2-CG 4.25Å; S177-L181 WeakPolarHBondContact O-CB 3.44Å; S177-L181 PolarHBondContact O-N 2.94Å; S178-L181 WeakPolarHBondContact O-CB 3.49Å; S178-L181 PolarHBondContact O-N 3.29Å; R179-L181 VanDerWaalsContact C-N 3.35Å; L181-Q183 VanDerWaalsContact C-N 3.28Å; L181-Q183 PolarHBondContact O-N 3.41Å; L181-I184 WeakPolarHBondContact O-CB 3.31Å; L181-I184 PolarHBondContact O-N 2.86Å; L181-V189 HydrophobicContact CD2-CG1 4.09Å; L181-I190 HydrophobicContact CB-CG1 4.27Å; L181-L193 HydrophobicContact CD1-CB 3.8Å; L181-L193 HydrophobicContact CD1-CD1 4.39Å; L181-L193 HydrophobicContact CD2-CB 4.08Å; L181-L193 HydrophobicContact CD2-CD1 3.66Å; L181-L193 HydrophobicContact CD2-CG 4.22Å; L181-L193 HydrophobicContact CG-CD1 4.36Å
182	A	96.3	Very high	96.3	Very high	64 Å²	64	45.8 Å²	45.8	53%	0.529	28%	0.279	S	S	.	.	H	α-helix	trans	-63.2	-34	176.2	0	0	0	0	0	112.5	S178 R179 L180 G185	S178-A182 PolarHBondContact O-N 2.9Å; R179-A182 PolarHBondContact O-N 2.95Å; L180-A182 VanDerWaalsContact C-N 3.34Å; L180-A182 PolarHBondContact O-N 3.46Å; A182-G185 WeakPolarHBondContact O-CA 3.46Å; A182-G185 PolarHBondContact O-N 3.42Å
183	Q	95.7	Very high	96.4	Very high	124 Å²	124	43.2 Å²	43.2	58%	0.579	27%	0.267	S	S	*	.	H	α-helix	trans	-71.6	-29.4	177.2	-71.9	176	-21.8	0	0	113.3	R179 L180 L181 G185	R179-Q183 WeakPolarHBondContact O-CG 3.37Å; R179-Q183 PolarHBondContact O-N 3.43Å; R179-Q183 VanDerWaalsContact O-N 3.1Å; L180-Q183 WeakPolarHBondContact O-CB 3.31Å; L180-Q183 PolarHBondContact O-N 3.37Å; L180-Q183 VanDerWaalsContact O-N 3.08Å; L181-Q183 VanDerWaalsContact C-N 3.28Å; L181-Q183 PolarHBondContact O-N 3.41Å; Q183-G185 PolarHBondContact O-N 3.44Å
184	I	96.2	Very high	96.5	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-60.3	-35.2	170.1	-67.8	174	0	0	0	110.3	K123 E126 I127 I130 L180 L181 D186 L244	K123-I184 HydrophobicContact CB-CG2 4.35Å; K123-I184 HydrophobicContact CD-CG2 4.16Å; K123-I184 VanDerWaalsContact CE-O 3.31Å; K123-I184 WeakPolarHBondContact CE-O 3.47Å; K123-I184 HydrophobicContact CG-CG2 4.44Å; K123-I184 PolarHBondContact NZ-O 3.32Å; E126-I184 HydrophobicContact CB-CD1 3.85Å; E126-I184 HydrophobicContact CB-CG1 4.11Å; I127-I184 HydrophobicContact CD1-CD1 3.42Å; I127-I184 VanDerWaalsContact CD1-CD1 3.42Å; I127-I184 HydrophobicContact CG1-CD1 3.96Å; I130-I184 HydrophobicContact CD1-CD1 3.72Å; L180-I184 PolarHBondContact O-N 3.4Å; L181-I184 WeakPolarHBondContact O-CB 3.31Å; L181-I184 PolarHBondContact O-N 2.86Å; I184-D186 VanDerWaalsContact C-N 3.33Å; I184-D186 HydrophobicContact CG2-CB 4.33Å; I184-D186 PolarHBondContact O-N 2.89Å; I184-L244 HydrophobicContact CG2-CD1 4.18Å; I184-L244 HydrophobicContact CG2-CD2 3.92Å
185	G	93.7	Very high	96.6	Very high	56 Å²	56	47.6 Å²	47.6	58%	0.577	29%	0.293	S	S	*	.			trans	74.8	17.4	169.6	0	0	0	0	0	115.1	A182 Q183	A182-G185 WeakPolarHBondContact O-CA 3.46Å; A182-G185 PolarHBondContact O-N 3.42Å; Q183-G185 PolarHBondContact O-N 3.44Å
186	D	97.2	Very high	96.7	Very high	51 Å²	51	43.1 Å²	43.1	27%	0.273	27%	0.266	S	S	.	.			trans	-107.7	113.6	175.5	-174.2	-62.7	0	0	0	109.9	I184 G188 V189 I190 L244	I184-D186 VanDerWaalsContact C-N 3.33Å; I184-D186 HydrophobicContact CG2-CB 4.33Å; I184-D186 PolarHBondContact O-N 2.89Å; D186-G188 VanDerWaalsContact C-N 3.3Å; D186-G188 PolarHBondContact O-N 3.18Å; D186-G188 WeakPolarHBondContact OD1-CA 3.4Å; D186-G188 PolarHBondContact OD1-N 3.37Å; D186-V189 HydrophobicContact CB-CB 4Å; D186-V189 HydrophobicContact CB-CG2 3.96Å; D186-V189 PolarHBondContact O-N 2.85Å; D186-V189 PolarHBondContact OD1-N 3.37Å; D186-I190 VanDerWaalsContact O-CG1 3.28Å; D186-I190 WeakPolarHBondContact O-CG1 3.47Å; D186-I190 PolarHBondContact O-N 3.36Å; D186-L244 HydrophobicContact CB-CD2 4.18Å
187	T	97.5	Very high	96.8	Very high	120 Å²	120	43.7 Å²	43.7	74%	0.736	27%	0.269	S	S	*	.	H	α-helix	trans	-67.1	-30.4	-175.4	51.8	0	0	0	0	113	A191	T187-A191 WeakPolarHBondContact O-CB 3.23Å; T187-A191 PolarHBondContact O-N 3.12Å
188	G	97.9	Very high	96.9	Very high	25 Å²	25	48 Å²	48	26%	0.258	29%	0.289	S	S	.	.	H	α-helix	trans	-67.8	-44	175.4	0	0	0	0	0	111.3	D186 A191 V192 M243	D186-G188 VanDerWaalsContact C-N 3.3Å; D186-G188 PolarHBondContact O-N 3.18Å; D186-G188 WeakPolarHBondContact OD1-CA 3.4Å; D186-G188 PolarHBondContact OD1-N 3.37Å; G188-A191 PolarHBondContact O-N 3.39Å; G188-V192 WeakPolarHBondContact O-CB 3.35Å; G188-V192 VanDerWaalsContact O-CG2 3.31Å; G188-V192 WeakPolarHBondContact O-CG2 3.4Å; G188-V192 PolarHBondContact O-N 2.88Å; G188-M243 VanDerWaalsContact C-CE 3.44Å
189	V	98.3	Very high	97	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.8	-42.1	175.5	170.1	0	0	0	0	111.6	I127 L181 D186 V192 L193 A240 M243 L244	I127-V189 HydrophobicContact CD1-CG1 3.54Å; L181-V189 HydrophobicContact CD2-CG1 4.09Å; D186-V189 HydrophobicContact CB-CB 4Å; D186-V189 HydrophobicContact CB-CG2 3.96Å; D186-V189 PolarHBondContact O-N 2.85Å; D186-V189 PolarHBondContact OD1-N 3.37Å; V189-V192 PolarHBondContact O-N 3.47Å; V189-L193 PolarHBondContact O-N 3Å; V189-A240 HydrophobicContact CG1-CB 4Å; V189-A240 HydrophobicContact CG2-CB 4.41Å; V189-M243 HydrophobicContact CG2-CB 4.12Å; V189-M243 HydrophobicContact CG2-CE 4.2Å; V189-M243 HydrophobicContact CG2-SD 4.48Å; V189-L244 HydrophobicContact CG2-CD1 4.37Å; V189-L244 HydrophobicContact CG2-CD2 3.99Å; V189-L244 HydrophobicContact CG2-CG 3.91Å
190	I	97.9	Very high	97.1	Very high	53 Å²	53	42 Å²	42	27%	0.272	26%	0.26	S	S	.	.	H	α-helix	trans	-58.1	-50.9	174.9	-67.7	164.3	0	0	0	109.8	L181 D186 V192 L193 S194	L181-I190 HydrophobicContact CB-CG1 4.27Å; D186-I190 VanDerWaalsContact O-CG1 3.28Å; D186-I190 WeakPolarHBondContact O-CG1 3.47Å; D186-I190 PolarHBondContact O-N 3.36Å; I190-V192 VanDerWaalsContact C-N 3.32Å; I190-V192 PolarHBondContact O-N 2.94Å; I190-L193 PolarHBondContact O-N 3.4Å; I190-S194 WeakPolarHBondContact O-CB 3.35Å; I190-S194 PolarHBondContact O-N 2.91Å; I190-S194 PolarHBondContact O-OG 2.89Å; I190-S194 VanDerWaalsContact O-OG 3.05Å
191	A	98.1	Very high	97.1	Very high	63 Å²	63	45.7 Å²	45.7	52%	0.521	28%	0.279	S	S	.	.	H	α-helix	trans	-58.3	-43.7	179	0	0	0	0	0	112.4	T187 G188 S194 Q195	T187-A191 WeakPolarHBondContact O-CB 3.23Å; T187-A191 PolarHBondContact O-N 3.12Å; G188-A191 PolarHBondContact O-N 3.39Å; A191-S194 PolarHBondContact O-N 3.32Å; A191-Q195 PolarHBondContact O-N 3.31Å
192	V	98.2	Very high	97.1	Very high	16 Å²	16	48.8 Å²	48.8	10%	0.097	29%	0.293	C	S	.	.	H	α-helix	trans	-63.4	-42.5	179.6	162.9	0	0	0	0	112.5	G188 V189 I190 Q195 N236 K239 A240 M243	G188-V192 WeakPolarHBondContact O-CB 3.35Å; G188-V192 VanDerWaalsContact O-CG2 3.31Å; G188-V192 WeakPolarHBondContact O-CG2 3.4Å; G188-V192 PolarHBondContact O-N 2.88Å; V189-V192 PolarHBondContact O-N 3.47Å; I190-V192 VanDerWaalsContact C-N 3.32Å; I190-V192 PolarHBondContact O-N 2.94Å; V192-Q195 WeakPolarHBondContact O-CB 3.25Å; V192-N236 HydrophobicContact CG1-CB 3.61Å; V192-N236 WeakPolarHBondContact CG1-O 3.32Å; V192-N236 WeakPolarHBondContact CG1-OD1 3.26Å; V192-K239 HydrophobicContact CG1-CB 4.4Å; V192-K239 HydrophobicContact CG1-CD 4.2Å; V192-K239 HydrophobicContact CG2-CD 4.06Å; V192-A240 HydrophobicContact CG1-CB 4.47Å; V192-M243 HydrophobicContact CG2-SD 4.02Å
193	L	97.7	Very high	97	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-81.8	-25.7	178	-68.2	-164.7	0	0	0	113.4	I127 I130 L181 V189 I190 Q195 V196 N236 A240	I127-L193 HydrophobicContact CD1-CD1 3.73Å; I127-L193 HydrophobicContact CG2-CD1 4.33Å; I130-L193 HydrophobicContact CB-CD1 4.49Å; I130-L193 HydrophobicContact CG2-CD1 3.68Å; L181-L193 HydrophobicContact CD1-CB 3.8Å; L181-L193 HydrophobicContact CD1-CD1 4.39Å; L181-L193 HydrophobicContact CD2-CB 4.08Å; L181-L193 HydrophobicContact CD2-CD1 3.66Å; L181-L193 HydrophobicContact CD2-CG 4.22Å; L181-L193 HydrophobicContact CG-CD1 4.36Å; V189-L193 PolarHBondContact O-N 3Å; I190-L193 PolarHBondContact O-N 3.4Å; L193-Q195 VanDerWaalsContact C-N 3.3Å; L193-V196 HydrophobicContact CD2-CG2 4.25Å; L193-V196 WeakPolarHBondContact O-CB 3.28Å; L193-V196 PolarHBondContact O-N 2.91Å; L193-N236 HydrophobicContact CD2-CB 4.26Å; L193-A240 HydrophobicContact CD2-CB 4.45Å; L193-A240 HydrophobicContact CG-CB 4.45Å
194	S	96.7	Very high	96.8	Very high	55 Å²	55	40.9 Å²	40.9	39%	0.385	25%	0.246	S	C	.	.	H	α-helix	trans	-63.5	-37.2	168.5	-67.9	0	0	0	0	111.7	I190 A191 V196 I197 E198	I190-S194 WeakPolarHBondContact O-CB 3.35Å; I190-S194 PolarHBondContact O-N 2.91Å; I190-S194 PolarHBondContact O-OG 2.89Å; I190-S194 VanDerWaalsContact O-OG 3.05Å; A191-S194 PolarHBondContact O-N 3.32Å; S194-V196 PolarHBondContact O-N 2.97Å; S194-I197 PolarHBondContact O-N 2.86Å; S194-I197 VanDerWaalsContact O-N 3.1Å; S194-E198 PolarHBondContact O-N 2.85Å
195	Q	98.2	Very high	96.6	Very high	74 Å²	74	46.1 Å²	46.1	35%	0.346	27%	0.271	S	S	.	.	H	α-helix	trans	-58.1	-32.9	174.1	-174.8	62.7	76.7	0	0	112.5	A191 V192 L193 I197 E198 D199	A191-Q195 PolarHBondContact O-N 3.31Å; V192-Q195 WeakPolarHBondContact O-CB 3.25Å; L193-Q195 VanDerWaalsContact C-N 3.3Å; Q195-I197 VanDerWaalsContact C-N 3.35Å; Q195-E198 PolarHBondContact NE2-OE2 3.4Å; Q195-E198 PolarHBondContact O-N 3.42Å; Q195-D199 WeakPolarHBondContact O-CB 3.43Å; Q195-D199 PolarHBondContact O-N 3.42Å
196	V	98.4	Very high	96.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.2	-41.2	177.1	178.2	0	0	0	0	111.3	I134 L193 S194 E198 D199 L200 L233 N236	I134-V196 HydrophobicContact CG2-CG1 4.22Å; L193-V196 HydrophobicContact CD2-CG2 4.25Å; L193-V196 WeakPolarHBondContact O-CB 3.28Å; L193-V196 PolarHBondContact O-N 2.91Å; S194-V196 PolarHBondContact O-N 2.97Å; V196-E198 VanDerWaalsContact C-N 3.33Å; V196-D199 PolarHBondContact O-N 3.19Å; V196-L200 HydrophobicContact CG1-CD1 4.19Å; V196-L200 HydrophobicContact CG1-CG 4.4Å; V196-L200 VanDerWaalsContact O-CG 3.3Å; V196-L200 WeakPolarHBondContact O-CG 3.5Å; V196-L200 PolarHBondContact O-N 3.34Å; V196-L233 HydrophobicContact CG1-CB 3.64Å; V196-L233 HydrophobicContact CG1-CD1 3.79Å; V196-L233 HydrophobicContact CG1-CG 4.22Å; V196-N236 HydrophobicContact CG2-CB 3.41Å; V196-N236 VanDerWaalsContact CG2-CB 3.41Å
197	I	96.6	Very high	95.8	Very high	39 Å²	39	45.5 Å²	45.5	20%	0.2	25%	0.252	C	S	.	.	H	α-helix	trans	-63.9	-44.3	178.2	-60.1	174	0	0	0	109.5	L174 S194 Q195 D199 L200 I201	L174-I197 HydrophobicContact CD2-CD1 4.5Å; S194-I197 PolarHBondContact O-N 2.86Å; S194-I197 VanDerWaalsContact O-N 3.1Å; Q195-I197 VanDerWaalsContact C-N 3.35Å; I197-D199 VanDerWaalsContact C-N 3.34Å; I197-D199 PolarHBondContact O-N 2.9Å; I197-L200 PolarHBondContact O-N 3Å; I197-I201 HydrophobicContact CG2-CD1 3.99Å; I197-I201 WeakPolarHBondContact O-CG1 3.38Å; I197-I201 PolarHBondContact O-N 3.34Å; I197-I201 VanDerWaalsContact O-N 3.11Å
198	E	97.9	Very high	95.1	Very high	90 Å²	90	46.8 Å²	46.8	42%	0.421	25%	0.254	S	S	.	.	H	α-helix	trans	-60.4	-43.2	174.3	-179.3	-178.6	-175.2	0	0	111.9	S194 Q195 V196 I201 H202	S194-E198 PolarHBondContact O-N 2.85Å; Q195-E198 PolarHBondContact NE2-OE2 3.4Å; Q195-E198 PolarHBondContact O-N 3.42Å; V196-E198 VanDerWaalsContact C-N 3.33Å; E198-I201 PolarHBondContact O-N 3.33Å; E198-H202 WeakPolarHBondContact CG-CE1 3.35Å; E198-H202 WeakPolarHBondContact CG-ND1 3.36Å; E198-H202 WeakPolarHBondContact O-CB 3.21Å; E198-H202 PolarHBondContact O-N 3.39Å; E198-H202 PolarHBondContact O-ND1 3.2Å; E198-H202 IonicContact OE1-CE1 2.94Å; E198-H202 PolarHBondContact OE1-CE1 3.26Å; E198-H202 VanDerWaalsContact OE1-CE1 3.3Å; E198-H202 IonicContact OE1-ND1 3.68Å
199	D	98.5	Very high	94.5	Very high	6 Å²	6	48 Å²	48	3%	0.032	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-45.8	177.6	-82.6	-28.9	0	0	0	111.8	Q195 V196 I197 I201 H202 G203 R228 S232	Q195-D199 WeakPolarHBondContact O-CB 3.43Å; Q195-D199 PolarHBondContact O-N 3.42Å; V196-D199 PolarHBondContact O-N 3.19Å; I197-D199 VanDerWaalsContact C-N 3.34Å; I197-D199 PolarHBondContact O-N 2.9Å; D199-I201 PolarHBondContact O-N 2.95Å; D199-H202 PolarHBondContact O-N 3.44Å; D199-G203 PolarHBondContact O-N 3.49Å; D199-R228 HydrophobicContact CB-CB 4.29Å; D199-R228 HydrophobicContact CB-CG 4.16Å; D199-R228 WeakPolarHBondContact O-CB 3.37Å; D199-R228 IonicContact OD1-CZ 3.94Å; D199-R228 IonicContact OD1-NH1 2.76Å; D199-R228 PolarHBondContact OD1-NH1 3.01Å; D199-S232 VanDerWaalsContact OD2-CB 3.25Å; D199-S232 WeakPolarHBondContact OD2-CB 3.24Å; D199-S232 PolarHBondContact OD2-OG 3.28Å
200	L	96.8	Very high	93.8	Very high	28 Å²	28	53.4 Å²	53.4	15%	0.147	30%	0.297	C	S	.	.	H	α-helix	trans	-58	-48.2	177.1	-71.2	169.9	0	0	0	111.3	I134 V196 I197 G203 E204	I134-L200 HydrophobicContact CG2-CD1 3.66Å; V196-L200 HydrophobicContact CG1-CD1 4.19Å; V196-L200 HydrophobicContact CG1-CG 4.4Å; V196-L200 VanDerWaalsContact O-CG 3.3Å; V196-L200 WeakPolarHBondContact O-CG 3.5Å; V196-L200 PolarHBondContact O-N 3.34Å; I197-L200 PolarHBondContact O-N 3Å; L200-G203 PolarHBondContact O-N 2.85Å; L200-E204 PolarHBondContact O-N 3.04Å
201	I	95.5	Very high	93.1	Very high	86 Å²	86	53.1 Å²	53.1	44%	0.441	30%	0.296	S	S	.	.	H	α-helix	trans	-63.4	-46.8	179.5	-67.2	167.4	0	0	0	111	I197 E198 D199 G203 E204 M205	I197-I201 HydrophobicContact CG2-CD1 3.99Å; I197-I201 WeakPolarHBondContact O-CG1 3.38Å; I197-I201 PolarHBondContact O-N 3.34Å; I197-I201 VanDerWaalsContact O-N 3.11Å; E198-I201 PolarHBondContact O-N 3.33Å; D199-I201 PolarHBondContact O-N 2.95Å; I201-G203 VanDerWaalsContact C-N 3.32Å; I201-G203 PolarHBondContact O-N 2.76Å; I201-E204 WeakPolarHBondContact O-CB 3.38Å; I201-E204 PolarHBondContact O-N 2.88Å; I201-E204 VanDerWaalsContact O-N 3.16Å; I201-M205 HydrophobicContact CG2-CE 3.57Å; I201-M205 HydrophobicContact CG2-SD 4.16Å; I201-M205 WeakPolarHBondContact O-CG 3.31Å; I201-M205 PolarHBondContact O-N 3Å
202	H	95.8	Very high	92.6	Very high	70 Å²	70	51.9 Å²	51.9	32%	0.324	28%	0.283	S	S	.	.	H	α-helix	trans	-63.6	-39.8	177.1	-80.3	87.5	0	0	0	111.8	E198 D199 E204 M205 M206	E198-H202 WeakPolarHBondContact CG-CE1 3.35Å; E198-H202 WeakPolarHBondContact CG-ND1 3.36Å; E198-H202 WeakPolarHBondContact O-CB 3.21Å; E198-H202 PolarHBondContact O-N 3.39Å; E198-H202 PolarHBondContact O-ND1 3.2Å; E198-H202 IonicContact OE1-CE1 2.94Å; E198-H202 PolarHBondContact OE1-CE1 3.26Å; E198-H202 VanDerWaalsContact OE1-CE1 3.3Å; E198-H202 IonicContact OE1-ND1 3.68Å; D199-H202 PolarHBondContact O-N 3.44Å; H202-E204 PolarHBondContact O-N 3.26Å; H202-M205 PolarHBondContact O-N 2.92Å; H202-M206 WeakPolarHBondContact O-CG 3.48Å; H202-M206 PolarHBondContact O-N 3.1Å
203	G	94.5	Very high	92.1	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-59.2	-34.5	175	0	0	0	0	0	112.3	D199 L200 I201	D199-G203 PolarHBondContact O-N 3.49Å; L200-G203 PolarHBondContact O-N 2.85Å; I201-G203 VanDerWaalsContact C-N 3.32Å; I201-G203 PolarHBondContact O-N 2.76Å
204	E	91.2	Very high	91.8	Very high	23 Å²	23	60 Å²	60	11%	0.107	33%	0.326	C	S	.	.	H	α-helix	trans	-74.8	-44.7	174.9	-163.1	50.8	-131.8	0	0	112.5	I145 L200 I201 H202 M206 Q207 K229	I145-E204 HydrophobicContact CD1-CG 3.87Å; L200-E204 PolarHBondContact O-N 3.04Å; I201-E204 WeakPolarHBondContact O-CB 3.38Å; I201-E204 PolarHBondContact O-N 2.88Å; I201-E204 VanDerWaalsContact O-N 3.16Å; H202-E204 PolarHBondContact O-N 3.26Å; E204-M206 PolarHBondContact O-N 2.77Å; E204-Q207 VanDerWaalsContact CD-NE2 3.28Å; E204-Q207 VanDerWaalsContact O-CB 3.28Å; E204-Q207 WeakPolarHBondContact O-CB 3.42Å; E204-Q207 WeakPolarHBondContact O-CG 3.36Å; E204-Q207 PolarHBondContact O-N 3.17Å; E204-Q207 PolarHBondContact OE1-NE2 3.01Å; E204-Q207 PolarHBondContact OE2-NE2 3.2Å; E204-K229 IonicContact OE2-NZ 2.76Å; E204-K229 PolarHBondContact OE2-NZ 2.76Å
205	M	92.3	Very high	91.5	Very high	113 Å²	113	59.9 Å²	59.9	56%	0.557	32%	0.321	S	S	*	.	H	α-helix	trans	-58.6	-34.9	174.4	-69.8	176.2	176.4	0	0	112.5	I201 H202 Q207 L208	I201-M205 HydrophobicContact CG2-CE 3.57Å; I201-M205 HydrophobicContact CG2-SD 4.16Å; I201-M205 WeakPolarHBondContact O-CG 3.31Å; I201-M205 PolarHBondContact O-N 3Å; H202-M205 PolarHBondContact O-N 2.92Å; M205-Q207 PolarHBondContact O-N 2.89Å; M205-L208 WeakPolarHBondContact O-CB 3.47Å; M205-L208 PolarHBondContact O-N 3.49Å; M205-L208 VanDerWaalsContact O-N 3.11Å
206	M	91.1	Very high	91.2	Very high	49 Å²	49	61.9 Å²	61.9	24%	0.241	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-63.4	-24.1	175.4	-73.4	175.7	68.8	0	0	113	H202 E204 L208 A209 T221 T224	H202-M206 WeakPolarHBondContact O-CG 3.48Å; H202-M206 PolarHBondContact O-N 3.1Å; E204-M206 PolarHBondContact O-N 2.77Å; M206-L208 VanDerWaalsContact C-N 3.27Å; M206-L208 PolarHBondContact O-N 3.25Å; M206-A209 PolarHBondContact O-N 3.43Å; M206-T221 HydrophobicContact CE-CG2 3.77Å; M206-T224 HydrophobicContact CE-CG2 3.76Å; M206-T224 HydrophobicContact SD-CG2 3.87Å
207	Q	82.5	Confident	91	Very high	46 Å²	46	68.1 Å²	68.1	22%	0.215	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-69.9	-26.4	174.8	-52.5	-149	71.2	0	0	112.5	E204 M205 A209 K225	E204-Q207 VanDerWaalsContact CD-NE2 3.28Å; E204-Q207 VanDerWaalsContact O-CB 3.28Å; E204-Q207 WeakPolarHBondContact O-CB 3.42Å; E204-Q207 WeakPolarHBondContact O-CG 3.36Å; E204-Q207 PolarHBondContact O-N 3.17Å; E204-Q207 PolarHBondContact OE1-NE2 3.01Å; E204-Q207 PolarHBondContact OE2-NE2 3.2Å; M205-Q207 PolarHBondContact O-N 2.89Å; Q207-A209 VanDerWaalsContact C-N 3.31Å; Q207-K225 VanDerWaalsContact CD-NZ 3.34Å; Q207-K225 HydrophobicContact CG-CD 4.5Å
208	L	83.6	Confident	90.8	Very high	146 Å²	146	66.7 Å²	66.7	76%	0.764	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-80.3	-15.3	-179.7	-55.6	176.4	0	0	0	112.6	M205 M206	M205-L208 WeakPolarHBondContact O-CB 3.47Å; M205-L208 PolarHBondContact O-N 3.49Å; M205-L208 VanDerWaalsContact O-N 3.11Å; M206-L208 VanDerWaalsContact C-N 3.27Å; M206-L208 PolarHBondContact O-N 3.25Å
209	A	85.4	Confident	90.7	Very high	50 Å²	50	63.8 Å²	63.8	41%	0.413	34%	0.339	S	S	.	.	S	Bend	trans	-77.4	143.1	-180	0	0	0	0	0	110.9	M206 Q207	M206-A209 PolarHBondContact O-N 3.43Å; Q207-A209 VanDerWaalsContact C-N 3.31Å
210	P	82.7	Confident	90.5	Very high	115 Å²	115	69 Å²	69	75%	0.747	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-63.7	148.8	173.2	28	-34.3	0	0	0	110.8
211	N	83.8	Confident	90.4	Very high	47 Å²	47	70.6 Å²	70.6	25%	0.251	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-63.3	139.1	174.4	-73.9	-28.8	0	0	0	110.4	L315	N211-L315 PolarHBondContact ND2-O 3.13Å
212	S	87.4	Confident	90.4	Very high	37 Å²	37	67.3 Å²	67.3	26%	0.259	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-67.4	146.1	172.5	-162.5	0	0	0	0	110.7	D214 R218	S212-D214 PolarHBondContact OG-N 3.04Å; S212-R218 PolarHBondContact O-NH1 3.32Å; S212-R218 PolarHBondContact O-NH2 3.02Å; S212-R218 VanDerWaalsContact O-NH2 3.12Å
213	D	87.6	Confident	90.5	Very high	117 Å²	117	65.5 Å²	65.5	63%	0.626	35%	0.349	S	S	*	.	S	Bend	trans	-75	-13.5	168.3	-166.7	24	0	0	0	112.5	L316	D213-L316 HydrophobicContact CB-CD2 4.05Å; D213-L316 WeakPolarHBondContact OD1-CD1 3.35Å
214	D	91.7	Very high	90.6	Very high	70 Å²	70	68 Å²	68	37%	0.374	37%	0.365	S	S	.	.	S	Bend	trans	-93.1	126	177.9	178.7	-100.1	0	0	0	111.1	S212 D216 K217 R218	S212-D214 PolarHBondContact OG-N 3.04Å; D214-D216 PolarHBondContact O-N 3.41Å; D214-D216 PolarHBondContact OD1-N 3.49Å; D214-K217 HydrophobicContact CB-CB 4.12Å; D214-K217 HydrophobicContact CB-CD 4Å; D214-K217 HydrophobicContact CB-CG 4.26Å; D214-K217 PolarHBondContact O-N 3.3Å; D214-K217 WeakPolarHBondContact OD1-CB 3.26Å; D214-K217 VanDerWaalsContact OD1-CG 3.24Å; D214-K217 WeakPolarHBondContact OD1-CG 3.12Å; D214-K217 PolarHBondContact OD1-N 2.88Å; D214-R218 WeakPolarHBondContact O-CB 3.38Å; D214-R218 PolarHBondContact O-N 3.2Å
215	D	90.1	Very high	90.8	Very high	52 Å²	52	69 Å²	69	28%	0.278	37%	0.369	S	S	.	.	H	α-helix	trans	-67.5	-38.7	-172.4	-68.1	-16.3	0	0	0	112.5	R218 F219 N312	D215-R218 WeakPolarHBondContact O-CB 3.39Å; D215-R218 PolarHBondContact O-N 3.24Å; D215-R218 IonicContact OD1-CZ 3.82Å; D215-R218 IonicContact OD1-NE 2.74Å; D215-R218 IonicContact OD1-NH2 2.69Å; D215-R218 PolarHBondContact OD1-NH2 3.2Å; D215-F219 PolarHBondContact O-N 3.31Å; D215-N312 PolarHBondContact OD1-ND2 3.47Å; D215-N312 PolarHBondContact OD1-OD1 3.05Å; D215-N312 PolarHBondContact OD2-ND2 3.42Å
216	D	91.6	Very high	91	Very high	116 Å²	116	64 Å²	64	62%	0.62	34%	0.344	S	S	*	.	H	α-helix	trans	-64.8	-46.5	176.8	-75.1	-21.1	0	0	0	110.8	D214 R218 F219 Q220	D214-D216 PolarHBondContact O-N 3.41Å; D214-D216 PolarHBondContact OD1-N 3.49Å; D216-R218 VanDerWaalsContact C-N 3.29Å; D216-R218 PolarHBondContact O-N 3.24Å; D216-F219 PolarHBondContact O-N 3.48Å; D216-Q220 WeakPolarHBondContact O-CG 3.19Å; D216-Q220 PolarHBondContact O-N 2.85Å
217	K	93.9	Very high	91.3	Very high	131 Å²	131	63.7 Å²	63.7	57%	0.57	34%	0.341	S	S	*	.	H	α-helix	trans	-61.8	-37.1	174.9	-75.2	175.8	-166.9	168.4	0	112.3	D214 Q220 T221	D214-K217 HydrophobicContact CB-CB 4.12Å; D214-K217 HydrophobicContact CB-CD 4Å; D214-K217 HydrophobicContact CB-CG 4.26Å; D214-K217 PolarHBondContact O-N 3.3Å; D214-K217 WeakPolarHBondContact OD1-CB 3.26Å; D214-K217 VanDerWaalsContact OD1-CG 3.24Å; D214-K217 WeakPolarHBondContact OD1-CG 3.12Å; D214-K217 PolarHBondContact OD1-N 2.88Å; K217-Q220 PolarHBondContact O-N 3.47Å; K217-T221 VanDerWaalsContact O-CB 3.31Å; K217-T221 WeakPolarHBondContact O-CB 3.1Å; K217-T221 PolarHBondContact O-N 2.94Å; K217-T221 PolarHBondContact O-OG1 2.66Å
218	R	93.2	Very high	92.1	Very high	9 Å²	9	64.3 Å²	64.3	3%	0.034	34%	0.341	C	S	.	.	H	α-helix	trans	-62.5	-46	175.7	-156.8	-171.3	-42.4	-105.5	2.2	110.5	S212 D214 D215 D216 T221 Y222 L302	S212-R218 PolarHBondContact O-NH1 3.32Å; S212-R218 PolarHBondContact O-NH2 3.02Å; S212-R218 VanDerWaalsContact O-NH2 3.12Å; D214-R218 WeakPolarHBondContact O-CB 3.38Å; D214-R218 PolarHBondContact O-N 3.2Å; D215-R218 WeakPolarHBondContact O-CB 3.39Å; D215-R218 PolarHBondContact O-N 3.24Å; D215-R218 IonicContact OD1-CZ 3.82Å; D215-R218 IonicContact OD1-NE 2.74Å; D215-R218 IonicContact OD1-NH2 2.69Å; D215-R218 PolarHBondContact OD1-NH2 3.2Å; D216-R218 VanDerWaalsContact C-N 3.29Å; D216-R218 PolarHBondContact O-N 3.24Å; R218-T221 WeakPolarHBondContact O-CB 3.44Å; R218-T221 PolarHBondContact O-N 3.45Å; R218-Y222 PolarHBondContact O-N 3.02Å; R218-L302 HydrophobicContact CB-CD2 4.47Å; R218-L302 VanDerWaalsContact CD-CD2 3.41Å; R218-L302 HydrophobicContact CG-CD2 3.75Å
219	F	94.7	Very high	92.6	Very high	28 Å²	28	59.3 Å²	59.3	12%	0.123	31%	0.313	C	S	.	.	H	α-helix	trans	-65.8	-41.6	177.5	-159.1	-93.8	0	0	0	112.7	D215 D216 T221 Y222 L223 L302 F303 L344	D215-F219 PolarHBondContact O-N 3.31Å; D216-F219 PolarHBondContact O-N 3.48Å; F219-T221 PolarHBondContact O-N 3.26Å; F219-Y222 WeakPolarHBondContact O-CB 3.23Å; F219-Y222 PolarHBondContact O-N 3.01Å; F219-L223 HydrophobicContact CD1-CD1 3.9Å; F219-L223 HydrophobicContact CD1-CG 4.1Å; F219-L223 HydrophobicContact CE1-CD1 3.7Å; F219-L223 HydrophobicContact CE1-CD2 4.18Å; F219-L223 HydrophobicContact CE1-CG 3.93Å; F219-L223 PolarHBondContact O-N 3.29Å; F219-L302 HydrophobicContact CD2-CB 3.89Å; F219-L302 HydrophobicContact CD2-CD1 4.2Å; F219-L302 HydrophobicContact CE2-CB 4.28Å; F219-F303 HydrophobicContact CE1-CZ 4.44Å; F219-F303 HydrophobicContact CE2-CD1 4.18Å; F219-F303 HydrophobicContact CE2-CD2 4.11Å; F219-F303 AromaticContact CE2-CE1 3.84Å; F219-F303 HydrophobicContact CE2-CE1 3.84Å; F219-F303 AromaticContact CE2-CE2 3.74Å; F219-F303 HydrophobicContact CE2-CE2 3.74Å; F219-F303 HydrophobicContact CE2-CG 4.34Å; F219-F303 AromaticContact CE2-CZ 3.62Å; F219-F303 HydrophobicContact CE2-CZ 3.62Å; F219-F303 AromaticContact CZ-CE1 3.84Å; F219-F303 HydrophobicContact CZ-CE1 3.84Å; F219-F303 AromaticContact CZ-CE2 3.72Å; F219-F303 HydrophobicContact CZ-CE2 3.72Å; F219-F303 AromaticContact CZ-CZ 3.34Å; F219-F303 HydrophobicContact CZ-CZ 3.34Å; F219-L344 HydrophobicContact CE1-CD2 4.21Å; F219-L344 HydrophobicContact CZ-CD2 3.84Å
220	Q	95.4	Very high	93.1	Very high	115 Å²	115	57.5 Å²	57.5	54%	0.537	30%	0.297	S	S	.	.	H	α-helix	trans	-64.3	-39.6	175.2	-68.7	-56.6	-32.5	0	0	112.5	D216 K217 Y222 L223 T224	D216-Q220 WeakPolarHBondContact O-CG 3.19Å; D216-Q220 PolarHBondContact O-N 2.85Å; K217-Q220 PolarHBondContact O-N 3.47Å; Q220-Y222 VanDerWaalsContact C-N 3.33Å; Q220-L223 PolarHBondContact O-N 3Å; Q220-T224 VanDerWaalsContact O-CB 3.3Å; Q220-T224 WeakPolarHBondContact O-CB 3.37Å; Q220-T224 PolarHBondContact O-N 2.92Å; Q220-T224 PolarHBondContact O-OG1 3.46Å
221	T	94.8	Very high	93.8	Very high	62 Å²	62	52 Å²	52	38%	0.38	26%	0.261	S	S	.	.	H	α-helix	trans	-60.4	-45.5	174.1	-61.5	0	0	0	0	110.6	M206 K217 R218 F219 T224 K225	M206-T221 HydrophobicContact CE-CG2 3.77Å; K217-T221 VanDerWaalsContact O-CB 3.31Å; K217-T221 WeakPolarHBondContact O-CB 3.1Å; K217-T221 PolarHBondContact O-N 2.94Å; K217-T221 PolarHBondContact O-OG1 2.66Å; R218-T221 WeakPolarHBondContact O-CB 3.44Å; R218-T221 PolarHBondContact O-N 3.45Å; F219-T221 PolarHBondContact O-N 3.26Å; T221-T224 PolarHBondContact O-N 3.29Å; T221-K225 WeakPolarHBondContact O-CB 3.25Å; T221-K225 PolarHBondContact O-N 3.41Å
222	Y	95.2	Very high	94.5	Very high	17 Å²	17	49.8 Å²	49.8	7%	0.067	25%	0.249	C	C	.	.	H	α-helix	trans	-58.6	-51.3	175.5	162.9	-107.1	0	0	0	112.5	R218 F219 Q220 T224 K225 T226 L270 D273 G299 L302	R218-Y222 PolarHBondContact O-N 3.02Å; F219-Y222 WeakPolarHBondContact O-CB 3.23Å; F219-Y222 PolarHBondContact O-N 3.01Å; Q220-Y222 VanDerWaalsContact C-N 3.33Å; Y222-T224 VanDerWaalsContact C-N 3.3Å; Y222-T224 PolarHBondContact O-N 2.89Å; Y222-K225 PolarHBondContact O-N 2.93Å; Y222-T226 WeakPolarHBondContact O-CB 3.48Å; Y222-T226 PolarHBondContact O-N 3.3Å; Y222-T226 PolarHBondContact O-OG1 3.34Å; Y222-T226 VanDerWaalsContact O-OG1 3.14Å; Y222-L270 HydrophobicContact CE1-CD2 4.03Å; Y222-L270 VanDerWaalsContact OH-CD2 3.22Å; Y222-L270 WeakPolarHBondContact OH-CD2 3.27Å; Y222-D273 WeakPolarHBondContact CE2-OD2 3.44Å; Y222-D273 VanDerWaalsContact CZ-OD2 3.25Å; Y222-D273 PolarHBondContact OH-OD2 2.85Å; Y222-G299 PolarHBondContact OH-N 3Å; Y222-L302 HydrophobicContact CD1-CD1 3.71Å; Y222-L302 HydrophobicContact CD2-CD1 4.03Å; Y222-L302 HydrophobicContact CG-CD1 3.42Å; Y222-L302 VanDerWaalsContact CG-CD1 3.42Å
223	L	97.4	Very high	95	Very high	32 Å²	32	48.2 Å²	48.2	17%	0.168	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-38.9	178.5	-67.5	-178.4	0	0	0	112.3	F219 Q220 T226 Y227 M266 L344	F219-L223 HydrophobicContact CD1-CD1 3.9Å; F219-L223 HydrophobicContact CD1-CG 4.1Å; F219-L223 HydrophobicContact CE1-CD1 3.7Å; F219-L223 HydrophobicContact CE1-CD2 4.18Å; F219-L223 HydrophobicContact CE1-CG 3.93Å; F219-L223 PolarHBondContact O-N 3.29Å; Q220-L223 PolarHBondContact O-N 3Å; L223-T226 PolarHBondContact O-N 3.21Å; L223-Y227 PolarHBondContact O-N 3.03Å; L223-M266 HydrophobicContact CB-CE 4.28Å; L223-M266 HydrophobicContact CD2-CE 3.81Å; L223-L344 HydrophobicContact CD2-CD2 4.11Å
224	T	97.4	Very high	95.5	Very high	53 Å²	53	42.9 Å²	42.9	33%	0.325	21%	0.21	S	C	.	.	H	α-helix	trans	-65.6	-43.5	177.1	-59.7	0	0	0	0	111.2	M206 Q220 T221 Y222 Y227 R228	M206-T224 HydrophobicContact CE-CG2 3.76Å; M206-T224 HydrophobicContact SD-CG2 3.87Å; Q220-T224 VanDerWaalsContact O-CB 3.3Å; Q220-T224 WeakPolarHBondContact O-CB 3.37Å; Q220-T224 PolarHBondContact O-N 2.92Å; Q220-T224 PolarHBondContact O-OG1 3.46Å; T221-T224 PolarHBondContact O-N 3.29Å; Y222-T224 VanDerWaalsContact C-N 3.3Å; Y222-T224 PolarHBondContact O-N 2.89Å; T224-Y227 PolarHBondContact O-N 2.92Å; T224-R228 HydrophobicContact CG2-CG 4.48Å; T224-R228 WeakPolarHBondContact O-CB 3.39Å; T224-R228 WeakPolarHBondContact O-CG 3.44Å; T224-R228 PolarHBondContact O-N 3.23Å
225	K	95.2	Very high	95.9	Very high	44 Å²	44	39.5 Å²	39.5	19%	0.191	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-45.8	174.4	-178.2	-177.5	175.3	-179.4	0	110.9	Q207 T221 Y222 Y227 R228 K229	Q207-K225 VanDerWaalsContact CD-NZ 3.34Å; Q207-K225 HydrophobicContact CG-CD 4.5Å; T221-K225 WeakPolarHBondContact O-CB 3.25Å; T221-K225 PolarHBondContact O-N 3.41Å; Y222-K225 PolarHBondContact O-N 2.93Å; K225-Y227 VanDerWaalsContact C-N 3.34Å; K225-Y227 PolarHBondContact O-N 3.31Å; K225-R228 PolarHBondContact O-N 2.91Å; K225-K229 HydrophobicContact CG-CD 4.23Å; K225-K229 HydrophobicContact CG-CG 4.29Å; K225-K229 WeakPolarHBondContact O-CB 3.49Å; K225-K229 PolarHBondContact O-N 2.92Å
226	T	96.2	Very high	96.3	Very high	8 Å²	8	37.4 Å²	37.4	5%	0.049	18%	0.18	C	C	.	.	H	α-helix	trans	-58.9	-44	176.2	-68.8	0	0	0	0	112.1	Y222 L223 T230 A231 M266 Q269	Y222-T226 WeakPolarHBondContact O-CB 3.48Å; Y222-T226 PolarHBondContact O-N 3.3Å; Y222-T226 PolarHBondContact O-OG1 3.34Å; Y222-T226 VanDerWaalsContact O-OG1 3.14Å; L223-T226 PolarHBondContact O-N 3.21Å; T226-T230 WeakPolarHBondContact O-CB 3.49Å; T226-T230 PolarHBondContact O-N 3.46Å; T226-T230 VanDerWaalsContact O-N 3.13Å; T226-A231 PolarHBondContact O-N 3.01Å; T226-M266 HydrophobicContact CG2-CE 3.76Å; T226-M266 HydrophobicContact CG2-SD 3.74Å; T226-Q269 HydrophobicContact CG2-CB 3.46Å; T226-Q269 VanDerWaalsContact CG2-CB 3.46Å; T226-Q269 HydrophobicContact CG2-CG 3.65Å
227	Y	98.5	Very high	96.6	Very high	42 Å²	42	31.9 Å²	31.9	17%	0.165	15%	0.151	C	C	.	.	I	π-helix	trans	-60.6	-53.1	174.1	171.1	-97.7	0	0	0	110.9	L223 T224 K225 A231 S232 Y258 K262	L223-Y227 PolarHBondContact O-N 3.03Å; T224-Y227 PolarHBondContact O-N 2.92Å; K225-Y227 VanDerWaalsContact C-N 3.34Å; K225-Y227 PolarHBondContact O-N 3.31Å; Y227-A231 HydrophobicContact CD2-CB 3.99Å; Y227-A231 CarbonylContact O-C 3.53Å; Y227-A231 PolarHBondContact O-N 2.99Å; Y227-S232 WeakPolarHBondContact O-CB 3.47Å; Y227-S232 PolarHBondContact O-N 3Å; Y227-Y258 WeakPolarHBondContact CE2-OH 3.37Å; Y227-Y258 PolarHBondContact OH-OH 3.29Å; Y227-K262 HydrophobicContact CD2-CD 4.27Å; Y227-K262 HydrophobicContact CD2-CG 4Å; Y227-K262 HydrophobicContact CE2-CD 4Å; Y227-K262 HydrophobicContact CE2-CG 4Å
228	R	97.9	Very high	96.9	Very high	59 Å²	59	25.7 Å²	25.7	22%	0.223	12%	0.124	C	C	.	.	I	π-helix	trans	-65.1	-47.3	-173.2	-77.7	-170.3	-172.1	-97.3	15.5	113.4	D199 T224 K225	D199-R228 HydrophobicContact CB-CB 4.29Å; D199-R228 HydrophobicContact CB-CG 4.16Å; D199-R228 WeakPolarHBondContact O-CB 3.37Å; D199-R228 IonicContact OD1-CZ 3.94Å; D199-R228 IonicContact OD1-NH1 2.76Å; D199-R228 PolarHBondContact OD1-NH1 3.01Å; T224-R228 HydrophobicContact CG2-CG 4.48Å; T224-R228 WeakPolarHBondContact O-CB 3.39Å; T224-R228 WeakPolarHBondContact O-CG 3.44Å; T224-R228 PolarHBondContact O-N 3.23Å; K225-R228 PolarHBondContact O-N 2.91Å
229	K	95.1	Very high	97.1	Very high	42 Å²	42	27.4 Å²	27.4	18%	0.183	13%	0.132	C	C	.	.	I	π-helix	trans	-75.6	-29.6	-178.3	-68.5	-158.3	63.1	152.1	0	113.4	D142 E204 K225	D142-K229 IonicContact OD1-NZ 3.42Å; D142-K229 IonicContact OD2-NZ 3.82Å; D142-K229 PolarHBondContact OD2-NZ 3.1Å; E204-K229 IonicContact OE2-NZ 2.76Å; E204-K229 PolarHBondContact OE2-NZ 2.76Å; K225-K229 HydrophobicContact CG-CD 4.23Å; K225-K229 HydrophobicContact CG-CG 4.29Å; K225-K229 WeakPolarHBondContact O-CB 3.49Å; K225-K229 PolarHBondContact O-N 2.92Å
230	T	94.5	Very high	97.3	Very high	11 Å²	11	26 Å²	26	7%	0.067	13%	0.126	C	C	.	.	I	π-helix	trans	-124.5	-56.1	-170.4	-60.6	0	0	0	0	113.6	T226 F268 Q269	T226-T230 WeakPolarHBondContact O-CB 3.49Å; T226-T230 PolarHBondContact O-N 3.46Å; T226-T230 VanDerWaalsContact O-N 3.13Å; T230-F268 HydrophobicContact CG2-CD1 3.98Å; T230-Q269 HydrophobicContact CG2-CB 4.26Å; T230-Q269 PolarHBondContact OG1-OE1 3.26Å
231	A	98	Very high	97.5	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.1	C	C	.	.	I	π-helix	trans	-76.5	-31.8	-168.6	0	0	0	0	0	114	T226 Y227 L233 I234 A235 M266	T226-A231 PolarHBondContact O-N 3.01Å; Y227-A231 HydrophobicContact CD2-CB 3.99Å; Y227-A231 CarbonylContact O-C 3.53Å; Y227-A231 PolarHBondContact O-N 2.99Å; A231-L233 PolarHBondContact O-N 3.44Å; A231-I234 PolarHBondContact O-N 3.3Å; A231-A235 VanDerWaalsContact O-CB 3.31Å; A231-A235 WeakPolarHBondContact O-CB 3.47Å; A231-A235 PolarHBondContact O-N 2.98Å; A231-M266 HydrophobicContact CB-CG 4.07Å; A231-M266 HydrophobicContact CB-SD 4.04Å
232	S	98.6	Very high	97.6	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-58.6	-46.8	-176	175.5	0	0	0	0	111.8	D199 Y227 I234 A235 N236	D199-S232 VanDerWaalsContact OD2-CB 3.25Å; D199-S232 WeakPolarHBondContact OD2-CB 3.24Å; D199-S232 PolarHBondContact OD2-OG 3.28Å; Y227-S232 WeakPolarHBondContact O-CB 3.47Å; Y227-S232 PolarHBondContact O-N 3Å; S232-I234 PolarHBondContact O-N 3.16Å; S232-A235 PolarHBondContact O-N 3.26Å; S232-N236 VanDerWaalsContact O-CB 3.29Å; S232-N236 WeakPolarHBondContact O-CB 3.31Å; S232-N236 PolarHBondContact O-N 3.04Å; S232-N236 PolarHBondContact O-ND2 3.34Å; S232-N236 PolarHBondContact OG-ND2 3.13Å
233	L	98.5	Very high	97.8	Very high	5 Å²	5	18.7 Å²	18.7	3%	0.026	9%	0.088	C	C	.	.	H	α-helix	trans	-59.7	-45.7	177.7	176.1	55.5	0	0	0	111.5	A131 I134 H135 V196 A231 S237	A131-L233 HydrophobicContact CB-CD1 4.19Å; I134-L233 HydrophobicContact CB-CD1 4.38Å; I134-L233 HydrophobicContact CG2-CD1 4.23Å; I134-L233 HydrophobicContact CG2-CD2 4.32Å; H135-L233 HydrophobicContact CB-CD2 3.84Å; V196-L233 HydrophobicContact CG1-CB 3.64Å; V196-L233 HydrophobicContact CG1-CD1 3.79Å; V196-L233 HydrophobicContact CG1-CG 4.22Å; A231-L233 PolarHBondContact O-N 3.44Å; L233-S237 VanDerWaalsContact O-CB 3.23Å; L233-S237 WeakPolarHBondContact O-CB 3.48Å; L233-S237 PolarHBondContact O-N 3.49Å; L233-S237 PolarHBondContact O-OG 3.01Å
234	I	98.3	Very high	97.8	Very high	4 Å²	4	17.9 Å²	17.9	2%	0.021	8%	0.084	C	C	.	.	H	α-helix	trans	-64.9	-47.8	179.2	-58.9	174.4	0	0	0	110.3	R80 L83 A231 S232 C238 G261	R80-I234 HydrophobicContact CG-CG1 4.34Å; L83-I234 HydrophobicContact CD1-CG2 4.43Å; A231-I234 PolarHBondContact O-N 3.3Å; S232-I234 PolarHBondContact O-N 3.16Å; I234-C238 WeakPolarHBondContact O-CB 3.49Å; I234-C238 PolarHBondContact O-N 3.05Å; I234-C238 PolarHBondContact O-SG 2.75Å; I234-G261 WeakPolarHBondContact CG2-O 3.32Å
235	A	98.8	Very high	97.8	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-58.2	-52.5	-179.9	0	0	0	0	0	112.1	A231 S232 C238 K239 Y258 K262	A231-A235 VanDerWaalsContact O-CB 3.31Å; A231-A235 WeakPolarHBondContact O-CB 3.47Å; A231-A235 PolarHBondContact O-N 2.98Å; S232-A235 PolarHBondContact O-N 3.26Å; A235-C238 PolarHBondContact O-N 3.41Å; A235-K239 WeakPolarHBondContact O-CB 3.34Å; A235-K239 PolarHBondContact O-N 2.54Å; A235-Y258 HydrophobicContact CB-CD2 3.68Å; A235-Y258 HydrophobicContact CB-CE2 3.56Å; A235-Y258 HydrophobicContact CB-CG 4.43Å; A235-K262 HydrophobicContact CB-CB 3.76Å
236	N	98.8	Very high	97.6	Very high	7 Å²	7	17.7 Å²	17.7	4%	0.037	9%	0.086	C	C	.	.	H	α-helix	trans	-73.7	-32.2	-176.1	-74.5	-57.6	0	0	0	112.3	V192 L193 V196 S232 K239 A240	V192-N236 HydrophobicContact CG1-CB 3.61Å; V192-N236 WeakPolarHBondContact CG1-O 3.32Å; V192-N236 WeakPolarHBondContact CG1-OD1 3.26Å; L193-N236 HydrophobicContact CD2-CB 4.26Å; V196-N236 HydrophobicContact CG2-CB 3.41Å; V196-N236 VanDerWaalsContact CG2-CB 3.41Å; S232-N236 VanDerWaalsContact O-CB 3.29Å; S232-N236 WeakPolarHBondContact O-CB 3.31Å; S232-N236 PolarHBondContact O-N 3.04Å; S232-N236 PolarHBondContact O-ND2 3.34Å; S232-N236 PolarHBondContact OG-ND2 3.13Å; N236-K239 PolarHBondContact O-N 3.24Å; N236-A240 VanDerWaalsContact O-CB 3.25Å; N236-A240 WeakPolarHBondContact O-CB 3.44Å; N236-A240 PolarHBondContact O-N 2.86Å
237	S	98.8	Very high	97.5	Very high	1 Å²	1	21 Å²	21	1%	0.007	11%	0.107	C	C	.	.	H	α-helix	trans	-67.9	-41	170.9	-61	0	0	0	0	112.5	V84 A131 L233 A240 V241	V84-S237 VanDerWaalsContact CG2-CB 3.41Å; A131-S237 WeakPolarHBondContact CB-OG 3.49Å; L233-S237 VanDerWaalsContact O-CB 3.23Å; L233-S237 WeakPolarHBondContact O-CB 3.48Å; L233-S237 PolarHBondContact O-N 3.49Å; L233-S237 PolarHBondContact O-OG 3.01Å; S237-A240 PolarHBondContact O-N 3.32Å; S237-V241 PolarHBondContact O-N 3.36Å; S237-V241 VanDerWaalsContact O-N 3.12Å
238	C	98.8	Very high	97.2	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-63.7	-41.9	173.9	-66	0	0	0	0	111.2	A87 I234 A235 V241 A242 M257	A87-C238 HydrophobicContact CB-CB 4.26Å; I234-C238 WeakPolarHBondContact O-CB 3.49Å; I234-C238 PolarHBondContact O-N 3.05Å; I234-C238 PolarHBondContact O-SG 2.75Å; A235-C238 PolarHBondContact O-N 3.41Å; C238-V241 WeakPolarHBondContact O-CG2 3.29Å; C238-A242 PolarHBondContact O-N 2.9Å; C238-M257 HydrophobicContact CB-CG 3.8Å; C238-M257 WeakPolarHBondContact CB-O 3.36Å; C238-M257 HydrophobicContact CB-SD 4.26Å; C238-M257 WeakPolarHBondContact O-CG 3.39Å
239	K	98.8	Very high	97.1	Very high	45 Å²	45	21.5 Å²	21.5	20%	0.196	12%	0.121	C	C	.	.	H	α-helix	trans	-58.9	-49	173.1	-171.1	179.6	179.6	168.3	0	111.9	V192 A235 N236 V241 A242 M243 I254 Y258	V192-K239 HydrophobicContact CG1-CB 4.4Å; V192-K239 HydrophobicContact CG1-CD 4.2Å; V192-K239 HydrophobicContact CG2-CD 4.06Å; A235-K239 WeakPolarHBondContact O-CB 3.34Å; A235-K239 PolarHBondContact O-N 2.54Å; N236-K239 PolarHBondContact O-N 3.24Å; K239-V241 PolarHBondContact O-N 3.23Å; K239-A242 WeakPolarHBondContact O-CB 3.48Å; K239-A242 PolarHBondContact O-N 3.07Å; K239-A242 VanDerWaalsContact O-N 3.15Å; K239-M243 HydrophobicContact CG-CG 4.46Å; K239-M243 HydrophobicContact CG-SD 4.02Å; K239-M243 VanDerWaalsContact O-CG 3.31Å; K239-M243 WeakPolarHBondContact O-CG 3.25Å; K239-M243 PolarHBondContact O-N 3.44Å; K239-I254 HydrophobicContact CG-CG2 3.76Å; K239-Y258 HydrophobicContact CB-CD2 4.28Å; K239-Y258 HydrophobicContact CD-CD2 3.97Å; K239-Y258 HydrophobicContact CD-CG 4.26Å
240	A	98.8	Very high	97.2	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-59.4	-44.2	-178.3	0	0	0	0	0	112.3	I127 V189 V192 L193 N236 S237 A242 M243 L244	I127-A240 HydrophobicContact CD1-CB 4.15Å; I127-A240 HydrophobicContact CG1-CB 4.37Å; I127-A240 HydrophobicContact CG2-CB 4.04Å; V189-A240 HydrophobicContact CG1-CB 4Å; V189-A240 HydrophobicContact CG2-CB 4.41Å; V192-A240 HydrophobicContact CG1-CB 4.47Å; L193-A240 HydrophobicContact CD2-CB 4.45Å; L193-A240 HydrophobicContact CG-CB 4.45Å; N236-A240 VanDerWaalsContact O-CB 3.25Å; N236-A240 WeakPolarHBondContact O-CB 3.44Å; N236-A240 PolarHBondContact O-N 2.86Å; S237-A240 PolarHBondContact O-N 3.32Å; A240-A242 VanDerWaalsContact C-N 3.33Å; A240-A242 PolarHBondContact O-N 3.12Å; A240-M243 WeakPolarHBondContact O-CB 3.35Å; A240-M243 PolarHBondContact O-N 3.31Å; A240-L244 WeakPolarHBondContact O-CG 3.41Å; A240-L244 PolarHBondContact O-N 3.31Å
241	V	98.7	Very high	97.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-68	-32.4	176.9	-63.9	0	0	0	0	113	V84 A87 A88 Q124 I127 S237 C238 K239 L244 T245	V84-V241 HydrophobicContact CG1-CG1 3.56Å; A87-V241 HydrophobicContact CB-CG2 3.98Å; A88-V241 HydrophobicContact CB-CB 3.78Å; A88-V241 HydrophobicContact CB-CG1 4.13Å; A88-V241 HydrophobicContact CB-CG2 4.05Å; Q124-V241 HydrophobicContact CB-CB 4.34Å; Q124-V241 HydrophobicContact CB-CG1 4.06Å; Q124-V241 HydrophobicContact CG-CB 3.98Å; Q124-V241 HydrophobicContact CG-CG1 4.19Å; Q124-V241 PolarHBondContact NE2-O 3.04Å; I127-V241 HydrophobicContact CB-CG1 3.75Å; I127-V241 HydrophobicContact CG1-CG1 4.27Å; I127-V241 HydrophobicContact CG2-CG1 3.73Å; S237-V241 PolarHBondContact O-N 3.36Å; S237-V241 VanDerWaalsContact O-N 3.12Å; C238-V241 WeakPolarHBondContact O-CG2 3.29Å; K239-V241 PolarHBondContact O-N 3.23Å; V241-L244 PolarHBondContact O-N 3.05Å; V241-T245 PolarHBondContact O-OG1 2.88Å
242	A	98.5	Very high	97.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.8	-40.8	172.7	0	0	0	0	0	111.9	A91 C238 K239 A240 L244 T245 L249 I254 M257	A91-A242 HydrophobicContact CB-CB 4.43Å; C238-A242 PolarHBondContact O-N 2.9Å; K239-A242 WeakPolarHBondContact O-CB 3.48Å; K239-A242 PolarHBondContact O-N 3.07Å; K239-A242 VanDerWaalsContact O-N 3.15Å; A240-A242 VanDerWaalsContact C-N 3.33Å; A240-A242 PolarHBondContact O-N 3.12Å; A242-L244 PolarHBondContact O-N 3.13Å; A242-T245 VanDerWaalsContact O-CB 3.26Å; A242-T245 WeakPolarHBondContact O-CB 3.37Å; A242-T245 PolarHBondContact O-N 3.37Å; A242-T245 VanDerWaalsContact O-N 3.14Å; A242-T245 PolarHBondContact O-OG1 3.25Å; A242-L249 HydrophobicContact CB-CD1 4.07Å; A242-I254 HydrophobicContact CB-CG1 4.32Å; A242-M257 HydrophobicContact CB-CB 3.86Å; A242-M257 HydrophobicContact CB-CG 3.93Å
243	M	98.5	Very high	97.4	Very high	39 Å²	39	34.6 Å²	34.6	19%	0.192	18%	0.184	C	C	.	.	H	α-helix	trans	-60.1	-33.3	175.8	-69.2	169.7	65.8	0	0	112.7	G188 V189 V192 K239 A240 T245 I254	G188-M243 VanDerWaalsContact C-CE 3.44Å; V189-M243 HydrophobicContact CG2-CB 4.12Å; V189-M243 HydrophobicContact CG2-CE 4.2Å; V189-M243 HydrophobicContact CG2-SD 4.48Å; V192-M243 HydrophobicContact CG2-SD 4.02Å; K239-M243 HydrophobicContact CG-CG 4.46Å; K239-M243 HydrophobicContact CG-SD 4.02Å; K239-M243 VanDerWaalsContact O-CG 3.31Å; K239-M243 WeakPolarHBondContact O-CG 3.25Å; K239-M243 PolarHBondContact O-N 3.44Å; A240-M243 WeakPolarHBondContact O-CB 3.35Å; A240-M243 PolarHBondContact O-N 3.31Å; M243-T245 VanDerWaalsContact C-N 3.27Å; M243-T245 PolarHBondContact O-N 3.45Å; M243-I254 HydrophobicContact CG-CD1 4.16Å; M243-I254 HydrophobicContact CG-CG2 3.69Å
244	L	97.5	Very high	97.4	Very high	16 Å²	16	34.8 Å²	34.8	8%	0.084	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	3.3	179.3	-67	171.1	0	0	0	114.4	K123 Q124 I127 I184 D186 V189 A240 V241 A242	K123-L244 HydrophobicContact CB-CD1 3.99Å; K123-L244 HydrophobicContact CB-CD2 4.4Å; K123-L244 HydrophobicContact CD-CD2 4.26Å; Q124-L244 HydrophobicContact CG-CB 3.9Å; Q124-L244 HydrophobicContact CG-CD1 4.4Å; I127-L244 HydrophobicContact CD1-CD1 4.35Å; I127-L244 HydrophobicContact CG1-CD1 3.74Å; I184-L244 HydrophobicContact CG2-CD1 4.18Å; I184-L244 HydrophobicContact CG2-CD2 3.92Å; D186-L244 HydrophobicContact CB-CD2 4.18Å; V189-L244 HydrophobicContact CG2-CD1 4.37Å; V189-L244 HydrophobicContact CG2-CD2 3.99Å; V189-L244 HydrophobicContact CG2-CG 3.91Å; A240-L244 WeakPolarHBondContact O-CG 3.41Å; A240-L244 PolarHBondContact O-N 3.31Å; V241-L244 PolarHBondContact O-N 3.05Å; A242-L244 PolarHBondContact O-N 3.13Å
245	T	96.6	Very high	97.4	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.006	20%	0.2	C	C	.	.			trans	-70.3	141.3	177.8	-54.7	0	0	0	0	110.4	A91 N92 I95 V241 A242 M243 P247 T248 L249	A91-T245 WeakPolarHBondContact CB-OG1 3.3Å; N92-T245 WeakPolarHBondContact OD1-CG2 3.3Å; I95-T245 HydrophobicContact CB-CG2 4.33Å; I95-T245 HydrophobicContact CG1-CG2 3.66Å; V241-T245 PolarHBondContact O-OG1 2.88Å; A242-T245 VanDerWaalsContact O-CB 3.26Å; A242-T245 WeakPolarHBondContact O-CB 3.37Å; A242-T245 PolarHBondContact O-N 3.37Å; A242-T245 VanDerWaalsContact O-N 3.14Å; A242-T245 PolarHBondContact O-OG1 3.25Å; M243-T245 VanDerWaalsContact C-N 3.27Å; M243-T245 PolarHBondContact O-N 3.45Å; T245-P247 CarbonylContact C-O 3.59Å; T245-P247 CarbonylContact O-C 3.33Å; T245-T248 VanDerWaalsContact O-CA 3.28Å; T245-T248 WeakPolarHBondContact O-CA 3.44Å; T245-T248 PolarHBondContact O-N 3.11Å; T245-L249 HydrophobicContact CG2-CD1 4.25Å; T245-L249 HydrophobicContact CG2-CG 3.99Å
246	V	92.4	Very high	97.4	Very high	92 Å²	92	38.9 Å²	38.9	56%	0.558	21%	0.207	S	C	*	.	S	Bend	trans	-127.6	129.6	179.9	-178.1	0	0	0	0	111.1
247	P	92.4	Very high	97.4	Very high	76 Å²	76	38.5 Å²	38.5	49%	0.494	21%	0.205	S	C	.	.	S	Bend	cis	-54.5	154.2	-15	24.4	-37.7	0	0	0	112.9	I95 T245 L249	I95-P247 VanDerWaalsContact CG2-CD 3.43Å; I95-P247 HydrophobicContact CG2-CG 3.65Å; T245-P247 CarbonylContact C-O 3.59Å; T245-P247 CarbonylContact O-C 3.33Å; P247-L249 PolarHBondContact O-N 2.94Å
248	T	93.4	Very high	97.5	Very high	105 Å²	105	40.3 Å²	40.3	64%	0.644	21%	0.212	S	C	*	.	P	Polyproline II helix	trans	-55.5	130.8	-176.5	-51.2	0	0	0	0	111.3	T245	T245-T248 VanDerWaalsContact O-CA 3.28Å; T245-T248 WeakPolarHBondContact O-CA 3.44Å; T245-T248 PolarHBondContact O-N 3.11Å
249	L	95.9	Very high	97.5	Very high	7 Å²	7	43 Å²	43	4%	0.037	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-62.6	153.1	171.8	-78.9	170.1	0	0	0	110.8	A91 I95 A242 T245 P247 H253 I254 F359	A91-L249 HydrophobicContact CB-CD1 3.77Å; I95-L249 HydrophobicContact CD1-CD2 3.66Å; I95-L249 HydrophobicContact CD1-CG 4.38Å; I95-L249 HydrophobicContact CG1-CD2 3.74Å; I95-L249 HydrophobicContact CG1-CG 4.24Å; A242-L249 HydrophobicContact CB-CD1 4.07Å; T245-L249 HydrophobicContact CG2-CD1 4.25Å; T245-L249 HydrophobicContact CG2-CG 3.99Å; P247-L249 PolarHBondContact O-N 2.94Å; L249-H253 HydrophobicContact CB-CB 4.17Å; L249-H253 HydrophobicContact CD1-CB 4.4Å; L249-H253 HydrophobicContact CD2-CB 4.12Å; L249-H253 HydrophobicContact CG-CB 4.49Å; L249-I254 HydrophobicContact CB-CD1 4.5Å; L249-I254 HydrophobicContact CB-CG1 4.04Å; L249-F359 HydrophobicContact CD1-CE1 4.22Å
250	S	97.3	Very high	97.5	Very high	61 Å²	61	41 Å²	41	43%	0.427	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-61.4	150.2	170	66.7	0	0	0	0	110.8	W252 H253 I254	S250-W252 PolarHBondContact O-N 3.44Å; S250-W252 VanDerWaalsContact O-N 3.12Å; S250-H253 PolarHBondContact O-N 2.97Å; S250-H253 PolarHBondContact OG-ND1 3.48Å; S250-I254 PolarHBondContact O-N 2.82Å; S250-I254 VanDerWaalsContact O-N 3.14Å
251	Q	98.1	Very high	97.4	Very high	112 Å²	112	41 Å²	41	52%	0.523	22%	0.215	S	C	.	.	H	α-helix	trans	-52.1	-39	177.6	-173.3	58.7	48.7	0	0	111.9	H253 I254 D255	Q251-H253 VanDerWaalsContact C-N 3.34Å; Q251-H253 PolarHBondContact O-N 3.42Å; Q251-I254 WeakPolarHBondContact O-CB 3.4Å; Q251-I254 PolarHBondContact O-N 3Å; Q251-I254 VanDerWaalsContact O-N 3.15Å; Q251-D255 PolarHBondContact NE2-OD1 3.36Å; Q251-D255 VanDerWaalsContact O-CG 3.24Å; Q251-D255 PolarHBondContact O-N 3.21Å
252	W	98.5	Very high	97.4	Very high	133 Å²	133	43.6 Å²	43.6	50%	0.504	23%	0.227	S	C	.	.	H	α-helix	trans	-59.4	-38.5	176.7	-178.1	80.5	0	0	0	113.7	S250 N256 Q358	S250-W252 PolarHBondContact O-N 3.44Å; S250-W252 VanDerWaalsContact O-N 3.12Å; W252-N256 WeakPolarHBondContact O-CB 3.38Å; W252-N256 PolarHBondContact O-N 3.19Å; W252-N256 PolarHBondContact O-ND2 3.38Å; W252-Q358 HydrophobicContact CH2-CB 3.45Å; W252-Q358 VanDerWaalsContact CH2-CB 3.45Å; W252-Q358 HydrophobicContact CH2-CG 3.58Å; W252-Q358 HydrophobicContact CZ2-CB 4.11Å; W252-Q358 HydrophobicContact CZ2-CG 3.75Å; W252-Q358 VanDerWaalsContact CZ2-OE1 3.22Å; W252-Q358 HydrophobicContact CZ3-CB 3.76Å; W252-Q358 HydrophobicContact CZ3-CG 4.34Å
253	H	98.6	Very high	97.5	Very high	23 Å²	23	45 Å²	45	11%	0.106	23%	0.233	C	C	.	.	H	α-helix	trans	-72.5	-38.5	174.5	-72.6	109.9	0	0	0	111.9	H94 L249 S250 Q251 D255 N256 M257 Q358 F359	H94-H253 AromaticContact CE1-CD2 3.74Å; H94-H253 AromaticContact CE1-CE1 3.46Å; H94-H253 PolarHBondContact CE1-CE1 3.14Å; H94-H253 VanDerWaalsContact CE1-CE1 3.46Å; H94-H253 AromaticContact CE1-NE2 3.05Å; H94-H253 PolarHBondContact CE1-NE2 3.45Å; H94-H253 AromaticContact ND1-NE2 3.91Å; H94-H253 AromaticContact NE2-CE1 3.32Å; H94-H253 PolarHBondContact NE2-CE1 2.96Å; H94-H253 VanDerWaalsContact NE2-CE1 3.32Å; H94-H253 AromaticContact NE2-ND1 3.93Å; H94-H253 AromaticContact NE2-NE2 3.42Å; H94-H253 PolarHBondContact NE2-NE2 3.39Å; L249-H253 HydrophobicContact CB-CB 4.17Å; L249-H253 HydrophobicContact CD1-CB 4.4Å; L249-H253 HydrophobicContact CD2-CB 4.12Å; L249-H253 HydrophobicContact CG-CB 4.49Å; S250-H253 PolarHBondContact O-N 2.97Å; S250-H253 PolarHBondContact OG-ND1 3.48Å; Q251-H253 VanDerWaalsContact C-N 3.34Å; Q251-H253 PolarHBondContact O-N 3.42Å; H253-D255 VanDerWaalsContact C-N 3.31Å; H253-D255 PolarHBondContact O-N 3.41Å; H253-N256 PolarHBondContact O-N 2.96Å; H253-M257 PolarHBondContact O-N 3.42Å; H253-Q358 PolarHBondContact NE2-O 3.26Å; H253-F359 HydrophobicContact CB-CE1 4.1Å; H253-F359 HydrophobicContact CB-CZ 4.06Å; H253-F359 VanDerWaalsContact O-CZ 3.31Å; H253-F359 WeakPolarHBondContact O-CZ 3.31Å
254	I	98.7	Very high	97.4	Very high	8 Å²	8	43.1 Å²	43.1	4%	0.041	22%	0.224	C	C	.	.	H	α-helix	trans	-60	-44.4	175.7	-65.3	169.9	0	0	0	110.2	K239 A242 M243 L249 S250 Q251 M257 Y258	K239-I254 HydrophobicContact CG-CG2 3.76Å; A242-I254 HydrophobicContact CB-CG1 4.32Å; M243-I254 HydrophobicContact CG-CD1 4.16Å; M243-I254 HydrophobicContact CG-CG2 3.69Å; L249-I254 HydrophobicContact CB-CD1 4.5Å; L249-I254 HydrophobicContact CB-CG1 4.04Å; S250-I254 PolarHBondContact O-N 2.82Å; S250-I254 VanDerWaalsContact O-N 3.14Å; Q251-I254 WeakPolarHBondContact O-CB 3.4Å; Q251-I254 PolarHBondContact O-N 3Å; Q251-I254 VanDerWaalsContact O-N 3.15Å; I254-M257 PolarHBondContact O-N 3.36Å; I254-Y258 PolarHBondContact O-N 3.15Å
255	D	98.7	Very high	97.4	Very high	66 Å²	66	42.4 Å²	42.4	35%	0.353	22%	0.22	S	C	.	.	H	α-helix	trans	-67	-38.9	177.4	-64.7	-21.8	0	0	0	111.9	Q251 H253 M257 Y258 E259	Q251-D255 PolarHBondContact NE2-OD1 3.36Å; Q251-D255 VanDerWaalsContact O-CG 3.24Å; Q251-D255 PolarHBondContact O-N 3.21Å; H253-D255 VanDerWaalsContact C-N 3.31Å; H253-D255 PolarHBondContact O-N 3.41Å; D255-M257 VanDerWaalsContact C-N 3.31Å; D255-M257 PolarHBondContact O-N 2.94Å; D255-Y258 WeakPolarHBondContact O-CB 3.3Å; D255-Y258 PolarHBondContact O-N 2.91Å; D255-E259 PolarHBondContact O-N 3.04Å
256	N	98.8	Very high	97.5	Very high	24 Å²	24	42.8 Å²	42.8	13%	0.128	22%	0.222	C	C	.	.	H	α-helix	trans	-63.8	-35.5	173	-87.8	-81.3	0	0	0	112.3	W252 H253 E259 F260 C355 Q358 F359	W252-N256 WeakPolarHBondContact O-CB 3.38Å; W252-N256 PolarHBondContact O-N 3.19Å; W252-N256 PolarHBondContact O-ND2 3.38Å; H253-N256 PolarHBondContact O-N 2.96Å; N256-E259 PolarHBondContact O-N 3.03Å; N256-F260 VanDerWaalsContact O-CB 3.32Å; N256-F260 WeakPolarHBondContact O-CB 3.22Å; N256-F260 PolarHBondContact O-N 3.33Å; N256-C355 HydrophobicContact CB-CB 4.47Å; N256-C355 WeakPolarHBondContact O-CB 3.31Å; N256-Q358 HydrophobicContact CB-CB 4.47Å; N256-Q358 VanDerWaalsContact OD1-CG 3.29Å; N256-Q358 WeakPolarHBondContact OD1-CG 3.42Å; N256-F359 HydrophobicContact CB-CE2 4.13Å
257	M	98.8	Very high	97.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-69.1	-36.5	175.7	-167.1	60.6	80.8	0	0	111.9	A87 C90 A91 C238 A242 H253 I254 D255 F260 G261 L356 F359	A87-M257 HydrophobicContact CB-CE 4.31Å; A87-M257 HydrophobicContact CB-SD 3.83Å; A87-M257 WeakPolarHBondContact O-CE 3.37Å; C90-M257 HydrophobicContact CB-CE 4.35Å; A91-M257 HydrophobicContact CB-CE 4.26Å; C238-M257 HydrophobicContact CB-CG 3.8Å; C238-M257 WeakPolarHBondContact CB-O 3.36Å; C238-M257 HydrophobicContact CB-SD 4.26Å; C238-M257 WeakPolarHBondContact O-CG 3.39Å; A242-M257 HydrophobicContact CB-CB 3.86Å; A242-M257 HydrophobicContact CB-CG 3.93Å; H253-M257 PolarHBondContact O-N 3.42Å; I254-M257 PolarHBondContact O-N 3.36Å; D255-M257 VanDerWaalsContact C-N 3.31Å; D255-M257 PolarHBondContact O-N 2.94Å; M257-F260 HydrophobicContact SD-CD1 3.92Å; M257-G261 PolarHBondContact O-N 3.34Å; M257-L356 HydrophobicContact SD-CD2 4.39Å; M257-F359 HydrophobicContact CB-CZ 4.04Å; M257-F359 HydrophobicContact CE-CD1 4.45Å; M257-F359 HydrophobicContact CE-CE1 3.83Å; M257-F359 HydrophobicContact CE-CE2 4.04Å; M257-F359 HydrophobicContact CE-CZ 3.61Å
258	Y	98.9	Very high	97.7	Very high	39 Å²	39	35.9 Å²	35.9	15%	0.153	18%	0.177	C	C	.	.	H	α-helix	trans	-62.2	-52.8	170.5	171.1	-95.8	0	0	0	111.6	Y227 A235 K239 I254 D255 F260 G261 K262	Y227-Y258 WeakPolarHBondContact CE2-OH 3.37Å; Y227-Y258 PolarHBondContact OH-OH 3.29Å; A235-Y258 HydrophobicContact CB-CD2 3.68Å; A235-Y258 HydrophobicContact CB-CE2 3.56Å; A235-Y258 HydrophobicContact CB-CG 4.43Å; K239-Y258 HydrophobicContact CB-CD2 4.28Å; K239-Y258 HydrophobicContact CD-CD2 3.97Å; K239-Y258 HydrophobicContact CD-CG 4.26Å; I254-Y258 PolarHBondContact O-N 3.15Å; D255-Y258 WeakPolarHBondContact O-CB 3.3Å; D255-Y258 PolarHBondContact O-N 2.91Å; Y258-F260 VanDerWaalsContact C-N 3.29Å; Y258-F260 PolarHBondContact O-N 3.36Å; Y258-G261 PolarHBondContact O-N 3.13Å; Y258-G261 VanDerWaalsContact O-N 3.12Å; Y258-K262 HydrophobicContact CE1-CD 3.84Å; Y258-K262 WeakPolarHBondContact O-CB 3.17Å; Y258-K262 PolarHBondContact O-N 3.21Å
259	E	98.9	Very high	97.8	Very high	57 Å²	57	32.6 Å²	32.6	27%	0.266	15%	0.154	S	C	.	.	H	α-helix	trans	-63.4	-35.5	-179.1	-72.9	-60.7	150.3	0	0	111.7	D255 N256 K262 H263	D255-E259 PolarHBondContact O-N 3.04Å; N256-E259 PolarHBondContact O-N 3.03Å; E259-K262 PolarHBondContact O-N 3.01Å; E259-K262 IonicContact OE1-NZ 4Å; E259-K262 PolarHBondContact OE1-NZ 3.41Å; E259-K262 WeakPolarHBondContact OE2-CD 3.45Å; E259-K262 IonicContact OE2-NZ 3.78Å; E259-K262 PolarHBondContact OE2-NZ 2.86Å; E259-H263 VanDerWaalsContact O-CB 3.31Å; E259-H263 WeakPolarHBondContact O-CB 3.19Å; E259-H263 PolarHBondContact O-CD2 2.89Å; E259-H263 PolarHBondContact O-N 3.4Å; E259-H263 IonicContact OE2-CD2 2.79Å; E259-H263 IonicContact OE2-NE2 3.68Å
260	F	98.7	Very high	97.8	Very high	1 Å²	1	32.2 Å²	32.2	0%	0.004	15%	0.152	C	C	.	.	H	α-helix	trans	-54.6	-55.7	169.3	160.5	-106.4	0	0	0	111.5	N256 M257 Y258 K262 H263 L264 A352 C355 L356 L368 A372	N256-F260 VanDerWaalsContact O-CB 3.32Å; N256-F260 WeakPolarHBondContact O-CB 3.22Å; N256-F260 PolarHBondContact O-N 3.33Å; M257-F260 HydrophobicContact SD-CD1 3.92Å; Y258-F260 VanDerWaalsContact C-N 3.29Å; Y258-F260 PolarHBondContact O-N 3.36Å; F260-K262 VanDerWaalsContact C-N 3.32Å; F260-K262 PolarHBondContact O-N 3.18Å; F260-H263 PolarHBondContact O-N 3.37Å; F260-L264 HydrophobicContact CE1-CD2 4.39Å; F260-L264 HydrophobicContact CE2-CB 4.37Å; F260-L264 HydrophobicContact CE2-CD2 4.05Å; F260-L264 HydrophobicContact CZ-CD2 3.65Å; F260-L264 WeakPolarHBondContact O-CB 3.35Å; F260-L264 PolarHBondContact O-N 3.24Å; F260-A352 HydrophobicContact CD2-CB 3.86Å; F260-A352 HydrophobicContact CE2-CB 4.3Å; F260-C355 HydrophobicContact CB-CB 3.82Å; F260-L356 HydrophobicContact CB-CD2 4.22Å; F260-L356 HydrophobicContact CB-CG 4.44Å; F260-L356 HydrophobicContact CD1-CD2 4.02Å; F260-L356 HydrophobicContact CD2-CD1 3.65Å; F260-L356 HydrophobicContact CD2-CD2 3.85Å; F260-L356 HydrophobicContact CD2-CG 3.45Å; F260-L356 VanDerWaalsContact CD2-CG 3.45Å; F260-L356 HydrophobicContact CE1-CD2 4.4Å; F260-L356 HydrophobicContact CE2-CD1 3.39Å; F260-L356 HydrophobicContact CE2-CD2 4.25Å; F260-L356 HydrophobicContact CE2-CG 3.79Å; F260-L356 HydrophobicContact CG-CD1 4.35Å; F260-L356 HydrophobicContact CG-CD2 3.72Å; F260-L356 HydrophobicContact CG-CG 3.87Å; F260-L356 HydrophobicContact CZ-CD1 3.89Å; F260-L356 HydrophobicContact CZ-CG 4.45Å; F260-L368 HydrophobicContact CD1-CD2 4.46Å; F260-L368 HydrophobicContact CE1-CD1 3.96Å; F260-L368 HydrophobicContact CE1-CD2 3.77Å; F260-L368 HydrophobicContact CE1-CG 4.07Å; F260-L368 HydrophobicContact CZ-CD1 3.76Å; F260-L368 HydrophobicContact CZ-CD2 3.91Å; F260-L368 HydrophobicContact CZ-CG 3.74Å; F260-A372 HydrophobicContact CE2-CB 4.41Å
261	G	98.5	Very high	97.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.7	-37.3	-177.2	0	0	0	0	0	112.5	I234 M257 Y258 G265	I234-G261 WeakPolarHBondContact CG2-O 3.32Å; M257-G261 PolarHBondContact O-N 3.34Å; Y258-G261 PolarHBondContact O-N 3.13Å; Y258-G261 VanDerWaalsContact O-N 3.12Å; G261-G265 PolarHBondContact O-N 2.76Å
262	K	98.8	Very high	97.2	Very high	56 Å²	56	28.2 Å²	28.2	24%	0.243	13%	0.129	C	C	.	.	H	α-helix	trans	-61.8	-55.3	174.4	172.7	174.9	155.3	-146.4	0	111	Y227 A235 Y258 E259 F260 L264 G265 M266	Y227-K262 HydrophobicContact CD2-CD 4.27Å; Y227-K262 HydrophobicContact CD2-CG 4Å; Y227-K262 HydrophobicContact CE2-CD 4Å; Y227-K262 HydrophobicContact CE2-CG 4Å; A235-K262 HydrophobicContact CB-CB 3.76Å; Y258-K262 HydrophobicContact CE1-CD 3.84Å; Y258-K262 WeakPolarHBondContact O-CB 3.17Å; Y258-K262 PolarHBondContact O-N 3.21Å; E259-K262 PolarHBondContact O-N 3.01Å; E259-K262 IonicContact OE1-NZ 4Å; E259-K262 PolarHBondContact OE1-NZ 3.41Å; E259-K262 WeakPolarHBondContact OE2-CD 3.45Å; E259-K262 IonicContact OE2-NZ 3.78Å; E259-K262 PolarHBondContact OE2-NZ 2.86Å; F260-K262 VanDerWaalsContact C-N 3.32Å; F260-K262 PolarHBondContact O-N 3.18Å; K262-L264 VanDerWaalsContact C-N 3.34Å; K262-L264 PolarHBondContact O-N 3.19Å; K262-G265 PolarHBondContact O-N 3.36Å; K262-M266 VanDerWaalsContact O-CG 3.24Å; K262-M266 WeakPolarHBondContact O-CG 3.22Å; K262-M266 PolarHBondContact O-N 2.88Å
263	H	98.7	Very high	96.9	Very high	29 Å²	29	22.1 Å²	22.1	13%	0.134	11%	0.106	C	C	.	.	H	α-helix	trans	-62.2	-40.5	-179.7	-82.9	-68.6	0	0	0	112.3	E259 F260 M266 A267 H348 A351 A352	E259-H263 VanDerWaalsContact O-CB 3.31Å; E259-H263 WeakPolarHBondContact O-CB 3.19Å; E259-H263 PolarHBondContact O-CD2 2.89Å; E259-H263 PolarHBondContact O-N 3.4Å; E259-H263 IonicContact OE2-CD2 2.79Å; E259-H263 IonicContact OE2-NE2 3.68Å; F260-H263 PolarHBondContact O-N 3.37Å; H263-M266 PolarHBondContact O-N 3.23Å; H263-A267 WeakPolarHBondContact O-CB 3.26Å; H263-A267 PolarHBondContact O-N 2.99Å; H263-H348 WeakPolarHBondContact CB-O 3.41Å; H263-H348 AromaticContact CE1-ND1 3.74Å; H263-H348 AromaticContact CG-ND1 3.9Å; H263-H348 AromaticContact ND1-CE1 3.76Å; H263-H348 AromaticContact ND1-CG 3.75Å; H263-H348 AromaticContact ND1-ND1 2.93Å; H263-H348 PolarHBondContact ND1-ND1 3.48Å; H263-H348 WeakPolarHBondContact O-CB 3.36Å; H263-A351 HydrophobicContact CB-CB 4.33Å; H263-A351 VanDerWaalsContact CE1-CB 3.48Å; H263-A351 WeakPolarHBondContact CE1-CB 3.32Å; H263-A351 WeakPolarHBondContact ND1-CB 3.43Å; H263-A352 HydrophobicContact CB-CB 3.8Å
264	L	97.7	Very high	96.6	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63	-43.8	175.1	-179.3	59.4	0	0	0	112	L83 F260 K262 A267 F268 A352 A372	L83-L264 HydrophobicContact CD1-CD2 3.8Å; L83-L264 HydrophobicContact CD2-CD2 3.69Å; L83-L264 HydrophobicContact CG-CD2 4.39Å; F260-L264 HydrophobicContact CE1-CD2 4.39Å; F260-L264 HydrophobicContact CE2-CB 4.37Å; F260-L264 HydrophobicContact CE2-CD2 4.05Å; F260-L264 HydrophobicContact CZ-CD2 3.65Å; F260-L264 WeakPolarHBondContact O-CB 3.35Å; F260-L264 PolarHBondContact O-N 3.24Å; K262-L264 VanDerWaalsContact C-N 3.34Å; K262-L264 PolarHBondContact O-N 3.19Å; L264-A267 PolarHBondContact O-N 2.94Å; L264-F268 WeakPolarHBondContact O-CB 3.39Å; L264-F268 PolarHBondContact O-N 3.4Å; L264-A352 HydrophobicContact CB-CB 4.41Å; L264-A372 HydrophobicContact CD1-CB 3.81Å; L264-A372 HydrophobicContact CD2-CB 3.87Å
265	G	97.1	Very high	96.1	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-64.5	-39.9	177.7	0	0	0	0	0	113.3	G261 K262 F268 Q269	G261-G265 PolarHBondContact O-N 2.76Å; K262-G265 PolarHBondContact O-N 3.36Å; G265-F268 PolarHBondContact O-N 3Å; G265-Q269 PolarHBondContact O-N 3.27Å; G265-Q269 VanDerWaalsContact O-N 3.16Å
266	M	98.1	Very high	95.5	Very high	9 Å²	9	18.6 Å²	18.6	4%	0.044	9%	0.089	C	C	.	.	H	α-helix	trans	-62	-50.7	173.1	-66.9	-62.8	-60.8	0	0	111	L223 T226 A231 K262 H263 F268 Q269 L270 H348	L223-M266 HydrophobicContact CB-CE 4.28Å; L223-M266 HydrophobicContact CD2-CE 3.81Å; T226-M266 HydrophobicContact CG2-CE 3.76Å; T226-M266 HydrophobicContact CG2-SD 3.74Å; A231-M266 HydrophobicContact CB-CG 4.07Å; A231-M266 HydrophobicContact CB-SD 4.04Å; K262-M266 VanDerWaalsContact O-CG 3.24Å; K262-M266 WeakPolarHBondContact O-CG 3.22Å; K262-M266 PolarHBondContact O-N 2.88Å; H263-M266 PolarHBondContact O-N 3.23Å; M266-F268 VanDerWaalsContact C-N 3.26Å; M266-F268 PolarHBondContact O-N 3.44Å; M266-Q269 PolarHBondContact O-N 2.76Å; M266-L270 WeakPolarHBondContact O-CB 3.34Å; M266-L270 WeakPolarHBondContact O-CD1 3.43Å; M266-L270 VanDerWaalsContact O-CG 3.26Å; M266-L270 WeakPolarHBondContact O-CG 3.33Å; M266-L270 PolarHBondContact O-N 3.25Å; M266-H348 HydrophobicContact CB-CB 4.36Å; M266-H348 WeakPolarHBondContact CB-ND1 3.15Å
267	A	96.9	Very high	94.9	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-58.2	-40.3	178.4	0	0	0	0	0	111.7	H263 L264 L270 I271 A345 H348 F349 L376	H263-A267 WeakPolarHBondContact O-CB 3.26Å; H263-A267 PolarHBondContact O-N 2.99Å; L264-A267 PolarHBondContact O-N 2.94Å; A267-L270 PolarHBondContact O-N 3.26Å; A267-I271 WeakPolarHBondContact O-CG1 3.36Å; A267-I271 PolarHBondContact O-N 3.28Å; A267-A345 WeakPolarHBondContact CB-O 3.38Å; A267-H348 HydrophobicContact CB-CB 3.89Å; A267-F349 HydrophobicContact CB-CB 4.34Å; A267-L376 HydrophobicContact CB-CD1 3.97Å; A267-L376 HydrophobicContact CB-CD2 3.84Å
268	F	92.9	Very high	94.2	Very high	24 Å²	24	21.5 Å²	21.5	11%	0.105	11%	0.105	C	C	.	.	H	α-helix	trans	-61	-50.3	178.5	174.6	-107.1	0	0	0	112.3	T230 L264 G265 M266 L270 I271 D272 F375 L376	T230-F268 HydrophobicContact CG2-CD1 3.98Å; L264-F268 WeakPolarHBondContact O-CB 3.39Å; L264-F268 PolarHBondContact O-N 3.4Å; G265-F268 PolarHBondContact O-N 3Å; M266-F268 VanDerWaalsContact C-N 3.26Å; M266-F268 PolarHBondContact O-N 3.44Å; F268-L270 VanDerWaalsContact C-N 3.35Å; F268-L270 PolarHBondContact O-N 2.84Å; F268-I271 PolarHBondContact O-N 2.98Å; F268-D272 PolarHBondContact O-N 2.72Å; F268-F375 HydrophobicContact CB-CD1 4.17Å; F268-F375 HydrophobicContact CB-CE1 3.69Å; F268-F375 HydrophobicContact CB-CZ 4.44Å; F268-F375 AromaticContact CD1-CE1 3.9Å; F268-F375 HydrophobicContact CD1-CE1 3.9Å; F268-F375 AromaticContact CD1-CZ 3.85Å; F268-F375 HydrophobicContact CD1-CZ 3.85Å; F268-F375 AromaticContact CD2-CD1 3.53Å; F268-F375 HydrophobicContact CD2-CD1 3.53Å; F268-F375 HydrophobicContact CD2-CD2 4.06Å; F268-F375 AromaticContact CD2-CE1 3.03Å; F268-F375 HydrophobicContact CD2-CE1 3.03Å; F268-F375 AromaticContact CD2-CE2 3.58Å; F268-F375 HydrophobicContact CD2-CE2 3.58Å; F268-F375 HydrophobicContact CD2-CG 4.04Å; F268-F375 AromaticContact CD2-CZ 3.07Å; F268-F375 HydrophobicContact CD2-CZ 3.07Å; F268-F375 HydrophobicContact CE1-CE1 4.34Å; F268-F375 AromaticContact CE1-CZ 3.81Å; F268-F375 HydrophobicContact CE1-CZ 3.81Å; F268-F375 HydrophobicContact CE2-CD1 4.21Å; F268-F375 AromaticContact CE2-CD2 3.95Å; F268-F375 HydrophobicContact CE2-CD2 3.95Å; F268-F375 AromaticContact CE2-CE1 3.58Å; F268-F375 HydrophobicContact CE2-CE1 3.58Å; F268-F375 AromaticContact CE2-CE2 3.21Å; F268-F375 HydrophobicContact CE2-CE2 3.21Å; F268-F375 HydrophobicContact CE2-CG 4.4Å; F268-F375 AromaticContact CE2-CZ 3.02Å; F268-F375 HydrophobicContact CE2-CZ 3.02Å; F268-F375 AromaticContact CG-CD1 3.99Å; F268-F375 HydrophobicContact CG-CD1 3.99Å; F268-F375 AromaticContact CG-CE1 3.21Å; F268-F375 HydrophobicContact CG-CE1 3.21Å; F268-F375 HydrophobicContact CG-CE2 4.42Å; F268-F375 AromaticContact CG-CZ 3.49Å; F268-F375 HydrophobicContact CG-CZ 3.49Å; F268-F375 VanDerWaalsContact CG-CZ 3.49Å; F268-F375 HydrophobicContact CZ-CE1 4.2Å; F268-F375 AromaticContact CZ-CE2 3.81Å; F268-F375 HydrophobicContact CZ-CE2 3.81Å; F268-F375 AromaticContact CZ-CZ 3.42Å; F268-F375 HydrophobicContact CZ-CZ 3.42Å; F268-F375 VanDerWaalsContact CZ-CZ 3.42Å; F268-L376 HydrophobicContact CB-CD2 4.33Å
269	Q	94.6	Very high	92.9	Very high	35 Å²	35	21 Å²	21	16%	0.164	11%	0.106	C	C	.	.	H	α-helix	trans	-65.1	-40.2	179.4	-169.8	61.3	54.9	0	0	111.7	T226 T230 G265 M266 I271 D272 D273	T226-Q269 HydrophobicContact CG2-CB 3.46Å; T226-Q269 VanDerWaalsContact CG2-CB 3.46Å; T226-Q269 HydrophobicContact CG2-CG 3.65Å; T230-Q269 HydrophobicContact CG2-CB 4.26Å; T230-Q269 PolarHBondContact OG1-OE1 3.26Å; G265-Q269 PolarHBondContact O-N 3.27Å; G265-Q269 VanDerWaalsContact O-N 3.16Å; M266-Q269 PolarHBondContact O-N 2.76Å; Q269-I271 VanDerWaalsContact C-N 3.28Å; Q269-I271 PolarHBondContact O-N 3.45Å; Q269-D272 WeakPolarHBondContact O-CB 3.39Å; Q269-D272 PolarHBondContact O-N 2.91Å; Q269-D272 VanDerWaalsContact O-N 3.11Å; Q269-D273 PolarHBondContact NE2-OD1 2.5Å; Q269-D273 PolarHBondContact O-N 3.46Å; Q269-D273 VanDerWaalsContact O-OD1 3.12Å
270	L	95.9	Very high	91.3	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.6	-37.8	176.6	-71.2	160.9	0	0	0	112.3	Y222 M266 A267 F268 V274 T341 L344 A345	Y222-L270 HydrophobicContact CE1-CD2 4.03Å; Y222-L270 VanDerWaalsContact OH-CD2 3.22Å; Y222-L270 WeakPolarHBondContact OH-CD2 3.27Å; M266-L270 WeakPolarHBondContact O-CB 3.34Å; M266-L270 WeakPolarHBondContact O-CD1 3.43Å; M266-L270 VanDerWaalsContact O-CG 3.26Å; M266-L270 WeakPolarHBondContact O-CG 3.33Å; M266-L270 PolarHBondContact O-N 3.25Å; A267-L270 PolarHBondContact O-N 3.26Å; F268-L270 VanDerWaalsContact C-N 3.35Å; F268-L270 PolarHBondContact O-N 2.84Å; L270-V274 VanDerWaalsContact O-CG2 3.32Å; L270-V274 WeakPolarHBondContact O-CG2 3.42Å; L270-V274 PolarHBondContact O-N 3.02Å; L270-V274 VanDerWaalsContact O-N 3.13Å; L270-T341 HydrophobicContact CB-CG2 4.24Å; L270-T341 HydrophobicContact CD2-CG2 3.84Å; L270-T341 WeakPolarHBondContact O-CG2 3.22Å; L270-L344 HydrophobicContact CD1-CB 4.4Å; L270-L344 HydrophobicContact CD1-CD2 4.21Å; L270-L344 HydrophobicContact CD1-CG 3.83Å; L270-L344 HydrophobicContact CD2-CD2 3.93Å; L270-L344 HydrophobicContact CD2-CG 4.32Å; L270-A345 HydrophobicContact CB-CB 3.68Å; L270-A345 HydrophobicContact CD1-CB 4.28Å
271	I	93.1	Very high	89.3	Confident	28 Å²	28	29.8 Å²	29.8	14%	0.144	15%	0.151	C	C	.	.	H	α-helix	trans	-70.4	-40.8	173.5	-67.4	-59.2	0	0	0	111.1	A267 F268 Q269 D273 V274 L275 A345 L376	A267-I271 WeakPolarHBondContact O-CG1 3.36Å; A267-I271 PolarHBondContact O-N 3.28Å; F268-I271 PolarHBondContact O-N 2.98Å; Q269-I271 VanDerWaalsContact C-N 3.28Å; Q269-I271 PolarHBondContact O-N 3.45Å; I271-D273 VanDerWaalsContact C-N 3.31Å; I271-D273 PolarHBondContact O-N 3.49Å; I271-V274 WeakPolarHBondContact O-CB 3.43Å; I271-V274 PolarHBondContact O-N 3.14Å; I271-V274 VanDerWaalsContact O-N 3.13Å; I271-L275 HydrophobicContact CG2-CD1 4.26Å; I271-L275 HydrophobicContact CG2-CG 4.31Å; I271-L275 VanDerWaalsContact O-CG 3.3Å; I271-L275 WeakPolarHBondContact O-CG 3.5Å; I271-L275 PolarHBondContact O-N 3.32Å; I271-A345 HydrophobicContact CD1-CB 3.69Å; I271-A345 HydrophobicContact CG1-CB 3.88Å; I271-L376 HydrophobicContact CG1-CD2 4.08Å
272	D	89.9	Confident	87.1	Confident	61 Å²	61	34.3 Å²	34.3	33%	0.326	19%	0.189	S	C	.	.	H	α-helix	trans	-57.6	-45.8	176	-161.7	63.6	0	0	0	111.2	F268 Q269 V274 L275 D276	F268-D272 PolarHBondContact O-N 2.72Å; Q269-D272 WeakPolarHBondContact O-CB 3.39Å; Q269-D272 PolarHBondContact O-N 2.91Å; Q269-D272 VanDerWaalsContact O-N 3.11Å; D272-V274 VanDerWaalsContact C-N 3.3Å; D272-V274 PolarHBondContact O-N 3.23Å; D272-L275 WeakPolarHBondContact O-CB 3.25Å; D272-L275 PolarHBondContact O-N 3.13Å; D272-L275 VanDerWaalsContact O-N 3.07Å; D272-D276 PolarHBondContact O-N 3.45Å
273	D	92.9	Very high	85	Confident	4 Å²	4	37.7 Å²	37.7	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-62.5	-36.8	175.8	-62.7	-1.2	0	0	0	111.7	Y222 Q269 I271 D276 F277 T298	Y222-D273 WeakPolarHBondContact CE2-OD2 3.44Å; Y222-D273 VanDerWaalsContact CZ-OD2 3.25Å; Y222-D273 PolarHBondContact OH-OD2 2.85Å; Q269-D273 PolarHBondContact NE2-OD1 2.5Å; Q269-D273 PolarHBondContact O-N 3.46Å; Q269-D273 VanDerWaalsContact O-OD1 3.12Å; I271-D273 VanDerWaalsContact C-N 3.31Å; I271-D273 PolarHBondContact O-N 3.49Å; D273-D276 WeakPolarHBondContact O-CB 3.37Å; D273-F277 VanDerWaalsContact O-CD2 3.24Å; D273-F277 WeakPolarHBondContact O-CD2 3.22Å; D273-T298 HydrophobicContact CB-CG2 4.45Å
274	V	91.7	Very high	83	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-65	-41.5	173	158.8	0	0	0	0	111.5	L270 I271 D272 D276 F277 V278 P300 V338 T341 R342	L270-V274 VanDerWaalsContact O-CG2 3.32Å; L270-V274 WeakPolarHBondContact O-CG2 3.42Å; L270-V274 PolarHBondContact O-N 3.02Å; L270-V274 VanDerWaalsContact O-N 3.13Å; I271-V274 WeakPolarHBondContact O-CB 3.43Å; I271-V274 PolarHBondContact O-N 3.14Å; I271-V274 VanDerWaalsContact O-N 3.13Å; D272-V274 VanDerWaalsContact C-N 3.3Å; D272-V274 PolarHBondContact O-N 3.23Å; V274-D276 PolarHBondContact O-N 2.91Å; V274-F277 PolarHBondContact O-N 3.44Å; V274-F277 VanDerWaalsContact O-N 3.12Å; V274-V278 HydrophobicContact CG1-CG1 4.32Å; V274-V278 HydrophobicContact CG1-CG2 4.21Å; V274-V278 WeakPolarHBondContact O-CG2 3.45Å; V274-V278 PolarHBondContact O-N 2.9Å; V274-P300 HydrophobicContact CG2-CG 4.42Å; V274-V338 HydrophobicContact CG1-CG1 4.13Å; V274-T341 HydrophobicContact CG2-CG2 3.61Å; V274-R342 HydrophobicContact CB-CG 4.43Å; V274-R342 HydrophobicContact CG1-CG 3.85Å; V274-R342 VanDerWaalsContact CG1-NE 3.29Å; V274-R342 HydrophobicContact CG2-CG 3.8Å
275	L	88.2	Confident	80.9	Confident	22 Å²	22	42.2 Å²	42.2	12%	0.115	25%	0.253	C	S	.	.	H	α-helix	trans	-61.7	-31.8	-178.2	-68.8	175	0	0	0	111.8	I271 D272 F277 V278 T279 R378	I271-L275 HydrophobicContact CG2-CD1 4.26Å; I271-L275 HydrophobicContact CG2-CG 4.31Å; I271-L275 VanDerWaalsContact O-CG 3.3Å; I271-L275 WeakPolarHBondContact O-CG 3.5Å; I271-L275 PolarHBondContact O-N 3.32Å; D272-L275 WeakPolarHBondContact O-CB 3.25Å; D272-L275 PolarHBondContact O-N 3.13Å; D272-L275 VanDerWaalsContact O-N 3.07Å; L275-F277 PolarHBondContact O-N 3.4Å; L275-V278 HydrophobicContact CD2-CG2 4.32Å; L275-V278 PolarHBondContact O-N 3.48Å; L275-T279 VanDerWaalsContact O-CB 3.3Å; L275-T279 WeakPolarHBondContact O-CB 3.45Å; L275-T279 PolarHBondContact O-N 3.26Å; L275-T279 PolarHBondContact O-OG1 3.35Å; L275-R378 HydrophobicContact CD1-CB 4.16Å
276	D	86.5	Confident	79.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.5	-23.3	176.2	-159.5	59.7	0	0	0	113.5	D272 D273 V274 K286 T288 G289 A290 D291	D272-D276 PolarHBondContact O-N 3.45Å; D273-D276 WeakPolarHBondContact O-CB 3.37Å; V274-D276 PolarHBondContact O-N 2.91Å; D276-K286 WeakPolarHBondContact OD1-CE 3.46Å; D276-K286 IonicContact OD1-NZ 3.24Å; D276-K286 PolarHBondContact OD1-NZ 2.89Å; D276-T288 WeakPolarHBondContact O-CG2 3.38Å; D276-G289 PolarHBondContact O-N 3.45Å; D276-G289 WeakPolarHBondContact OD2-CA 3.43Å; D276-G289 PolarHBondContact OD2-N 3.22Å; D276-A290 PolarHBondContact OD1-N 2.84Å; D276-A290 PolarHBondContact OD2-N 2.76Å; D276-D291 PolarHBondContact OD2-N 2.84Å
277	F	86.8	Confident	77.6	Confident	23 Å²	23	47.2 Å²	47.2	10%	0.101	28%	0.28	C	S	.	.	H	α-helix	trans	-105.7	-23.6	-178.5	-69	-93.2	0	0	0	114.9	D273 V274 L275 L292 P300 V301 L329 V332 V338	D273-F277 VanDerWaalsContact O-CD2 3.24Å; D273-F277 WeakPolarHBondContact O-CD2 3.22Å; V274-F277 PolarHBondContact O-N 3.44Å; V274-F277 VanDerWaalsContact O-N 3.12Å; L275-F277 PolarHBondContact O-N 3.4Å; F277-L292 HydrophobicContact CE1-CD1 4.08Å; F277-L292 HydrophobicContact CZ-CD1 4.36Å; F277-L292 HydrophobicContact CZ-CD2 4.45Å; F277-L292 HydrophobicContact CZ-CG 4.31Å; F277-P300 HydrophobicContact CD2-CB 3.79Å; F277-P300 HydrophobicContact CD2-CG 3.65Å; F277-P300 HydrophobicContact CE2-CB 3.83Å; F277-P300 HydrophobicContact CE2-CG 3.82Å; F277-P300 HydrophobicContact CG-CB 4.2Å; F277-P300 HydrophobicContact CG-CG 4.41Å; F277-P300 HydrophobicContact CZ-CB 4.25Å; F277-V301 HydrophobicContact CE1-CG2 4.09Å; F277-V301 HydrophobicContact CE2-CG2 4.37Å; F277-V301 HydrophobicContact CZ-CG2 3.47Å; F277-V301 VanDerWaalsContact CZ-CG2 3.47Å; F277-L329 HydrophobicContact CD1-CD2 3.88Å; F277-L329 HydrophobicContact CE1-CD2 3.86Å; F277-V332 HydrophobicContact CD1-CB 4.34Å; F277-V332 HydrophobicContact CD1-CG1 3.71Å; F277-V332 HydrophobicContact CE1-CB 4.3Å; F277-V332 HydrophobicContact CE1-CG1 4.01Å; F277-V332 HydrophobicContact CE1-CG2 4.09Å; F277-V332 HydrophobicContact CG-CG1 4.36Å; F277-V338 HydrophobicContact CB-CG2 4.08Å
278	V	82.7	Confident	76.5	Confident	62 Å²	62	49.2 Å²	49.2	38%	0.376	29%	0.292	S	S	.	.	H	α-helix	trans	-108	-18	-170.2	-57.3	0	0	0	0	114.4	V274 L275 V338	V274-V278 HydrophobicContact CG1-CG1 4.32Å; V274-V278 HydrophobicContact CG1-CG2 4.21Å; V274-V278 WeakPolarHBondContact O-CG2 3.45Å; V274-V278 PolarHBondContact O-N 2.9Å; L275-V278 HydrophobicContact CD2-CG2 4.32Å; L275-V278 PolarHBondContact O-N 3.48Å; V278-V338 HydrophobicContact CG1-CG1 3.6Å; V278-V338 HydrophobicContact CG1-CG2 4.43Å
279	T	72.5	Confident	75.7	Confident	29 Å²	29	48 Å²	48	18%	0.178	29%	0.287	C	S	.	.	S	Bend	trans	-96.5	138.9	-172.1	-48.8	0	0	0	0	109.5	L275 N283 L284 T288	L275-T279 VanDerWaalsContact O-CB 3.3Å; L275-T279 WeakPolarHBondContact O-CB 3.45Å; L275-T279 PolarHBondContact O-N 3.26Å; L275-T279 PolarHBondContact O-OG1 3.35Å; T279-N283 HydrophobicContact CG2-CB 3.39Å; T279-L284 HydrophobicContact CG2-CD1 4.22Å; T279-L284 HydrophobicContact CG2-CG 3.94Å; T279-L284 WeakPolarHBondContact O-CD1 3.47Å; T279-T288 PolarHBondContact O-OG1 2.87Å
280	D	64.4	Low	74.9	Confident	119 Å²	119	46.6 Å²	46.6	64%	0.636	28%	0.281	S	S	*	.			trans	-62.2	145.9	173.1	-63.2	-37.6	0	0	0	110.7	A282 N283 L284	D280-A282 PolarHBondContact O-N 2.86Å; D280-N283 PolarHBondContact O-N 2.91Å; D280-L284 PolarHBondContact O-N 3.39Å
281	E	56.6	Low	74.4	Confident	123 Å²	123	47.4 Å²	47.4	58%	0.575	29%	0.285	S	S	*	.	H	α-helix	trans	-49.4	-37.1	-179	-61.5	-174.9	160.7	0	0	113	N283 L284 G285	E281-N283 PolarHBondContact O-N 3.23Å; E281-L284 PolarHBondContact O-N 3.11Å; E281-G285 PolarHBondContact O-N 3.44Å
282	A	52.8	Low	74	Confident	95 Å²	95	46.1 Å²	46.1	79%	0.785	28%	0.279	S	S	*	.	H	α-helix	trans	-60	-29.3	178.9	0	0	0	0	0	113.7	D280	D280-A282 PolarHBondContact O-N 2.86Å
283	N	55.2	Low	73.6	Confident	127 Å²	127	49.1 Å²	49.1	68%	0.679	29%	0.291	S	S	*	.	H	α-helix	trans	-97.1	-25.6	-176.3	-73.3	-32.8	0	0	0	112.9	T279 D280 E281	T279-N283 HydrophobicContact CG2-CB 3.39Å; D280-N283 PolarHBondContact O-N 2.91Å; E281-N283 PolarHBondContact O-N 3.23Å
284	L	56.1	Low	73	Confident	44 Å²	44	55 Å²	55	23%	0.23	32%	0.319	C	S	.	.	H	α-helix	trans	-77.9	-35.6	177.4	-91.1	149.5	0	0	0	113	T279 D280 E281 K286	T279-L284 HydrophobicContact CG2-CD1 4.22Å; T279-L284 HydrophobicContact CG2-CG 3.94Å; T279-L284 WeakPolarHBondContact O-CD1 3.47Å; D280-L284 PolarHBondContact O-N 3.39Å; E281-L284 PolarHBondContact O-N 3.11Å; L284-K286 HydrophobicContact CB-CG 4.14Å; L284-K286 WeakPolarHBondContact CB-O 3.35Å; L284-K286 HydrophobicContact CD2-CG 4.14Å; L284-K286 PolarHBondContact O-N 3.1Å
285	G	54.9	Low	72.6	Confident	80 Å²	80	55.6 Å²	55.6	83%	0.825	33%	0.326	S	S	*	.	S	Bend	trans	72.4	5.5	-168	0	0	0	0	0	114.1	E281	E281-G285 PolarHBondContact O-N 3.44Å
286	K	62.6	Low	72.5	Confident	63 Å²	63	56.7 Å²	56.7	27%	0.274	33%	0.332	S	S	.	.	S	Bend	trans	-137	153.8	169.7	63	176.8	-178.3	141.5	0	108.7	D276 L284 A290 D291	D276-K286 WeakPolarHBondContact OD1-CE 3.46Å; D276-K286 IonicContact OD1-NZ 3.24Å; D276-K286 PolarHBondContact OD1-NZ 2.89Å; L284-K286 HydrophobicContact CB-CG 4.14Å; L284-K286 WeakPolarHBondContact CB-O 3.35Å; L284-K286 HydrophobicContact CD2-CG 4.14Å; L284-K286 PolarHBondContact O-N 3.1Å; K286-A290 HydrophobicContact CB-CB 4.18Å; K286-A290 HydrophobicContact CD-CB 3.69Å; K286-A290 HydrophobicContact CG-CB 4.05Å; K286-D291 IonicContact NZ-OD1 3.19Å; K286-D291 PolarHBondContact NZ-OD1 2.81Å; K286-D291 IonicContact NZ-OD2 3.97Å
287	P	61.9	Low	72.7	Confident	50 Å²	50	57.7 Å²	57.7	33%	0.325	34%	0.34	S	S	.	.			trans	-58.5	150.6	176.7	23.6	-32.8	0	0	0	111	G289 A290	P287-G289 PolarHBondContact O-N 3.26Å; P287-A290 HydrophobicContact CG-CB 4.21Å; P287-A290 WeakPolarHBondContact O-CB 3.42Å; P287-A290 PolarHBondContact O-N 2.92Å
288	T	73.9	Confident	73.1	Confident	42 Å²	42	57.1 Å²	57.1	26%	0.258	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	133.3	173.4	-57.2	0	0	0	0	109.5	D276 T279 A290	D276-T288 WeakPolarHBondContact O-CG2 3.38Å; T279-T288 PolarHBondContact O-OG1 2.87Å; T288-A290 VanDerWaalsContact C-N 3.34Å
289	G	77.4	Confident	73.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	27.7	-175.7	0	0	0	0	0	113.4	D276 P287 D291 L292 Q293	D276-G289 PolarHBondContact O-N 3.45Å; D276-G289 WeakPolarHBondContact OD2-CA 3.43Å; D276-G289 PolarHBondContact OD2-N 3.22Å; P287-G289 PolarHBondContact O-N 3.26Å; G289-D291 PolarHBondContact O-N 3.43Å; G289-L292 VanDerWaalsContact O-CB 3.31Å; G289-L292 WeakPolarHBondContact O-CB 3.5Å; G289-L292 PolarHBondContact O-N 3.37Å; G289-Q293 PolarHBondContact O-N 3.5Å
290	A	77.8	Confident	74.9	Confident	4 Å²	4	52.8 Å²	52.8	3%	0.033	31%	0.312	C	S	.	.	H	α-helix	trans	-56.9	-31.6	176.8	0	0	0	0	0	112	D276 K286 P287 T288 L292 Q293 M294	D276-A290 PolarHBondContact OD1-N 2.84Å; D276-A290 PolarHBondContact OD2-N 2.76Å; K286-A290 HydrophobicContact CB-CB 4.18Å; K286-A290 HydrophobicContact CD-CB 3.69Å; K286-A290 HydrophobicContact CG-CB 4.05Å; P287-A290 HydrophobicContact CG-CB 4.21Å; P287-A290 WeakPolarHBondContact O-CB 3.42Å; P287-A290 PolarHBondContact O-N 2.92Å; T288-A290 VanDerWaalsContact C-N 3.34Å; A290-L292 VanDerWaalsContact C-N 3.29Å; A290-L292 PolarHBondContact O-N 3.08Å; A290-Q293 WeakPolarHBondContact O-CB 3.3Å; A290-Q293 PolarHBondContact O-N 2.7Å; A290-M294 WeakPolarHBondContact O-CG 3.34Å; A290-M294 PolarHBondContact O-N 2.89Å
291	D	84.5	Confident	76.4	Confident	18 Å²	18	47.1 Å²	47.1	10%	0.096	28%	0.281	C	S	.	.	H	α-helix	trans	-65.7	-36.7	178.2	-62.1	-11.2	0	0	0	110.8	D276 K286 G289 M294 G295 L296 T298	D276-D291 PolarHBondContact OD2-N 2.84Å; K286-D291 IonicContact NZ-OD1 3.19Å; K286-D291 PolarHBondContact NZ-OD1 2.81Å; K286-D291 IonicContact NZ-OD2 3.97Å; G289-D291 PolarHBondContact O-N 3.43Å; D291-M294 CarbonylContact O-C 3.6Å; D291-M294 PolarHBondContact O-N 3.18Å; D291-M294 VanDerWaalsContact O-N 3.15Å; D291-G295 PolarHBondContact O-N 3.48Å; D291-L296 HydrophobicContact CB-CB 4.31Å; D291-L296 WeakPolarHBondContact O-CA 3.24Å; D291-L296 WeakPolarHBondContact O-CB 3.33Å; D291-L296 PolarHBondContact O-N 2.99Å; D291-T298 HydrophobicContact CB-CG2 4.23Å
292	L	85.3	Confident	78.3	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-40.7	175	-60.8	179.8	0	0	0	111.9	F277 G289 A290 M294 G295 V301 F319 T325 A328 L329	F277-L292 HydrophobicContact CE1-CD1 4.08Å; F277-L292 HydrophobicContact CZ-CD1 4.36Å; F277-L292 HydrophobicContact CZ-CD2 4.45Å; F277-L292 HydrophobicContact CZ-CG 4.31Å; G289-L292 VanDerWaalsContact O-CB 3.31Å; G289-L292 WeakPolarHBondContact O-CB 3.5Å; G289-L292 PolarHBondContact O-N 3.37Å; A290-L292 VanDerWaalsContact C-N 3.29Å; A290-L292 PolarHBondContact O-N 3.08Å; L292-M294 PolarHBondContact O-N 3.47Å; L292-G295 PolarHBondContact O-N 3.17Å; L292-V301 HydrophobicContact CD2-CG2 3.59Å; L292-F319 HydrophobicContact CD2-CD1 4.22Å; L292-F319 HydrophobicContact CD2-CE1 3.55Å; L292-F319 HydrophobicContact CD2-CE2 4.04Å; L292-F319 HydrophobicContact CD2-CZ 3.43Å; L292-F319 VanDerWaalsContact CD2-CZ 3.43Å; L292-T325 HydrophobicContact CB-CG2 3.84Å; L292-T325 HydrophobicContact CD1-CG2 4.12Å; L292-A328 HydrophobicContact CD1-CB 4.21Å; L292-L329 HydrophobicContact CD1-CD2 3.72Å; L292-L329 HydrophobicContact CD1-CG 3.66Å
293	Q	81.1	Confident	80.4	Confident	124 Å²	124	38.3 Å²	38.3	58%	0.579	22%	0.224	S	C	*	.	H	α-helix	trans	-63.5	-25.3	176.2	-63.2	179.5	-15.9	0	0	112.2	G289 A290 G295 T325	G289-Q293 PolarHBondContact O-N 3.5Å; A290-Q293 WeakPolarHBondContact O-CB 3.3Å; A290-Q293 PolarHBondContact O-N 2.7Å; Q293-G295 VanDerWaalsContact C-N 3.29Å; Q293-T325 HydrophobicContact CG-CG2 4.45Å
294	M	80.4	Confident	82.3	Confident	127 Å²	127	32.3 Å²	32.3	63%	0.626	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	6.3	173.6	-64.2	179.7	-178.6	0	0	113	A290 D291 L292 L296	A290-M294 WeakPolarHBondContact O-CG 3.34Å; A290-M294 PolarHBondContact O-N 2.89Å; D291-M294 CarbonylContact O-C 3.6Å; D291-M294 PolarHBondContact O-N 3.18Å; D291-M294 VanDerWaalsContact O-N 3.15Å; L292-M294 PolarHBondContact O-N 3.47Å; M294-L296 VanDerWaalsContact C-N 3.29Å; M294-L296 HydrophobicContact CB-CD1 4.19Å; M294-L296 HydrophobicContact CB-CG 4.1Å; M294-L296 PolarHBondContact O-N 3.16Å
295	G	83.1	Confident	84.2	Confident	14 Å²	14	30.3 Å²	30.3	14%	0.144	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	9.5	-179	0	0	0	0	0	114.2	D291 L292 Q293	D291-G295 PolarHBondContact O-N 3.48Å; L292-G295 PolarHBondContact O-N 3.17Å; Q293-G295 VanDerWaalsContact C-N 3.29Å
296	L	86	Confident	86.1	Confident	46 Å²	46	31.5 Å²	31.5	24%	0.241	17%	0.166	C	C	.	.			trans	-96.7	127	-170.2	-58.4	178.8	0	0	0	112.2	D291 M294	D291-L296 HydrophobicContact CB-CB 4.31Å; D291-L296 WeakPolarHBondContact O-CA 3.24Å; D291-L296 WeakPolarHBondContact O-CB 3.33Å; D291-L296 PolarHBondContact O-N 2.99Å; M294-L296 VanDerWaalsContact C-N 3.29Å; M294-L296 HydrophobicContact CB-CD1 4.19Å; M294-L296 HydrophobicContact CB-CG 4.1Å; M294-L296 PolarHBondContact O-N 3.16Å
297	A	91.3	Very high	87.6	Confident	20 Å²	20	35.9 Å²	35.9	17%	0.165	18%	0.181	C	C	.	.			trans	-95.5	109.5	171.9	0	0	0	0	0	110.9	L302 L315 F319	A297-L302 HydrophobicContact CB-CD2 3.9Å; A297-L302 HydrophobicContact CB-CG 4.35Å; A297-L315 HydrophobicContact CB-CD2 3.42Å; A297-L315 VanDerWaalsContact CB-CD2 3.42Å; A297-F319 HydrophobicContact CB-CE2 4.47Å; A297-F319 HydrophobicContact CB-CZ 4.48Å
298	T	94.2	Very high	89.2	Confident	11 Å²	11	35.8 Å²	35.8	7%	0.067	17%	0.174	C	C	.	.			trans	-102.9	178.1	177.3	59.7	0	0	0	0	111.9	D273 D291 P300 V301 L302	D273-T298 HydrophobicContact CB-CG2 4.45Å; D291-T298 HydrophobicContact CB-CG2 4.23Å; T298-P300 VanDerWaalsContact O-N 3.16Å; T298-V301 PolarHBondContact O-N 3.31Å; T298-L302 WeakPolarHBondContact O-CG 3.15Å; T298-L302 PolarHBondContact O-N 2.79Å
299	G	96.4	Very high	90.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-40.7	-53.7	-174.6	0	0	0	0	0	114.8	Y222 V301 L302 F303 T341	Y222-G299 PolarHBondContact OH-N 3Å; G299-V301 VanDerWaalsContact C-N 3.28Å; G299-V301 PolarHBondContact O-N 3.24Å; G299-L302 PolarHBondContact O-N 3.01Å; G299-F303 VanDerWaalsContact O-CD2 3.25Å; G299-F303 WeakPolarHBondContact O-CD2 3.06Å; G299-F303 PolarHBondContact O-N 3.4Å; G299-T341 PolarHBondContact O-OG1 2.79Å
300	P	96.1	Very high	91	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.2	-36.8	-177.4	-28.4	38.1	0	0	0	113.9	V274 F277 T298 A304 V332 G337 V338 T341	V274-P300 HydrophobicContact CG2-CG 4.42Å; F277-P300 HydrophobicContact CD2-CB 3.79Å; F277-P300 HydrophobicContact CD2-CG 3.65Å; F277-P300 HydrophobicContact CE2-CB 3.83Å; F277-P300 HydrophobicContact CE2-CG 3.82Å; F277-P300 HydrophobicContact CG-CB 4.2Å; F277-P300 HydrophobicContact CG-CG 4.41Å; F277-P300 HydrophobicContact CZ-CB 4.25Å; T298-P300 VanDerWaalsContact O-N 3.16Å; P300-A304 VanDerWaalsContact O-CB 3.28Å; P300-A304 WeakPolarHBondContact O-CB 3.27Å; P300-A304 PolarHBondContact O-N 3.45Å; P300-A304 VanDerWaalsContact O-N 3.09Å; P300-V332 HydrophobicContact CB-CG1 4.03Å; P300-G337 WeakPolarHBondContact O-CA 3.28Å; P300-V338 HydrophobicContact CB-CG2 4.04Å; P300-V338 HydrophobicContact CG-CG2 4.44Å; P300-T341 WeakPolarHBondContact CA-OG1 3.48Å; P300-T341 WeakPolarHBondContact CD-OG1 3.49Å; P300-T341 HydrophobicContact CG-CG2 4.39Å
301	V	96.3	Very high	91.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-74.4	-43.4	179.2	-171.4	0	0	0	0	111	F277 L292 T298 G299 F303 A304 A305 L311 L315 F319 V332	F277-V301 HydrophobicContact CE1-CG2 4.09Å; F277-V301 HydrophobicContact CE2-CG2 4.37Å; F277-V301 HydrophobicContact CZ-CG2 3.47Å; F277-V301 VanDerWaalsContact CZ-CG2 3.47Å; L292-V301 HydrophobicContact CD2-CG2 3.59Å; T298-V301 PolarHBondContact O-N 3.31Å; G299-V301 VanDerWaalsContact C-N 3.28Å; G299-V301 PolarHBondContact O-N 3.24Å; V301-F303 PolarHBondContact O-N 3.26Å; V301-A304 WeakPolarHBondContact O-CB 3.35Å; V301-A304 PolarHBondContact O-N 3.15Å; V301-A305 WeakPolarHBondContact O-CB 3.48Å; V301-A305 PolarHBondContact O-N 3.35Å; V301-L311 HydrophobicContact CG1-CD2 4.46Å; V301-L315 HydrophobicContact CG1-CD2 3.56Å; V301-F319 HydrophobicContact CG1-CZ 4.17Å; V301-V332 HydrophobicContact CB-CG2 4.44Å; V301-V332 HydrophobicContact CG2-CG2 4.15Å
302	L	96.5	Very high	92.2	Very high	10 Å²	10	42.6 Å²	42.6	5%	0.052	21%	0.21	C	C	.	.	H	α-helix	trans	-65.5	-40.3	-178.5	-62.8	172.6	0	0	0	111.7	R218 F219 Y222 A297 T298 G299 A305 L315	R218-L302 HydrophobicContact CB-CD2 4.47Å; R218-L302 VanDerWaalsContact CD-CD2 3.41Å; R218-L302 HydrophobicContact CG-CD2 3.75Å; F219-L302 HydrophobicContact CD2-CB 3.89Å; F219-L302 HydrophobicContact CD2-CD1 4.2Å; F219-L302 HydrophobicContact CE2-CB 4.28Å; Y222-L302 HydrophobicContact CD1-CD1 3.71Å; Y222-L302 HydrophobicContact CD2-CD1 4.03Å; Y222-L302 HydrophobicContact CG-CD1 3.42Å; Y222-L302 VanDerWaalsContact CG-CD1 3.42Å; A297-L302 HydrophobicContact CB-CD2 3.9Å; A297-L302 HydrophobicContact CB-CG 4.35Å; T298-L302 WeakPolarHBondContact O-CG 3.15Å; T298-L302 PolarHBondContact O-N 2.79Å; G299-L302 PolarHBondContact O-N 3.01Å; L302-A305 PolarHBondContact O-N 2.66Å; L302-L315 HydrophobicContact CD2-CD1 4.46Å
303	F	96.9	Very high	92.6	Very high	24 Å²	24	45 Å²	45	11%	0.105	23%	0.231	C	C	.	.	H	α-helix	trans	-70.1	-34	172.3	-76.4	-61.6	0	0	0	112.6	F219 G299 V301 A305 Q306 Q340 T341 L344	F219-F303 HydrophobicContact CE1-CZ 4.44Å; F219-F303 HydrophobicContact CE2-CD1 4.18Å; F219-F303 HydrophobicContact CE2-CD2 4.11Å; F219-F303 AromaticContact CE2-CE1 3.84Å; F219-F303 HydrophobicContact CE2-CE1 3.84Å; F219-F303 AromaticContact CE2-CE2 3.74Å; F219-F303 HydrophobicContact CE2-CE2 3.74Å; F219-F303 HydrophobicContact CE2-CG 4.34Å; F219-F303 AromaticContact CE2-CZ 3.62Å; F219-F303 HydrophobicContact CE2-CZ 3.62Å; F219-F303 AromaticContact CZ-CE1 3.84Å; F219-F303 HydrophobicContact CZ-CE1 3.84Å; F219-F303 AromaticContact CZ-CE2 3.72Å; F219-F303 HydrophobicContact CZ-CE2 3.72Å; F219-F303 AromaticContact CZ-CZ 3.34Å; F219-F303 HydrophobicContact CZ-CZ 3.34Å; G299-F303 VanDerWaalsContact O-CD2 3.25Å; G299-F303 WeakPolarHBondContact O-CD2 3.06Å; G299-F303 PolarHBondContact O-N 3.4Å; V301-F303 PolarHBondContact O-N 3.26Å; F303-A305 VanDerWaalsContact C-N 3.29Å; F303-A305 PolarHBondContact O-N 3.04Å; F303-Q306 PolarHBondContact O-N 3.33Å; F303-Q340 HydrophobicContact CB-CB 4.06Å; F303-Q340 HydrophobicContact CD1-CB 3.83Å; F303-Q340 HydrophobicContact CD1-CG 4.49Å; F303-Q340 HydrophobicContact CD2-CB 3.76Å; F303-Q340 HydrophobicContact CE1-CB 4.08Å; F303-Q340 HydrophobicContact CE2-CB 4.05Å; F303-Q340 HydrophobicContact CG-CB 3.63Å; F303-Q340 HydrophobicContact CZ-CB 4.17Å; F303-T341 WeakPolarHBondContact CD2-OG1 3.35Å; F303-L344 HydrophobicContact CE2-CD2 4.32Å; F303-L344 HydrophobicContact CZ-CD2 4.15Å
304	A	96.6	Very high	93.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.7	-37	173.3	0	0	0	0	0	111.9	P300 V301 Q306 R307 Y308 L311 V332 S335	P300-A304 VanDerWaalsContact O-CB 3.28Å; P300-A304 WeakPolarHBondContact O-CB 3.27Å; P300-A304 PolarHBondContact O-N 3.45Å; P300-A304 VanDerWaalsContact O-N 3.09Å; V301-A304 WeakPolarHBondContact O-CB 3.35Å; V301-A304 PolarHBondContact O-N 3.15Å; A304-Q306 VanDerWaalsContact C-N 3.29Å; A304-Q306 PolarHBondContact O-N 2.79Å; A304-R307 PolarHBondContact O-N 3.01Å; A304-Y308 PolarHBondContact O-N 3.21Å; A304-L311 HydrophobicContact CB-CD1 3.57Å; A304-V332 HydrophobicContact CB-CB 4.47Å; A304-V332 HydrophobicContact CB-CG2 3.83Å; A304-S335 VanDerWaalsContact CB-OG 3.31Å; A304-S335 WeakPolarHBondContact CB-OG 3.27Å
305	A	95.9	Very high	93.9	Very high	3 Å²	3	33.4 Å²	33.4	3%	0.025	18%	0.175	C	C	.	.	H	α-helix	trans	-63.5	-32.4	-179.3	0	0	0	0	0	113.3	V301 L302 F303 R307 Y308 L311 L315	V301-A305 WeakPolarHBondContact O-CB 3.48Å; V301-A305 PolarHBondContact O-N 3.35Å; L302-A305 PolarHBondContact O-N 2.66Å; F303-A305 VanDerWaalsContact C-N 3.29Å; F303-A305 PolarHBondContact O-N 3.04Å; A305-R307 PolarHBondContact O-N 3.01Å; A305-Y308 CarbonylContact O-C 3.55Å; A305-Y308 VanDerWaalsContact O-C 3.29Å; A305-Y308 PolarHBondContact O-N 3.4Å; A305-L311 HydrophobicContact CB-CB 3.78Å; A305-L311 HydrophobicContact CB-CD1 4.15Å; A305-L315 HydrophobicContact CB-CD1 3.8Å
306	Q	94.2	Very high	94.3	Very high	104 Å²	104	36.3 Å²	36.3	49%	0.486	19%	0.187	S	C	.	.	H	α-helix	trans	-61.4	-30	172.8	-64.1	178.4	-3.4	0	0	112.8	F303 A304	F303-Q306 PolarHBondContact O-N 3.33Å; A304-Q306 VanDerWaalsContact C-N 3.29Å; A304-Q306 PolarHBondContact O-N 2.79Å
307	R	94.2	Very high	94.6	Very high	156 Å²	156	38 Å²	38	59%	0.589	19%	0.19	S	C	*	.	H	α-helix	trans	-91.5	-33.8	178	-179.2	172.1	174.9	154.3	-1.2	112.7	A304 A305 P309	A304-R307 PolarHBondContact O-N 3.01Å; A305-R307 PolarHBondContact O-N 3.01Å; R307-P309 WeakPolarHBondContact O-CD 3.12Å
308	Y	96.1	Very high	94.6	Very high	48 Å²	48	41.1 Å²	41.1	19%	0.188	20%	0.201	C	C	.	.			trans	-123.3	85.3	-176.8	-60.3	-68.9	0	0	0	109.8	A304 A305 E310 L311 L331 Q334	A304-Y308 PolarHBondContact O-N 3.21Å; A305-Y308 CarbonylContact O-C 3.55Å; A305-Y308 VanDerWaalsContact O-C 3.29Å; A305-Y308 PolarHBondContact O-N 3.4Å; Y308-E310 PolarHBondContact O-N 3.3Å; Y308-L311 WeakPolarHBondContact O-CB 3.18Å; Y308-L311 PolarHBondContact O-N 2.86Å; Y308-L331 HydrophobicContact CD1-CD2 4.03Å; Y308-L331 HydrophobicContact CD2-CB 4.19Å; Y308-L331 HydrophobicContact CD2-CD2 4.11Å; Y308-L331 HydrophobicContact CG-CD2 3.82Å; Y308-Q334 HydrophobicContact CE2-CB 4.16Å; Y308-Q334 PolarHBondContact OH-O 3.37Å
309	P	93	Very high	94.4	Very high	90 Å²	90	41.4 Å²	41.4	58%	0.584	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-17.6	-177.3	-27.5	35.6	0	0	0	114.8	R307 L311 N312	R307-P309 WeakPolarHBondContact O-CD 3.12Å; P309-L311 PolarHBondContact O-N 3.2Å; P309-N312 VanDerWaalsContact O-CB 3.26Å; P309-N312 WeakPolarHBondContact O-CB 3.07Å; P309-N312 PolarHBondContact O-N 3.05Å
310	E	94.2	Very high	94.2	Very high	91 Å²	91	45.6 Å²	45.6	43%	0.425	23%	0.231	S	C	.	.	H	α-helix	trans	-58.8	-26.9	170.6	62.3	174.2	-121.5	0	0	113.2	Y308 N312 A313 R327 L331	Y308-E310 PolarHBondContact O-N 3.3Å; E310-N312 PolarHBondContact O-N 3.1Å; E310-A313 PolarHBondContact O-N 2.8Å; E310-R327 IonicContact OE1-CZ 2.7Å; E310-R327 IonicContact OE1-NE 3.9Å; E310-R327 PolarHBondContact OE1-NE 3.22Å; E310-R327 IonicContact OE1-NH2 2.89Å; E310-R327 PolarHBondContact OE1-NH2 2.9Å; E310-R327 IonicContact OE2-NH2 2.78Å; E310-R327 PolarHBondContact OE2-NH2 2.89Å; E310-L331 HydrophobicContact CG-CD1 3.79Å; E310-L331 WeakPolarHBondContact OE1-CD1 3.37Å; E310-L331 WeakPolarHBondContact OE1-CD2 3.42Å
311	L	95.2	Very high	94	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.7	-31.7	171.7	-81.9	168.1	0	0	0	111.5	V301 A304 A305 Y308 P309 A313 I314 L315 A328 L331	V301-L311 HydrophobicContact CG1-CD2 4.46Å; A304-L311 HydrophobicContact CB-CD1 3.57Å; A305-L311 HydrophobicContact CB-CB 3.78Å; A305-L311 HydrophobicContact CB-CD1 4.15Å; Y308-L311 WeakPolarHBondContact O-CB 3.18Å; Y308-L311 PolarHBondContact O-N 2.86Å; P309-L311 PolarHBondContact O-N 3.2Å; L311-A313 PolarHBondContact O-N 2.91Å; L311-I314 HydrophobicContact CD2-CD1 4.22Å; L311-I314 CarbonylContact O-C 3.57Å; L311-I314 WeakPolarHBondContact O-CA 3.2Å; L311-I314 WeakPolarHBondContact O-CB 3.32Å; L311-I314 PolarHBondContact O-N 3.5Å; L311-L315 VanDerWaalsContact O-CG 3.25Å; L311-L315 WeakPolarHBondContact O-CG 3.46Å; L311-L315 PolarHBondContact O-N 3.35Å; L311-A328 HydrophobicContact CD2-CB 3.88Å; L311-L331 HydrophobicContact CD1-CB 4.04Å; L311-L331 HydrophobicContact CD1-CD1 4.22Å; L311-L331 HydrophobicContact CD2-CB 4.42Å; L311-L331 HydrophobicContact CD2-CD1 3.76Å; L311-L331 HydrophobicContact CG-CB 4.28Å; L311-L331 HydrophobicContact CG-CD1 3.57Å
312	N	94.1	Very high	93.9	Very high	25 Å²	25	58.7 Å²	58.7	13%	0.134	30%	0.3	C	S	.	.	H	α-helix	trans	-58.7	-39.2	-176.9	-67.5	-11.2	0	0	0	111.6	D215 P309 E310 I314 L315 L316	D215-N312 PolarHBondContact OD1-ND2 3.47Å; D215-N312 PolarHBondContact OD1-OD1 3.05Å; D215-N312 PolarHBondContact OD2-ND2 3.42Å; P309-N312 VanDerWaalsContact O-CB 3.26Å; P309-N312 WeakPolarHBondContact O-CB 3.07Å; P309-N312 PolarHBondContact O-N 3.05Å; E310-N312 PolarHBondContact O-N 3.1Å; N312-I314 PolarHBondContact O-N 3.38Å; N312-L315 PolarHBondContact O-N 3.5Å; N312-L316 WeakPolarHBondContact O-CB 3.34Å; N312-L316 WeakPolarHBondContact O-CG 3.39Å; N312-L316 PolarHBondContact O-N 3.47Å
313	A	93.6	Very high	93.7	Very high	52 Å²	52	60 Å²	60	43%	0.43	32%	0.316	S	S	.	.	H	α-helix	trans	-66.1	-36.2	174.9	0	0	0	0	0	112.7	E310 L311 R317	E310-A313 PolarHBondContact O-N 2.8Å; L311-A313 PolarHBondContact O-N 2.91Å; A313-R317 WeakPolarHBondContact O-CG 3.44Å; A313-R317 PolarHBondContact O-NH1 2.71Å
314	I	94.7	Very high	93.6	Very high	7 Å²	7	59.2 Å²	59.2	4%	0.036	31%	0.313	C	S	.	.	H	α-helix	trans	-68.5	-43.2	175.5	-66.5	165.9	0	0	0	110.3	L311 N312 R317 Q318 F319 D324 R327	L311-I314 HydrophobicContact CD2-CD1 4.22Å; L311-I314 CarbonylContact O-C 3.57Å; L311-I314 WeakPolarHBondContact O-CA 3.2Å; L311-I314 WeakPolarHBondContact O-CB 3.32Å; L311-I314 PolarHBondContact O-N 3.5Å; N312-I314 PolarHBondContact O-N 3.38Å; I314-R317 VanDerWaalsContact CG1-NH2 3.31Å; I314-R317 WeakPolarHBondContact O-CG 3.12Å; I314-R317 PolarHBondContact O-N 2.97Å; I314-Q318 PolarHBondContact O-N 3.28Å; I314-Q318 VanDerWaalsContact O-N 3.15Å; I314-F319 HydrophobicContact CG2-CD1 3.26Å; I314-F319 HydrophobicContact CG2-CE1 3.5Å; I314-F319 VanDerWaalsContact CG2-CE1 3.5Å; I314-F319 HydrophobicContact CG2-CG 4.06Å; I314-F319 HydrophobicContact CG2-CZ 4.47Å; I314-F319 PolarHBondContact O-N 3.37Å; I314-D324 HydrophobicContact CG2-CB 3.94Å; I314-R327 HydrophobicContact CD1-CB 4.31Å; I314-R327 HydrophobicContact CD1-CG 4.02Å
315	L	93	Very high	93.4	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66.5	-40.1	-179.3	-62.9	172.9	0	0	0	112.2	N211 A297 V301 L302 A305 L311 N312 R317 Q318 F319	N211-L315 PolarHBondContact ND2-O 3.13Å; A297-L315 HydrophobicContact CB-CD2 3.42Å; A297-L315 VanDerWaalsContact CB-CD2 3.42Å; V301-L315 HydrophobicContact CG1-CD2 3.56Å; L302-L315 HydrophobicContact CD2-CD1 4.46Å; A305-L315 HydrophobicContact CB-CD1 3.8Å; L311-L315 VanDerWaalsContact O-CG 3.25Å; L311-L315 WeakPolarHBondContact O-CG 3.46Å; L311-L315 PolarHBondContact O-N 3.35Å; N312-L315 PolarHBondContact O-N 3.5Å; L315-R317 VanDerWaalsContact C-N 3.28Å; L315-R317 PolarHBondContact O-N 2.9Å; L315-Q318 PolarHBondContact O-N 2.82Å; L315-Q318 VanDerWaalsContact O-N 3.16Å; L315-F319 HydrophobicContact CD2-CE1 4.22Å; L315-F319 HydrophobicContact CD2-CE2 4.12Å; L315-F319 HydrophobicContact CD2-CZ 3.46Å; L315-F319 VanDerWaalsContact CD2-CZ 3.46Å
316	L	91.9	Very high	93.3	Very high	75 Å²	75	66 Å²	66	39%	0.393	35%	0.346	S	S	.	.	H	α-helix	trans	-60.2	-37.6	177.2	-80.8	175.4	0	0	0	112.8	D213 N312 Q318	D213-L316 HydrophobicContact CB-CD2 4.05Å; D213-L316 WeakPolarHBondContact OD1-CD1 3.35Å; N312-L316 WeakPolarHBondContact O-CB 3.34Å; N312-L316 WeakPolarHBondContact O-CG 3.39Å; N312-L316 PolarHBondContact O-N 3.47Å; L316-Q318 VanDerWaalsContact C-N 3.34Å
317	R	91.8	Very high	93.3	Very high	81 Å²	81	65.1 Å²	65.1	31%	0.306	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	9	178.2	72	-174	175.6	-109.5	13	113.7	A313 I314 L315 F319 S320 D324	A313-R317 WeakPolarHBondContact O-CG 3.44Å; A313-R317 PolarHBondContact O-NH1 2.71Å; I314-R317 VanDerWaalsContact CG1-NH2 3.31Å; I314-R317 WeakPolarHBondContact O-CG 3.12Å; I314-R317 PolarHBondContact O-N 2.97Å; L315-R317 VanDerWaalsContact C-N 3.28Å; L315-R317 PolarHBondContact O-N 2.9Å; R317-F319 VanDerWaalsContact C-N 3.28Å; R317-F319 PolarHBondContact O-N 3.23Å; R317-S320 WeakPolarHBondContact O-CB 3.3Å; R317-S320 PolarHBondContact O-N 3.46Å; R317-S320 VanDerWaalsContact O-N 3.16Å; R317-S320 PolarHBondContact O-OG 3.43Å; R317-D324 IonicContact CZ-OD1 3.36Å; R317-D324 IonicContact CZ-OD2 3.57Å; R317-D324 IonicContact NE-OD1 3.29Å; R317-D324 PolarHBondContact NE-OD1 3.49Å; R317-D324 IonicContact NE-OD2 2.74Å; R317-D324 PolarHBondContact NE-OD2 3.05Å; R317-D324 IonicContact NH2-OD1 2.65Å; R317-D324 PolarHBondContact NH2-OD1 3.21Å; R317-D324 IonicContact NH2-OD2 3.65Å
318	Q	90.7	Very high	93.3	Very high	87 Å²	87	57.7 Å²	57.7	41%	0.407	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	43.2	175.6	-60.2	176.2	-7.7	0	0	113.3	I314 L315 L316 S320	I314-Q318 PolarHBondContact O-N 3.28Å; I314-Q318 VanDerWaalsContact O-N 3.15Å; L315-Q318 PolarHBondContact O-N 2.82Å; L315-Q318 VanDerWaalsContact O-N 3.16Å; L316-Q318 VanDerWaalsContact C-N 3.34Å; Q318-S320 PolarHBondContact O-N 3.09Å; Q318-S320 VanDerWaalsContact O-N 3.16Å
319	F	91.8	Very high	93.1	Very high	17 Å²	17	56.9 Å²	56.9	8%	0.075	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	27.4	177.4	-44.6	-91.8	0	0	0	114.4	L292 A297 V301 I314 L315 R317 L321 D324 A328	L292-F319 HydrophobicContact CD2-CD1 4.22Å; L292-F319 HydrophobicContact CD2-CE1 3.55Å; L292-F319 HydrophobicContact CD2-CE2 4.04Å; L292-F319 HydrophobicContact CD2-CZ 3.43Å; L292-F319 VanDerWaalsContact CD2-CZ 3.43Å; A297-F319 HydrophobicContact CB-CE2 4.47Å; A297-F319 HydrophobicContact CB-CZ 4.48Å; V301-F319 HydrophobicContact CG1-CZ 4.17Å; I314-F319 HydrophobicContact CG2-CD1 3.26Å; I314-F319 HydrophobicContact CG2-CE1 3.5Å; I314-F319 VanDerWaalsContact CG2-CE1 3.5Å; I314-F319 HydrophobicContact CG2-CG 4.06Å; I314-F319 HydrophobicContact CG2-CZ 4.47Å; I314-F319 PolarHBondContact O-N 3.37Å; L315-F319 HydrophobicContact CD2-CE1 4.22Å; L315-F319 HydrophobicContact CD2-CE2 4.12Å; L315-F319 HydrophobicContact CD2-CZ 3.46Å; L315-F319 VanDerWaalsContact CD2-CZ 3.46Å; R317-F319 VanDerWaalsContact C-N 3.28Å; R317-F319 PolarHBondContact O-N 3.23Å; F319-L321 PolarHBondContact O-N 3.48Å; F319-D324 VanDerWaalsContact C-OD2 3.31Å; F319-D324 WeakPolarHBondContact CA-OD2 3.24Å; F319-D324 HydrophobicContact CB-CB 4.01Å; F319-D324 HydrophobicContact CD1-CB 4.44Å; F319-A328 HydrophobicContact CD1-CB 4.09Å; F319-A328 HydrophobicContact CE1-CB 3.66Å
320	S	90.4	Very high	93.2	Very high	87 Å²	87	56.6 Å²	56.6	61%	0.608	30%	0.299	S	S	*	.			trans	-77.9	-10.1	-173.5	55	0	0	0	0	115.6	R317 Q318 D324	R317-S320 WeakPolarHBondContact O-CB 3.3Å; R317-S320 PolarHBondContact O-N 3.46Å; R317-S320 VanDerWaalsContact O-N 3.16Å; R317-S320 PolarHBondContact O-OG 3.43Å; Q318-S320 PolarHBondContact O-N 3.09Å; Q318-S320 VanDerWaalsContact O-N 3.16Å; S320-D324 PolarHBondContact N-OD2 3.24Å
321	L	93.6	Very high	93.3	Very high	103 Å²	103	52.3 Å²	52.3	54%	0.539	28%	0.279	S	S	.	.	S	Bend	trans	-97.2	149.3	177	-60.1	179	0	0	0	111.8	F319 G323 D324	F319-L321 PolarHBondContact O-N 3.48Å; L321-G323 PolarHBondContact O-N 3.17Å; L321-D324 PolarHBondContact N-OD2 2.98Å; L321-D324 WeakPolarHBondContact O-CB 3.42Å; L321-D324 VanDerWaalsContact O-CG 3.23Å; L321-D324 PolarHBondContact O-N 2.97Å; L321-D324 VanDerWaalsContact O-N 3.08Å
322	D	92.8	Very high	93.2	Very high	172 Å²	172	52.5 Å²	52.5	92%	0.92	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	130.1	174	-66	-21.6	0	0	0	110.9	D324	D322-D324 VanDerWaalsContact C-N 3.35Å
323	G	93.2	Very high	93.1	Very high	37 Å²	37	59.3 Å²	59.3	38%	0.381	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	-9.1	-178.6	0	0	0	0	0	115	L321 T325 E326 R327	L321-G323 PolarHBondContact O-N 3.17Å; G323-T325 PolarHBondContact O-N 3.25Å; G323-E326 VanDerWaalsContact C-OE2 3.26Å; G323-E326 WeakPolarHBondContact CA-OE2 3.31Å; G323-E326 PolarHBondContact O-N 3Å; G323-R327 VanDerWaalsContact O-CB 3.29Å; G323-R327 WeakPolarHBondContact O-CB 3.48Å; G323-R327 PolarHBondContact O-N 3.3Å
324	D	94.8	Very high	93.1	Very high	8 Å²	8	61 Å²	61	4%	0.043	31%	0.308	C	S	.	.	H	α-helix	trans	-61.7	-44.1	-178.6	-81.8	-7.3	0	0	0	112.3	I314 R317 F319 S320 L321 D322 R327 A328	I314-D324 HydrophobicContact CG2-CB 3.94Å; R317-D324 IonicContact CZ-OD1 3.36Å; R317-D324 IonicContact CZ-OD2 3.57Å; R317-D324 IonicContact NE-OD1 3.29Å; R317-D324 PolarHBondContact NE-OD1 3.49Å; R317-D324 IonicContact NE-OD2 2.74Å; R317-D324 PolarHBondContact NE-OD2 3.05Å; R317-D324 IonicContact NH2-OD1 2.65Å; R317-D324 PolarHBondContact NH2-OD1 3.21Å; R317-D324 IonicContact NH2-OD2 3.65Å; F319-D324 VanDerWaalsContact C-OD2 3.31Å; F319-D324 WeakPolarHBondContact CA-OD2 3.24Å; F319-D324 HydrophobicContact CB-CB 4.01Å; F319-D324 HydrophobicContact CD1-CB 4.44Å; S320-D324 PolarHBondContact N-OD2 3.24Å; L321-D324 PolarHBondContact N-OD2 2.98Å; L321-D324 WeakPolarHBondContact O-CB 3.42Å; L321-D324 VanDerWaalsContact O-CG 3.23Å; L321-D324 PolarHBondContact O-N 2.97Å; L321-D324 VanDerWaalsContact O-N 3.08Å; D322-D324 VanDerWaalsContact C-N 3.35Å; D324-R327 PolarHBondContact O-N 2.85Å; D324-A328 VanDerWaalsContact O-CB 3.23Å; D324-A328 WeakPolarHBondContact O-CB 3.45Å; D324-A328 PolarHBondContact O-N 3.33Å
325	T	92.8	Very high	93.2	Very high	23 Å²	23	61.6 Å²	61.6	14%	0.141	31%	0.313	C	S	.	.	H	α-helix	trans	-65.6	-45.4	-179.5	-65.4	0	0	0	0	110.3	L292 Q293 G323 A328 L329	L292-T325 HydrophobicContact CB-CG2 3.84Å; L292-T325 HydrophobicContact CD1-CG2 4.12Å; Q293-T325 HydrophobicContact CG-CG2 4.45Å; G323-T325 PolarHBondContact O-N 3.25Å; T325-A328 PolarHBondContact O-N 3.16Å; T325-L329 HydrophobicContact CG2-CD1 4.1Å; T325-L329 WeakPolarHBondContact O-CB 3.42Å; T325-L329 VanDerWaalsContact O-CG 3.28Å; T325-L329 WeakPolarHBondContact O-CG 3.19Å; T325-L329 PolarHBondContact O-N 3.46Å
326	E	92.6	Very high	93.2	Very high	124 Å²	124	65.6 Å²	65.6	58%	0.579	33%	0.334	S	S	*	.	H	α-helix	trans	-62.2	-46	178.3	-65.9	75.4	-169.9	0	0	111.2	G323 L329 E330	G323-E326 VanDerWaalsContact C-OE2 3.26Å; G323-E326 WeakPolarHBondContact CA-OE2 3.31Å; G323-E326 PolarHBondContact O-N 3Å; E326-L329 PolarHBondContact O-N 2.85Å; E326-E330 PolarHBondContact O-N 3.3Å
327	R	95	Very high	93.3	Very high	84 Å²	84	62 Å²	62	32%	0.317	32%	0.316	S	S	.	.	H	α-helix	trans	-65.5	-41.6	178.1	-176.6	55.9	-179.7	170.7	-0.2	111.4	E310 I314 G323 D324 E330 L331	E310-R327 IonicContact OE1-CZ 2.7Å; E310-R327 IonicContact OE1-NE 3.9Å; E310-R327 PolarHBondContact OE1-NE 3.22Å; E310-R327 IonicContact OE1-NH2 2.89Å; E310-R327 PolarHBondContact OE1-NH2 2.9Å; E310-R327 IonicContact OE2-NH2 2.78Å; E310-R327 PolarHBondContact OE2-NH2 2.89Å; I314-R327 HydrophobicContact CD1-CB 4.31Å; I314-R327 HydrophobicContact CD1-CG 4.02Å; G323-R327 VanDerWaalsContact O-CB 3.29Å; G323-R327 WeakPolarHBondContact O-CB 3.48Å; G323-R327 PolarHBondContact O-N 3.3Å; D324-R327 PolarHBondContact O-N 2.85Å; R327-E330 IonicContact CZ-OE2 3.97Å; R327-E330 IonicContact NH1-OE1 3.12Å; R327-E330 PolarHBondContact NH1-OE1 2.79Å; R327-E330 IonicContact NH1-OE2 3.43Å; R327-E330 PolarHBondContact NH1-OE2 3.04Å; R327-E330 WeakPolarHBondContact O-CB 3.28Å; R327-E330 PolarHBondContact O-N 2.95Å; R327-L331 HydrophobicContact CG-CD1 4.12Å; R327-L331 VanDerWaalsContact O-CG 3.31Å; R327-L331 WeakPolarHBondContact O-CG 3.37Å; R327-L331 PolarHBondContact O-N 2.92Å
328	A	94.7	Very high	93.4	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-62.3	-44.2	176.2	0	0	0	0	0	111.9	L292 L311 F319 D324 T325 E330 L331 V332	L292-A328 HydrophobicContact CD1-CB 4.21Å; L311-A328 HydrophobicContact CD2-CB 3.88Å; F319-A328 HydrophobicContact CD1-CB 4.09Å; F319-A328 HydrophobicContact CE1-CB 3.66Å; D324-A328 VanDerWaalsContact O-CB 3.23Å; D324-A328 WeakPolarHBondContact O-CB 3.45Å; D324-A328 PolarHBondContact O-N 3.33Å; T325-A328 PolarHBondContact O-N 3.16Å; A328-E330 VanDerWaalsContact C-N 3.32Å; A328-E330 PolarHBondContact O-N 3.03Å; A328-L331 PolarHBondContact O-N 3.27Å; A328-V332 VanDerWaalsContact O-CG2 3.27Å; A328-V332 WeakPolarHBondContact O-CG2 3.37Å; A328-V332 PolarHBondContact O-N 3.45Å
329	L	92	Very high	93.6	Very high	32 Å²	32	56.7 Å²	56.7	17%	0.168	30%	0.303	C	S	.	.	H	α-helix	trans	-60.1	-41.6	174.8	-74.6	169.5	0	0	0	112.2	F277 L292 T325 E326 K333	F277-L329 HydrophobicContact CD1-CD2 3.88Å; F277-L329 HydrophobicContact CE1-CD2 3.86Å; L292-L329 HydrophobicContact CD1-CD2 3.72Å; L292-L329 HydrophobicContact CD1-CG 3.66Å; T325-L329 HydrophobicContact CG2-CD1 4.1Å; T325-L329 WeakPolarHBondContact O-CB 3.42Å; T325-L329 VanDerWaalsContact O-CG 3.28Å; T325-L329 WeakPolarHBondContact O-CG 3.19Å; T325-L329 PolarHBondContact O-N 3.46Å; E326-L329 PolarHBondContact O-N 2.85Å; L329-K333 VanDerWaalsContact O-CG 3.3Å; L329-K333 WeakPolarHBondContact O-CG 3.35Å; L329-K333 PolarHBondContact O-N 3.03Å
330	E	93.9	Very high	93.8	Very high	83 Å²	83	59 Å²	59	39%	0.388	31%	0.313	S	S	.	.	H	α-helix	trans	-60.7	-48.6	176.5	-167.6	-165.1	163.5	0	0	111.4	E326 R327 A328 K333 Q334	E326-E330 PolarHBondContact O-N 3.3Å; R327-E330 IonicContact CZ-OE2 3.97Å; R327-E330 IonicContact NH1-OE1 3.12Å; R327-E330 PolarHBondContact NH1-OE1 2.79Å; R327-E330 IonicContact NH1-OE2 3.43Å; R327-E330 PolarHBondContact NH1-OE2 3.04Å; R327-E330 WeakPolarHBondContact O-CB 3.28Å; R327-E330 PolarHBondContact O-N 2.95Å; A328-E330 VanDerWaalsContact C-N 3.32Å; A328-E330 PolarHBondContact O-N 3.03Å; E330-K333 WeakPolarHBondContact O-CB 3.25Å; E330-K333 PolarHBondContact O-N 3.45Å; E330-Q334 WeakPolarHBondContact O-CG 3.3Å; E330-Q334 PolarHBondContact O-N 2.88Å; E330-Q334 PolarHBondContact OE1-NE2 3.15Å
331	L	96	Very high	94.1	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-66.5	-38.5	-179.9	-67.1	169.2	0	0	0	112.3	Y308 E310 L311 R327 A328 K333 Q334 S335	Y308-L331 HydrophobicContact CD1-CD2 4.03Å; Y308-L331 HydrophobicContact CD2-CB 4.19Å; Y308-L331 HydrophobicContact CD2-CD2 4.11Å; Y308-L331 HydrophobicContact CG-CD2 3.82Å; E310-L331 HydrophobicContact CG-CD1 3.79Å; E310-L331 WeakPolarHBondContact OE1-CD1 3.37Å; E310-L331 WeakPolarHBondContact OE1-CD2 3.42Å; L311-L331 HydrophobicContact CD1-CB 4.04Å; L311-L331 HydrophobicContact CD1-CD1 4.22Å; L311-L331 HydrophobicContact CD2-CB 4.42Å; L311-L331 HydrophobicContact CD2-CD1 3.76Å; L311-L331 HydrophobicContact CG-CB 4.28Å; L311-L331 HydrophobicContact CG-CD1 3.57Å; R327-L331 HydrophobicContact CG-CD1 4.12Å; R327-L331 VanDerWaalsContact O-CG 3.31Å; R327-L331 WeakPolarHBondContact O-CG 3.37Å; R327-L331 PolarHBondContact O-N 2.92Å; A328-L331 PolarHBondContact O-N 3.27Å; L331-K333 VanDerWaalsContact C-N 3.33Å; L331-K333 PolarHBondContact O-N 3.37Å; L331-Q334 CarbonylContact O-C 3.29Å; L331-Q334 PolarHBondContact O-N 2.9Å; L331-S335 VanDerWaalsContact O-CB 3.24Å; L331-S335 WeakPolarHBondContact O-CB 3.46Å; L331-S335 PolarHBondContact O-N 3.21Å; L331-S335 PolarHBondContact O-OG 2.91Å
332	V	94.4	Very high	94.2	Very high	4 Å²	4	54.5 Å²	54.5	2%	0.024	28%	0.276	C	S	.	.	H	α-helix	trans	-59.9	-45.2	173.2	171.9	0	0	0	0	110.2	F277 P300 V301 A304 A328 Q334 S335 V338	F277-V332 HydrophobicContact CD1-CB 4.34Å; F277-V332 HydrophobicContact CD1-CG1 3.71Å; F277-V332 HydrophobicContact CE1-CB 4.3Å; F277-V332 HydrophobicContact CE1-CG1 4.01Å; F277-V332 HydrophobicContact CE1-CG2 4.09Å; F277-V332 HydrophobicContact CG-CG1 4.36Å; P300-V332 HydrophobicContact CB-CG1 4.03Å; V301-V332 HydrophobicContact CB-CG2 4.44Å; V301-V332 HydrophobicContact CG2-CG2 4.15Å; A304-V332 HydrophobicContact CB-CB 4.47Å; A304-V332 HydrophobicContact CB-CG2 3.83Å; A328-V332 VanDerWaalsContact O-CG2 3.27Å; A328-V332 WeakPolarHBondContact O-CG2 3.37Å; A328-V332 PolarHBondContact O-N 3.45Å; V332-Q334 VanDerWaalsContact C-N 3.33Å; V332-Q334 PolarHBondContact O-N 3.4Å; V332-S335 WeakPolarHBondContact CA-OG 3.39Å; V332-S335 PolarHBondContact O-N 2.76Å; V332-S335 VanDerWaalsContact O-N 3.13Å; V332-S335 PolarHBondContact O-OG 2.97Å; V332-V338 HydrophobicContact CG1-CG2 4.03Å
333	K	91.1	Very high	94.3	Very high	169 Å²	169	52.7 Å²	52.7	74%	0.735	26%	0.264	S	S	*	.	H	α-helix	trans	-63.8	-33.8	176.2	-73.1	171.7	-178.4	175.9	0	113.4	L329 E330 L331 S335	L329-K333 VanDerWaalsContact O-CG 3.3Å; L329-K333 WeakPolarHBondContact O-CG 3.35Å; L329-K333 PolarHBondContact O-N 3.03Å; E330-K333 WeakPolarHBondContact O-CB 3.25Å; E330-K333 PolarHBondContact O-N 3.45Å; L331-K333 VanDerWaalsContact C-N 3.33Å; L331-K333 PolarHBondContact O-N 3.37Å; K333-S335 VanDerWaalsContact C-N 3.31Å
334	Q	94.8	Very high	94.5	Very high	87 Å²	87	52.6 Å²	52.6	41%	0.407	25%	0.254	S	S	.	.	H	α-helix	trans	-82.5	-9.2	176.2	-68.1	174.9	10.5	0	0	113.1	Y308 E330 L331 V332	Y308-Q334 HydrophobicContact CE2-CB 4.16Å; Y308-Q334 PolarHBondContact OH-O 3.37Å; E330-Q334 WeakPolarHBondContact O-CG 3.3Å; E330-Q334 PolarHBondContact O-N 2.88Å; E330-Q334 PolarHBondContact OE1-NE2 3.15Å; L331-Q334 CarbonylContact O-C 3.29Å; L331-Q334 PolarHBondContact O-N 2.9Å; V332-Q334 VanDerWaalsContact C-N 3.33Å; V332-Q334 PolarHBondContact O-N 3.4Å
335	S	95.3	Very high	94.6	Very high	19 Å²	19	52.3 Å²	52.3	13%	0.133	25%	0.253	C	S	.	.	S	Bend	trans	-97.5	-177.3	177.1	80.1	0	0	0	0	111.4	A304 L331 V332 K333 G337	A304-S335 VanDerWaalsContact CB-OG 3.31Å; A304-S335 WeakPolarHBondContact CB-OG 3.27Å; L331-S335 VanDerWaalsContact O-CB 3.24Å; L331-S335 WeakPolarHBondContact O-CB 3.46Å; L331-S335 PolarHBondContact O-N 3.21Å; L331-S335 PolarHBondContact O-OG 2.91Å; V332-S335 WeakPolarHBondContact CA-OG 3.39Å; V332-S335 PolarHBondContact O-N 2.76Å; V332-S335 VanDerWaalsContact O-N 3.13Å; V332-S335 PolarHBondContact O-OG 2.97Å; K333-S335 VanDerWaalsContact C-N 3.31Å; S335-G337 PolarHBondContact OG-N 3.28Å
336	D	93.4	Very high	94.7	Very high	85 Å²	85	53.8 Å²	53.8	46%	0.455	26%	0.258	S	S	.	.	S	Bend	trans	-106.2	25.3	163.9	-169	36.6	0	0	0	111.6	V338 G339 Q340	D336-V338 VanDerWaalsContact C-N 3.28Å; D336-V338 PolarHBondContact O-N 2.78Å; D336-G339 PolarHBondContact O-N 3Å; D336-G339 WeakPolarHBondContact OD1-CA 3.48Å; D336-Q340 WeakPolarHBondContact O-CG 3.48Å; D336-Q340 PolarHBondContact O-N 3.15Å
337	G	95.6	Very high	94.9	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59.6	-38.9	-174.9	0	0	0	0	0	113.1	P300 S335 T341	P300-G337 WeakPolarHBondContact O-CA 3.28Å; S335-G337 PolarHBondContact OG-N 3.28Å; G337-T341 WeakPolarHBondContact O-CB 3.46Å; G337-T341 PolarHBondContact O-N 3.14Å; G337-T341 PolarHBondContact O-OG1 3.19Å
338	V	93.6	Very high	95	Very high	31 Å²	31	50 Å²	50	19%	0.188	24%	0.243	C	C	.	.	H	α-helix	trans	-62.8	-45.1	172.1	174.5	0	0	0	0	111.3	V274 F277 V278 P300 V332 D336 T341 R342	V274-V338 HydrophobicContact CG1-CG1 4.13Å; F277-V338 HydrophobicContact CB-CG2 4.08Å; V278-V338 HydrophobicContact CG1-CG1 3.6Å; V278-V338 HydrophobicContact CG1-CG2 4.43Å; P300-V338 HydrophobicContact CB-CG2 4.04Å; P300-V338 HydrophobicContact CG-CG2 4.44Å; V332-V338 HydrophobicContact CG1-CG2 4.03Å; D336-V338 VanDerWaalsContact C-N 3.28Å; D336-V338 PolarHBondContact O-N 2.78Å; V338-T341 PolarHBondContact O-N 3.32Å; V338-R342 WeakPolarHBondContact O-CG 3.31Å; V338-R342 PolarHBondContact O-N 3.26Å
339	G	93.8	Very high	95.1	Very high	24 Å²	24	50.7 Å²	50.7	25%	0.247	25%	0.246	C	C	.	.	H	α-helix	trans	-65.3	-43.1	179.8	0	0	0	0	0	112.6	D336 R342 M343	D336-G339 PolarHBondContact O-N 3Å; D336-G339 WeakPolarHBondContact OD1-CA 3.48Å; G339-R342 WeakPolarHBondContact O-CB 3.32Å; G339-R342 PolarHBondContact O-N 2.84Å; G339-M343 PolarHBondContact O-N 3.1Å
340	Q	97.1	Very high	95.3	Very high	65 Å²	65	52.2 Å²	52.2	30%	0.304	25%	0.252	S	S	.	.	H	α-helix	trans	-65	-40.5	176.2	-68.1	-177.5	33.7	0	0	112.1	F303 D336 R342 M343 L344	F303-Q340 HydrophobicContact CB-CB 4.06Å; F303-Q340 HydrophobicContact CD1-CB 3.83Å; F303-Q340 HydrophobicContact CD1-CG 4.49Å; F303-Q340 HydrophobicContact CD2-CB 3.76Å; F303-Q340 HydrophobicContact CE1-CB 4.08Å; F303-Q340 HydrophobicContact CE2-CB 4.05Å; F303-Q340 HydrophobicContact CG-CB 3.63Å; F303-Q340 HydrophobicContact CZ-CB 4.17Å; D336-Q340 WeakPolarHBondContact O-CG 3.48Å; D336-Q340 PolarHBondContact O-N 3.15Å; Q340-R342 PolarHBondContact O-N 2.95Å; Q340-M343 WeakPolarHBondContact O-CB 3.44Å; Q340-M343 PolarHBondContact O-N 2.96Å; Q340-L344 PolarHBondContact O-N 3.27Å
341	T	96	Very high	95.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.1	-42.8	174.3	-51.6	0	0	0	0	111.5	L270 V274 G299 P300 F303 G337 V338 M343 L344 A345	L270-T341 HydrophobicContact CB-CG2 4.24Å; L270-T341 HydrophobicContact CD2-CG2 3.84Å; L270-T341 WeakPolarHBondContact O-CG2 3.22Å; V274-T341 HydrophobicContact CG2-CG2 3.61Å; G299-T341 PolarHBondContact O-OG1 2.79Å; P300-T341 WeakPolarHBondContact CA-OG1 3.48Å; P300-T341 WeakPolarHBondContact CD-OG1 3.49Å; P300-T341 HydrophobicContact CG-CG2 4.39Å; F303-T341 WeakPolarHBondContact CD2-OG1 3.35Å; G337-T341 WeakPolarHBondContact O-CB 3.46Å; G337-T341 PolarHBondContact O-N 3.14Å; G337-T341 PolarHBondContact O-OG1 3.19Å; V338-T341 PolarHBondContact O-N 3.32Å; T341-M343 VanDerWaalsContact C-N 3.33Å; T341-M343 PolarHBondContact O-N 3.33Å; T341-L344 PolarHBondContact O-N 3.35Å; T341-A345 PolarHBondContact O-N 3.26Å
342	R	94.9	Very high	95.6	Very high	96 Å²	96	48.5 Å²	48.5	36%	0.362	24%	0.236	S	C	.	.	H	α-helix	trans	-61.4	-40.5	173.7	-74.3	177.9	176.5	-157	-5.9	112.1	V274 V338 G339 Q340 A345 E346	V274-R342 HydrophobicContact CB-CG 4.43Å; V274-R342 HydrophobicContact CG1-CG 3.85Å; V274-R342 VanDerWaalsContact CG1-NE 3.29Å; V274-R342 HydrophobicContact CG2-CG 3.8Å; V338-R342 WeakPolarHBondContact O-CG 3.31Å; V338-R342 PolarHBondContact O-N 3.26Å; G339-R342 WeakPolarHBondContact O-CB 3.32Å; G339-R342 PolarHBondContact O-N 2.84Å; Q340-R342 PolarHBondContact O-N 2.95Å; R342-A345 PolarHBondContact O-N 3.09Å; R342-E346 WeakPolarHBondContact O-CB 3.34Å; R342-E346 PolarHBondContact O-N 3.36Å
343	M	96.3	Very high	95.8	Very high	135 Å²	135	49.1 Å²	49.1	67%	0.665	24%	0.238	S	C	*	.	H	α-helix	trans	-64.2	-41.2	177.2	-171.7	-177.5	-65	0	0	111.5	G339 Q340 T341 E346 F347	G339-M343 PolarHBondContact O-N 3.1Å; Q340-M343 WeakPolarHBondContact O-CB 3.44Å; Q340-M343 PolarHBondContact O-N 2.96Å; T341-M343 VanDerWaalsContact C-N 3.33Å; T341-M343 PolarHBondContact O-N 3.33Å; M343-E346 PolarHBondContact O-N 3.4Å; M343-F347 PolarHBondContact O-N 3.29Å
344	L	97	Very high	96.1	Very high	34 Å²	34	46.9 Å²	46.9	18%	0.178	23%	0.225	C	C	.	.	H	α-helix	trans	-65.3	-41.2	174.7	-176.9	57.9	0	0	0	111.8	F219 L223 L270 F303 Q340 T341 E346 F347 H348	F219-L344 HydrophobicContact CE1-CD2 4.21Å; F219-L344 HydrophobicContact CZ-CD2 3.84Å; L223-L344 HydrophobicContact CD2-CD2 4.11Å; L270-L344 HydrophobicContact CD1-CB 4.4Å; L270-L344 HydrophobicContact CD1-CD2 4.21Å; L270-L344 HydrophobicContact CD1-CG 3.83Å; L270-L344 HydrophobicContact CD2-CD2 3.93Å; L270-L344 HydrophobicContact CD2-CG 4.32Å; F303-L344 HydrophobicContact CE2-CD2 4.32Å; F303-L344 HydrophobicContact CZ-CD2 4.15Å; Q340-L344 PolarHBondContact O-N 3.27Å; T341-L344 PolarHBondContact O-N 3.35Å; L344-E346 VanDerWaalsContact C-N 3.33Å; L344-E346 PolarHBondContact O-N 2.96Å; L344-F347 HydrophobicContact CD1-CD1 4.35Å; L344-F347 WeakPolarHBondContact O-CB 3.39Å; L344-F347 PolarHBondContact O-N 2.89Å; L344-H348 PolarHBondContact O-CD2 2.91Å; L344-H348 VanDerWaalsContact O-CD2 3.31Å; L344-H348 PolarHBondContact O-N 3.47Å
345	A	95.8	Very high	96.3	Very high	2 Å²	2	43.3 Å²	43.3	2%	0.017	21%	0.21	C	C	.	.	H	α-helix	trans	-60.3	-44	174.7	0	0	0	0	0	111.8	A267 L270 I271 T341 R342 H348 F349	A267-A345 WeakPolarHBondContact CB-O 3.38Å; L270-A345 HydrophobicContact CB-CB 3.68Å; L270-A345 HydrophobicContact CD1-CB 4.28Å; I271-A345 HydrophobicContact CD1-CB 3.69Å; I271-A345 HydrophobicContact CG1-CB 3.88Å; T341-A345 PolarHBondContact O-N 3.26Å; R342-A345 PolarHBondContact O-N 3.09Å; A345-H348 PolarHBondContact O-N 3.02Å; A345-F349 PolarHBondContact O-N 2.88Å
346	E	95.1	Very high	96.4	Very high	54 Å²	54	42.4 Å²	42.4	25%	0.252	20%	0.203	S	C	.	.	H	α-helix	trans	-63.3	-41.5	176.2	178.4	58.7	-154.3	0	0	111.9	S24 R342 M343 L344 H348 F349 Q350	S24-E346 WeakPolarHBondContact CB-OE1 3.4Å; S24-E346 PolarHBondContact OG-OE1 3.49Å; R342-E346 WeakPolarHBondContact O-CB 3.34Å; R342-E346 PolarHBondContact O-N 3.36Å; M343-E346 PolarHBondContact O-N 3.4Å; L344-E346 VanDerWaalsContact C-N 3.33Å; L344-E346 PolarHBondContact O-N 2.96Å; E346-H348 VanDerWaalsContact C-N 3.34Å; E346-H348 PolarHBondContact O-N 3.23Å; E346-F349 PolarHBondContact O-N 3.39Å; E346-Q350 WeakPolarHBondContact O-CG 3.36Å; E346-Q350 PolarHBondContact O-N 2.95Å; E346-Q350 WeakPolarHBondContact OE1-CG 3.45Å; E346-Q350 PolarHBondContact OE1-NE2 2.89Å
347	F	97.2	Very high	96.5	Very high	110 Å²	110	42.1 Å²	42.1	48%	0.482	20%	0.198	S	C	.	.	H	α-helix	trans	-57	-47.6	173.4	169.2	-93.8	0	0	0	111.6	M343 L344 Q350 A351	M343-F347 PolarHBondContact O-N 3.29Å; L344-F347 HydrophobicContact CD1-CD1 4.35Å; L344-F347 WeakPolarHBondContact O-CB 3.39Å; L344-F347 PolarHBondContact O-N 2.89Å; F347-Q350 PolarHBondContact O-N 2.74Å; F347-A351 PolarHBondContact O-N 3.37Å
348	H	98	Very high	96.6	Very high	20 Å²	20	45.7 Å²	45.7	9%	0.093	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-44.3	175.3	-84.4	-82.5	0	0	0	111.3	H263 M266 A267 L344 A345 E346 Q350 A351 A352	H263-H348 WeakPolarHBondContact CB-O 3.41Å; H263-H348 AromaticContact CE1-ND1 3.74Å; H263-H348 AromaticContact CG-ND1 3.9Å; H263-H348 AromaticContact ND1-CE1 3.76Å; H263-H348 AromaticContact ND1-CG 3.75Å; H263-H348 AromaticContact ND1-ND1 2.93Å; H263-H348 PolarHBondContact ND1-ND1 3.48Å; H263-H348 WeakPolarHBondContact O-CB 3.36Å; M266-H348 HydrophobicContact CB-CB 4.36Å; M266-H348 WeakPolarHBondContact CB-ND1 3.15Å; A267-H348 HydrophobicContact CB-CB 3.89Å; L344-H348 PolarHBondContact O-CD2 2.91Å; L344-H348 VanDerWaalsContact O-CD2 3.31Å; L344-H348 PolarHBondContact O-N 3.47Å; A345-H348 PolarHBondContact O-N 3.02Å; E346-H348 VanDerWaalsContact C-N 3.34Å; E346-H348 PolarHBondContact O-N 3.23Å; H348-Q350 PolarHBondContact O-N 3.39Å; H348-A351 WeakPolarHBondContact O-CB 3.32Å; H348-A351 PolarHBondContact O-N 2.88Å; H348-A351 VanDerWaalsContact O-N 3.14Å; H348-A352 PolarHBondContact O-N 3.31Å
349	F	96.6	Very high	96.8	Very high	14 Å²	14	44.4 Å²	44.4	6%	0.061	21%	0.207	C	C	.	.	H	α-helix	trans	-62.8	-42.2	179.4	-176.1	-127	0	0	0	113	A267 A345 E346 A351 A352 Q353 A372 A373 L376	A267-F349 HydrophobicContact CB-CB 4.34Å; A345-F349 PolarHBondContact O-N 2.88Å; E346-F349 PolarHBondContact O-N 3.39Å; F349-A351 VanDerWaalsContact C-N 3.29Å; F349-A351 PolarHBondContact O-N 3.24Å; F349-A352 WeakPolarHBondContact O-CB 3.47Å; F349-A352 PolarHBondContact O-N 3.29Å; F349-A352 VanDerWaalsContact O-N 3.17Å; F349-Q353 HydrophobicContact CE1-CG 4.3Å; F349-Q353 HydrophobicContact CE2-CG 4.22Å; F349-Q353 HydrophobicContact CZ-CG 4.07Å; F349-Q353 WeakPolarHBondContact O-CG 3.48Å; F349-Q353 PolarHBondContact O-N 3.29Å; F349-A372 HydrophobicContact CE2-CB 4.03Å; F349-A373 HydrophobicContact CE1-CB 4.38Å; F349-A373 HydrophobicContact CZ-CB 3.73Å; F349-L376 HydrophobicContact CB-CD1 3.51Å; F349-L376 HydrophobicContact CD1-CD1 3.95Å; F349-L376 HydrophobicContact CD2-CD1 3.2Å; F349-L376 HydrophobicContact CD2-CG 4.47Å; F349-L376 HydrophobicContact CE1-CD1 4.5Å; F349-L376 HydrophobicContact CE2-CD1 3.85Å; F349-L376 HydrophobicContact CG-CD1 3.26Å; F349-L376 HydrophobicContact CZ-CD1 4.46Å
350	Q	96.4	Very high	96.7	Very high	63 Å²	63	48 Å²	48	29%	0.294	21%	0.213	S	C	.	.	H	α-helix	trans	-62.3	-37	174.5	-69.9	176.7	8.8	0	0	112.2	E346 F347 H348 Q353 R354	E346-Q350 WeakPolarHBondContact O-CG 3.36Å; E346-Q350 PolarHBondContact O-N 2.95Å; E346-Q350 WeakPolarHBondContact OE1-CG 3.45Å; E346-Q350 PolarHBondContact OE1-NE2 2.89Å; F347-Q350 PolarHBondContact O-N 2.74Å; H348-Q350 PolarHBondContact O-N 3.39Å; Q350-Q353 PolarHBondContact O-N 3.45Å; Q350-R354 WeakPolarHBondContact O-CG 3.43Å; Q350-R354 PolarHBondContact O-N 2.89Å
351	A	98.3	Very high	96.5	Very high	6 Å²	6	49.3 Å²	49.3	5%	0.05	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-44	173.2	0	0	0	0	0	111.7	H263 F347 H348 F349 Q353 R354 C355	H263-A351 HydrophobicContact CB-CB 4.33Å; H263-A351 VanDerWaalsContact CE1-CB 3.48Å; H263-A351 WeakPolarHBondContact CE1-CB 3.32Å; H263-A351 WeakPolarHBondContact ND1-CB 3.43Å; F347-A351 PolarHBondContact O-N 3.37Å; H348-A351 WeakPolarHBondContact O-CB 3.32Å; H348-A351 PolarHBondContact O-N 2.88Å; H348-A351 VanDerWaalsContact O-N 3.14Å; F349-A351 VanDerWaalsContact C-N 3.29Å; F349-A351 PolarHBondContact O-N 3.24Å; A351-Q353 VanDerWaalsContact C-N 3.31Å; A351-Q353 PolarHBondContact O-N 3.49Å; A351-R354 PolarHBondContact O-N 3.5Å; A351-R354 VanDerWaalsContact O-N 3.16Å; A351-C355 PolarHBondContact O-N 2.92Å; A351-C355 PolarHBondContact O-SG 3.01Å; A351-C355 VanDerWaalsContact O-SG 3.34Å
352	A	98	Very high	96.3	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.008	23%	0.228	C	C	.	.	H	α-helix	trans	-58	-42.6	174.3	0	0	0	0	0	111.9	F260 H263 L264 H348 F349 C355 L356	F260-A352 HydrophobicContact CD2-CB 3.86Å; F260-A352 HydrophobicContact CE2-CB 4.3Å; H263-A352 HydrophobicContact CB-CB 3.8Å; L264-A352 HydrophobicContact CB-CB 4.41Å; H348-A352 PolarHBondContact O-N 3.31Å; F349-A352 WeakPolarHBondContact O-CB 3.47Å; F349-A352 PolarHBondContact O-N 3.29Å; F349-A352 VanDerWaalsContact O-N 3.17Å; A352-C355 WeakPolarHBondContact O-CB 3.32Å; A352-C355 PolarHBondContact O-N 3.44Å; A352-L356 PolarHBondContact O-N 2.94Å; A352-L356 VanDerWaalsContact O-N 3.15Å
353	Q	96.6	Very high	96.2	Very high	16 Å²	16	48.5 Å²	48.5	8%	0.075	23%	0.226	C	C	.	.	H	α-helix	trans	-61.8	-44.9	175.4	-67.6	178.3	-52.9	0	0	111.9	F349 Q350 A351 C355 L356 F357 L369	F349-Q353 HydrophobicContact CE1-CG 4.3Å; F349-Q353 HydrophobicContact CE2-CG 4.22Å; F349-Q353 HydrophobicContact CZ-CG 4.07Å; F349-Q353 WeakPolarHBondContact O-CG 3.48Å; F349-Q353 PolarHBondContact O-N 3.29Å; Q350-Q353 PolarHBondContact O-N 3.45Å; A351-Q353 VanDerWaalsContact C-N 3.31Å; A351-Q353 PolarHBondContact O-N 3.49Å; Q353-C355 VanDerWaalsContact C-N 3.29Å; Q353-C355 PolarHBondContact O-N 3.24Å; Q353-L356 PolarHBondContact O-N 3.11Å; Q353-L356 VanDerWaalsContact O-N 3.14Å; Q353-F357 HydrophobicContact CB-CE2 3.99Å; Q353-F357 HydrophobicContact CB-CZ 4.4Å; Q353-F357 WeakPolarHBondContact O-CD2 3.5Å; Q353-F357 WeakPolarHBondContact O-CG 3.49Å; Q353-F357 PolarHBondContact O-N 3.36Å; Q353-L369 HydrophobicContact CB-CD2 4.24Å; Q353-L369 HydrophobicContact CG-CD2 3.88Å
354	R	98.2	Very high	96.1	Very high	122 Å²	122	42.2 Å²	42.2	46%	0.46	20%	0.195	S	C	.	.	H	α-helix	trans	-59.2	-39.7	176.8	-73.5	-172.8	-62.9	-91.5	5.1	112.3	Q350 A351 F357 Q358	Q350-R354 WeakPolarHBondContact O-CG 3.43Å; Q350-R354 PolarHBondContact O-N 2.89Å; A351-R354 PolarHBondContact O-N 3.5Å; A351-R354 VanDerWaalsContact O-N 3.16Å; R354-F357 PolarHBondContact O-N 3.38Å; R354-Q358 PolarHBondContact O-NE2 2.92Å
355	C	98.6	Very high	96	Very high	12 Å²	12	42.1 Å²	42.1	8%	0.081	19%	0.193	C	C	.	.	H	α-helix	trans	-61.4	-44.7	174.4	-66.4	0	0	0	0	111.7	N256 F260 A351 A352 Q353 F357 Q358	N256-C355 HydrophobicContact CB-CB 4.47Å; N256-C355 WeakPolarHBondContact O-CB 3.31Å; F260-C355 HydrophobicContact CB-CB 3.82Å; A351-C355 PolarHBondContact O-N 2.92Å; A351-C355 PolarHBondContact O-SG 3.01Å; A351-C355 VanDerWaalsContact O-SG 3.34Å; A352-C355 WeakPolarHBondContact O-CB 3.32Å; A352-C355 PolarHBondContact O-N 3.44Å; Q353-C355 VanDerWaalsContact C-N 3.29Å; Q353-C355 PolarHBondContact O-N 3.24Å; C355-F357 VanDerWaalsContact C-N 3.34Å; C355-F357 PolarHBondContact O-N 2.87Å; C355-Q358 VanDerWaalsContact O-CB 3.28Å; C355-Q358 WeakPolarHBondContact O-CB 3.22Å; C355-Q358 WeakPolarHBondContact O-CG 3.07Å; C355-Q358 PolarHBondContact O-N 3.43Å
356	L	97.1	Very high	95.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-68.5	-29.7	177	-69.7	-173.9	0	0	0	113.4	M257 F260 A352 Q353 Q358 F359 R365 L368 L369	M257-L356 HydrophobicContact SD-CD2 4.39Å; F260-L356 HydrophobicContact CB-CD2 4.22Å; F260-L356 HydrophobicContact CB-CG 4.44Å; F260-L356 HydrophobicContact CD1-CD2 4.02Å; F260-L356 HydrophobicContact CD2-CD1 3.65Å; F260-L356 HydrophobicContact CD2-CD2 3.85Å; F260-L356 HydrophobicContact CD2-CG 3.45Å; F260-L356 VanDerWaalsContact CD2-CG 3.45Å; F260-L356 HydrophobicContact CE1-CD2 4.4Å; F260-L356 HydrophobicContact CE2-CD1 3.39Å; F260-L356 HydrophobicContact CE2-CD2 4.25Å; F260-L356 HydrophobicContact CE2-CG 3.79Å; F260-L356 HydrophobicContact CG-CD1 4.35Å; F260-L356 HydrophobicContact CG-CD2 3.72Å; F260-L356 HydrophobicContact CG-CG 3.87Å; F260-L356 HydrophobicContact CZ-CD1 3.89Å; F260-L356 HydrophobicContact CZ-CG 4.45Å; A352-L356 PolarHBondContact O-N 2.94Å; A352-L356 VanDerWaalsContact O-N 3.15Å; Q353-L356 PolarHBondContact O-N 3.11Å; Q353-L356 VanDerWaalsContact O-N 3.14Å; L356-Q358 PolarHBondContact O-N 3.47Å; L356-F359 HydrophobicContact CD2-CD2 4.47Å; L356-F359 WeakPolarHBondContact O-CB 3.35Å; L356-F359 PolarHBondContact O-N 3.46Å; L356-R365 HydrophobicContact CB-CG 4.43Å; L356-R365 VanDerWaalsContact O-CD 3.26Å; L356-R365 WeakPolarHBondContact O-CD 3.4Å; L356-L368 HydrophobicContact CD1-CB 4.41Å; L356-L368 HydrophobicContact CD1-CD2 3.79Å; L356-L368 HydrophobicContact CD1-CG 3.84Å; L356-L368 HydrophobicContact CD2-CD2 3.69Å; L356-L368 HydrophobicContact CG-CD2 4.43Å; L356-L369 HydrophobicContact CB-CD2 4.19Å; L356-L369 HydrophobicContact CB-CG 4.38Å; L356-L369 HydrophobicContact CD1-CD2 3.68Å; L356-L369 HydrophobicContact CD1-CG 3.71Å
357	F	96.9	Very high	95.8	Very high	79 Å²	79	43.1 Å²	43.1	35%	0.346	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-11.1	173.8	-64.4	-40.1	0	0	0	114.1	L27 Q353 R354 C355 L369	L27-F357 HydrophobicContact CD1-CE2 4.27Å; L27-F357 HydrophobicContact CD1-CZ 3.69Å; Q353-F357 HydrophobicContact CB-CE2 3.99Å; Q353-F357 HydrophobicContact CB-CZ 4.4Å; Q353-F357 WeakPolarHBondContact O-CD2 3.5Å; Q353-F357 WeakPolarHBondContact O-CG 3.49Å; Q353-F357 PolarHBondContact O-N 3.36Å; R354-F357 PolarHBondContact O-N 3.38Å; C355-F357 VanDerWaalsContact C-N 3.34Å; C355-F357 PolarHBondContact O-N 2.87Å; F357-L369 HydrophobicContact CE1-CD1 3.81Å; F357-L369 HydrophobicContact CZ-CD1 4.41Å
358	Q	97.5	Very high	95.7	Very high	76 Å²	76	37.9 Å²	37.9	36%	0.355	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-17.7	168.7	-55.7	-38.1	-64.9	0	0	112.3	W252 H253 N256 R354 C355 L356	W252-Q358 HydrophobicContact CH2-CB 3.45Å; W252-Q358 VanDerWaalsContact CH2-CB 3.45Å; W252-Q358 HydrophobicContact CH2-CG 3.58Å; W252-Q358 HydrophobicContact CZ2-CB 4.11Å; W252-Q358 HydrophobicContact CZ2-CG 3.75Å; W252-Q358 VanDerWaalsContact CZ2-OE1 3.22Å; W252-Q358 HydrophobicContact CZ3-CB 3.76Å; W252-Q358 HydrophobicContact CZ3-CG 4.34Å; H253-Q358 PolarHBondContact NE2-O 3.26Å; N256-Q358 HydrophobicContact CB-CB 4.47Å; N256-Q358 VanDerWaalsContact OD1-CG 3.29Å; N256-Q358 WeakPolarHBondContact OD1-CG 3.42Å; R354-Q358 PolarHBondContact O-NE2 2.92Å; C355-Q358 VanDerWaalsContact O-CB 3.28Å; C355-Q358 WeakPolarHBondContact O-CB 3.22Å; C355-Q358 WeakPolarHBondContact O-CG 3.07Å; C355-Q358 PolarHBondContact O-N 3.43Å; L356-Q358 PolarHBondContact O-N 3.47Å
359	F	96.7	Very high	95.5	Very high	3 Å²	3	38 Å²	38	1%	0.013	17%	0.174	C	C	.	.	S	Bend	trans	-88.6	153.5	173.4	-64.8	-99.5	0	0	0	111	H94 L249 H253 N256 M257 L356 R365	H94-F359 HydrophobicContact CB-CD1 3.92Å; H94-F359 WeakPolarHBondContact ND1-CA 3.32Å; H94-F359 AromaticContact ND1-CD1 3.87Å; L249-F359 HydrophobicContact CD1-CE1 4.22Å; H253-F359 HydrophobicContact CB-CE1 4.1Å; H253-F359 HydrophobicContact CB-CZ 4.06Å; H253-F359 VanDerWaalsContact O-CZ 3.31Å; H253-F359 WeakPolarHBondContact O-CZ 3.31Å; N256-F359 HydrophobicContact CB-CE2 4.13Å; M257-F359 HydrophobicContact CB-CZ 4.04Å; M257-F359 HydrophobicContact CE-CD1 4.45Å; M257-F359 HydrophobicContact CE-CE1 3.83Å; M257-F359 HydrophobicContact CE-CE2 4.04Å; M257-F359 HydrophobicContact CE-CZ 3.61Å; L356-F359 HydrophobicContact CD2-CD2 4.47Å; L356-F359 WeakPolarHBondContact O-CB 3.35Å; L356-F359 PolarHBondContact O-N 3.46Å; F359-R365 PolarHBondContact O-NH1 3.37Å
360	R	93.1	Very high	95.3	Very high	99 Å²	99	38.6 Å²	38.6	37%	0.374	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-61.6	152.8	178.8	-71.2	-176.5	176.1	-164.3	2.2	111.5	H94 C97 N98 S362 R365	H94-R360 PolarHBondContact ND1-N 3.26Å; H94-R360 VanDerWaalsContact ND1-N 3.18Å; C97-R360 VanDerWaalsContact C-NH1 3.29Å; C97-R360 PolarHBondContact O-NH1 3.45Å; N98-R360 PolarHBondContact OD1-NH1 2.85Å; N98-R360 PolarHBondContact OD1-NH2 3.44Å; R360-S362 PolarHBondContact O-N 2.96Å; R360-R365 WeakPolarHBondContact O-CD 3.46Å
361	D	91.5	Very high	95	Very high	93 Å²	93	36.2 Å²	36.2	50%	0.497	17%	0.167	S	C	.	.	P	Polyproline II helix	trans	-62.2	128.3	171.6	-165.5	40.5	0	0	0	110.6	R365 K366	D361-R365 VanDerWaalsContact CB-NH2 3.27Å; D361-R365 VanDerWaalsContact CG-NH2 3.25Å; D361-R365 IonicContact OD1-CZ 3.24Å; D361-R365 IonicContact OD1-NE 3.3Å; D361-R365 IonicContact OD1-NH2 2.86Å; D361-R365 PolarHBondContact OD1-NH2 3.49Å; D361-K366 VanDerWaalsContact OD1-CE 3.26Å; D361-K366 WeakPolarHBondContact OD1-CE 3.47Å; D361-K366 WeakPolarHBondContact OD2-CE 3.23Å; D361-K366 IonicContact OD2-NZ 3.31Å
362	S	92	Very high	94.7	Very high	18 Å²	18	36 Å²	36	13%	0.126	17%	0.165	C	C	.	.			trans	-160.7	156.4	-176.9	59.2	0	0	0	0	109.2	R360 S364 R365 K366	R360-S362 PolarHBondContact O-N 2.96Å; S362-S364 PolarHBondContact O-N 3.24Å; S362-R365 PolarHBondContact O-N 3.25Å; S362-R365 WeakPolarHBondContact OG-CB 3.28Å; S362-R365 PolarHBondContact OG-N 2.9Å; S362-R365 VanDerWaalsContact OG-N 3.16Å; S362-K366 WeakPolarHBondContact O-CG 3.26Å; S362-K366 PolarHBondContact O-N 2.97Å; S362-K366 VanDerWaalsContact O-N 3.09Å
363	L	92.3	Very high	94.3	Very high	61 Å²	61	36 Å²	36	32%	0.319	17%	0.166	S	C	.	.	H	α-helix	trans	-58.6	-38.3	174.7	-62.4	177	0	0	0	111.3	D34 L38 K366 A367	D34-L363 HydrophobicContact CB-CD1 3.49Å; D34-L363 VanDerWaalsContact CB-CD1 3.49Å; D34-L363 HydrophobicContact CB-CD2 3.73Å; D34-L363 HydrophobicContact CB-CG 4.24Å; L38-L363 HydrophobicContact CD1-CB 4.04Å; L363-K366 PolarHBondContact O-N 3.33Å; L363-A367 VanDerWaalsContact O-CB 3.31Å; L363-A367 WeakPolarHBondContact O-CB 3.49Å; L363-A367 PolarHBondContact O-N 2.69Å
364	S	94.2	Very high	93.8	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-61.6	-45.6	176.9	-48.7	0	0	0	0	112.5	A89 S93 S362 A367 L368	A89-S364 VanDerWaalsContact C-CB 3.48Å; A89-S364 PolarHBondContact O-OG 3.35Å; S93-S364 WeakPolarHBondContact OG-CB 3.25Å; S93-S364 PolarHBondContact OG-OG 3.42Å; S362-S364 PolarHBondContact O-N 3.24Å; S364-A367 PolarHBondContact O-N 3.21Å; S364-L368 WeakPolarHBondContact O-CB 3.43Å; S364-L368 PolarHBondContact O-N 3.19Å
365	R	95	Very high	92.9	Very high	33 Å²	33	33.4 Å²	33.4	13%	0.125	16%	0.16	C	C	.	.	H	α-helix	trans	-62.1	-44.7	175.9	-174.3	-174	71	167.8	8.6	111.3	L356 F359 R360 D361 S362 L368 L369	L356-R365 HydrophobicContact CB-CG 4.43Å; L356-R365 VanDerWaalsContact O-CD 3.26Å; L356-R365 WeakPolarHBondContact O-CD 3.4Å; F359-R365 PolarHBondContact O-NH1 3.37Å; R360-R365 WeakPolarHBondContact O-CD 3.46Å; D361-R365 VanDerWaalsContact CB-NH2 3.27Å; D361-R365 VanDerWaalsContact CG-NH2 3.25Å; D361-R365 IonicContact OD1-CZ 3.24Å; D361-R365 IonicContact OD1-NE 3.3Å; D361-R365 IonicContact OD1-NH2 2.86Å; D361-R365 PolarHBondContact OD1-NH2 3.49Å; S362-R365 PolarHBondContact O-N 3.25Å; S362-R365 WeakPolarHBondContact OG-CB 3.28Å; S362-R365 PolarHBondContact OG-N 2.9Å; S362-R365 VanDerWaalsContact OG-N 3.16Å; R365-L368 PolarHBondContact O-N 2.97Å; R365-L369 HydrophobicContact CG-CD1 4.27Å; R365-L369 WeakPolarHBondContact O-CB 3.11Å; R365-L369 WeakPolarHBondContact O-CG 3.24Å; R365-L369 PolarHBondContact O-N 2.97Å
366	K	93.9	Very high	92	Very high	75 Å²	75	34 Å²	34	33%	0.326	16%	0.163	S	C	.	.	H	α-helix	trans	-64	-44.2	177.9	-66.8	179.6	-168	178.2	0	111.8	D32 D361 S362 L363 L369 H370	D32-K366 WeakPolarHBondContact OD2-CD 3.34Å; D32-K366 IonicContact OD2-NZ 3.88Å; D32-K366 PolarHBondContact OD2-NZ 3.04Å; D361-K366 VanDerWaalsContact OD1-CE 3.26Å; D361-K366 WeakPolarHBondContact OD1-CE 3.47Å; D361-K366 WeakPolarHBondContact OD2-CE 3.23Å; D361-K366 IonicContact OD2-NZ 3.31Å; S362-K366 WeakPolarHBondContact O-CG 3.26Å; S362-K366 PolarHBondContact O-N 2.97Å; S362-K366 VanDerWaalsContact O-N 3.09Å; L363-K366 PolarHBondContact O-N 3.33Å; K366-L369 PolarHBondContact O-N 2.74Å; K366-H370 WeakPolarHBondContact O-CB 3.42Å; K366-H370 PolarHBondContact O-N 3.12Å
367	A	93	Very high	91	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.008	18%	0.178	C	C	.	.	H	α-helix	trans	-62.2	-43.4	176.5	0	0	0	0	0	111.8	L38 L86 L363 S364 H370 V371	L38-A367 HydrophobicContact CD2-CB 3.79Å; L86-A367 HydrophobicContact CD2-CB 4.14Å; L363-A367 VanDerWaalsContact O-CB 3.31Å; L363-A367 WeakPolarHBondContact O-CB 3.49Å; L363-A367 PolarHBondContact O-N 2.69Å; S364-A367 PolarHBondContact O-N 3.21Å; A367-H370 PolarHBondContact O-N 2.82Å; A367-V371 WeakPolarHBondContact O-CG2 3.34Å; A367-V371 PolarHBondContact O-N 3.39Å
368	L	95.5	Very high	89.2	Confident	0 Å²	0	38 Å²	38	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.3	-46.2	175.8	-177.8	59.2	0	0	0	112	L83 L86 A87 C90 F260 L356 S364 R365 H370 V371 A372	L83-L368 HydrophobicContact CD2-CD1 3.94Å; L86-L368 HydrophobicContact CB-CB 4.08Å; L86-L368 HydrophobicContact CB-CD1 3.77Å; L86-L368 HydrophobicContact CB-CG 4.44Å; A87-L368 HydrophobicContact CB-CD2 4.27Å; C90-L368 HydrophobicContact CB-CD2 4.2Å; F260-L368 HydrophobicContact CD1-CD2 4.46Å; F260-L368 HydrophobicContact CE1-CD1 3.96Å; F260-L368 HydrophobicContact CE1-CD2 3.77Å; F260-L368 HydrophobicContact CE1-CG 4.07Å; F260-L368 HydrophobicContact CZ-CD1 3.76Å; F260-L368 HydrophobicContact CZ-CD2 3.91Å; F260-L368 HydrophobicContact CZ-CG 3.74Å; L356-L368 HydrophobicContact CD1-CB 4.41Å; L356-L368 HydrophobicContact CD1-CD2 3.79Å; L356-L368 HydrophobicContact CD1-CG 3.84Å; L356-L368 HydrophobicContact CD2-CD2 3.69Å; L356-L368 HydrophobicContact CG-CD2 4.43Å; S364-L368 WeakPolarHBondContact O-CB 3.43Å; S364-L368 PolarHBondContact O-N 3.19Å; R365-L368 PolarHBondContact O-N 2.97Å; L368-H370 VanDerWaalsContact C-N 3.31Å; L368-H370 PolarHBondContact O-N 3.18Å; L368-V371 PolarHBondContact O-N 3.16Å; L368-A372 VanDerWaalsContact O-CB 3.28Å; L368-A372 WeakPolarHBondContact O-CB 3.39Å; L368-A372 PolarHBondContact O-N 3.29Å
369	L	94.1	Very high	86.7	Confident	22 Å²	22	36.1 Å²	36.1	12%	0.115	18%	0.18	C	C	.	.	H	α-helix	trans	-59.1	-41.9	174	-80.2	167.4	0	0	0	111.9	Q353 L356 F357 R365 K366 A372 A373	Q353-L369 HydrophobicContact CB-CD2 4.24Å; Q353-L369 HydrophobicContact CG-CD2 3.88Å; L356-L369 HydrophobicContact CB-CD2 4.19Å; L356-L369 HydrophobicContact CB-CG 4.38Å; L356-L369 HydrophobicContact CD1-CD2 3.68Å; L356-L369 HydrophobicContact CD1-CG 3.71Å; F357-L369 HydrophobicContact CE1-CD1 3.81Å; F357-L369 HydrophobicContact CZ-CD1 4.41Å; R365-L369 HydrophobicContact CG-CD1 4.27Å; R365-L369 WeakPolarHBondContact O-CB 3.11Å; R365-L369 WeakPolarHBondContact O-CG 3.24Å; R365-L369 PolarHBondContact O-N 2.97Å; K366-L369 PolarHBondContact O-N 2.74Å; L369-A372 PolarHBondContact O-N 3.08Å; L369-A373 WeakPolarHBondContact O-CB 3.37Å; L369-A373 PolarHBondContact O-N 2.78Å
370	H	91.5	Very high	83.6	Confident	27 Å²	27	45.6 Å²	45.6	13%	0.125	22%	0.216	C	C	.	.	H	α-helix	trans	-64.3	-47.2	178.7	-178.5	66.6	0	0	0	111.9	P31 K366 A367 L368 A373 N374	P31-H370 VanDerWaalsContact CD-CE1 3.48Å; P31-H370 WeakPolarHBondContact CD-CE1 3.29Å; K366-H370 WeakPolarHBondContact O-CB 3.42Å; K366-H370 PolarHBondContact O-N 3.12Å; A367-H370 PolarHBondContact O-N 2.82Å; L368-H370 VanDerWaalsContact C-N 3.31Å; L368-H370 PolarHBondContact O-N 3.18Å; H370-A373 PolarHBondContact O-N 3.37Å; H370-N374 PolarHBondContact CD2-ND2 3.15Å; H370-N374 PolarHBondContact CE1-ND2 2.92Å; H370-N374 VanDerWaalsContact CE1-ND2 3.25Å; H370-N374 PolarHBondContact NE2-ND2 2.83Å; H370-N374 VanDerWaalsContact O-CG 3.3Å; H370-N374 PolarHBondContact O-N 3.25Å
371	V	91	Very high	83.2	Confident	14 Å²	14	42.9 Å²	42.9	9%	0.085	21%	0.208	C	C	.	.	H	α-helix	trans	-62.5	-44	176	171.3	0	0	0	0	111	L39 L82 L83 L86 A367 L368 A373 N374 F375	L39-V371 HydrophobicContact CD1-CG2 3.49Å; L39-V371 VanDerWaalsContact CD1-CG2 3.49Å; L39-V371 HydrophobicContact CD2-CG2 4.36Å; L82-V371 HydrophobicContact CD2-CG1 3.88Å; L82-V371 HydrophobicContact CD2-CG2 4.15Å; L82-V371 HydrophobicContact CG-CG1 4.28Å; L83-V371 HydrophobicContact CD2-CG1 3.83Å; L83-V371 HydrophobicContact CG-CG1 4.49Å; L86-V371 HydrophobicContact CD1-CB 4.09Å; L86-V371 HydrophobicContact CD1-CG2 3.6Å; A367-V371 WeakPolarHBondContact O-CG2 3.34Å; A367-V371 PolarHBondContact O-N 3.39Å; L368-V371 PolarHBondContact O-N 3.16Å; V371-A373 VanDerWaalsContact C-N 3.35Å; V371-A373 PolarHBondContact O-N 2.74Å; V371-N374 PolarHBondContact O-N 2.64Å; V371-F375 VanDerWaalsContact O-CB 3.32Å; V371-F375 WeakPolarHBondContact O-CB 3.21Å; V371-F375 PolarHBondContact O-N 2.65Å
372	A	91.4	Very high	82.7	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-59.3	-44.2	176.7	0	0	0	0	0	112	F260 L264 F349 L368 L369 F375	F260-A372 HydrophobicContact CE2-CB 4.41Å; L264-A372 HydrophobicContact CD1-CB 3.81Å; L264-A372 HydrophobicContact CD2-CB 3.87Å; F349-A372 HydrophobicContact CE2-CB 4.03Å; L368-A372 VanDerWaalsContact O-CB 3.28Å; L368-A372 WeakPolarHBondContact O-CB 3.39Å; L368-A372 PolarHBondContact O-N 3.29Å; L369-A372 PolarHBondContact O-N 3.08Å; A372-F375 PolarHBondContact O-N 3.42Å
373	A	90.7	Very high	82.2	Confident	2 Å²	2	41.5 Å²	41.5	2%	0.017	20%	0.196	C	C	.	.	H	α-helix	trans	-64	-48.8	176.9	0	0	0	0	0	112.4	F349 L369 H370 V371 F375 L376 Q377	F349-A373 HydrophobicContact CE1-CB 4.38Å; F349-A373 HydrophobicContact CZ-CB 3.73Å; L369-A373 WeakPolarHBondContact O-CB 3.37Å; L369-A373 PolarHBondContact O-N 2.78Å; H370-A373 PolarHBondContact O-N 3.37Å; V371-A373 VanDerWaalsContact C-N 3.35Å; V371-A373 PolarHBondContact O-N 2.74Å; A373-F375 PolarHBondContact O-N 3.04Å; A373-L376 PolarHBondContact O-N 3.16Å; A373-L376 VanDerWaalsContact O-N 3.16Å; A373-Q377 WeakPolarHBondContact O-CG 3.4Å; A373-Q377 PolarHBondContact O-N 3.16Å
374	N	86.1	Confident	81.6	Confident	69 Å²	69	40.4 Å²	40.4	37%	0.369	19%	0.189	S	C	.	.	H	α-helix	trans	-61.7	-34.1	-179.9	-71.6	-13.2	0	0	0	112	H370 V371 L376 Q377	H370-N374 PolarHBondContact CD2-ND2 3.15Å; H370-N374 PolarHBondContact CE1-ND2 2.92Å; H370-N374 VanDerWaalsContact CE1-ND2 3.25Å; H370-N374 PolarHBondContact NE2-ND2 2.83Å; H370-N374 VanDerWaalsContact O-CG 3.3Å; H370-N374 PolarHBondContact O-N 3.25Å; V371-N374 PolarHBondContact O-N 2.64Å; N374-L376 PolarHBondContact O-N 3.35Å; N374-Q377 PolarHBondContact O-N 3.45Å
375	F	78.5	Confident	80.8	Confident	13 Å²	13	42.7 Å²	42.7	6%	0.057	20%	0.199	C	C	.	.	H	α-helix	trans	-65.1	-28.8	179.9	-170.5	-134.4	0	0	0	112.7	V79 F268 V371 A372 A373 R378	V79-F375 HydrophobicContact CB-CD2 4.45Å; V79-F375 HydrophobicContact CB-CE2 3.9Å; V79-F375 HydrophobicContact CB-CZ 4.08Å; V79-F375 HydrophobicContact CG1-CD1 4.12Å; V79-F375 HydrophobicContact CG1-CD2 3.76Å; V79-F375 HydrophobicContact CG1-CE1 3.86Å; V79-F375 HydrophobicContact CG1-CE2 3.51Å; V79-F375 HydrophobicContact CG1-CG 4.06Å; V79-F375 HydrophobicContact CG1-CZ 3.54Å; V79-F375 HydrophobicContact CG2-CD2 4.05Å; V79-F375 HydrophobicContact CG2-CE2 3.63Å; V79-F375 HydrophobicContact CG2-CZ 4.3Å; F268-F375 HydrophobicContact CB-CD1 4.17Å; F268-F375 HydrophobicContact CB-CE1 3.69Å; F268-F375 HydrophobicContact CB-CZ 4.44Å; F268-F375 AromaticContact CD1-CE1 3.9Å; F268-F375 HydrophobicContact CD1-CE1 3.9Å; F268-F375 AromaticContact CD1-CZ 3.85Å; F268-F375 HydrophobicContact CD1-CZ 3.85Å; F268-F375 AromaticContact CD2-CD1 3.53Å; F268-F375 HydrophobicContact CD2-CD1 3.53Å; F268-F375 HydrophobicContact CD2-CD2 4.06Å; F268-F375 AromaticContact CD2-CE1 3.03Å; F268-F375 HydrophobicContact CD2-CE1 3.03Å; F268-F375 AromaticContact CD2-CE2 3.58Å; F268-F375 HydrophobicContact CD2-CE2 3.58Å; F268-F375 HydrophobicContact CD2-CG 4.04Å; F268-F375 AromaticContact CD2-CZ 3.07Å; F268-F375 HydrophobicContact CD2-CZ 3.07Å; F268-F375 HydrophobicContact CE1-CE1 4.34Å; F268-F375 AromaticContact CE1-CZ 3.81Å; F268-F375 HydrophobicContact CE1-CZ 3.81Å; F268-F375 HydrophobicContact CE2-CD1 4.21Å; F268-F375 AromaticContact CE2-CD2 3.95Å; F268-F375 HydrophobicContact CE2-CD2 3.95Å; F268-F375 AromaticContact CE2-CE1 3.58Å; F268-F375 HydrophobicContact CE2-CE1 3.58Å; F268-F375 AromaticContact CE2-CE2 3.21Å; F268-F375 HydrophobicContact CE2-CE2 3.21Å; F268-F375 HydrophobicContact CE2-CG 4.4Å; F268-F375 AromaticContact CE2-CZ 3.02Å; F268-F375 HydrophobicContact CE2-CZ 3.02Å; F268-F375 AromaticContact CG-CD1 3.99Å; F268-F375 HydrophobicContact CG-CD1 3.99Å; F268-F375 AromaticContact CG-CE1 3.21Å; F268-F375 HydrophobicContact CG-CE1 3.21Å; F268-F375 HydrophobicContact CG-CE2 4.42Å; F268-F375 AromaticContact CG-CZ 3.49Å; F268-F375 HydrophobicContact CG-CZ 3.49Å; F268-F375 VanDerWaalsContact CG-CZ 3.49Å; F268-F375 HydrophobicContact CZ-CE1 4.2Å; F268-F375 AromaticContact CZ-CE2 3.81Å; F268-F375 HydrophobicContact CZ-CE2 3.81Å; F268-F375 AromaticContact CZ-CZ 3.42Å; F268-F375 HydrophobicContact CZ-CZ 3.42Å; F268-F375 VanDerWaalsContact CZ-CZ 3.42Å; V371-F375 VanDerWaalsContact O-CB 3.32Å; V371-F375 WeakPolarHBondContact O-CB 3.21Å; V371-F375 PolarHBondContact O-N 2.65Å; A372-F375 PolarHBondContact O-N 3.42Å; A373-F375 PolarHBondContact O-N 3.04Å; F375-R378 WeakPolarHBondContact O-CD 3.43Å; F375-R378 WeakPolarHBondContact O-CG 3.2Å
376	L	80.4	Confident	79.9	Confident	26 Å²	26	43.3 Å²	43.3	14%	0.136	20%	0.204	C	C	.	.	H	α-helix	trans	-88.2	-13.1	176.2	-60.8	178.6	0	0	0	113.8	A267 F268 I271 F349 A373 N374 R378	A267-L376 HydrophobicContact CB-CD1 3.97Å; A267-L376 HydrophobicContact CB-CD2 3.84Å; F268-L376 HydrophobicContact CB-CD2 4.33Å; I271-L376 HydrophobicContact CG1-CD2 4.08Å; F349-L376 HydrophobicContact CB-CD1 3.51Å; F349-L376 HydrophobicContact CD1-CD1 3.95Å; F349-L376 HydrophobicContact CD2-CD1 3.2Å; F349-L376 HydrophobicContact CD2-CG 4.47Å; F349-L376 HydrophobicContact CE1-CD1 4.5Å; F349-L376 HydrophobicContact CE2-CD1 3.85Å; F349-L376 HydrophobicContact CG-CD1 3.26Å; F349-L376 HydrophobicContact CZ-CD1 4.46Å; A373-L376 PolarHBondContact O-N 3.16Å; A373-L376 VanDerWaalsContact O-N 3.16Å; N374-L376 PolarHBondContact O-N 3.35Å; L376-R378 VanDerWaalsContact C-N 3.27Å; L376-R378 PolarHBondContact O-N 3.41Å
377	Q	74.7	Confident	78.9	Confident	68 Å²	68	41.1 Å²	41.1	32%	0.318	20%	0.196	S	C	.	.			trans	-86.6	14.2	-178.8	-70.8	178.7	11.3	0	0	114	A373 N374 G379 R380	A373-Q377 WeakPolarHBondContact O-CG 3.4Å; A373-Q377 PolarHBondContact O-N 3.16Å; N374-Q377 PolarHBondContact O-N 3.45Å; Q377-G379 PolarHBondContact O-N 3.22Å; Q377-R380 PolarHBondContact O-N 2.87Å
378	R	60.4	Low	77.8	Confident	93 Å²	93	44.2 Å²	44.2	35%	0.351	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-8.9	-170.9	-77.5	178.9	169.8	-168.7	0.6	117.2	L275 F375 L376	L275-R378 HydrophobicContact CD1-CB 4.16Å; F375-R378 WeakPolarHBondContact O-CD 3.43Å; F375-R378 WeakPolarHBondContact O-CG 3.2Å; L376-R378 VanDerWaalsContact C-N 3.27Å; L376-R378 PolarHBondContact O-N 3.41Å
379	G	44.3	Very low	76.3	Confident	38 Å²	38	47.8 Å²	47.8	39%	0.392	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-137	42.1	177.3	0	0	0	0	0	113.8	Q377	Q377-G379 PolarHBondContact O-N 3.22Å
380	R	32.6	Very low	74.7	Confident	201 Å²	201	50.2 Å²	50.2	76%	0.758	24%	0.238	S	C	*	.			trans	-98.3	0	165.9	-75	-170.7	-178.9	-177.8	2	111.4	Q377	Q377-R380 PolarHBondContact O-N 2.87Å

Retrieved 380 of 380 residues in 196.9 ms (Link to these results)

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