A0A096M4X5_POEFO Loading...

Interleukin enhancer binding factor 2

AlphaFold DB , UniProt , Accession A0A096M4X5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 393 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.3	Very low	32.8	Very low	238 Å²	238	160.4 Å²	160.4	100%	1.172	88%	0.875	S	S	*	*				0	122.6	0	-96.7	176.1	169.7	0	0	108.1
2	R	35.6	Very low	32.6	Very low	253 Å²	253	167.8 Å²	167.8	96%	0.955	88%	0.88	S	S	*	*			trans	42.5	124.1	154	-60	-178.4	177.5	-169.8	-0.7	118.5
3	G	32.2	Very low	32.6	Very low	77 Å²	77	171.2 Å²	171.2	79%	0.794	88%	0.884	S	S	*	*			cis	116.3	119.5	13.7	0	0	0	0	0	111.3
4	D	33.1	Very low	32.5	Very low	144 Å²	144	164.1 Å²	164.1	77%	0.77	88%	0.875	S	S	*	*			trans	-166.3	109	146.8	-125	-2.1	0	0	0	107.9
5	R	36.7	Very low	32.6	Very low	241 Å²	241	158.1 Å²	158.1	91%	0.909	87%	0.866	S	S	*	*				50.6	124.3	92.1	-64	-179.9	178.7	175.8	0.6	113
6	G	31.4	Very low	32.7	Very low	70 Å²	70	163.9 Å²	163.9	72%	0.722	87%	0.872	S	S	*	*			cis	152	144.1	4.8	0	0	0	0	0	109
7	R	33.7	Very low	32.7	Very low	261 Å²	261	158.8 Å²	158.8	99%	0.985	87%	0.867	S	S	*	*			trans	170.7	122	141.4	-99.8	178	179.7	-172.9	0.9	110.7
8	G	30.3	Very low	32.7	Very low	77 Å²	77	153.3 Å²	153.3	79%	0.794	85%	0.853	S	S	*	*			trans	-92.6	160.1	168.8	0	0	0	0	0	113.1
9	R	33.1	Very low	32.9	Very low	250 Å²	250	154.7 Å²	154.7	94%	0.943	86%	0.857	S	S	*	*			trans	-178.6	116.2	148.7	-108.2	179.8	171.7	-174.4	-3	104.1
10	G	31	Very low	33.5	Very low	80 Å²	80	153.4 Å²	153.4	83%	0.825	85%	0.853	S	S	*	*				81.6	56.8	58.5	0	0	0	0	0	109.6
11	G	29.4	Very low	34.1	Very low	73 Å²	73	153.6 Å²	153.6	75%	0.753	85%	0.848	S	S	*	*			trans	-95.5	94.2	174.7	0	0	0	0	0	110.4	F13	G11-F13 PolarHBondContact O-N 3.48Å
12	R	30.3	Very low	34.4	Very low	249 Å²	249	145.3 Å²	145.3	94%	0.94	82%	0.824	S	S	*	*			trans	-60.7	107.8	165.1	-94.6	174.3	166.5	176.1	-4.9	108.4	G14	R12-G14 PolarHBondContact O-N 2.86Å
13	F	33.4	Very low	34.8	Very low	212 Å²	212	143.8 Å²	143.8	93%	0.93	82%	0.819	S	S	*	*			trans	-75.8	100.5	154.6	-100.6	-90.2	0	0	0	107.2	G11 G15	G11-F13 PolarHBondContact O-N 3.48Å; F13-G15 VanDerWaalsContact C-N 3.32Å; F13-G15 PolarHBondContact O-N 3.35Å
14	G	30.7	Very low	35.9	Very low	73 Å²	73	151.2 Å²	151.2	75%	0.753	82%	0.824	S	S	*	*			trans	-69.4	90.6	168.2	0	0	0	0	0	109.1	R12 R16	R12-G14 PolarHBondContact O-N 2.86Å; G14-R16 PolarHBondContact O-N 3.35Å; G14-R16 VanDerWaalsContact O-N 3.11Å
15	G	33.6	Very low	37.4	Very low	73 Å²	73	149.1 Å²	149.1	75%	0.753	82%	0.818	S	S	*	*			trans	-68.4	100.4	161.5	0	0	0	0	0	108.1	F13 G17	F13-G15 VanDerWaalsContact C-N 3.32Å; F13-G15 PolarHBondContact O-N 3.35Å; G15-G17 VanDerWaalsContact C-N 3.34Å; G15-G17 PolarHBondContact O-N 2.83Å
16	R	34.4	Very low	39	Very low	252 Å²	252	143 Å²	143	95%	0.951	80%	0.798	S	S	*	*			trans	-59.4	102.7	161.3	-96.5	-180	169.1	176.7	-4	106.5	G14 G18	G14-R16 PolarHBondContact O-N 3.35Å; G14-R16 VanDerWaalsContact O-N 3.11Å; R16-G18 PolarHBondContact O-N 3.23Å
17	G	33.3	Very low	41.1	Very low	76 Å²	76	145.2 Å²	145.2	78%	0.784	80%	0.797	S	S	*	*			trans	-64.8	98.7	170.6	0	0	0	0	0	109.3	G15	G15-G17 VanDerWaalsContact C-N 3.34Å; G15-G17 PolarHBondContact O-N 2.83Å
18	G	32.8	Very low	43.4	Very low	60 Å²	60	136.5 Å²	136.5	62%	0.619	77%	0.774	S	S	*	*			trans	-70	129.3	153.2	0	0	0	0	0	107.9	R16 V20	R16-G18 PolarHBondContact O-N 3.23Å; G18-V20 VanDerWaalsContact C-N 3.26Å; G18-V20 PolarHBondContact O-N 3.48Å
19	L	36.3	Very low	46.3	Very low	180 Å²	180	138.3 Å²	138.3	94%	0.942	76%	0.762	S	S	*	*			trans	-64.3	86.4	174.3	-78.3	151.8	0	0	0	109	Q21	L19-Q21 PolarHBondContact O-N 3.48Å; L19-Q21 VanDerWaalsContact O-N 3.09Å
20	V	45	Very low	49.3	Very low	128 Å²	128	132.8 Å²	132.8	78%	0.776	75%	0.75	S	S	*	*			trans	-62	113.1	162.9	-177.3	0	0	0	0	106	G18 G22	G18-V20 VanDerWaalsContact C-N 3.26Å; G18-V20 PolarHBondContact O-N 3.48Å; V20-G22 PolarHBondContact O-N 3.34Å
21	Q	45.8	Very low	52.4	Low	159 Å²	159	129.7 Å²	129.7	74%	0.743	72%	0.715	S	S	*	*			trans	-40.4	116.3	175	-155.1	173.6	26.9	0	0	109	L19 Y23	L19-Q21 PolarHBondContact O-N 3.48Å; L19-Q21 VanDerWaalsContact O-N 3.09Å; Q21-Y23 PolarHBondContact O-N 2.92Å
22	G	40.9	Very low	55.7	Low	64 Å²	64	131.4 Å²	131.4	66%	0.66	70%	0.702	S	S	*	*			trans	-51.7	112.9	-157.8	0	0	0	0	0	113.8	V20 R24	V20-G22 PolarHBondContact O-N 3.34Å; G22-R24 PolarHBondContact O-N 3.36Å
23	Y	44.7	Very low	58.9	Low	220 Å²	220	120.6 Å²	120.6	86%	0.863	66%	0.663	S	S	*	*			trans	-63.6	89.8	163.9	-143.2	-89.8	0	0	0	107.1	Q21 P25	Q21-Y23 PolarHBondContact O-N 2.92Å; Y23-P25 WeakPolarHBondContact O-CD 3.21Å
24	R	55	Low	61.9	Low	234 Å²	234	112 Å²	112	88%	0.883	63%	0.625	S	S	*	*			trans	-72.2	113.1	171.1	-71.3	-163	-176.3	-158.8	3.7	106.6	G22 F26	G22-R24 PolarHBondContact O-N 3.36Å; R24-F26 PolarHBondContact O-N 2.92Å
25	P	64.6	Low	65	Low	99 Å²	99	109.2 Å²	109.2	64%	0.643	59%	0.592	S	S	*	*			trans	-59	134.5	175.8	23.5	-30.9	0	0	0	108.8	Y23 V27	Y23-P25 WeakPolarHBondContact O-CD 3.21Å; P25-V27 PolarHBondContact O-N 3.39Å
26	F	70.4	Confident	67.9	Low	113 Å²	113	109.4 Å²	109.4	50%	0.496	58%	0.578	S	S	.	*			trans	-59.2	112.7	171.4	173	-103.5	0	0	0	108.3	R24 P28	R24-F26 PolarHBondContact O-N 2.92Å; F26-P28 HydrophobicContact CD1-CB 4.43Å; F26-P28 HydrophobicContact CE1-CB 3.79Å; F26-P28 HydrophobicContact CZ-CB 4.4Å; F26-P28 VanDerWaalsContact O-CD 3.29Å; F26-P28 WeakPolarHBondContact O-CD 3.25Å
27	V	74.7	Confident	70.8	Confident	116 Å²	116	99.4 Å²	99.4	70%	0.703	55%	0.546	S	S	*	.			trans	-92.6	106.7	172.2	-178.6	0	0	0	0	106.8	P25 H29	P25-V27 PolarHBondContact O-N 3.39Å; V27-H29 PolarHBondContact O-N 3.37Å; V27-H29 VanDerWaalsContact O-N 3.16Å
28	P	81.2	Confident	73.6	Confident	78 Å²	78	100 Å²	100	51%	0.506	53%	0.529	S	S	.	.			trans	-61.1	119.4	-178.4	21	-30.1	0	0	0	110.5	F26 V285	F26-P28 HydrophobicContact CD1-CB 4.43Å; F26-P28 HydrophobicContact CE1-CB 3.79Å; F26-P28 HydrophobicContact CZ-CB 4.4Å; F26-P28 VanDerWaalsContact O-CD 3.29Å; F26-P28 WeakPolarHBondContact O-CD 3.25Å; P28-V285 HydrophobicContact CB-CG1 3.34Å
29	H	92.3	Very high	76.5	Confident	116 Å²	116	106.2 Å²	106.2	54%	0.537	54%	0.544	S	S	.	.	B	Isolated β-bridge	trans	-98.5	131	172.6	-178.1	64.3	0	0	0	109.7	V27 P31 G283 S284 V285	V27-H29 PolarHBondContact O-N 3.37Å; V27-H29 VanDerWaalsContact O-N 3.16Å; H29-P31 WeakPolarHBondContact O-CD 2.94Å; H29-G283 WeakPolarHBondContact CB-O 3.43Å; H29-G283 PolarHBondContact N-O 3.34Å; H29-S284 CarbonylContact O-C 3.48Å; H29-S284 WeakPolarHBondContact O-CA 3.33Å; H29-V285 PolarHBondContact O-N 3.34Å
30	I	95.1	Very high	79.4	Confident	134 Å²	134	101.1 Å²	101.1	69%	0.687	53%	0.528	S	S	*	.			trans	-94.2	110	169.4	-55.9	179.4	0	0	0	106.5	V285	I30-V285 HydrophobicContact CB-CG2 4.4Å; I30-V285 HydrophobicContact CG1-CG1 4.31Å; I30-V285 HydrophobicContact CG1-CG2 3.88Å
31	P	96.6	Very high	81.8	Confident	15 Å²	15	99.8 Å²	99.8	10%	0.097	51%	0.512	C	S	.	.			trans	-63.3	160.1	179.3	-23.4	36.7	0	0	0	112	H29 D33 A277 S284	H29-P31 WeakPolarHBondContact O-CD 2.94Å; P31-D33 PolarHBondContact O-N 2.91Å; P31-A277 WeakPolarHBondContact CB-O 3.21Å; P31-S284 VanDerWaalsContact CD-OG 3.31Å; P31-S284 WeakPolarHBondContact CD-OG 3.12Å; P31-S284 WeakPolarHBondContact CG-OG 3.37Å
32	F	98	Very high	84.1	Confident	108 Å²	108	97.3 Å²	97.3	47%	0.474	51%	0.509	S	S	.	.			trans	-61.3	131.8	179.8	178.3	-99.4	0	0	0	111.9	F34 C37 F41 A277	F32-F34 HydrophobicContact CE1-CB 3.98Å; F32-F34 HydrophobicContact CZ-CB 4.1Å; F32-C37 VanDerWaalsContact CE2-SG 3.59Å; F32-F41 HydrophobicContact CE2-CD2 4.49Å; F32-F41 AromaticContact CE2-CE2 3.56Å; F32-F41 HydrophobicContact CE2-CE2 3.56Å; F32-F41 AromaticContact CE2-CZ 3.65Å; F32-F41 HydrophobicContact CE2-CZ 3.65Å; F32-F41 HydrophobicContact CZ-CD2 4.43Å; F32-F41 AromaticContact CZ-CE2 3.85Å; F32-F41 HydrophobicContact CZ-CE2 3.85Å; F32-F41 AromaticContact CZ-CZ 3.9Å; F32-F41 HydrophobicContact CZ-CZ 3.9Å; F32-A277 VanDerWaalsContact O-CB 3.27Å; F32-A277 WeakPolarHBondContact O-CB 3.36Å
33	D	97.9	Very high	86.6	Confident	23 Å²	23	99.6 Å²	99.6	12%	0.123	50%	0.498	C	S	.	.			trans	-136	112.5	168.6	-176.8	-13.3	0	0	0	109.1	P31 Y35 V36 C37 R270	P31-D33 PolarHBondContact O-N 2.91Å; D33-Y35 PolarHBondContact O-N 2.79Å; D33-Y35 PolarHBondContact OD1-N 3.33Å; D33-V36 HydrophobicContact CB-CB 4.36Å; D33-V36 HydrophobicContact CB-CG2 3.96Å; D33-V36 PolarHBondContact O-N 2.98Å; D33-V36 VanDerWaalsContact O-N 3.13Å; D33-C37 PolarHBondContact O-SG 3.43Å; D33-R270 IonicContact OD1-NE 3.73Å; D33-R270 PolarHBondContact OD1-NE 3.07Å; D33-R270 IonicContact OD1-NH2 3.88Å; D33-R270 IonicContact OD2-CZ 3.99Å; D33-R270 VanDerWaalsContact OD2-CZ 3.26Å; D33-R270 IonicContact OD2-NE 3.27Å; D33-R270 PolarHBondContact OD2-NE 2.79Å; D33-R270 IonicContact OD2-NH2 3.85Å; D33-R270 PolarHBondContact OD2-NH2 3.44Å
34	F	96.7	Very high	89.1	Confident	32 Å²	32	96 Å²	96	14%	0.14	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-52.5	-39.7	180	172.3	-95.6	0	0	0	112.1	F32 V36 C37 E38 F41	F32-F34 HydrophobicContact CE1-CB 3.98Å; F32-F34 HydrophobicContact CZ-CB 4.1Å; F34-V36 VanDerWaalsContact C-N 3.27Å; F34-V36 PolarHBondContact O-N 2.94Å; F34-C37 CarbonylContact O-C 3.36Å; F34-C37 PolarHBondContact O-N 3.27Å; F34-C37 VanDerWaalsContact O-N 3.17Å; F34-E38 HydrophobicContact CE1-CB 4.28Å; F34-E38 HydrophobicContact CE1-CG 3.87Å; F34-E38 HydrophobicContact CZ-CB 4.32Å; F34-E38 HydrophobicContact CZ-CG 3.72Å; F34-E38 WeakPolarHBondContact O-CA 3.39Å; F34-E38 PolarHBondContact O-N 3.28Å; F34-F41 HydrophobicContact CD2-CB 4.12Å; F34-F41 HydrophobicContact CD2-CD2 4.48Å; F34-F41 HydrophobicContact CD2-CG 4.33Å; F34-F41 HydrophobicContact CE2-CB 3.59Å; F34-F41 HydrophobicContact CE2-CG 4.28Å
35	Y	95.8	Very high	91	Very high	14 Å²	14	92.9 Å²	92.9	6%	0.055	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-78.8	-10.5	-173.3	-63.2	-83.7	0	0	0	113.6	D33 P257 L262 V266 R270	D33-Y35 PolarHBondContact O-N 2.79Å; D33-Y35 PolarHBondContact OD1-N 3.33Å; Y35-P257 WeakPolarHBondContact O-CD 3.22Å; Y35-L262 HydrophobicContact CD1-CD1 4.06Å; Y35-L262 HydrophobicContact CG-CD1 4.26Å; Y35-V266 HydrophobicContact CD1-CG1 3.96Å; Y35-V266 HydrophobicContact CE1-CG1 3.24Å; Y35-R270 HydrophobicContact CD2-CB 3.7Å; Y35-R270 HydrophobicContact CD2-CG 3.36Å; Y35-R270 HydrophobicContact CE2-CB 3.47Å; Y35-R270 VanDerWaalsContact CE2-CB 3.47Å; Y35-R270 HydrophobicContact CE2-CG 3.69Å; Y35-R270 HydrophobicContact CG-CG 4.19Å
36	V	95.4	Very high	92.3	Very high	76 Å²	76	93.9 Å²	93.9	46%	0.461	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-85.4	-25.4	170.4	178.2	0	0	0	0	111.2	D33 F34 P257	D33-V36 HydrophobicContact CB-CB 4.36Å; D33-V36 HydrophobicContact CB-CG2 3.96Å; D33-V36 PolarHBondContact O-N 2.98Å; D33-V36 VanDerWaalsContact O-N 3.13Å; F34-V36 VanDerWaalsContact C-N 3.27Å; F34-V36 PolarHBondContact O-N 2.94Å; V36-P257 WeakPolarHBondContact O-CG 3.29Å
37	C	94.9	Very high	93.1	Very high	42 Å²	42	92.6 Å²	92.6	28%	0.284	50%	0.495	S	S	.	.	S	Bend	trans	-128.1	28.2	-173.8	61.8	0	0	0	0	113.5	F32 D33 F34 M39 A40	F32-C37 VanDerWaalsContact CE2-SG 3.59Å; D33-C37 PolarHBondContact O-SG 3.43Å; F34-C37 CarbonylContact O-C 3.36Å; F34-C37 PolarHBondContact O-N 3.27Å; F34-C37 VanDerWaalsContact O-N 3.17Å; C37-M39 PolarHBondContact O-N 3.45Å; C37-A40 WeakPolarHBondContact O-CB 3.48Å; C37-A40 PolarHBondContact O-N 3.26Å
38	E	92.6	Very high	93.9	Very high	89 Å²	89	91.9 Å²	91.9	42%	0.416	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-55.5	-32.3	-174.9	-178.3	166.5	-151.7	0	0	112.7	F34 A40 F41 R43	F34-E38 HydrophobicContact CE1-CB 4.28Å; F34-E38 HydrophobicContact CE1-CG 3.87Å; F34-E38 HydrophobicContact CZ-CB 4.32Å; F34-E38 HydrophobicContact CZ-CG 3.72Å; F34-E38 WeakPolarHBondContact O-CA 3.39Å; F34-E38 PolarHBondContact O-N 3.28Å; E38-A40 PolarHBondContact O-N 3.46Å; E38-F41 CarbonylContact O-C 3.35Å; E38-F41 PolarHBondContact O-N 3.33Å; E38-R43 IonicContact OE1-NE 2.88Å; E38-R43 IonicContact OE1-NH2 2.8Å
39	M	93.1	Very high	94.5	Very high	190 Å²	190	94.4 Å²	94.4	94%	0.936	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-60.8	-25.7	175.3	-65.3	-171.8	71.7	0	0	114	C37 F41	C37-M39 PolarHBondContact O-N 3.45Å; M39-F41 VanDerWaalsContact C-N 3.3Å
40	A	96.9	Very high	94.7	Very high	73 Å²	73	90.3 Å²	90.3	60%	0.603	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-80.4	-12.5	175.3	0	0	0	0	0	112.8	C37 E38 P42	C37-A40 WeakPolarHBondContact O-CB 3.48Å; C37-A40 PolarHBondContact O-N 3.26Å; E38-A40 PolarHBondContact O-N 3.46Å; A40-P42 VanDerWaalsContact C-CD 3.42Å; A40-P42 WeakPolarHBondContact O-CD 3.33Å
41	F	95.9	Very high	94.8	Very high	101 Å²	101	87.3 Å²	87.3	44%	0.443	47%	0.471	S	S	.	.	S	Bend	trans	-125	64.1	-177.3	-64.7	-90.1	0	0	0	111.1	F32 F34 E38 M39 R43	F32-F41 HydrophobicContact CE2-CD2 4.49Å; F32-F41 AromaticContact CE2-CE2 3.56Å; F32-F41 HydrophobicContact CE2-CE2 3.56Å; F32-F41 AromaticContact CE2-CZ 3.65Å; F32-F41 HydrophobicContact CE2-CZ 3.65Å; F32-F41 HydrophobicContact CZ-CD2 4.43Å; F32-F41 AromaticContact CZ-CE2 3.85Å; F32-F41 HydrophobicContact CZ-CE2 3.85Å; F32-F41 AromaticContact CZ-CZ 3.9Å; F32-F41 HydrophobicContact CZ-CZ 3.9Å; F34-F41 HydrophobicContact CD2-CB 4.12Å; F34-F41 HydrophobicContact CD2-CD2 4.48Å; F34-F41 HydrophobicContact CD2-CG 4.33Å; F34-F41 HydrophobicContact CE2-CB 3.59Å; F34-F41 HydrophobicContact CE2-CG 4.28Å; E38-F41 CarbonylContact O-C 3.35Å; E38-F41 PolarHBondContact O-N 3.33Å; M39-F41 VanDerWaalsContact C-N 3.3Å; F41-R43 PolarHBondContact O-N 3.17Å
42	P	94.2	Very high	94.9	Very high	106 Å²	106	88.6 Å²	88.6	69%	0.688	48%	0.483	S	S	*	.			trans	-59.7	129.9	178.7	26.6	-34.4	0	0	0	110.2	A40 V44	A40-P42 VanDerWaalsContact C-CD 3.42Å; A40-P42 WeakPolarHBondContact O-CD 3.33Å; P42-V44 PolarHBondContact O-N 3.16Å
43	R	93.1	Very high	94.9	Very high	113 Å²	113	83.8 Å²	83.8	43%	0.426	46%	0.462	S	S	.	.			trans	-71.8	128.9	-178.8	-61.6	-177.4	178.5	-86.9	-4.3	110.3	E38 F41 K45 M47	E38-R43 IonicContact OE1-NE 2.88Å; E38-R43 IonicContact OE1-NH2 2.8Å; F41-R43 PolarHBondContact O-N 3.17Å; R43-K45 VanDerWaalsContact C-N 3.33Å; R43-K45 VanDerWaalsContact CB-O 3.32Å; R43-K45 WeakPolarHBondContact CB-O 3.46Å; R43-M47 PolarHBondContact NH2-SD 2.96Å; R43-M47 VanDerWaalsContact NH2-SD 3.37Å
44	V	96.6	Very high	94.9	Very high	144 Å²	144	84.2 Å²	84.2	87%	0.873	47%	0.467	S	S	*	.	S	Bend	trans	-71.6	-31.8	174.9	179.6	0	0	0	0	111.6	P42	P42-V44 PolarHBondContact O-N 3.16Å
45	K	94.9	Very high	95	Very high	168 Å²	168	88.6 Å²	88.6	73%	0.73	49%	0.487	S	S	*	.	S	Bend	trans	-125.8	151.8	176.7	-63.7	-178.3	-177.4	178.3	0	109.5	R43	R43-K45 VanDerWaalsContact C-N 3.33Å; R43-K45 VanDerWaalsContact CB-O 3.32Å; R43-K45 WeakPolarHBondContact CB-O 3.46Å
46	P	91.5	Very high	95.1	Very high	121 Å²	121	88.6 Å²	88.6	79%	0.786	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-53.1	155.6	170.7	-23.9	33.9	0	0	0	111.6
47	M	88.5	Confident	95.3	Very high	86 Å²	86	85 Å²	85	42%	0.424	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-60.2	143	171.9	-70.6	-133.5	-60.8	0	0	110.3	R43 V266	R43-M47 PolarHBondContact NH2-SD 2.96Å; R43-M47 VanDerWaalsContact NH2-SD 3.37Å; M47-V266 HydrophobicContact CE-CG2 4.46Å
48	P	90.9	Very high	95.5	Very high	100 Å²	100	87.9 Å²	87.9	65%	0.649	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-54.5	152.3	166.6	-22.1	33.5	0	0	0	110.7	E50	P48-E50 PolarHBondContact O-N 3.2Å
49	D	94.3	Very high	95.8	Very high	132 Å²	132	88.8 Å²	88.8	71%	0.706	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-65.9	119.6	170.5	176.6	38.6	0	0	0	109.8	T51	D49-T51 WeakPolarHBondContact OD1-CB 3.22Å; D49-T51 PolarHBondContact OD1-N 3.01Å; D49-T51 VanDerWaalsContact OD1-N 3.11Å; D49-T51 PolarHBondContact OD1-OG1 2.96Å
50	E	96.2	Very high	96	Very high	29 Å²	29	81.9 Å²	81.9	14%	0.136	45%	0.446	C	S	.	.			trans	-110.6	21.7	178.1	-66.4	-166.9	162.5	0	0	111.9	P48 A52 F53 S54 N265 R269	P48-E50 PolarHBondContact O-N 3.2Å; E50-A52 VanDerWaalsContact C-N 3.35Å; E50-A52 PolarHBondContact O-N 3.1Å; E50-F53 HydrophobicContact CB-CB 4.38Å; E50-F53 PolarHBondContact O-N 3.42Å; E50-S54 PolarHBondContact O-N 3.13Å; E50-S54 PolarHBondContact O-OG 3.21Å; E50-N265 PolarHBondContact OE2-ND2 3.02Å; E50-R269 IonicContact OE1-CZ 2.67Å; E50-R269 IonicContact OE1-NE 3.26Å; E50-R269 PolarHBondContact OE1-NE 2.96Å; E50-R269 IonicContact OE1-NH2 3.84Å; E50-R269 PolarHBondContact OE1-NH2 3.5Å
51	T	97.4	Very high	96.1	Very high	71 Å²	71	79.4 Å²	79.4	44%	0.436	42%	0.422	S	S	.	.	H	α-helix	trans	-56.2	-48.7	178.3	-61.7	0	0	0	0	111.2	D49 F53 S54 E55	D49-T51 WeakPolarHBondContact OD1-CB 3.22Å; D49-T51 PolarHBondContact OD1-N 3.01Å; D49-T51 VanDerWaalsContact OD1-N 3.11Å; D49-T51 PolarHBondContact OD1-OG1 2.96Å; T51-F53 VanDerWaalsContact C-N 3.31Å; T51-F53 PolarHBondContact O-N 3.07Å; T51-S54 WeakPolarHBondContact O-CB 3.37Å; T51-S54 PolarHBondContact O-N 3.42Å; T51-S54 VanDerWaalsContact O-N 3.13Å; T51-E55 WeakPolarHBondContact O-CG 3.22Å; T51-E55 PolarHBondContact O-N 3.06Å
52	A	97.8	Very high	96.2	Very high	43 Å²	43	81.5 Å²	81.5	36%	0.355	43%	0.434	S	S	.	.	H	α-helix	trans	-62.3	-35.2	178.8	0	0	0	0	0	113.4	E50 C56	E50-A52 VanDerWaalsContact C-N 3.35Å; E50-A52 PolarHBondContact O-N 3.1Å; A52-C56 WeakPolarHBondContact O-CB 3.33Å; A52-C56 PolarHBondContact O-N 2.97Å; A52-C56 PolarHBondContact O-SG 2.83Å
53	F	98.3	Very high	96.4	Very high	6 Å²	6	80.4 Å²	80.4	3%	0.026	42%	0.422	C	S	.	.	H	α-helix	trans	-68.5	-43.4	175.2	175.2	-144.3	0	0	0	110.8	E50 T51 E55 C56 L57 N265 Y268 L321 Y326 L330	E50-F53 HydrophobicContact CB-CB 4.38Å; E50-F53 PolarHBondContact O-N 3.42Å; T51-F53 VanDerWaalsContact C-N 3.31Å; T51-F53 PolarHBondContact O-N 3.07Å; F53-E55 PolarHBondContact O-N 3.24Å; F53-C56 PolarHBondContact O-N 3.08Å; F53-L57 HydrophobicContact CD1-CD1 4.3Å; F53-L57 HydrophobicContact CD2-CD1 3.93Å; F53-L57 HydrophobicContact CD2-CG 3.98Å; F53-L57 HydrophobicContact CE1-CD1 3.99Å; F53-L57 HydrophobicContact CE2-CD1 3.59Å; F53-L57 HydrophobicContact CE2-CD2 3.86Å; F53-L57 HydrophobicContact CE2-CG 3.63Å; F53-L57 HydrophobicContact CG-CD1 4.28Å; F53-L57 HydrophobicContact CZ-CD1 3.63Å; F53-L57 HydrophobicContact CZ-CD2 4.21Å; F53-L57 HydrophobicContact CZ-CG 4.13Å; F53-L57 WeakPolarHBondContact O-CG 3.2Å; F53-L57 PolarHBondContact O-N 2.94Å; F53-N265 HydrophobicContact CD1-CB 3.66Å; F53-N265 HydrophobicContact CE1-CB 3.8Å; F53-N265 HydrophobicContact CG-CB 4.49Å; F53-Y268 AromaticContact CZ-CD1 3.84Å; F53-Y268 HydrophobicContact CZ-CD1 3.84Å; F53-Y268 HydrophobicContact CZ-CG 4.3Å; F53-L321 HydrophobicContact CE1-CD1 4.23Å; F53-L321 HydrophobicContact CE2-CD1 4.18Å; F53-L321 HydrophobicContact CZ-CD1 3.89Å; F53-L321 HydrophobicContact CZ-CD2 4.47Å; F53-Y326 HydrophobicContact CB-CD1 4.36Å; F53-Y326 HydrophobicContact CB-CD2 4.31Å; F53-Y326 HydrophobicContact CB-CG 4.24Å; F53-Y326 VanDerWaalsContact CD2-CB 3.48Å; F53-Y326 AromaticContact CD2-CD2 3.9Å; F53-Y326 HydrophobicContact CD2-CD2 3.9Å; F53-Y326 AromaticContact CD2-CG 3.73Å; F53-Y326 HydrophobicContact CD2-CG 3.73Å; F53-Y326 HydrophobicContact CE2-CG 4.46Å; F53-Y326 HydrophobicContact CG-CG 4.23Å; F53-L330 HydrophobicContact CD2-CD1 4.33Å; F53-L330 HydrophobicContact CE2-CD1 4.13Å
54	S	98.2	Very high	96.7	Very high	32 Å²	32	75.9 Å²	75.9	22%	0.224	41%	0.406	C	S	.	.	H	α-helix	trans	-60.2	-44.6	176.8	-57.3	0	0	0	0	111.8	E50 T51 C56 L57 L58 N265	E50-S54 PolarHBondContact O-N 3.13Å; E50-S54 PolarHBondContact O-OG 3.21Å; T51-S54 WeakPolarHBondContact O-CB 3.37Å; T51-S54 PolarHBondContact O-N 3.42Å; T51-S54 VanDerWaalsContact O-N 3.13Å; S54-C56 PolarHBondContact O-N 2.9Å; S54-L57 PolarHBondContact O-N 3.36Å; S54-L58 WeakPolarHBondContact O-CG 3.24Å; S54-L58 PolarHBondContact O-N 2.92Å; S54-N265 WeakPolarHBondContact OG-CB 3.38Å
55	E	98.5	Very high	96.7	Very high	124 Å²	124	70.5 Å²	70.5	58%	0.579	38%	0.375	S	S	*	.	H	α-helix	trans	-62.1	-41.6	174.8	-71.3	175.7	172.8	0	0	112.2	T51 F53 L57 L58 K59	T51-E55 WeakPolarHBondContact O-CG 3.22Å; T51-E55 PolarHBondContact O-N 3.06Å; F53-E55 PolarHBondContact O-N 3.24Å; E55-L57 PolarHBondContact O-N 2.95Å; E55-L58 PolarHBondContact O-N 3.49Å; E55-K59 WeakPolarHBondContact O-CB 3.46Å; E55-K59 PolarHBondContact O-N 3.45Å
56	C	98.7	Very high	96.9	Very high	14 Å²	14	63.1 Å²	63.1	10%	0.095	34%	0.344	C	S	.	.	H	α-helix	trans	-64.5	-38.3	176.7	-71.8	0	0	0	0	112.4	A52 F53 S54 R60 Y326 L330 M332	A52-C56 WeakPolarHBondContact O-CB 3.33Å; A52-C56 PolarHBondContact O-N 2.97Å; A52-C56 PolarHBondContact O-SG 2.83Å; F53-C56 PolarHBondContact O-N 3.08Å; S54-C56 PolarHBondContact O-N 2.9Å; C56-R60 WeakPolarHBondContact O-CB 3.27Å; C56-R60 PolarHBondContact O-N 3.25Å; C56-Y326 HydrophobicContact CB-CD2 4.15Å; C56-Y326 HydrophobicContact CB-CE2 4.25Å; C56-L330 HydrophobicContact CB-CD1 3.77Å; C56-M332 HydrophobicContact CB-CE 4.44Å; C56-M332 HydrophobicContact CB-SD 3.66Å
57	L	98.8	Very high	97.2	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-63.5	-44.9	174.7	-72.4	162	0	0	0	111.7	F53 S54 E55 R60 N61 L226 L264 N265 Y268 L330	F53-L57 HydrophobicContact CD1-CD1 4.3Å; F53-L57 HydrophobicContact CD2-CD1 3.93Å; F53-L57 HydrophobicContact CD2-CG 3.98Å; F53-L57 HydrophobicContact CE1-CD1 3.99Å; F53-L57 HydrophobicContact CE2-CD1 3.59Å; F53-L57 HydrophobicContact CE2-CD2 3.86Å; F53-L57 HydrophobicContact CE2-CG 3.63Å; F53-L57 HydrophobicContact CG-CD1 4.28Å; F53-L57 HydrophobicContact CZ-CD1 3.63Å; F53-L57 HydrophobicContact CZ-CD2 4.21Å; F53-L57 HydrophobicContact CZ-CG 4.13Å; F53-L57 WeakPolarHBondContact O-CG 3.2Å; F53-L57 PolarHBondContact O-N 2.94Å; S54-L57 PolarHBondContact O-N 3.36Å; E55-L57 PolarHBondContact O-N 2.95Å; L57-R60 PolarHBondContact O-N 3.44Å; L57-N61 WeakPolarHBondContact O-CB 3.29Å; L57-N61 PolarHBondContact O-N 3.04Å; L57-L226 HydrophobicContact CB-CD1 4.31Å; L57-L226 HydrophobicContact CD2-CD1 3.75Å; L57-L264 HydrophobicContact CB-CD2 3.76Å; L57-L264 HydrophobicContact CB-CG 4.26Å; L57-L264 HydrophobicContact CD1-CG 4.2Å; L57-N265 VanDerWaalsContact CD1-CA 3.44Å; L57-N265 HydrophobicContact CD1-CB 3.85Å; L57-Y268 HydrophobicContact CD2-CD1 4.41Å; L57-Y268 HydrophobicContact CD2-CD2 3.59Å; L57-Y268 HydrophobicContact CD2-CE2 4Å; L57-Y268 HydrophobicContact CD2-CG 3.82Å; L57-L330 HydrophobicContact CD2-CD1 4.04Å; L57-L330 HydrophobicContact CD2-CD2 3.63Å; L57-L330 HydrophobicContact CD2-CG 4.45Å; L57-L330 HydrophobicContact CG-CD1 4.13Å
58	L	98.6	Very high	97.6	Very high	103 Å²	103	61.3 Å²	61.3	54%	0.539	34%	0.338	S	S	.	.	H	α-helix	trans	-65.2	-43.8	177.9	-68.6	176.8	0	0	0	111.5	S54 E55 N61 Q62 L264	S54-L58 WeakPolarHBondContact O-CG 3.24Å; S54-L58 PolarHBondContact O-N 2.92Å; E55-L58 PolarHBondContact O-N 3.49Å; L58-N61 PolarHBondContact O-N 3.32Å; L58-Q62 PolarHBondContact O-N 2.79Å; L58-L264 HydrophobicContact CD2-CD2 4.06Å
59	K	98.6	Very high	98	Very high	109 Å²	109	60 Å²	60	47%	0.474	34%	0.335	S	S	.	.	H	α-helix	trans	-60.7	-49.5	174.8	179.3	169.9	172.8	-177.3	0	111.3	E55 N61 Q62 D63 M332	E55-K59 WeakPolarHBondContact O-CB 3.46Å; E55-K59 PolarHBondContact O-N 3.45Å; K59-N61 VanDerWaalsContact C-N 3.28Å; K59-N61 PolarHBondContact O-N 3.02Å; K59-Q62 WeakPolarHBondContact O-CA 3.44Å; K59-Q62 WeakPolarHBondContact O-CB 3.38Å; K59-Q62 PolarHBondContact O-N 3.39Å; K59-D63 VanDerWaalsContact O-CG 3.27Å; K59-D63 PolarHBondContact O-N 2.94Å; K59-M332 HydrophobicContact CB-CE 4.22Å; K59-M332 HydrophobicContact CD-CE 3.64Å; K59-M332 HydrophobicContact CG-CE 3.92Å
60	R	98.6	Very high	98.2	Very high	44 Å²	44	55.1 Å²	55.1	17%	0.166	31%	0.308	C	S	.	.	H	α-helix	trans	-61.2	-38.5	177.9	-175.8	57.9	177.5	-178.6	0.5	111.5	C56 L57 Q62 D63 L64 L226 D229 L330	C56-R60 WeakPolarHBondContact O-CB 3.27Å; C56-R60 PolarHBondContact O-N 3.25Å; L57-R60 PolarHBondContact O-N 3.44Å; R60-Q62 VanDerWaalsContact C-N 3.35Å; R60-D63 PolarHBondContact O-N 3.06Å; R60-L64 HydrophobicContact CG-CD1 3.87Å; R60-L64 HydrophobicContact CG-CG 4.44Å; R60-L64 WeakPolarHBondContact O-CB 3.31Å; R60-L64 WeakPolarHBondContact O-CD1 3.47Å; R60-L64 WeakPolarHBondContact O-CG 3.2Å; R60-L64 PolarHBondContact O-N 3.26Å; R60-L226 HydrophobicContact CB-CD2 3.94Å; R60-L226 HydrophobicContact CG-CD2 3.76Å; R60-D229 IonicContact CZ-OD1 3.71Å; R60-D229 IonicContact CZ-OD2 3.65Å; R60-D229 IonicContact NE-OD1 3.26Å; R60-D229 IonicContact NE-OD2 2.65Å; R60-D229 PolarHBondContact NE-OD2 2.97Å; R60-D229 IonicContact NH2-OD1 2.9Å; R60-D229 PolarHBondContact NH2-OD1 2.65Å; R60-D229 IonicContact NH2-OD2 2.81Å; R60-D229 PolarHBondContact NH2-OD2 3.05Å; R60-L330 WeakPolarHBondContact CD-O 3.23Å; R60-L330 HydrophobicContact CG-CB 4.4Å; R60-L330 PolarHBondContact NE-O 2.87Å; R60-L330 VanDerWaalsContact NE-O 3.08Å
61	N	98.4	Very high	98.3	Very high	21 Å²	21	58.8 Å²	58.8	11%	0.112	33%	0.325	C	S	.	.	H	α-helix	trans	-63.7	-40	173.8	173.6	78	0	0	0	112.2	L57 L58 K59 L64 S65 V222 R225 L226	L57-N61 WeakPolarHBondContact O-CB 3.29Å; L57-N61 PolarHBondContact O-N 3.04Å; L58-N61 PolarHBondContact O-N 3.32Å; K59-N61 VanDerWaalsContact C-N 3.28Å; K59-N61 PolarHBondContact O-N 3.02Å; N61-L64 PolarHBondContact O-N 2.71Å; N61-S65 WeakPolarHBondContact O-CB 3.45Å; N61-S65 PolarHBondContact O-N 3.23Å; N61-S65 PolarHBondContact O-OG 2.87Å; N61-V222 HydrophobicContact CB-CG1 3.79Å; N61-R225 WeakPolarHBondContact OD1-CD 3.49Å; N61-R225 PolarHBondContact OD1-NH1 2.85Å; N61-L226 HydrophobicContact CB-CD2 4.28Å; N61-L226 HydrophobicContact CB-CG 4.45Å
62	Q	98.3	Very high	98.3	Very high	146 Å²	146	59.2 Å²	59.2	68%	0.682	33%	0.331	S	S	*	.	H	α-helix	trans	-61.5	-46.4	174.9	-175.4	177.5	11.9	0	0	110.8	L58 K59 R60 L64 S65	L58-Q62 PolarHBondContact O-N 2.79Å; K59-Q62 WeakPolarHBondContact O-CA 3.44Å; K59-Q62 WeakPolarHBondContact O-CB 3.38Å; K59-Q62 PolarHBondContact O-N 3.39Å; R60-Q62 VanDerWaalsContact C-N 3.35Å; Q62-L64 PolarHBondContact O-N 3.13Å; Q62-S65 PolarHBondContact O-N 2.93Å
63	D	98.2	Very high	98.3	Very high	82 Å²	82	58.2 Å²	58.2	44%	0.439	32%	0.322	S	S	.	.	H	α-helix	trans	-61	-31.3	177.7	-61.4	-22.5	0	0	0	112.4	K59 R60 T115	K59-D63 VanDerWaalsContact O-CG 3.27Å; K59-D63 PolarHBondContact O-N 2.94Å; R60-D63 PolarHBondContact O-N 3.06Å; D63-T115 WeakPolarHBondContact O-CG2 3.43Å
64	L	98.4	Very high	98.3	Very high	18 Å²	18	58.1 Å²	58.1	9%	0.094	32%	0.321	C	S	.	.	H	α-helix	trans	-90.4	-12.7	179.9	-68.1	168.2	0	0	0	113.8	R60 N61 Q62 T114 T115 R225 L226 D229	R60-L64 HydrophobicContact CG-CD1 3.87Å; R60-L64 HydrophobicContact CG-CG 4.44Å; R60-L64 WeakPolarHBondContact O-CB 3.31Å; R60-L64 WeakPolarHBondContact O-CD1 3.47Å; R60-L64 WeakPolarHBondContact O-CG 3.2Å; R60-L64 PolarHBondContact O-N 3.26Å; N61-L64 PolarHBondContact O-N 2.71Å; Q62-L64 PolarHBondContact O-N 3.13Å; L64-T114 CarbonylContact O-C 3.6Å; L64-T114 VanDerWaalsContact O-CA 3.25Å; L64-T114 WeakPolarHBondContact O-CA 3.35Å; L64-T115 PolarHBondContact O-N 2.98Å; L64-R225 HydrophobicContact CB-CG 4.04Å; L64-L226 HydrophobicContact CD1-CD2 4.11Å; L64-D229 HydrophobicContact CD1-CB 3.44Å; L64-D229 VanDerWaalsContact CD1-CB 3.44Å; L64-D229 HydrophobicContact CD2-CB 3.97Å; L64-D229 HydrophobicContact CG-CB 4.36Å
65	S	97.9	Very high	98.4	Very high	31 Å²	31	60.9 Å²	60.9	22%	0.217	33%	0.333	C	S	.	.	S	Bend	trans	-76.8	137.9	-175	-69.2	0	0	0	0	110.2	N61 Q62 T67	N61-S65 WeakPolarHBondContact O-CB 3.45Å; N61-S65 PolarHBondContact O-N 3.23Å; N61-S65 PolarHBondContact O-OG 2.87Å; Q62-S65 PolarHBondContact O-N 2.93Å; S65-T67 PolarHBondContact O-N 3.35Å
66	P	98.1	Very high	98.4	Very high	13 Å²	13	57.3 Å²	57.3	8%	0.084	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-53.3	134.4	175.5	-24.9	32.8	0	0	0	111.3	E70 Q71 M113	P66-E70 WeakPolarHBondContact CA-OE2 3.38Å; P66-E70 HydrophobicContact CB-CB 4.07Å; P66-Q71 HydrophobicContact CB-CG 4Å; P66-Q71 PolarHBondContact O-NE2 3.32Å; P66-M113 WeakPolarHBondContact CD-O 3.35Å; P66-M113 HydrophobicContact CG-CB 3.62Å
67	T	98.3	Very high	98.3	Very high	62 Å²	62	56.7 Å²	56.7	38%	0.38	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-64	160.5	177.8	64.5	0	0	0	0	111.1	S65 A69 E70 Q71	S65-T67 PolarHBondContact O-N 3.35Å; T67-A69 PolarHBondContact O-N 3.09Å; T67-E70 PolarHBondContact N-OE2 3.22Å; T67-E70 PolarHBondContact O-N 2.68Å; T67-E70 VanDerWaalsContact O-N 3.11Å; T67-E70 WeakPolarHBondContact OG1-CG 3.29Å; T67-E70 PolarHBondContact OG1-N 2.65Å; T67-E70 PolarHBondContact OG1-OE2 2.76Å; T67-E70 VanDerWaalsContact OG1-OE2 3.13Å; T67-Q71 WeakPolarHBondContact O-CG 3.39Å; T67-Q71 PolarHBondContact O-N 2.93Å
68	P	98.1	Very high	98.3	Very high	108 Å²	108	56.7 Å²	56.7	70%	0.701	32%	0.318	S	S	*	.	H	α-helix	trans	-55.7	-33.8	175.8	-27.5	36.1	0	0	0	113.8	S72	P68-S72 WeakPolarHBondContact O-CB 3.38Å; P68-S72 PolarHBondContact O-N 2.9Å
69	A	98.1	Very high	98.4	Very high	72 Å²	72	54.7 Å²	54.7	60%	0.595	31%	0.31	S	S	*	.	H	α-helix	trans	-68.4	-44.5	175.9	0	0	0	0	0	112	T67 S72 S73	T67-A69 PolarHBondContact O-N 3.09Å; A69-S72 PolarHBondContact O-N 3.08Å; A69-S73 WeakPolarHBondContact O-CB 3.49Å; A69-S73 PolarHBondContact O-N 2.84Å; A69-S73 PolarHBondContact O-OG 2.74Å
70	E	98.3	Very high	98.3	Very high	29 Å²	29	51.8 Å²	51.8	14%	0.136	30%	0.297	C	S	.	.	H	α-helix	trans	-60.6	-47	173.5	-73.2	173	123.3	0	0	110.9	P66 T67 S72 S73 I74 T115 G116 N118	P66-E70 WeakPolarHBondContact CA-OE2 3.38Å; P66-E70 HydrophobicContact CB-CB 4.07Å; T67-E70 PolarHBondContact N-OE2 3.22Å; T67-E70 PolarHBondContact O-N 2.68Å; T67-E70 VanDerWaalsContact O-N 3.11Å; T67-E70 WeakPolarHBondContact OG1-CG 3.29Å; T67-E70 PolarHBondContact OG1-N 2.65Å; T67-E70 PolarHBondContact OG1-OE2 2.76Å; T67-E70 VanDerWaalsContact OG1-OE2 3.13Å; E70-S72 PolarHBondContact O-N 3.02Å; E70-S73 WeakPolarHBondContact CA-OG 3.46Å; E70-S73 PolarHBondContact O-N 3.46Å; E70-S73 PolarHBondContact O-OG 3.18Å; E70-I74 VanDerWaalsContact O-CG2 3.26Å; E70-I74 WeakPolarHBondContact O-CG2 3.39Å; E70-I74 PolarHBondContact O-N 2.98Å; E70-T115 PolarHBondContact OE1-OG1 3.49Å; E70-T115 WeakPolarHBondContact OE2-CB 3.4Å; E70-T115 PolarHBondContact OE2-OG1 2.85Å; E70-G116 PolarHBondContact OE1-N 2.97Å; E70-N118 HydrophobicContact CB-CB 4.46Å; E70-N118 HydrophobicContact CG-CB 4.36Å; E70-N118 PolarHBondContact O-ND2 3.04Å; E70-N118 PolarHBondContact O-OD1 3.07Å
71	Q	98.1	Very high	98.4	Very high	107 Å²	107	49.7 Å²	49.7	50%	0.5	29%	0.289	S	S	.	.	H	α-helix	trans	-59.4	-44.4	178.2	-68.5	177.8	13.9	0	0	112.3	P66 T67 I74 L75	P66-Q71 HydrophobicContact CB-CG 4Å; P66-Q71 PolarHBondContact O-NE2 3.32Å; T67-Q71 WeakPolarHBondContact O-CG 3.39Å; T67-Q71 PolarHBondContact O-N 2.93Å; Q71-I74 WeakPolarHBondContact O-CG2 3.48Å; Q71-L75 WeakPolarHBondContact O-CB 3.38Å; Q71-L75 PolarHBondContact O-N 2.87Å
72	S	98.4	Very high	98.4	Very high	80 Å²	80	49.8 Å²	49.8	56%	0.559	29%	0.29	S	S	*	.	H	α-helix	trans	-68.6	-41.5	179.8	-171.1	0	0	0	0	112.2	P68 A69 E70 S76	P68-S72 WeakPolarHBondContact O-CB 3.38Å; P68-S72 PolarHBondContact O-N 2.9Å; A69-S72 PolarHBondContact O-N 3.08Å; E70-S72 PolarHBondContact O-N 3.02Å; S72-S76 VanDerWaalsContact O-CB 3.3Å; S72-S76 WeakPolarHBondContact O-CB 3.46Å; S72-S76 PolarHBondContact O-N 3.04Å
73	S	98.2	Very high	98.4	Very high	22 Å²	22	46.7 Å²	46.7	15%	0.154	28%	0.278	C	S	.	.	H	α-helix	trans	-68.4	-43.9	-178.6	50.7	0	0	0	0	111.7	A69 E70 S76 L77 N118	A69-S73 WeakPolarHBondContact O-CB 3.49Å; A69-S73 PolarHBondContact O-N 2.84Å; A69-S73 PolarHBondContact O-OG 2.74Å; E70-S73 WeakPolarHBondContact CA-OG 3.46Å; E70-S73 PolarHBondContact O-N 3.46Å; E70-S73 PolarHBondContact O-OG 3.18Å; S73-S76 PolarHBondContact O-N 3.15Å; S73-L77 PolarHBondContact O-N 2.84Å; S73-N118 PolarHBondContact OG-ND2 2.8Å
74	I	98.6	Very high	98.4	Very high	3 Å²	3	43 Å²	43	2%	0.015	26%	0.258	C	S	.	.	H	α-helix	trans	-69.1	-40	177.5	-166.7	62.5	0	0	0	112.1	E70 Q71 S76 L77 V78 Y108 M113 N118 A120 A171 T172 V173	E70-I74 VanDerWaalsContact O-CG2 3.26Å; E70-I74 WeakPolarHBondContact O-CG2 3.39Å; E70-I74 PolarHBondContact O-N 2.98Å; Q71-I74 WeakPolarHBondContact O-CG2 3.48Å; I74-S76 VanDerWaalsContact C-N 3.34Å; I74-S76 PolarHBondContact O-N 2.75Å; I74-L77 PolarHBondContact O-N 2.81Å; I74-V78 HydrophobicContact CD1-CG2 4.19Å; I74-V78 HydrophobicContact CG1-CG2 4.13Å; I74-V78 WeakPolarHBondContact O-CB 3.49Å; I74-V78 VanDerWaalsContact O-CG2 3.23Å; I74-V78 WeakPolarHBondContact O-CG2 3.47Å; I74-V78 PolarHBondContact O-N 2.91Å; I74-Y108 HydrophobicContact CG1-CD2 4.02Å; I74-Y108 HydrophobicContact CG1-CE2 4.27Å; I74-Y108 HydrophobicContact CG2-CD2 4.19Å; I74-Y108 HydrophobicContact CG2-CE2 4.07Å; I74-M113 HydrophobicContact CG1-CE 4.2Å; I74-M113 HydrophobicContact CG2-CE 4.29Å; I74-M113 HydrophobicContact CG2-SD 4.46Å; I74-N118 WeakPolarHBondContact CB-OD1 3.35Å; I74-N118 WeakPolarHBondContact CG2-OD1 3.46Å; I74-A120 HydrophobicContact CD1-CB 3.67Å; I74-A120 HydrophobicContact CG1-CB 3.77Å; I74-A171 HydrophobicContact CB-CB 4.29Å; I74-A171 HydrophobicContact CD1-CB 3.89Å; I74-T172 WeakPolarHBondContact CD1-O 3.32Å; I74-V173 HydrophobicContact CD1-CG2 4.04Å
75	L	98.6	Very high	98.4	Very high	90 Å²	90	42.1 Å²	42.1	47%	0.471	25%	0.253	S	S	.	.	H	α-helix	trans	-59	-48.2	174.6	175.1	61.6	0	0	0	110.7	Q71 L77 V78 T79 Y108	Q71-L75 WeakPolarHBondContact O-CB 3.38Å; Q71-L75 PolarHBondContact O-N 2.87Å; L75-L77 PolarHBondContact O-N 3.41Å; L75-V78 PolarHBondContact O-N 3.21Å; L75-T79 WeakPolarHBondContact O-CB 3.47Å; L75-T79 PolarHBondContact O-N 3.18Å; L75-T79 PolarHBondContact O-OG1 3.41Å; L75-Y108 WeakPolarHBondContact CD1-OH 3.43Å
76	S	98.2	Very high	98.4	Very high	49 Å²	49	43.5 Å²	43.5	34%	0.343	26%	0.258	S	S	.	.	H	α-helix	trans	-56.2	-52.1	178	-178.3	0	0	0	0	111.6	S72 S73 I74 T79 K80	S72-S76 VanDerWaalsContact O-CB 3.3Å; S72-S76 WeakPolarHBondContact O-CB 3.46Å; S72-S76 PolarHBondContact O-N 3.04Å; S73-S76 PolarHBondContact O-N 3.15Å; I74-S76 VanDerWaalsContact C-N 3.34Å; I74-S76 PolarHBondContact O-N 2.75Å; S76-T79 PolarHBondContact O-N 3.36Å; S76-K80 WeakPolarHBondContact O-CB 3.29Å; S76-K80 VanDerWaalsContact O-CG 3.31Å; S76-K80 WeakPolarHBondContact O-CG 3.31Å; S76-K80 PolarHBondContact O-N 3.39Å
77	L	98.6	Very high	98.4	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-65.8	-43.8	-177.4	-173.1	58.9	0	0	0	112.1	S73 I74 L75 K80 I81 L155 I166 A171 V173	S73-L77 PolarHBondContact O-N 2.84Å; I74-L77 PolarHBondContact O-N 2.81Å; L75-L77 PolarHBondContact O-N 3.41Å; L77-K80 PolarHBondContact O-N 3.02Å; L77-I81 HydrophobicContact CD1-CD1 3.84Å; L77-I81 HydrophobicContact CD1-CG1 4.33Å; L77-I81 HydrophobicContact CG-CD1 3.84Å; L77-I81 WeakPolarHBondContact O-CG1 3.37Å; L77-I81 PolarHBondContact O-N 3.15Å; L77-L155 HydrophobicContact CD1-CD2 4.05Å; L77-I166 HydrophobicContact CD1-CG2 4.4Å; L77-A171 HydrophobicContact CB-CB 4.41Å; L77-A171 HydrophobicContact CD2-CB 3.91Å; L77-A171 WeakPolarHBondContact CD2-O 3.46Å; L77-V173 HydrophobicContact CB-CG2 4.22Å; L77-V173 HydrophobicContact CD2-CG2 3.87Å; L77-V173 HydrophobicContact CG-CG2 3.72Å
78	V	98.8	Very high	98.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.3	-47.7	176	169.6	0	0	0	0	110.9	I74 L75 K80 I81 N82 Q104 Y108 A120 L122 V173	I74-V78 HydrophobicContact CD1-CG2 4.19Å; I74-V78 HydrophobicContact CG1-CG2 4.13Å; I74-V78 WeakPolarHBondContact O-CB 3.49Å; I74-V78 VanDerWaalsContact O-CG2 3.23Å; I74-V78 WeakPolarHBondContact O-CG2 3.47Å; I74-V78 PolarHBondContact O-N 2.91Å; L75-V78 PolarHBondContact O-N 3.21Å; V78-K80 PolarHBondContact O-N 3.42Å; V78-I81 PolarHBondContact O-N 3.49Å; V78-N82 WeakPolarHBondContact O-CB 3.43Å; V78-N82 PolarHBondContact O-N 3Å; V78-Q104 HydrophobicContact CG1-CG 4.38Å; V78-Y108 HydrophobicContact CB-CE1 4.27Å; V78-Y108 HydrophobicContact CG1-CD1 4.47Å; V78-Y108 HydrophobicContact CG1-CE1 3.71Å; V78-Y108 HydrophobicContact CG2-CD1 4.41Å; V78-Y108 HydrophobicContact CG2-CE1 4.14Å; V78-Y108 HydrophobicContact CG2-CE2 4.29Å; V78-A120 HydrophobicContact CG2-CB 3.44Å; V78-A120 VanDerWaalsContact CG2-CB 3.44Å; V78-L122 HydrophobicContact CG1-CD2 4.26Å; V78-V173 HydrophobicContact CB-CG2 4.5Å; V78-V173 HydrophobicContact CG2-CG2 3.6Å
79	T	98.6	Very high	98.4	Very high	61 Å²	61	42.4 Å²	42.4	37%	0.374	24%	0.243	S	C	.	.	H	α-helix	trans	-61.7	-45.6	179.9	-65.9	0	0	0	0	111.5	L75 S76 N82 N83	L75-T79 WeakPolarHBondContact O-CB 3.47Å; L75-T79 PolarHBondContact O-N 3.18Å; L75-T79 PolarHBondContact O-OG1 3.41Å; S76-T79 PolarHBondContact O-N 3.36Å; T79-N82 PolarHBondContact O-N 3.42Å; T79-N83 WeakPolarHBondContact O-CB 3.35Å; T79-N83 PolarHBondContact O-N 3.48Å; T79-N83 PolarHBondContact O-ND2 3.49Å; T79-N83 PolarHBondContact O-OD1 3.04Å
80	K	98.5	Very high	98.4	Very high	49 Å²	49	44.9 Å²	44.9	21%	0.213	25%	0.251	C	S	.	.	H	α-helix	trans	-58.6	-50.9	177.1	-74.7	176.8	178.2	-173.6	0	111.6	S76 L77 V78 N83 V84 L146 D150 E153	S76-K80 WeakPolarHBondContact O-CB 3.29Å; S76-K80 VanDerWaalsContact O-CG 3.31Å; S76-K80 WeakPolarHBondContact O-CG 3.31Å; S76-K80 PolarHBondContact O-N 3.39Å; L77-K80 PolarHBondContact O-N 3.02Å; V78-K80 PolarHBondContact O-N 3.42Å; K80-N83 PolarHBondContact O-N 2.77Å; K80-V84 WeakPolarHBondContact O-CG2 3.27Å; K80-V84 PolarHBondContact O-N 3.44Å; K80-V84 VanDerWaalsContact O-N 3.15Å; K80-L146 HydrophobicContact CB-CD2 3.75Å; K80-D150 IonicContact NZ-OD2 2.68Å; K80-E153 IonicContact NZ-OE1 3.09Å; K80-E153 PolarHBondContact NZ-OE1 3.02Å; K80-E153 IonicContact NZ-OE2 3.23Å; K80-E153 PolarHBondContact NZ-OE2 2.86Å
81	I	98.7	Very high	98.3	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.9	-46	179.9	-69	166.4	0	0	0	111.3	L77 V78 N83 V84 I85 L122 V142 L146 I166 V173 I175	L77-I81 HydrophobicContact CD1-CD1 3.84Å; L77-I81 HydrophobicContact CD1-CG1 4.33Å; L77-I81 HydrophobicContact CG-CD1 3.84Å; L77-I81 WeakPolarHBondContact O-CG1 3.37Å; L77-I81 PolarHBondContact O-N 3.15Å; V78-I81 PolarHBondContact O-N 3.49Å; I81-N83 VanDerWaalsContact C-N 3.33Å; I81-N83 PolarHBondContact O-N 2.83Å; I81-V84 PolarHBondContact O-N 3.15Å; I81-I85 HydrophobicContact CG2-CD1 3.69Å; I81-I85 HydrophobicContact CG2-CG1 4.46Å; I81-I85 WeakPolarHBondContact O-CG1 3.41Å; I81-I85 PolarHBondContact O-N 2.83Å; I81-L122 HydrophobicContact CB-CD1 4.38Å; I81-L122 HydrophobicContact CG2-CD1 3.69Å; I81-V142 HydrophobicContact CG2-CG1 4.29Å; I81-L146 HydrophobicContact CG1-CD1 3.72Å; I81-I166 HydrophobicContact CD1-CB 3.85Å; I81-I166 HydrophobicContact CD1-CD1 4.16Å; I81-I166 HydrophobicContact CD1-CG2 4.08Å; I81-I166 HydrophobicContact CG1-CD1 4.26Å; I81-V173 HydrophobicContact CD1-CB 3.54Å; I81-V173 HydrophobicContact CD1-CG1 3.95Å; I81-V173 HydrophobicContact CD1-CG2 3.83Å; I81-I175 HydrophobicContact CG2-CD1 4.47Å
82	N	98.6	Very high	98	Very high	22 Å²	22	44.3 Å²	44.3	12%	0.118	27%	0.265	C	S	.	.	H	α-helix	trans	-60.1	-44.2	-179.9	-158.9	91.9	0	0	0	110.9	V78 T79 V84 I85 D86	V78-N82 WeakPolarHBondContact O-CB 3.43Å; V78-N82 PolarHBondContact O-N 3Å; T79-N82 PolarHBondContact O-N 3.42Å; N82-V84 VanDerWaalsContact C-N 3.34Å; N82-V84 PolarHBondContact O-N 2.9Å; N82-I85 PolarHBondContact O-N 3.05Å; N82-D86 PolarHBondContact ND2-OD2 2.81Å; N82-D86 WeakPolarHBondContact O-CB 3.39Å; N82-D86 VanDerWaalsContact O-CG 3.27Å; N82-D86 PolarHBondContact O-N 2.92Å
83	N	98.6	Very high	97.7	Very high	82 Å²	82	43.6 Å²	43.6	44%	0.439	27%	0.27	S	S	.	.	H	α-helix	trans	-62	-39.5	177.6	-69.7	-14.9	0	0	0	112.6	T79 K80 I81 N87	T79-N83 WeakPolarHBondContact O-CB 3.35Å; T79-N83 PolarHBondContact O-N 3.48Å; T79-N83 PolarHBondContact O-ND2 3.49Å; T79-N83 PolarHBondContact O-OD1 3.04Å; K80-N83 PolarHBondContact O-N 2.77Å; I81-N83 VanDerWaalsContact C-N 3.33Å; I81-N83 PolarHBondContact O-N 2.83Å; N83-N87 WeakPolarHBondContact O-CB 3.46Å; N83-N87 VanDerWaalsContact O-CG 3.25Å; N83-N87 PolarHBondContact O-N 2.9Å; N83-N87 PolarHBondContact O-ND2 3.18Å
84	V	98.5	Very high	97.4	Very high	3 Å²	3	50.6 Å²	50.6	2%	0.018	31%	0.306	C	S	.	.	H	α-helix	trans	-63.3	-44.6	175.2	171.6	0	0	0	0	110.5	K80 I81 N82 N87 L88 V142 T145 L146	K80-V84 WeakPolarHBondContact O-CG2 3.27Å; K80-V84 PolarHBondContact O-N 3.44Å; K80-V84 VanDerWaalsContact O-N 3.15Å; I81-V84 PolarHBondContact O-N 3.15Å; N82-V84 VanDerWaalsContact C-N 3.34Å; N82-V84 PolarHBondContact O-N 2.9Å; V84-N87 PolarHBondContact O-N 3.12Å; V84-L88 HydrophobicContact CG1-CD1 4.32Å; V84-L88 WeakPolarHBondContact O-CG 3.4Å; V84-L88 PolarHBondContact O-N 3.32Å; V84-V142 HydrophobicContact CB-CG1 4.49Å; V84-V142 HydrophobicContact CG1-CB 4.35Å; V84-V142 HydrophobicContact CG1-CG1 4.11Å; V84-V142 HydrophobicContact CG1-CG2 4.21Å; V84-T145 HydrophobicContact CG1-CG2 3.99Å; V84-T145 HydrophobicContact CG2-CG2 3.92Å; V84-L146 HydrophobicContact CG2-CD2 3.64Å; V84-L146 HydrophobicContact CG2-CG 4.15Å
85	I	98.5	Very high	97.2	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-67.6	-42.3	179.5	-63.5	166.1	0	0	0	111.3	I81 N82 N87 L88 I89 I99 V102 L122 V124 V142	I81-I85 HydrophobicContact CG2-CD1 3.69Å; I81-I85 HydrophobicContact CG2-CG1 4.46Å; I81-I85 WeakPolarHBondContact O-CG1 3.41Å; I81-I85 PolarHBondContact O-N 2.83Å; N82-I85 PolarHBondContact O-N 3.05Å; I85-N87 VanDerWaalsContact C-N 3.28Å; I85-N87 PolarHBondContact O-N 3.42Å; I85-L88 CarbonylContact O-C 3.54Å; I85-L88 WeakPolarHBondContact O-CB 3.48Å; I85-L88 PolarHBondContact O-N 3.15Å; I85-I89 HydrophobicContact CG2-CD1 4.13Å; I85-I89 WeakPolarHBondContact O-CG1 3.46Å; I85-I89 PolarHBondContact O-N 2.94Å; I85-I99 HydrophobicContact CG2-CD1 3.98Å; I85-I99 HydrophobicContact CG2-CG2 4.4Å; I85-V102 HydrophobicContact CB-CB 4.48Å; I85-V102 HydrophobicContact CB-CG1 4.45Å; I85-V102 HydrophobicContact CB-CG2 4.49Å; I85-V102 HydrophobicContact CD1-CG2 4.22Å; I85-V102 HydrophobicContact CG2-CB 3.64Å; I85-V102 HydrophobicContact CG2-CG1 3.9Å; I85-V102 HydrophobicContact CG2-CG2 4.01Å; I85-L122 HydrophobicContact CD1-CD1 4.37Å; I85-V124 HydrophobicContact CD1-CG2 3.84Å; I85-V124 HydrophobicContact CG2-CG2 4.28Å; I85-V142 HydrophobicContact CG1-CG2 4.2Å
86	D	98.4	Very high	97	Very high	60 Å²	60	56.3 Å²	56.3	32%	0.321	33%	0.33	S	S	.	.	H	α-helix	trans	-57.2	-42.7	174.6	-73	-32.5	0	0	0	111.1	N82 L88 I89 V90 V102	N82-D86 PolarHBondContact ND2-OD2 2.81Å; N82-D86 WeakPolarHBondContact O-CB 3.39Å; N82-D86 VanDerWaalsContact O-CG 3.27Å; N82-D86 PolarHBondContact O-N 2.92Å; D86-L88 PolarHBondContact O-N 3.03Å; D86-I89 WeakPolarHBondContact O-CB 3.37Å; D86-I89 PolarHBondContact O-N 3.01Å; D86-V90 WeakPolarHBondContact O-CG2 3.47Å; D86-V90 PolarHBondContact O-N 2.91Å; D86-V90 VanDerWaalsContact O-N 3.17Å; D86-V102 VanDerWaalsContact OD1-CG1 3.26Å; D86-V102 WeakPolarHBondContact OD1-CG1 3.47Å
87	N	98.1	Very high	96.9	Very high	99 Å²	99	54.3 Å²	54.3	53%	0.529	32%	0.315	S	S	.	.	H	α-helix	trans	-64.6	-39	175	-72.6	-33.6	0	0	0	112.4	N83 V84 I85 I89 V90 A91	N83-N87 WeakPolarHBondContact O-CB 3.46Å; N83-N87 VanDerWaalsContact O-CG 3.25Å; N83-N87 PolarHBondContact O-N 2.9Å; N83-N87 PolarHBondContact O-ND2 3.18Å; V84-N87 PolarHBondContact O-N 3.12Å; I85-N87 VanDerWaalsContact C-N 3.28Å; I85-N87 PolarHBondContact O-N 3.42Å; N87-I89 VanDerWaalsContact C-N 3.29Å; N87-I89 PolarHBondContact O-N 2.83Å; N87-V90 PolarHBondContact O-N 2.89Å; N87-A91 CarbonylContact O-C 3.6Å; N87-A91 WeakPolarHBondContact O-CA 3.43Å; N87-A91 PolarHBondContact O-N 2.94Å
88	L	98	Very high	96.9	Very high	18 Å²	18	59 Å²	59	9%	0.094	34%	0.337	C	S	.	.	H	α-helix	trans	-66.6	-29.4	175.1	-69.9	173.4	0	0	0	112.5	V84 I85 D86 P92 F95 I99 L138 K141 V142	V84-L88 HydrophobicContact CG1-CD1 4.32Å; V84-L88 WeakPolarHBondContact O-CG 3.4Å; V84-L88 PolarHBondContact O-N 3.32Å; I85-L88 CarbonylContact O-C 3.54Å; I85-L88 WeakPolarHBondContact O-CB 3.48Å; I85-L88 PolarHBondContact O-N 3.15Å; D86-L88 PolarHBondContact O-N 3.03Å; L88-P92 WeakPolarHBondContact O-CB 3.47Å; L88-F95 HydrophobicContact CD2-CD1 4.11Å; L88-I99 HydrophobicContact CB-CD1 3.95Å; L88-I99 HydrophobicContact CD1-CD1 4.33Å; L88-L138 HydrophobicContact CD1-CD1 4.02Å; L88-K141 HydrophobicContact CD1-CG 4.32Å; L88-K141 HydrophobicContact CD2-CG 4.31Å; L88-V142 HydrophobicContact CD1-CG2 4.19Å
89	I	98	Very high	96.8	Very high	43 Å²	43	59.1 Å²	59.1	22%	0.221	34%	0.338	C	S	.	.	H	α-helix	trans	-67.7	-45.7	174.6	-69.9	164.4	0	0	0	110.7	I85 D86 N87 I99 V102	I85-I89 HydrophobicContact CG2-CD1 4.13Å; I85-I89 WeakPolarHBondContact O-CG1 3.46Å; I85-I89 PolarHBondContact O-N 2.94Å; D86-I89 WeakPolarHBondContact O-CB 3.37Å; D86-I89 PolarHBondContact O-N 3.01Å; N87-I89 VanDerWaalsContact C-N 3.29Å; N87-I89 PolarHBondContact O-N 2.83Å; I89-I99 HydrophobicContact CD1-CG2 3.93Å; I89-I99 HydrophobicContact CG1-CB 3.73Å; I89-I99 HydrophobicContact CG1-CG2 3.52Å; I89-V102 HydrophobicContact CD1-CB 4.28Å; I89-V102 HydrophobicContact CD1-CG1 3.9Å
90	V	97.6	Very high	96.8	Very high	125 Å²	125	60.8 Å²	60.8	76%	0.758	34%	0.341	S	S	*	.	H	α-helix	trans	-85.2	-35.7	-173.2	-172.9	0	0	0	0	112.4	D86 N87	D86-V90 WeakPolarHBondContact O-CG2 3.47Å; D86-V90 PolarHBondContact O-N 2.91Å; D86-V90 VanDerWaalsContact O-N 3.17Å; N87-V90 PolarHBondContact O-N 2.89Å
91	A	96.2	Very high	96.8	Very high	74 Å²	74	61.6 Å²	61.6	61%	0.612	35%	0.346	S	S	*	.			trans	-137.9	69.9	-174.9	0	0	0	0	0	111.7	N87 G93	N87-A91 CarbonylContact O-C 3.6Å; N87-A91 WeakPolarHBondContact O-CA 3.43Å; N87-A91 PolarHBondContact O-N 2.94Å; A91-G93 PolarHBondContact O-N 2.97Å
92	P	91.7	Very high	96.8	Very high	50 Å²	50	62.3 Å²	62.3	33%	0.325	35%	0.35	S	S	.	.			trans	-67	-20.3	-177.8	26	-34.4	0	0	0	113.6	L88 N94 F95	L88-P92 WeakPolarHBondContact O-CB 3.47Å; P92-N94 PolarHBondContact O-N 3.2Å; P92-F95 WeakPolarHBondContact O-CB 3.31Å; P92-F95 PolarHBondContact O-N 2.78Å
93	G	92.6	Very high	96.8	Very high	65 Å²	65	66.1 Å²	66.1	67%	0.67	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	-126.5	-175.1	0	0	0	0	0	111.3	A91 F95	A91-G93 PolarHBondContact O-N 2.97Å; G93-F95 VanDerWaalsContact C-N 3.34Å
94	N	91.8	Very high	96.8	Very high	169 Å²	169	65.2 Å²	65.2	90%	0.904	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	9.5	177	-64.8	-10.8	0	0	0	113.2	P92 E96	P92-N94 PolarHBondContact O-N 3.2Å; N94-E96 PolarHBondContact O-N 2.86Å
95	F	94.8	Very high	96.8	Very high	41 Å²	41	65.1 Å²	65.1	18%	0.18	36%	0.355	C	S	.	.			trans	-76.2	123.1	-179.2	-170.4	-125.3	0	0	0	110.7	L88 P92 G93 V97 L138 K141	L88-F95 HydrophobicContact CD2-CD1 4.11Å; P92-F95 WeakPolarHBondContact O-CB 3.31Å; P92-F95 PolarHBondContact O-N 2.78Å; G93-F95 VanDerWaalsContact C-N 3.34Å; F95-V97 HydrophobicContact CD1-CB 4.23Å; F95-V97 HydrophobicContact CE1-CB 3.57Å; F95-V97 HydrophobicContact CE1-CG2 4.17Å; F95-V97 HydrophobicContact CE2-CG2 4.43Å; F95-V97 HydrophobicContact CZ-CB 3.78Å; F95-V97 HydrophobicContact CZ-CG2 3.83Å; F95-V97 PolarHBondContact O-N 3.47Å; F95-L138 HydrophobicContact CE1-CD1 3.9Å; F95-L138 HydrophobicContact CZ-CB 4.44Å; F95-L138 HydrophobicContact CZ-CD1 4.38Å; F95-K141 HydrophobicContact CD1-CG 4.26Å; F95-K141 HydrophobicContact CD2-CB 4.42Å; F95-K141 HydrophobicContact CD2-CD 4.32Å; F95-K141 HydrophobicContact CD2-CG 4.09Å; F95-K141 HydrophobicContact CE1-CB 4.15Å; F95-K141 HydrophobicContact CE1-CG 4.01Å; F95-K141 HydrophobicContact CE2-CB 3.72Å; F95-K141 HydrophobicContact CE2-CD 4.41Å; F95-K141 HydrophobicContact CE2-CG 3.88Å; F95-K141 HydrophobicContact CG-CG 4.29Å; F95-K141 HydrophobicContact CZ-CB 3.58Å; F95-K141 HydrophobicContact CZ-CG 3.85Å
96	E	93.7	Very high	96.8	Very high	171 Å²	171	65.7 Å²	65.7	80%	0.799	36%	0.362	S	S	*	.	S	Bend	trans	-73.3	-27.5	-170.8	-62.9	-176.4	170.2	0	0	113.6	N94 Q98	N94-E96 PolarHBondContact O-N 2.86Å; E96-Q98 PolarHBondContact O-N 2.78Å; E96-Q98 VanDerWaalsContact O-N 3.08Å
97	V	97.3	Very high	96.8	Very high	7 Å²	7	64.6 Å²	64.6	4%	0.042	36%	0.358	C	S	.	.			trans	-78.5	99	-179.8	-175.7	0	0	0	0	109.6	F95 L126 I128 A134 A137 L138	F95-V97 HydrophobicContact CD1-CB 4.23Å; F95-V97 HydrophobicContact CE1-CB 3.57Å; F95-V97 HydrophobicContact CE1-CG2 4.17Å; F95-V97 HydrophobicContact CE2-CG2 4.43Å; F95-V97 HydrophobicContact CZ-CB 3.78Å; F95-V97 HydrophobicContact CZ-CG2 3.83Å; F95-V97 PolarHBondContact O-N 3.47Å; V97-L126 HydrophobicContact CG1-CD1 4.35Å; V97-L126 HydrophobicContact CG1-CD2 3.81Å; V97-I128 HydrophobicContact CB-CD1 4.38Å; V97-I128 HydrophobicContact CG1-CD1 4.14Å; V97-I128 HydrophobicContact CG2-CD1 4.42Å; V97-A134 HydrophobicContact CG2-CB 4.04Å; V97-A137 HydrophobicContact CG2-CB 4.24Å; V97-L138 HydrophobicContact CG1-CB 4.2Å; V97-L138 HydrophobicContact CG1-CD2 4.34Å
98	Q	97.3	Very high	96.8	Very high	100 Å²	100	62 Å²	62	47%	0.467	34%	0.341	S	S	.	.			trans	-84.2	128.4	-179.4	-61.7	-173.4	-5.9	0	0	111.9	E96 K127 I128	E96-Q98 PolarHBondContact O-N 2.78Å; E96-Q98 VanDerWaalsContact O-N 3.08Å; Q98-K127 HydrophobicContact CB-CB 3.96Å; Q98-K127 HydrophobicContact CB-CD 4.13Å; Q98-K127 PolarHBondContact O-N 2.9Å; Q98-I128 HydrophobicContact CB-CG2 4.31Å
99	I	98.5	Very high	96.8	Very high	3 Å²	3	64.6 Å²	64.6	2%	0.015	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	136.4	-177.9	-50.1	176.6	0	0	0	109.4	I85 L88 I89 V124 L126 K127 L138	I85-I99 HydrophobicContact CG2-CD1 3.98Å; I85-I99 HydrophobicContact CG2-CG2 4.4Å; L88-I99 HydrophobicContact CB-CD1 3.95Å; L88-I99 HydrophobicContact CD1-CD1 4.33Å; I89-I99 HydrophobicContact CD1-CG2 3.93Å; I89-I99 HydrophobicContact CG1-CB 3.73Å; I89-I99 HydrophobicContact CG1-CG2 3.52Å; I99-V124 HydrophobicContact CD1-CG1 4.29Å; I99-V124 HydrophobicContact CG1-CG1 4.38Å; I99-V124 HydrophobicContact CG2-CG1 3.6Å; I99-L126 HydrophobicContact CG1-CD2 4.21Å; I99-K127 WeakPolarHBondContact O-CE 3.42Å; I99-K127 PolarHBondContact O-NZ 2.82Å; I99-L138 HydrophobicContact CD1-CD1 3.79Å; I99-L138 HydrophobicContact CD1-CD2 4.37Å
100	E	98.2	Very high	96.9	Very high	95 Å²	95	63.4 Å²	63.4	44%	0.444	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-52.6	172.3	-177.9	68.1	-165.1	0	0	110.2	I125 K127 V180	E100-I125 HydrophobicContact CB-CB 4.2Å; E100-I125 HydrophobicContact CB-CG2 4.12Å; E100-I125 WeakPolarHBondContact CB-O 3.47Å; E100-I125 PolarHBondContact N-O 3.23Å; E100-K127 HydrophobicContact CB-CG 3.91Å; E100-K127 WeakPolarHBondContact OE2-CE 3.33Å; E100-K127 WeakPolarHBondContact OE2-CG 2.72Å; E100-K127 IonicContact OE2-NZ 2.65Å; E100-V180 HydrophobicContact CB-CG1 4.2Å; E100-V180 HydrophobicContact CG-CG1 4.09Å
101	E	98	Very high	96.9	Very high	67 Å²	67	59.1 Å²	59.1	31%	0.313	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	153.7	-169.5	-172.2	170.3	-152.4	0	0	111.6	R103 I125	E101-R103 VanDerWaalsContact CD-NE 3.31Å; E101-R103 HydrophobicContact CG-CG 4.26Å; E101-R103 IonicContact OE1-CZ 3.31Å; E101-R103 IonicContact OE1-NE 3.65Å; E101-R103 PolarHBondContact OE1-NE 3.34Å; E101-R103 IonicContact OE1-NH2 2.89Å; E101-R103 PolarHBondContact OE1-NH2 2.83Å; E101-R103 IonicContact OE2-NE 3Å; E101-R103 IonicContact OE2-NH2 2.63Å; E101-I125 HydrophobicContact CB-CB 4.45Å; E101-I125 HydrophobicContact CB-CD1 4.19Å; E101-I125 HydrophobicContact CB-CG1 4.4Å; E101-I125 PolarHBondContact N-O 2.99Å; E101-I125 PolarHBondContact O-N 3.13Å
102	V	98.6	Very high	97	Very high	14 Å²	14	55.6 Å²	55.6	9%	0.085	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.4	167.6	62.8	0	0	0	0	110.7	I85 D86 I89 L122 V123 V124	I85-V102 HydrophobicContact CB-CB 4.48Å; I85-V102 HydrophobicContact CB-CG1 4.45Å; I85-V102 HydrophobicContact CB-CG2 4.49Å; I85-V102 HydrophobicContact CD1-CG2 4.22Å; I85-V102 HydrophobicContact CG2-CB 3.64Å; I85-V102 HydrophobicContact CG2-CG1 3.9Å; I85-V102 HydrophobicContact CG2-CG2 4.01Å; D86-V102 VanDerWaalsContact OD1-CG1 3.26Å; D86-V102 WeakPolarHBondContact OD1-CG1 3.47Å; I89-V102 HydrophobicContact CD1-CB 4.28Å; I89-V102 HydrophobicContact CD1-CG1 3.9Å; V102-L122 HydrophobicContact CG2-CB 4.36Å; V102-L122 HydrophobicContact CG2-CD1 4.49Å; V102-V123 CarbonylContact C-O 3.54Å; V102-V123 WeakPolarHBondContact CA-O 3.42Å; V102-V124 HydrophobicContact CB-CG2 4.36Å; V102-V124 HydrophobicContact CG2-CG2 3.88Å
103	R	98.7	Very high	97.3	Very high	103 Å²	103	54 Å²	54	39%	0.389	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	131.3	179.7	-69	-63.8	-172.8	102.1	6.2	111.4	E101 V105 L122 V123 I205	E101-R103 VanDerWaalsContact CD-NE 3.31Å; E101-R103 HydrophobicContact CG-CG 4.26Å; E101-R103 IonicContact OE1-CZ 3.31Å; E101-R103 IonicContact OE1-NE 3.65Å; E101-R103 PolarHBondContact OE1-NE 3.34Å; E101-R103 IonicContact OE1-NH2 2.89Å; E101-R103 PolarHBondContact OE1-NH2 2.83Å; E101-R103 IonicContact OE2-NE 3Å; E101-R103 IonicContact OE2-NH2 2.63Å; R103-V105 HydrophobicContact CB-CG1 4.36Å; R103-L122 CarbonylContact O-C 3.5Å; R103-L122 WeakPolarHBondContact O-CA 3.29Å; R103-V123 PolarHBondContact N-O 2.78Å; R103-V123 PolarHBondContact O-N 3.28Å; R103-I205 HydrophobicContact CB-CD1 4.34Å; R103-I205 HydrophobicContact CB-CG1 4.09Å; R103-I205 HydrophobicContact CG-CD1 4.23Å; R103-I205 HydrophobicContact CG-CG1 4.33Å; R103-I205 HydrophobicContact CG-CG2 4.33Å
104	Q	98.7	Very high	97.6	Very high	62 Å²	62	52.5 Å²	52.5	29%	0.29	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	130.5	166.8	-65.4	173.2	14.9	0	0	109.9	V78 K109 L122	V78-Q104 HydrophobicContact CG1-CG 4.38Å; Q104-K109 HydrophobicContact CB-CB 4.16Å; Q104-K109 HydrophobicContact CB-CD 4.24Å; Q104-K109 HydrophobicContact CB-CG 4.43Å; Q104-K109 WeakPolarHBondContact O-CG 3.08Å; Q104-L122 HydrophobicContact CB-CD2 4.09Å; Q104-L122 HydrophobicContact CG-CD2 3.43Å; Q104-L122 VanDerWaalsContact CG-CD2 3.43Å
105	V	98.8	Very high	97.9	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	-167.5	-179.4	-56.7	0	0	0	0	111.2	R103 K109 D121 V123 L176 A204 I205 A208	R103-V105 HydrophobicContact CB-CG1 4.36Å; V105-K109 WeakPolarHBondContact O-CB 3.42Å; V105-K109 PolarHBondContact O-N 3.36Å; V105-D121 HydrophobicContact CG2-CB 3.71Å; V105-D121 PolarHBondContact N-O 2.71Å; V105-V123 HydrophobicContact CB-CG2 4.4Å; V105-V123 HydrophobicContact CG1-CB 4.44Å; V105-V123 HydrophobicContact CG1-CG2 3.88Å; V105-V123 HydrophobicContact CG2-CG2 3.62Å; V105-L176 HydrophobicContact CG2-CD1 4.39Å; V105-A204 HydrophobicContact CB-CB 4.18Å; V105-A204 HydrophobicContact CG1-CB 4.43Å; V105-A204 HydrophobicContact CG2-CB 3.96Å; V105-I205 HydrophobicContact CG1-CG1 4.04Å; V105-A208 HydrophobicContact CB-CB 4.11Å; V105-A208 HydrophobicContact CG1-CB 3.98Å
106	G	98.3	Very high	97.9	Very high	13 Å²	13	48.4 Å²	48.4	13%	0.134	26%	0.263	C	S	.	.	H	α-helix	trans	67.9	-160.2	170.9	0	0	0	0	0	114.3	Y108 K110	G106-Y108 VanDerWaalsContact C-N 3.29Å; G106-Y108 PolarHBondContact O-N 3.07Å; G106-K110 WeakPolarHBondContact O-CB 3.34Å; G106-K110 WeakPolarHBondContact O-CD 3.48Å; G106-K110 WeakPolarHBondContact O-CG 3.5Å; G106-K110 PolarHBondContact O-N 2.92Å
107	S	98.3	Very high	98.1	Very high	36 Å²	36	45.5 Å²	45.5	25%	0.252	25%	0.249	S	C	.	.	H	α-helix	trans	-65.2	-32.7	-174.2	-61.9	0	0	0	0	112.8	G111 T112 M113 K228	S107-G111 PolarHBondContact O-N 3.17Å; S107-T112 PolarHBondContact O-N 3.35Å; S107-M113 PolarHBondContact O-N 2.87Å; S107-K228 PolarHBondContact OG-NZ 3.39Å
108	Y	98.5	Very high	98.1	Very high	44 Å²	44	45.9 Å²	45.9	17%	0.173	25%	0.251	C	S	.	.	H	α-helix	trans	-61.9	-57.7	177.2	173.8	-97.9	0	0	0	111.2	I74 L75 V78 G106 K110 G111 M113 A120	I74-Y108 HydrophobicContact CG1-CD2 4.02Å; I74-Y108 HydrophobicContact CG1-CE2 4.27Å; I74-Y108 HydrophobicContact CG2-CD2 4.19Å; I74-Y108 HydrophobicContact CG2-CE2 4.07Å; L75-Y108 WeakPolarHBondContact CD1-OH 3.43Å; V78-Y108 HydrophobicContact CB-CE1 4.27Å; V78-Y108 HydrophobicContact CG1-CD1 4.47Å; V78-Y108 HydrophobicContact CG1-CE1 3.71Å; V78-Y108 HydrophobicContact CG2-CD1 4.41Å; V78-Y108 HydrophobicContact CG2-CE1 4.14Å; V78-Y108 HydrophobicContact CG2-CE2 4.29Å; G106-Y108 VanDerWaalsContact C-N 3.29Å; G106-Y108 PolarHBondContact O-N 3.07Å; Y108-K110 VanDerWaalsContact C-N 3.25Å; Y108-K110 PolarHBondContact O-N 3.46Å; Y108-G111 PolarHBondContact O-N 3.28Å; Y108-G111 VanDerWaalsContact O-N 3.11Å; Y108-M113 HydrophobicContact CD2-SD 3.73Å; Y108-M113 HydrophobicContact CG-SD 4.28Å; Y108-A120 VanDerWaalsContact CB-CB 3.46Å; Y108-A120 HydrophobicContact CD1-CB 4.09Å; Y108-A120 HydrophobicContact CD2-CB 3.98Å; Y108-A120 HydrophobicContact CG-CB 3.57Å
109	K	98.4	Very high	98.2	Very high	73 Å²	73	42.1 Å²	42.1	32%	0.317	24%	0.235	S	C	.	.	H	α-helix	trans	-60.6	-34.9	179.1	176.4	60.3	-179.8	170.9	0	112.5	Q104 V105 G111 A208 E212	Q104-K109 HydrophobicContact CB-CB 4.16Å; Q104-K109 HydrophobicContact CB-CD 4.24Å; Q104-K109 HydrophobicContact CB-CG 4.43Å; Q104-K109 WeakPolarHBondContact O-CG 3.08Å; V105-K109 WeakPolarHBondContact O-CB 3.42Å; V105-K109 PolarHBondContact O-N 3.36Å; K109-G111 VanDerWaalsContact C-N 3.34Å; K109-A208 HydrophobicContact CG-CB 4.25Å; K109-E212 WeakPolarHBondContact CE-OE2 3.37Å; K109-E212 VanDerWaalsContact NZ-CD 3.32Å; K109-E212 IonicContact NZ-OE1 2.66Å; K109-E212 PolarHBondContact NZ-OE1 3.22Å; K109-E212 IonicContact NZ-OE2 3.26Å; K109-E212 PolarHBondContact NZ-OE2 3.2Å
110	K	98.5	Very high	98.2	Very high	18 Å²	18	42 Å²	42	8%	0.078	23%	0.234	C	C	.	.	H	α-helix	trans	-78.7	-14.4	-179.2	-65.1	172.2	-178.3	176.9	0	113.5	G106 Y108 T112 F211 K221 D246	G106-K110 WeakPolarHBondContact O-CB 3.34Å; G106-K110 WeakPolarHBondContact O-CD 3.48Å; G106-K110 WeakPolarHBondContact O-CG 3.5Å; G106-K110 PolarHBondContact O-N 2.92Å; Y108-K110 VanDerWaalsContact C-N 3.25Å; Y108-K110 PolarHBondContact O-N 3.46Å; K110-T112 VanDerWaalsContact C-N 3.34Å; K110-T112 HydrophobicContact CB-CG2 4.21Å; K110-F211 HydrophobicContact CB-CD1 3.82Å; K110-F211 HydrophobicContact CB-CD2 4.4Å; K110-F211 HydrophobicContact CB-CE1 3.77Å; K110-F211 HydrophobicContact CB-CE2 4.34Å; K110-F211 HydrophobicContact CB-CG 4.15Å; K110-F211 HydrophobicContact CB-CZ 4.05Å; K110-F211 HydrophobicContact CD-CB 4.33Å; K110-F211 HydrophobicContact CD-CD1 4.49Å; K110-F211 HydrophobicContact CD-CD2 3.8Å; K110-F211 HydrophobicContact CD-CE2 4.21Å; K110-F211 HydrophobicContact CD-CG 3.95Å; K110-F211 HydrophobicContact CG-CB 4.02Å; K110-F211 HydrophobicContact CG-CD1 3.75Å; K110-F211 HydrophobicContact CG-CD2 3.97Å; K110-F211 HydrophobicContact CG-CE1 4.2Å; K110-F211 HydrophobicContact CG-CE2 4.39Å; K110-F211 HydrophobicContact CG-CG 3.63Å; K110-F211 WeakPolarHBondContact O-CE1 3.4Å; K110-K221 VanDerWaalsContact O-CE 3.3Å; K110-K221 WeakPolarHBondContact O-CE 3.19Å; K110-D246 IonicContact NZ-OD2 3.61Å; K110-D246 PolarHBondContact NZ-OD2 2.9Å
111	G	98.2	Very high	98.2	Very high	35 Å²	35	39.2 Å²	39.2	36%	0.361	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.4	31.8	-174	0	0	0	0	0	113.3	S107 Y108 K109 R225	S107-G111 PolarHBondContact O-N 3.17Å; Y108-G111 PolarHBondContact O-N 3.28Å; Y108-G111 VanDerWaalsContact O-N 3.11Å; K109-G111 VanDerWaalsContact C-N 3.34Å; G111-R225 PolarHBondContact O-NH2 3.47Å
112	T	98.5	Very high	98.2	Very high	1 Å²	1	36 Å²	36	1%	0.006	21%	0.207	C	C	.	.			trans	-119	21.1	-177.5	63.3	0	0	0	0	112.9	S107 K110 F211 K221 I224 K228	S107-T112 PolarHBondContact O-N 3.35Å; K110-T112 VanDerWaalsContact C-N 3.34Å; K110-T112 HydrophobicContact CB-CG2 4.21Å; T112-F211 HydrophobicContact CG2-CZ 3.95Å; T112-K221 HydrophobicContact CG2-CB 4.18Å; T112-K221 HydrophobicContact CG2-CG 4.26Å; T112-I224 HydrophobicContact CG2-CB 4.15Å; T112-I224 HydrophobicContact CG2-CD1 4.33Å; T112-I224 HydrophobicContact CG2-CG2 3.96Å; T112-K228 PolarHBondContact O-NZ 3.02Å; T112-K228 PolarHBondContact OG1-NZ 3.36Å
113	M	98.4	Very high	98.3	Very high	16 Å²	16	35.3 Å²	35.3	8%	0.079	20%	0.203	C	C	.	.			trans	-61.8	155.4	172	-67.8	179.7	70.7	0	0	111.9	P66 I74 S107 Y108 N118 V119 R225	P66-M113 WeakPolarHBondContact CD-O 3.35Å; P66-M113 HydrophobicContact CG-CB 3.62Å; I74-M113 HydrophobicContact CG1-CE 4.2Å; I74-M113 HydrophobicContact CG2-CE 4.29Å; I74-M113 HydrophobicContact CG2-SD 4.46Å; S107-M113 PolarHBondContact O-N 2.87Å; Y108-M113 HydrophobicContact CD2-SD 3.73Å; Y108-M113 HydrophobicContact CG-SD 4.28Å; M113-N118 WeakPolarHBondContact CE-OD1 3.18Å; M113-V119 WeakPolarHBondContact CE-O 3.44Å; M113-R225 PolarHBondContact O-NE 2.77Å; M113-R225 PolarHBondContact O-NH2 2.91Å
114	T	98.1	Very high	98.3	Very high	33 Å²	33	30.4 Å²	30.4	20%	0.202	19%	0.185	C	C	.	.			trans	-117.9	144.5	174.9	47	0	0	0	0	110	L64 H117 R225	L64-T114 CarbonylContact O-C 3.6Å; L64-T114 VanDerWaalsContact O-CA 3.25Å; L64-T114 WeakPolarHBondContact O-CA 3.35Å; T114-H117 PolarHBondContact O-N 3.45Å; T114-R225 HydrophobicContact CG2-CG 3.76Å
115	T	97.9	Very high	98.3	Very high	51 Å²	51	28.2 Å²	28.2	31%	0.313	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	151.1	172.2	-168.9	0	0	0	0	111.3	D63 L64 E70 H117	D63-T115 WeakPolarHBondContact O-CG2 3.43Å; L64-T115 PolarHBondContact O-N 2.98Å; E70-T115 PolarHBondContact OE1-OG1 3.49Å; E70-T115 WeakPolarHBondContact OE2-CB 3.4Å; E70-T115 PolarHBondContact OE2-OG1 2.85Å; T115-H117 PolarHBondContact O-N 3.47Å
116	G	96.1	Very high	98.3	Very high	73 Å²	73	28.2 Å²	28.2	75%	0.753	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.2	-5.7	-174.6	0	0	0	0	0	114.3	E70	E70-G116 PolarHBondContact OE1-N 2.97Å
117	H	96.3	Very high	98.3	Very high	110 Å²	110	31.8 Å²	31.8	51%	0.509	19%	0.186	S	C	.	.			trans	-131.9	66.5	176.6	-170.2	-92.5	0	0	0	110.3	T114 T115 V119	T114-H117 PolarHBondContact O-N 3.45Å; T115-H117 PolarHBondContact O-N 3.47Å; H117-V119 PolarHBondContact O-N 2.78Å
118	N	97.9	Very high	98.2	Very high	15 Å²	15	32.6 Å²	32.6	8%	0.08	19%	0.187	C	C	.	.			trans	-78.9	64.4	-174.8	-157.7	30	0	0	0	112.6	E70 S73 I74 M113 D170 T172	E70-N118 HydrophobicContact CB-CB 4.46Å; E70-N118 HydrophobicContact CG-CB 4.36Å; E70-N118 PolarHBondContact O-ND2 3.04Å; E70-N118 PolarHBondContact O-OD1 3.07Å; S73-N118 PolarHBondContact OG-ND2 2.8Å; I74-N118 WeakPolarHBondContact CB-OD1 3.35Å; I74-N118 WeakPolarHBondContact CG2-OD1 3.46Å; M113-N118 WeakPolarHBondContact CE-OD1 3.18Å; N118-D170 PolarHBondContact ND2-O 2.91Å; N118-T172 PolarHBondContact O-N 2.77Å
119	V	98.6	Very high	98.2	Very high	22 Å²	22	33.1 Å²	33.1	13%	0.133	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.6	-174.7	-172.5	0	0	0	0	110.9	M113 H117 T172 K174	M113-V119 WeakPolarHBondContact CE-O 3.44Å; H117-V119 PolarHBondContact O-N 2.78Å; V119-T172 CarbonylContact C-O 3.6Å; V119-T172 VanDerWaalsContact CA-O 3.25Å; V119-T172 WeakPolarHBondContact CA-O 3.47Å; V119-T172 HydrophobicContact CG1-CG2 4.39Å; V119-K174 HydrophobicContact CG1-CD 4.08Å; V119-K174 HydrophobicContact CG1-CG 3.97Å
120	A	98.8	Very high	98.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	156	172.6	0	0	0	0	0	111.5	I74 V78 Y108 T172 V173 K174	I74-A120 HydrophobicContact CD1-CB 3.67Å; I74-A120 HydrophobicContact CG1-CB 3.77Å; V78-A120 HydrophobicContact CG2-CB 3.44Å; V78-A120 VanDerWaalsContact CG2-CB 3.44Å; Y108-A120 VanDerWaalsContact CB-CB 3.46Å; Y108-A120 HydrophobicContact CD1-CB 4.09Å; Y108-A120 HydrophobicContact CD2-CB 3.98Å; Y108-A120 HydrophobicContact CG-CB 3.57Å; A120-T172 PolarHBondContact N-O 2.85Å; A120-V173 HydrophobicContact CB-CG2 4.42Å; A120-V173 CarbonylContact O-C 3.59Å; A120-V173 WeakPolarHBondContact O-CA 3.37Å; A120-K174 PolarHBondContact O-N 3.47Å
121	D	98.8	Very high	98.1	Very high	36 Å²	36	30.4 Å²	30.4	19%	0.193	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	130.3	-178.7	-54.2	-47.9	0	0	0	110.1	V105 K174 L176	V105-D121 HydrophobicContact CG2-CB 3.71Å; V105-D121 PolarHBondContact N-O 2.71Å; D121-K174 CarbonylContact C-O 3.6Å; D121-K174 WeakPolarHBondContact CA-O 3.33Å; D121-L176 HydrophobicContact CB-CD1 4.31Å
122	L	98.9	Very high	98	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	132.9	168.2	-59.7	-176.6	0	0	0	108.6	V78 I81 I85 V102 R103 Q104 V173 K174 I175 L176	V78-L122 HydrophobicContact CG1-CD2 4.26Å; I81-L122 HydrophobicContact CB-CD1 4.38Å; I81-L122 HydrophobicContact CG2-CD1 3.69Å; I85-L122 HydrophobicContact CD1-CD1 4.37Å; V102-L122 HydrophobicContact CG2-CB 4.36Å; V102-L122 HydrophobicContact CG2-CD1 4.49Å; R103-L122 CarbonylContact O-C 3.5Å; R103-L122 WeakPolarHBondContact O-CA 3.29Å; Q104-L122 HydrophobicContact CB-CD2 4.09Å; Q104-L122 HydrophobicContact CG-CD2 3.43Å; Q104-L122 VanDerWaalsContact CG-CD2 3.43Å; L122-V173 HydrophobicContact CD1-CG1 3.88Å; L122-V173 HydrophobicContact CG-CG1 3.8Å; L122-K174 PolarHBondContact N-O 3.19Å; L122-I175 CarbonylContact O-C 3.58Å; L122-I175 WeakPolarHBondContact O-CA 3.25Å; L122-L176 PolarHBondContact O-N 3.42Å
123	V	98.9	Very high	97.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	128.9	167.6	177.4	0	0	0	0	108.5	V102 R103 V105 I125 L176 T178 A201 A204 I205	V102-V123 CarbonylContact C-O 3.54Å; V102-V123 WeakPolarHBondContact CA-O 3.42Å; R103-V123 PolarHBondContact N-O 2.78Å; R103-V123 PolarHBondContact O-N 3.28Å; V105-V123 HydrophobicContact CB-CG2 4.4Å; V105-V123 HydrophobicContact CG1-CB 4.44Å; V105-V123 HydrophobicContact CG1-CG2 3.88Å; V105-V123 HydrophobicContact CG2-CG2 3.62Å; V123-I125 HydrophobicContact CG1-CG1 4.48Å; V123-L176 VanDerWaalsContact CA-O 3.29Å; V123-L176 WeakPolarHBondContact CA-O 3.16Å; V123-L176 HydrophobicContact CG2-CB 4Å; V123-L176 HydrophobicContact CG2-CD1 4.12Å; V123-T178 HydrophobicContact CG1-CG2 3.71Å; V123-A201 HydrophobicContact CG1-CB 4.05Å; V123-A201 HydrophobicContact CG2-CB 4.25Å; V123-A201 WeakPolarHBondContact CG2-O 3.49Å; V123-A204 HydrophobicContact CG2-CB 4.31Å; V123-I205 HydrophobicContact CB-CD1 3.92Å; V123-I205 HydrophobicContact CB-CG1 3.84Å; V123-I205 HydrophobicContact CG1-CD1 3.5Å; V123-I205 HydrophobicContact CG1-CG1 3.9Å; V123-I205 HydrophobicContact CG2-CG1 4.04Å
124	V	98.9	Very high	97.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	121.3	175.3	175.6	0	0	0	0	108.7	I85 I99 V102 L126 L138 I175 L176 I177 T178	I85-V124 HydrophobicContact CD1-CG2 3.84Å; I85-V124 HydrophobicContact CG2-CG2 4.28Å; I99-V124 HydrophobicContact CD1-CG1 4.29Å; I99-V124 HydrophobicContact CG1-CG1 4.38Å; I99-V124 HydrophobicContact CG2-CG1 3.6Å; V102-V124 HydrophobicContact CB-CG2 4.36Å; V102-V124 HydrophobicContact CG2-CG2 3.88Å; V124-L126 HydrophobicContact CG1-CD2 4.06Å; V124-L138 HydrophobicContact CG1-CD2 4.19Å; V124-I175 HydrophobicContact CB-CG2 4.05Å; V124-I175 HydrophobicContact CG2-CG2 3.58Å; V124-L176 PolarHBondContact N-O 2.93Å; V124-I177 HydrophobicContact CB-CD1 4Å; V124-I177 HydrophobicContact CG1-CD1 4.3Å; V124-T178 PolarHBondContact O-N 3.33Å
125	I	98.8	Very high	97.9	Very high	16 Å²	16	38 Å²	38	8%	0.082	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	117.3	179.8	-48	-175.7	0	0	0	108.3	E100 E101 V123 T178 V180 I205	E100-I125 HydrophobicContact CB-CB 4.2Å; E100-I125 HydrophobicContact CB-CG2 4.12Å; E100-I125 WeakPolarHBondContact CB-O 3.47Å; E100-I125 PolarHBondContact N-O 3.23Å; E101-I125 HydrophobicContact CB-CB 4.45Å; E101-I125 HydrophobicContact CB-CD1 4.19Å; E101-I125 HydrophobicContact CB-CG1 4.4Å; E101-I125 PolarHBondContact N-O 2.99Å; E101-I125 PolarHBondContact O-N 3.13Å; V123-I125 HydrophobicContact CG1-CG1 4.48Å; I125-T178 HydrophobicContact CB-CG2 4.21Å; I125-T178 HydrophobicContact CG1-CG2 3.75Å; I125-T178 HydrophobicContact CG2-CG2 4.3Å; I125-V180 HydrophobicContact CG2-CG1 3.99Å; I125-I205 HydrophobicContact CD1-CD1 3.84Å; I125-I205 HydrophobicContact CG1-CD1 4.17Å
126	L	98.6	Very high	97.9	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	143.2	176.2	-56.2	-175.5	0	0	0	111.4	V97 I99 V124 I128 P130 L138 I177 T178 T179 V180	V97-L126 HydrophobicContact CG1-CD1 4.35Å; V97-L126 HydrophobicContact CG1-CD2 3.81Å; I99-L126 HydrophobicContact CG1-CD2 4.21Å; V124-L126 HydrophobicContact CG1-CD2 4.06Å; L126-I128 VanDerWaalsContact C-N 3.31Å; L126-I128 HydrophobicContact CB-CG1 4.22Å; L126-I128 HydrophobicContact CD1-CG1 4.44Å; L126-P130 HydrophobicContact CD1-CB 4.17Å; L126-L138 HydrophobicContact CD2-CD2 4.09Å; L126-I177 HydrophobicContact CD1-CG2 3.69Å; L126-I177 HydrophobicContact CG-CG2 4.05Å; L126-T178 PolarHBondContact N-O 3.05Å; L126-T179 WeakPolarHBondContact O-CA 3.35Å; L126-T179 PolarHBondContact O-OG1 3.38Å; L126-V180 PolarHBondContact O-N 3.03Å
127	K	98.1	Very high	98	Very high	88 Å²	88	35.5 Å²	35.5	38%	0.383	19%	0.189	S	C	.	.	S	Bend	trans	-75.6	-25.5	167.6	-71.9	173.3	174.1	155.3	0	111.9	Q98 I99 E100 N183	Q98-K127 HydrophobicContact CB-CB 3.96Å; Q98-K127 HydrophobicContact CB-CD 4.13Å; Q98-K127 PolarHBondContact O-N 2.9Å; I99-K127 WeakPolarHBondContact O-CE 3.42Å; I99-K127 PolarHBondContact O-NZ 2.82Å; E100-K127 HydrophobicContact CB-CG 3.91Å; E100-K127 WeakPolarHBondContact OE2-CE 3.33Å; E100-K127 WeakPolarHBondContact OE2-CG 2.72Å; E100-K127 IonicContact OE2-NZ 2.65Å; K127-N183 PolarHBondContact O-ND2 2.99Å
128	I	97.6	Very high	98.1	Very high	53 Å²	53	30.2 Å²	30.2	27%	0.272	17%	0.165	S	C	.	.	S	Bend	trans	-94.3	173.1	179.2	64.4	165.8	0	0	0	111.8	V97 Q98 L126 A134 T179 N183	V97-I128 HydrophobicContact CB-CD1 4.38Å; V97-I128 HydrophobicContact CG1-CD1 4.14Å; V97-I128 HydrophobicContact CG2-CD1 4.42Å; Q98-I128 HydrophobicContact CB-CG2 4.31Å; L126-I128 VanDerWaalsContact C-N 3.31Å; L126-I128 HydrophobicContact CB-CG1 4.22Å; L126-I128 HydrophobicContact CD1-CG1 4.44Å; I128-A134 HydrophobicContact CD1-CB 4.02Å; I128-T179 PolarHBondContact O-OG1 3.36Å; I128-N183 PolarHBondContact O-ND2 3.42Å
129	L	97.9	Very high	98.1	Very high	55 Å²	55	29.5 Å²	29.5	29%	0.288	16%	0.161	S	C	.	.			trans	-69.7	135.1	171.5	-72.3	160.4	0	0	0	110.2	T131 N183 K186 L187 H192	L129-T131 PolarHBondContact O-N 2.99Å; L129-N183 HydrophobicContact CD2-CB 3.87Å; L129-K186 HydrophobicContact CD2-CB 4.28Å; L129-L187 HydrophobicContact CD2-CD2 4.2Å; L129-H192 WeakPolarHBondContact CB-NE2 3.33Å
130	P	97.6	Very high	98.1	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.173	C	C	.	.			trans	-83.2	78	-173.2	33.5	-34.3	0	0	0	111	L126 I177 T179 L187 H192 L193 L198	L126-P130 HydrophobicContact CD1-CB 4.17Å; P130-I177 HydrophobicContact CB-CG2 3.91Å; P130-T179 HydrophobicContact CG-CG2 4.18Å; P130-L187 HydrophobicContact CG-CD2 4.18Å; P130-H192 WeakPolarHBondContact O-CA 3.4Å; P130-L193 HydrophobicContact CB-CD1 4.33Å; P130-L193 HydrophobicContact CB-CG 4.44Å; P130-L193 PolarHBondContact O-N 2.94Å; P130-L198 HydrophobicContact CB-CD2 4.05Å; P130-L198 HydrophobicContact CG-CD1 3.68Å; P130-L198 HydrophobicContact CG-CD2 3.64Å; P130-L198 HydrophobicContact CG-CG 4.34Å
131	T	97.8	Very high	98.1	Very high	34 Å²	34	35.6 Å²	35.6	21%	0.209	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-76.5	158.2	172.7	82.8	0	0	0	0	111.3	L129 E133 A134 V135 L191	L129-T131 PolarHBondContact O-N 2.99Å; T131-E133 VanDerWaalsContact C-N 3.25Å; T131-E133 WeakPolarHBondContact CB-OE2 3.37Å; T131-E133 PolarHBondContact O-N 3.48Å; T131-E133 PolarHBondContact OG1-N 3.06Å; T131-E133 PolarHBondContact OG1-OE2 3.39Å; T131-A134 PolarHBondContact O-N 2.91Å; T131-A134 PolarHBondContact OG1-N 2.89Å; T131-A134 VanDerWaalsContact OG1-N 3.1Å; T131-V135 VanDerWaalsContact O-CG2 3.24Å; T131-V135 WeakPolarHBondContact O-CG2 3.49Å; T131-V135 PolarHBondContact O-N 3.47Å; T131-L191 WeakPolarHBondContact CA-O 3.45Å
132	L	95.4	Very high	98.1	Very high	106 Å²	106	33.9 Å²	33.9	56%	0.555	18%	0.18	S	C	*	.	H	α-helix	trans	-60.5	-36.5	176.3	-65.6	176	0	0	0	112.1	V135 A136 L193	L132-V135 PolarHBondContact O-N 3.48Å; L132-A136 WeakPolarHBondContact O-CB 3.38Å; L132-A136 PolarHBondContact O-N 3.4Å; L132-L193 HydrophobicContact CD2-CD2 3.64Å
133	E	96.8	Very high	98.1	Very high	129 Å²	129	34 Å²	34	60%	0.603	18%	0.181	S	C	*	.	H	α-helix	trans	-66.7	-42.6	177.3	-56.6	75.1	-163.7	0	0	111.4	T131 V135 A136 A137	T131-E133 VanDerWaalsContact C-N 3.25Å; T131-E133 WeakPolarHBondContact CB-OE2 3.37Å; T131-E133 PolarHBondContact O-N 3.48Å; T131-E133 PolarHBondContact OG1-N 3.06Å; T131-E133 PolarHBondContact OG1-OE2 3.39Å; E133-V135 VanDerWaalsContact C-N 3.33Å; E133-V135 PolarHBondContact O-N 3.04Å; E133-A136 PolarHBondContact O-N 3.42Å; E133-A137 VanDerWaalsContact O-CB 3.25Å; E133-A137 WeakPolarHBondContact O-CB 3.26Å; E133-A137 PolarHBondContact O-N 3.04Å
134	A	97.9	Very high	98	Very high	9 Å²	9	39.1 Å²	39.1	7%	0.074	21%	0.205	C	C	.	.	H	α-helix	trans	-63.5	-40.4	176.8	0	0	0	0	0	111.5	V97 I128 T131 A137 L138	V97-A134 HydrophobicContact CG2-CB 4.04Å; I128-A134 HydrophobicContact CD1-CB 4.02Å; T131-A134 PolarHBondContact O-N 2.91Å; T131-A134 PolarHBondContact OG1-N 2.89Å; T131-A134 VanDerWaalsContact OG1-N 3.1Å; A134-A137 PolarHBondContact O-N 3.44Å; A134-L138 WeakPolarHBondContact O-CB 3.23Å; A134-L138 PolarHBondContact O-N 2.89Å
135	V	98.1	Very high	97.9	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.012	22%	0.215	C	C	.	.	H	α-helix	trans	-62	-48.5	175.4	174	0	0	0	0	110.8	T131 L132 E133 L138 G139 T159 G163 F164 I177 L193	T131-V135 VanDerWaalsContact O-CG2 3.24Å; T131-V135 WeakPolarHBondContact O-CG2 3.49Å; T131-V135 PolarHBondContact O-N 3.47Å; L132-V135 PolarHBondContact O-N 3.48Å; E133-V135 VanDerWaalsContact C-N 3.33Å; E133-V135 PolarHBondContact O-N 3.04Å; V135-L138 PolarHBondContact O-N 3.11Å; V135-G139 PolarHBondContact O-N 2.97Å; V135-T159 HydrophobicContact CG1-CG2 4.4Å; V135-G163 VanDerWaalsContact CG1-C 3.48Å; V135-G163 WeakPolarHBondContact CG1-O 3.46Å; V135-F164 HydrophobicContact CG1-CD1 4.16Å; V135-I177 HydrophobicContact CG1-CG1 4.33Å; V135-I177 HydrophobicContact CG2-CB 4.41Å; V135-I177 HydrophobicContact CG2-CG1 4.15Å; V135-I177 HydrophobicContact CG2-CG2 4.17Å; V135-L193 HydrophobicContact CG2-CD1 3.89Å; V135-L193 HydrophobicContact CG2-CG 4.29Å
136	A	98.1	Very high	97.9	Very high	30 Å²	30	40.1 Å²	40.1	25%	0.248	21%	0.211	C	C	.	.	H	α-helix	trans	-63.9	-42.4	178.3	0	0	0	0	0	112.2	L132 E133 L138 G139 N140 T159	L132-A136 WeakPolarHBondContact O-CB 3.38Å; L132-A136 PolarHBondContact O-N 3.4Å; E133-A136 PolarHBondContact O-N 3.42Å; A136-L138 VanDerWaalsContact C-N 3.35Å; A136-L138 PolarHBondContact O-N 2.98Å; A136-G139 PolarHBondContact O-N 2.98Å; A136-N140 WeakPolarHBondContact O-CB 3.25Å; A136-N140 PolarHBondContact O-N 3.25Å; A136-N140 PolarHBondContact O-ND2 3.21Å; A136-T159 HydrophobicContact CB-CG2 3.94Å
137	A	98.4	Very high	97.8	Very high	40 Å²	40	45.7 Å²	45.7	33%	0.331	23%	0.233	S	C	.	.	H	α-helix	trans	-61.8	-42.1	176.8	0	0	0	0	0	111.7	V97 E133 A134 K141	V97-A137 HydrophobicContact CG2-CB 4.24Å; E133-A137 VanDerWaalsContact O-CB 3.25Å; E133-A137 WeakPolarHBondContact O-CB 3.26Å; E133-A137 PolarHBondContact O-N 3.04Å; A134-A137 PolarHBondContact O-N 3.44Å; A137-K141 VanDerWaalsContact O-CB 3.27Å; A137-K141 WeakPolarHBondContact O-CB 3.36Å; A137-K141 PolarHBondContact O-N 3.24Å
138	L	98.6	Very high	97.7	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.5	-47.1	174.6	-179.9	59.6	0	0	0	112	L88 F95 V97 I99 V124 L126 A134 V135 A136 N140 K141 V142 F164 I177	L88-L138 HydrophobicContact CD1-CD1 4.02Å; F95-L138 HydrophobicContact CE1-CD1 3.9Å; F95-L138 HydrophobicContact CZ-CB 4.44Å; F95-L138 HydrophobicContact CZ-CD1 4.38Å; V97-L138 HydrophobicContact CG1-CB 4.2Å; V97-L138 HydrophobicContact CG1-CD2 4.34Å; I99-L138 HydrophobicContact CD1-CD1 3.79Å; I99-L138 HydrophobicContact CD1-CD2 4.37Å; V124-L138 HydrophobicContact CG1-CD2 4.19Å; L126-L138 HydrophobicContact CD2-CD2 4.09Å; A134-L138 WeakPolarHBondContact O-CB 3.23Å; A134-L138 PolarHBondContact O-N 2.89Å; V135-L138 PolarHBondContact O-N 3.11Å; A136-L138 VanDerWaalsContact C-N 3.35Å; A136-L138 PolarHBondContact O-N 2.98Å; L138-N140 PolarHBondContact O-N 3.18Å; L138-K141 PolarHBondContact O-N 3.28Å; L138-V142 HydrophobicContact CD1-CG2 3.99Å; L138-V142 HydrophobicContact CG-CG2 4.46Å; L138-V142 VanDerWaalsContact O-CG2 3.31Å; L138-V142 WeakPolarHBondContact O-CG2 3.21Å; L138-V142 PolarHBondContact O-N 3.44Å; L138-F164 HydrophobicContact CB-CE1 4.26Å; L138-F164 HydrophobicContact CD2-CE1 3.97Å; L138-F164 HydrophobicContact CD2-CZ 4.43Å; L138-F164 HydrophobicContact CG-CE1 3.83Å; L138-F164 HydrophobicContact CG-CZ 4.06Å; L138-I177 HydrophobicContact CD2-CD1 3.87Å
139	G	98.4	Very high	97.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-56.2	-48.9	176.4	0	0	0	0	0	112.3	V135 A136 V142 V143	V135-G139 PolarHBondContact O-N 2.97Å; A136-G139 PolarHBondContact O-N 2.98Å; G139-V142 PolarHBondContact O-N 3.31Å; G139-V143 WeakPolarHBondContact O-CG1 3.33Å; G139-V143 PolarHBondContact O-N 3.42Å
140	N	98.4	Very high	97.4	Very high	73 Å²	73	49.8 Å²	49.8	39%	0.39	26%	0.26	S	S	.	.	H	α-helix	trans	-60	-47.4	176.2	-75.6	-33.7	0	0	0	111.7	A136 L138 V142 V143 E144 M157	A136-N140 WeakPolarHBondContact O-CB 3.25Å; A136-N140 PolarHBondContact O-N 3.25Å; A136-N140 PolarHBondContact O-ND2 3.21Å; L138-N140 PolarHBondContact O-N 3.18Å; N140-V142 VanDerWaalsContact C-N 3.32Å; N140-V142 PolarHBondContact O-N 2.96Å; N140-V143 WeakPolarHBondContact O-CG1 3.45Å; N140-V143 PolarHBondContact O-N 3.32Å; N140-E144 VanDerWaalsContact O-CB 3.29Å; N140-E144 WeakPolarHBondContact O-CB 3.42Å; N140-E144 WeakPolarHBondContact O-CG 3.45Å; N140-E144 PolarHBondContact O-N 3.02Å; N140-M157 HydrophobicContact CB-CE 4.43Å; N140-M157 WeakPolarHBondContact OD1-CE 3.36Å
141	K	98.3	Very high	97.2	Very high	76 Å²	76	55 Å²	55	33%	0.33	29%	0.294	S	S	.	.	H	α-helix	trans	-60	-42.9	-179.7	-178.4	60.9	-179.5	176.5	0	112.1	L88 F95 A137 L138 T145	L88-K141 HydrophobicContact CD1-CG 4.32Å; L88-K141 HydrophobicContact CD2-CG 4.31Å; F95-K141 HydrophobicContact CD1-CG 4.26Å; F95-K141 HydrophobicContact CD2-CB 4.42Å; F95-K141 HydrophobicContact CD2-CD 4.32Å; F95-K141 HydrophobicContact CD2-CG 4.09Å; F95-K141 HydrophobicContact CE1-CB 4.15Å; F95-K141 HydrophobicContact CE1-CG 4.01Å; F95-K141 HydrophobicContact CE2-CB 3.72Å; F95-K141 HydrophobicContact CE2-CD 4.41Å; F95-K141 HydrophobicContact CE2-CG 3.88Å; F95-K141 HydrophobicContact CG-CG 4.29Å; F95-K141 HydrophobicContact CZ-CB 3.58Å; F95-K141 HydrophobicContact CZ-CG 3.85Å; A137-K141 VanDerWaalsContact O-CB 3.27Å; A137-K141 WeakPolarHBondContact O-CB 3.36Å; A137-K141 PolarHBondContact O-N 3.24Å; L138-K141 PolarHBondContact O-N 3.28Å; K141-T145 WeakPolarHBondContact O-CB 3.33Å; K141-T145 PolarHBondContact O-N 3.28Å; K141-T145 VanDerWaalsContact O-N 3.13Å; K141-T145 PolarHBondContact O-OG1 2.86Å
142	V	98.4	Very high	97	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-65.8	-51.7	179.8	174.5	0	0	0	0	110.3	I81 V84 I85 L88 L138 G139 N140 E144 T145 L146 F164 I166	I81-V142 HydrophobicContact CG2-CG1 4.29Å; V84-V142 HydrophobicContact CB-CG1 4.49Å; V84-V142 HydrophobicContact CG1-CB 4.35Å; V84-V142 HydrophobicContact CG1-CG1 4.11Å; V84-V142 HydrophobicContact CG1-CG2 4.21Å; I85-V142 HydrophobicContact CG1-CG2 4.2Å; L88-V142 HydrophobicContact CD1-CG2 4.19Å; L138-V142 HydrophobicContact CD1-CG2 3.99Å; L138-V142 HydrophobicContact CG-CG2 4.46Å; L138-V142 VanDerWaalsContact O-CG2 3.31Å; L138-V142 WeakPolarHBondContact O-CG2 3.21Å; L138-V142 PolarHBondContact O-N 3.44Å; G139-V142 PolarHBondContact O-N 3.31Å; N140-V142 VanDerWaalsContact C-N 3.32Å; N140-V142 PolarHBondContact O-N 2.96Å; V142-E144 PolarHBondContact O-N 3.42Å; V142-T145 PolarHBondContact O-N 3.34Å; V142-L146 HydrophobicContact CG1-CD1 4.22Å; V142-L146 WeakPolarHBondContact O-CG 3.35Å; V142-L146 PolarHBondContact O-N 2.97Å; V142-F164 HydrophobicContact CG2-CZ 4.43Å; V142-I166 HydrophobicContact CB-CD1 4.14Å; V142-I166 HydrophobicContact CG1-CD1 3.51Å
143	V	98.3	Very high	96.9	Very high	3 Å²	3	56.1 Å²	56.1	2%	0.018	30%	0.302	C	S	.	.	H	α-helix	trans	-66.5	-36.7	-177.2	73.1	0	0	0	0	112.7	G139 N140 L146 R147 L155 M157 I166	G139-V143 WeakPolarHBondContact O-CG1 3.33Å; G139-V143 PolarHBondContact O-N 3.42Å; N140-V143 WeakPolarHBondContact O-CG1 3.45Å; N140-V143 PolarHBondContact O-N 3.32Å; V143-L146 PolarHBondContact O-N 3.26Å; V143-R147 WeakPolarHBondContact O-CG 3.34Å; V143-R147 PolarHBondContact O-N 3.11Å; V143-L155 HydrophobicContact CG2-CB 4Å; V143-M157 HydrophobicContact CB-CB 3.85Å; V143-M157 HydrophobicContact CB-CG 4.27Å; V143-M157 HydrophobicContact CG1-CB 3.8Å; V143-M157 HydrophobicContact CG1-CE 4.48Å; V143-M157 HydrophobicContact CG1-CG 4.21Å; V143-M157 HydrophobicContact CG2-CB 4.01Å; V143-I166 HydrophobicContact CB-CD1 4.32Å
144	E	97.5	Very high	96.9	Very high	107 Å²	107	56.2 Å²	56.2	50%	0.5	31%	0.311	S	S	.	.	H	α-helix	trans	-65	-39.3	175.4	-74.8	175.4	175.2	0	0	112.2	N140 V142 L146 R147 T148	N140-E144 VanDerWaalsContact O-CB 3.29Å; N140-E144 WeakPolarHBondContact O-CB 3.42Å; N140-E144 WeakPolarHBondContact O-CG 3.45Å; N140-E144 PolarHBondContact O-N 3.02Å; V142-E144 PolarHBondContact O-N 3.42Å; E144-L146 VanDerWaalsContact C-N 3.34Å; E144-R147 PolarHBondContact O-N 3.43Å; E144-T148 WeakPolarHBondContact O-CB 3.47Å; E144-T148 PolarHBondContact O-N 2.63Å; E144-T148 PolarHBondContact O-OG1 3.23Å
145	T	97.5	Very high	96.9	Very high	35 Å²	35	56.1 Å²	56.1	22%	0.215	31%	0.31	C	S	.	.	H	α-helix	trans	-63.8	-42.8	175.8	-56.6	0	0	0	0	110.5	V84 K141 V142 T148 Q149	V84-T145 HydrophobicContact CG1-CG2 3.99Å; V84-T145 HydrophobicContact CG2-CG2 3.92Å; K141-T145 WeakPolarHBondContact O-CB 3.33Å; K141-T145 PolarHBondContact O-N 3.28Å; K141-T145 VanDerWaalsContact O-N 3.13Å; K141-T145 PolarHBondContact O-OG1 2.86Å; V142-T145 PolarHBondContact O-N 3.34Å; T145-T148 PolarHBondContact O-N 3.24Å; T145-Q149 WeakPolarHBondContact O-CG 3.45Å; T145-Q149 PolarHBondContact O-N 3.21Å; T145-Q149 VanDerWaalsContact O-N 3.08Å
146	L	97.7	Very high	96.8	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-62.8	-46.8	175.9	-67.6	174.3	0	0	0	112.3	K80 I81 V84 V142 V143 E144 T148 Q149 D150 L155 I166	K80-L146 HydrophobicContact CB-CD2 3.75Å; I81-L146 HydrophobicContact CG1-CD1 3.72Å; V84-L146 HydrophobicContact CG2-CD2 3.64Å; V84-L146 HydrophobicContact CG2-CG 4.15Å; V142-L146 HydrophobicContact CG1-CD1 4.22Å; V142-L146 WeakPolarHBondContact O-CG 3.35Å; V142-L146 PolarHBondContact O-N 2.97Å; V143-L146 PolarHBondContact O-N 3.26Å; E144-L146 VanDerWaalsContact C-N 3.34Å; L146-T148 PolarHBondContact O-N 3.37Å; L146-Q149 PolarHBondContact O-N 3.16Å; L146-Q149 VanDerWaalsContact O-N 3.09Å; L146-D150 PolarHBondContact O-N 2.83Å; L146-L155 HydrophobicContact CB-CD1 3.65Å; L146-L155 HydrophobicContact CD1-CD1 3.92Å; L146-L155 HydrophobicContact CG-CD1 4.42Å; L146-I166 HydrophobicContact CD1-CD1 4.32Å
147	R	96.9	Very high	96.8	Very high	118 Å²	118	58.8 Å²	58.8	45%	0.445	32%	0.323	S	S	.	.	H	α-helix	trans	-61.7	-29.2	176.3	-72.6	172.5	179.5	168	0.5	113	V143 E144 D150 P151 L155	V143-R147 WeakPolarHBondContact O-CG 3.34Å; V143-R147 PolarHBondContact O-N 3.11Å; E144-R147 PolarHBondContact O-N 3.43Å; R147-D150 CarbonylContact O-C 3.41Å; R147-P151 VanDerWaalsContact O-CA 3.22Å; R147-P151 WeakPolarHBondContact O-CA 3.42Å; R147-P151 WeakPolarHBondContact O-CG 3.26Å; R147-L155 PolarHBondContact NH2-O 3.31Å
148	T	96.4	Very high	96.8	Very high	114 Å²	114	61.9 Å²	61.9	70%	0.699	33%	0.334	S	S	*	.	H	α-helix	trans	-74	-37.7	175.3	-55.7	0	0	0	0	111.4	E144 T145 L146	E144-T148 WeakPolarHBondContact O-CB 3.47Å; E144-T148 PolarHBondContact O-N 2.63Å; E144-T148 PolarHBondContact O-OG1 3.23Å; T145-T148 PolarHBondContact O-N 3.24Å; L146-T148 PolarHBondContact O-N 3.37Å
149	Q	95.3	Very high	96.8	Very high	119 Å²	119	65.7 Å²	65.7	56%	0.556	36%	0.357	S	S	*	.	H	α-helix	trans	-72.6	-35.9	177.8	-70.5	174	1.5	0	0	112.5	T145 L146	T145-Q149 WeakPolarHBondContact O-CG 3.45Å; T145-Q149 PolarHBondContact O-N 3.21Å; T145-Q149 VanDerWaalsContact O-N 3.08Å; L146-Q149 PolarHBondContact O-N 3.16Å; L146-Q149 VanDerWaalsContact O-N 3.09Å
150	D	94.1	Very high	96.7	Very high	49 Å²	49	68 Å²	68	26%	0.262	37%	0.37	S	S	.	.			trans	-141.2	89	177.2	-172.4	-6.6	0	0	0	110.9	K80 L146 R147 T152 E153	K80-D150 IonicContact NZ-OD2 2.68Å; L146-D150 PolarHBondContact O-N 2.83Å; R147-D150 CarbonylContact O-C 3.41Å; D150-T152 PolarHBondContact O-N 3.08Å; D150-T152 VanDerWaalsContact O-N 3.16Å; D150-T152 PolarHBondContact OD1-N 2.93Å; D150-T152 PolarHBondContact OD1-OG1 2.78Å; D150-E153 HydrophobicContact CB-CB 4.32Å; D150-E153 PolarHBondContact O-N 2.89Å; D150-E153 PolarHBondContact OD1-N 2.66Å
151	P	93.3	Very high	96.6	Very high	109 Å²	109	72.5 Å²	72.5	71%	0.708	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-13.4	-179.1	-21.9	33.5	0	0	0	114.4	R147	R147-P151 VanDerWaalsContact O-CA 3.22Å; R147-P151 WeakPolarHBondContact O-CA 3.42Å; R147-P151 WeakPolarHBondContact O-CG 3.26Å
152	T	93.3	Very high	96.5	Very high	122 Å²	122	71 Å²	71	75%	0.748	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-20.8	-178.2	67.1	0	0	0	0	112.5	D150 V154	D150-T152 PolarHBondContact O-N 3.08Å; D150-T152 VanDerWaalsContact O-N 3.16Å; D150-T152 PolarHBondContact OD1-N 2.93Å; D150-T152 PolarHBondContact OD1-OG1 2.78Å; T152-V154 PolarHBondContact O-N 3.48Å
153	E	93.6	Very high	96.5	Very high	42 Å²	42	71 Å²	71	20%	0.196	39%	0.385	C	S	.	.	S	Bend	trans	-79.4	117	178.8	-168.1	174	-136.1	0	0	110.8	K80 D150 L155	K80-E153 IonicContact NZ-OE1 3.09Å; K80-E153 PolarHBondContact NZ-OE1 3.02Å; K80-E153 IonicContact NZ-OE2 3.23Å; K80-E153 PolarHBondContact NZ-OE2 2.86Å; D150-E153 HydrophobicContact CB-CB 4.32Å; D150-E153 PolarHBondContact O-N 2.89Å; D150-E153 PolarHBondContact OD1-N 2.66Å; E153-L155 HydrophobicContact CG-CD2 3.85Å; E153-L155 HydrophobicContact CG-CG 4Å; E153-L155 PolarHBondContact O-N 3.3Å
154	V	95.9	Very high	96.6	Very high	131 Å²	131	70.9 Å²	70.9	79%	0.794	39%	0.385	S	S	*	.			trans	-81.2	107.8	176.9	-177.5	0	0	0	0	109.1	T152	T152-V154 PolarHBondContact O-N 3.48Å
155	L	97.6	Very high	96.6	Very high	7 Å²	7	68.1 Å²	68.1	4%	0.037	37%	0.372	C	S	.	.			trans	-115.1	139.2	177.9	-60.2	176	0	0	0	111.1	L77 V143 L146 R147 E153 I166 S167	L77-L155 HydrophobicContact CD1-CD2 4.05Å; V143-L155 HydrophobicContact CG2-CB 4Å; L146-L155 HydrophobicContact CB-CD1 3.65Å; L146-L155 HydrophobicContact CD1-CD1 3.92Å; L146-L155 HydrophobicContact CG-CD1 4.42Å; R147-L155 PolarHBondContact NH2-O 3.31Å; E153-L155 HydrophobicContact CG-CD2 3.85Å; E153-L155 HydrophobicContact CG-CG 4Å; E153-L155 PolarHBondContact O-N 3.3Å; L155-I166 HydrophobicContact CB-CG2 4.48Å; L155-I166 HydrophobicContact CD2-CG2 4.48Å; L155-S167 WeakPolarHBondContact CA-O 3.47Å
156	S	97.6	Very high	96.7	Very high	57 Å²	57	66.4 Å²	66.4	40%	0.399	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	147.8	167.3	62.7	0	0	0	0	110	I166 S167	S156-I166 CarbonylContact O-C 3.5Å; S156-I166 VanDerWaalsContact O-CA 3.29Å; S156-I166 WeakPolarHBondContact O-CA 3.34Å; S156-S167 PolarHBondContact N-O 2.87Å; S156-S167 PolarHBondContact O-N 2.86Å; S156-S167 PolarHBondContact OG-O 3.21Å
157	M	98.1	Very high	96.7	Very high	31 Å²	31	67.3 Å²	67.3	15%	0.153	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	129.6	175.5	-175.4	-76.4	-58.3	0	0	108.4	N140 V143 T159 F164 E165 I166	N140-M157 HydrophobicContact CB-CE 4.43Å; N140-M157 WeakPolarHBondContact OD1-CE 3.36Å; V143-M157 HydrophobicContact CB-CB 3.85Å; V143-M157 HydrophobicContact CB-CG 4.27Å; V143-M157 HydrophobicContact CG1-CB 3.8Å; V143-M157 HydrophobicContact CG1-CE 4.48Å; V143-M157 HydrophobicContact CG1-CG 4.21Å; V143-M157 HydrophobicContact CG2-CB 4.01Å; M157-T159 HydrophobicContact SD-CG2 4.48Å; M157-F164 HydrophobicContact CG-CD2 4.23Å; M157-F164 HydrophobicContact SD-CB 4.14Å; M157-F164 HydrophobicContact SD-CD2 4.46Å; M157-E165 VanDerWaalsContact CA-O 3.29Å; M157-E165 WeakPolarHBondContact CA-O 3.38Å; M157-I166 HydrophobicContact CB-CG1 4.16Å; M157-I166 HydrophobicContact CG-CG1 3.84Å
158	L	98.3	Very high	96.7	Very high	105 Å²	105	62.9 Å²	62.9	55%	0.55	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	134.1	179.5	-64.7	174.4	0	0	0	109.7	F164 E165	L158-F164 CarbonylContact O-C 3.46Å; L158-F164 WeakPolarHBondContact O-CA 3.38Å; L158-F164 WeakPolarHBondContact O-CB 3.3Å; L158-E165 HydrophobicContact CB-CG 4.42Å; L158-E165 PolarHBondContact N-O 2.8Å; L158-E165 PolarHBondContact O-N 3.24Å
159	T	97.9	Very high	96.7	Very high	79 Å²	79	62.2 Å²	62.2	49%	0.485	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	151.8	169.3	52.3	0	0	0	0	110.6	V135 A136 M157 G163 F164	V135-T159 HydrophobicContact CG1-CG2 4.4Å; A136-T159 HydrophobicContact CB-CG2 3.94Å; M157-T159 HydrophobicContact SD-CG2 4.48Å; T159-G163 WeakPolarHBondContact CA-O 3.49Å; T159-F164 HydrophobicContact CG2-CB 4.25Å
160	N	96.6	Very high	96.7	Very high	50 Å²	50	62.1 Å²	62.1	27%	0.267	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	179.4	177.7	61.9	51.9	0	0	0	110.5	T162 G163	N160-T162 PolarHBondContact O-N 3.1Å; N160-T162 VanDerWaalsContact O-N 3.07Å; N160-T162 WeakPolarHBondContact OD1-CA 3.22Å; N160-T162 PolarHBondContact OD1-N 2.94Å; N160-T162 PolarHBondContact OD1-OG1 3.01Å; N160-G163 PolarHBondContact N-O 2.86Å; N160-G163 PolarHBondContact O-N 2.97Å; N160-G163 VanDerWaalsContact O-N 3.13Å; N160-G163 VanDerWaalsContact O-O 3.08Å; N160-G163 PolarHBondContact OD1-N 3.45Å; N160-G163 VanDerWaalsContact OD1-N 3.15Å
161	E	95.6	Very high	96.9	Very high	166 Å²	166	59.9 Å²	59.9	78%	0.776	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-25.1	-177.4	-62.3	-179.8	178.4	0	0	114
162	T	97.2	Very high	97.2	Very high	45 Å²	45	56.1 Å²	56.1	28%	0.276	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-9.5	-177.2	63.7	0	0	0	0	114.4	N160 L176 I177 V197	N160-T162 PolarHBondContact O-N 3.1Å; N160-T162 VanDerWaalsContact O-N 3.07Å; N160-T162 WeakPolarHBondContact OD1-CA 3.22Å; N160-T162 PolarHBondContact OD1-N 2.94Å; N160-T162 PolarHBondContact OD1-OG1 3.01Å; T162-L176 HydrophobicContact CG2-CD2 4.44Å; T162-L176 WeakPolarHBondContact O-CA 3.48Å; T162-I177 PolarHBondContact O-N 3.47Å; T162-V197 HydrophobicContact CG2-CG1 4.16Å
163	G	98.4	Very high	97.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	143.9	-112.3	-170	0	0	0	0	0	110.7	V135 T159 N160 I175	V135-G163 VanDerWaalsContact CG1-C 3.48Å; V135-G163 WeakPolarHBondContact CG1-O 3.46Å; T159-G163 WeakPolarHBondContact CA-O 3.49Å; N160-G163 PolarHBondContact N-O 2.86Å; N160-G163 PolarHBondContact O-N 2.97Å; N160-G163 VanDerWaalsContact O-N 3.13Å; N160-G163 VanDerWaalsContact O-O 3.08Å; N160-G163 PolarHBondContact OD1-N 3.45Å; N160-G163 VanDerWaalsContact OD1-N 3.15Å; G163-I175 WeakPolarHBondContact CA-O 3.33Å
164	F	98.8	Very high	97.7	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	168.1	175.9	62	-88.7	0	0	0	111.2	V135 L138 V142 M157 L158 T159 I166 I175 I177	V135-F164 HydrophobicContact CG1-CD1 4.16Å; L138-F164 HydrophobicContact CB-CE1 4.26Å; L138-F164 HydrophobicContact CD2-CE1 3.97Å; L138-F164 HydrophobicContact CD2-CZ 4.43Å; L138-F164 HydrophobicContact CG-CE1 3.83Å; L138-F164 HydrophobicContact CG-CZ 4.06Å; V142-F164 HydrophobicContact CG2-CZ 4.43Å; M157-F164 HydrophobicContact CG-CD2 4.23Å; M157-F164 HydrophobicContact SD-CB 4.14Å; M157-F164 HydrophobicContact SD-CD2 4.46Å; L158-F164 CarbonylContact O-C 3.46Å; L158-F164 WeakPolarHBondContact O-CA 3.38Å; L158-F164 WeakPolarHBondContact O-CB 3.3Å; T159-F164 HydrophobicContact CG2-CB 4.25Å; F164-I166 HydrophobicContact CD2-CD1 4.5Å; F164-I166 HydrophobicContact CD2-CG1 4.2Å; F164-I166 HydrophobicContact CE2-CD1 4.05Å; F164-I166 HydrophobicContact CE2-CG1 4.22Å; F164-I175 HydrophobicContact CD1-CB 4.11Å; F164-I175 HydrophobicContact CD1-CG2 4.2Å; F164-I175 HydrophobicContact CD2-CB 4.04Å; F164-I175 HydrophobicContact CD2-CD1 3.74Å; F164-I175 HydrophobicContact CD2-CG1 4.06Å; F164-I175 HydrophobicContact CE1-CB 3.83Å; F164-I175 HydrophobicContact CE1-CG1 4.31Å; F164-I175 HydrophobicContact CE1-CG2 3.58Å; F164-I175 HydrophobicContact CE2-CB 3.75Å; F164-I175 HydrophobicContact CE2-CD1 3.4Å; F164-I175 HydrophobicContact CE2-CG1 3.44Å; F164-I175 VanDerWaalsContact CE2-CG1 3.44Å; F164-I175 HydrophobicContact CE2-CG2 4.26Å; F164-I175 HydrophobicContact CG-CB 4.22Å; F164-I175 HydrophobicContact CZ-CB 3.64Å; F164-I175 HydrophobicContact CZ-CD1 4.11Å; F164-I175 HydrophobicContact CZ-CG1 3.59Å; F164-I175 HydrophobicContact CZ-CG2 3.62Å; F164-I175 PolarHBondContact N-O 3.14Å; F164-I175 WeakPolarHBondContact O-CA 3.44Å; F164-I175 PolarHBondContact O-N 3.23Å; F164-I177 HydrophobicContact CE1-CD1 4.14Å
165	E	98.6	Very high	97.8	Very high	49 Å²	49	45.5 Å²	45.5	23%	0.229	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	147.3	173.3	61.7	-172.8	-158	0	0	110.7	M157 L158 T172 V173 K174	M157-E165 VanDerWaalsContact CA-O 3.29Å; M157-E165 WeakPolarHBondContact CA-O 3.38Å; L158-E165 HydrophobicContact CB-CG 4.42Å; L158-E165 PolarHBondContact N-O 2.8Å; L158-E165 PolarHBondContact O-N 3.24Å; E165-T172 HydrophobicContact CB-CG2 4.16Å; E165-V173 VanDerWaalsContact CA-O 3.31Å; E165-V173 WeakPolarHBondContact CA-O 3.3Å; E165-K174 HydrophobicContact CB-CG 4.09Å; E165-K174 VanDerWaalsContact OE2-CE 3.29Å; E165-K174 WeakPolarHBondContact OE2-CE 3.43Å
166	I	98.8	Very high	97.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	125.4	174.3	-62.6	176.9	0	0	0	107.7	L77 I81 V142 V143 L146 L155 S156 M157 F164 T172 V173	L77-I166 HydrophobicContact CD1-CG2 4.4Å; I81-I166 HydrophobicContact CD1-CB 3.85Å; I81-I166 HydrophobicContact CD1-CD1 4.16Å; I81-I166 HydrophobicContact CD1-CG2 4.08Å; I81-I166 HydrophobicContact CG1-CD1 4.26Å; V142-I166 HydrophobicContact CB-CD1 4.14Å; V142-I166 HydrophobicContact CG1-CD1 3.51Å; V143-I166 HydrophobicContact CB-CD1 4.32Å; L146-I166 HydrophobicContact CD1-CD1 4.32Å; L155-I166 HydrophobicContact CB-CG2 4.48Å; L155-I166 HydrophobicContact CD2-CG2 4.48Å; S156-I166 CarbonylContact O-C 3.5Å; S156-I166 VanDerWaalsContact O-CA 3.29Å; S156-I166 WeakPolarHBondContact O-CA 3.34Å; M157-I166 HydrophobicContact CB-CG1 4.16Å; M157-I166 HydrophobicContact CG-CG1 3.84Å; F164-I166 HydrophobicContact CD2-CD1 4.5Å; F164-I166 HydrophobicContact CD2-CG1 4.2Å; F164-I166 HydrophobicContact CE2-CD1 4.05Å; F164-I166 HydrophobicContact CE2-CG1 4.22Å; I166-T172 WeakPolarHBondContact O-CA 3.42Å; I166-V173 PolarHBondContact N-O 2.86Å; I166-V173 PolarHBondContact O-N 3.34Å
167	S	98.4	Very high	97.9	Very high	20 Å²	20	43.8 Å²	43.8	14%	0.14	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.5	-177.7	-55.8	0	0	0	0	111.1	L155 S156 A171 T172	L155-S167 WeakPolarHBondContact CA-O 3.47Å; S156-S167 PolarHBondContact N-O 2.87Å; S156-S167 PolarHBondContact O-N 2.86Å; S156-S167 PolarHBondContact OG-O 3.21Å; S167-A171 WeakPolarHBondContact CA-O 3.12Å; S167-T172 WeakPolarHBondContact CB-OG1 3.41Å; S167-T172 VanDerWaalsContact OG-CG2 3.27Å; S167-T172 WeakPolarHBondContact OG-CG2 3.35Å; S167-T172 PolarHBondContact OG-OG1 3.08Å
168	S	97.2	Very high	98	Very high	26 Å²	26	42.3 Å²	42.3	18%	0.182	24%	0.239	C	C	.	.			trans	-93	-174.9	161.4	73	0	0	0	0	109.9	D170 A171	S168-D170 PolarHBondContact O-N 3.35Å; S168-D170 PolarHBondContact OG-N 2.94Å; S168-A171 PolarHBondContact N-O 2.85Å; S168-A171 PolarHBondContact OG-N 2.74Å; S168-A171 VanDerWaalsContact OG-N 3.15Å; S168-A171 PolarHBondContact OG-O 3.31Å
169	A	95.6	Very high	98	Very high	99 Å²	99	37.3 Å²	37.3	82%	0.818	21%	0.213	S	C	*	.	S	Bend	trans	-61.9	-29.8	173.6	0	0	0	0	0	113.2
170	D	96.6	Very high	98	Very high	117 Å²	117	35 Å²	35	63%	0.626	20%	0.198	S	C	*	.	S	Bend	trans	-117	-11.9	-167.9	-58.4	-48.8	0	0	0	114.1	N118 S168	N118-D170 PolarHBondContact ND2-O 2.91Å; S168-D170 PolarHBondContact O-N 3.35Å; S168-D170 PolarHBondContact OG-N 2.94Å
171	A	98.2	Very high	97.9	Very high	3 Å²	3	36.7 Å²	36.7	3%	0.025	21%	0.212	C	C	.	.			trans	-151.4	153.4	-171.9	0	0	0	0	0	112.5	I74 L77 S167 S168	I74-A171 HydrophobicContact CB-CB 4.29Å; I74-A171 HydrophobicContact CD1-CB 3.89Å; L77-A171 HydrophobicContact CB-CB 4.41Å; L77-A171 HydrophobicContact CD2-CB 3.91Å; L77-A171 WeakPolarHBondContact CD2-O 3.46Å; S167-A171 WeakPolarHBondContact CA-O 3.12Å; S168-A171 PolarHBondContact N-O 2.85Å; S168-A171 PolarHBondContact OG-N 2.74Å; S168-A171 VanDerWaalsContact OG-N 3.15Å; S168-A171 PolarHBondContact OG-O 3.31Å
172	T	98.8	Very high	97.9	Very high	30 Å²	30	32.4 Å²	32.4	18%	0.184	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	138.1	172.8	-63.8	0	0	0	0	110.8	I74 N118 V119 A120 E165 I166 S167 K174	I74-T172 WeakPolarHBondContact CD1-O 3.32Å; N118-T172 PolarHBondContact O-N 2.77Å; V119-T172 CarbonylContact C-O 3.6Å; V119-T172 VanDerWaalsContact CA-O 3.25Å; V119-T172 WeakPolarHBondContact CA-O 3.47Å; V119-T172 HydrophobicContact CG1-CG2 4.39Å; A120-T172 PolarHBondContact N-O 2.85Å; E165-T172 HydrophobicContact CB-CG2 4.16Å; I166-T172 WeakPolarHBondContact O-CA 3.42Å; S167-T172 WeakPolarHBondContact CB-OG1 3.41Å; S167-T172 VanDerWaalsContact OG-CG2 3.27Å; S167-T172 WeakPolarHBondContact OG-CG2 3.35Å; S167-T172 PolarHBondContact OG-OG1 3.08Å; T172-K174 HydrophobicContact CG2-CG 4.46Å
173	V	98.9	Very high	97.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	121.4	171.4	-179.4	0	0	0	0	108.6	I74 L77 V78 I81 A120 L122 E165 I166 I175	I74-V173 HydrophobicContact CD1-CG2 4.04Å; L77-V173 HydrophobicContact CB-CG2 4.22Å; L77-V173 HydrophobicContact CD2-CG2 3.87Å; L77-V173 HydrophobicContact CG-CG2 3.72Å; V78-V173 HydrophobicContact CB-CG2 4.5Å; V78-V173 HydrophobicContact CG2-CG2 3.6Å; I81-V173 HydrophobicContact CD1-CB 3.54Å; I81-V173 HydrophobicContact CD1-CG1 3.95Å; I81-V173 HydrophobicContact CD1-CG2 3.83Å; A120-V173 HydrophobicContact CB-CG2 4.42Å; A120-V173 CarbonylContact O-C 3.59Å; A120-V173 WeakPolarHBondContact O-CA 3.37Å; L122-V173 HydrophobicContact CD1-CG1 3.88Å; L122-V173 HydrophobicContact CG-CG1 3.8Å; E165-V173 VanDerWaalsContact CA-O 3.31Å; E165-V173 WeakPolarHBondContact CA-O 3.3Å; I166-V173 PolarHBondContact N-O 2.86Å; I166-V173 PolarHBondContact O-N 3.34Å; V173-I175 HydrophobicContact CG1-CD1 4.18Å; V173-I175 WeakPolarHBondContact O-CD1 3.49Å
174	K	98.8	Very high	97.8	Very high	71 Å²	71	32.1 Å²	32.1	31%	0.309	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	130.8	174.5	-63.3	-173.1	173.3	-170.4	0	109.6	V119 A120 D121 L122 E165 T172	V119-K174 HydrophobicContact CG1-CD 4.08Å; V119-K174 HydrophobicContact CG1-CG 3.97Å; A120-K174 PolarHBondContact O-N 3.47Å; D121-K174 CarbonylContact C-O 3.6Å; D121-K174 WeakPolarHBondContact CA-O 3.33Å; L122-K174 PolarHBondContact N-O 3.19Å; E165-K174 HydrophobicContact CB-CG 4.09Å; E165-K174 VanDerWaalsContact OE2-CE 3.29Å; E165-K174 WeakPolarHBondContact OE2-CE 3.43Å; T172-K174 HydrophobicContact CG2-CG 4.46Å
175	I	98.8	Very high	97.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	105.1	176.1	-63.7	75.1	0	0	0	107.1	I81 L122 V124 G163 F164 V173 I177	I81-I175 HydrophobicContact CG2-CD1 4.47Å; L122-I175 CarbonylContact O-C 3.58Å; L122-I175 WeakPolarHBondContact O-CA 3.25Å; V124-I175 HydrophobicContact CB-CG2 4.05Å; V124-I175 HydrophobicContact CG2-CG2 3.58Å; G163-I175 WeakPolarHBondContact CA-O 3.33Å; F164-I175 HydrophobicContact CD1-CB 4.11Å; F164-I175 HydrophobicContact CD1-CG2 4.2Å; F164-I175 HydrophobicContact CD2-CB 4.04Å; F164-I175 HydrophobicContact CD2-CD1 3.74Å; F164-I175 HydrophobicContact CD2-CG1 4.06Å; F164-I175 HydrophobicContact CE1-CB 3.83Å; F164-I175 HydrophobicContact CE1-CG1 4.31Å; F164-I175 HydrophobicContact CE1-CG2 3.58Å; F164-I175 HydrophobicContact CE2-CB 3.75Å; F164-I175 HydrophobicContact CE2-CD1 3.4Å; F164-I175 HydrophobicContact CE2-CG1 3.44Å; F164-I175 VanDerWaalsContact CE2-CG1 3.44Å; F164-I175 HydrophobicContact CE2-CG2 4.26Å; F164-I175 HydrophobicContact CG-CB 4.22Å; F164-I175 HydrophobicContact CZ-CB 3.64Å; F164-I175 HydrophobicContact CZ-CD1 4.11Å; F164-I175 HydrophobicContact CZ-CG1 3.59Å; F164-I175 HydrophobicContact CZ-CG2 3.62Å; F164-I175 PolarHBondContact N-O 3.14Å; F164-I175 WeakPolarHBondContact O-CA 3.44Å; F164-I175 PolarHBondContact O-N 3.23Å; V173-I175 HydrophobicContact CG1-CD1 4.18Å; V173-I175 WeakPolarHBondContact O-CD1 3.49Å; I175-I177 HydrophobicContact CG2-CD1 3.79Å; I175-I177 HydrophobicContact CG2-CG1 4.41Å
176	L	98.8	Very high	97.6	Very high	29 Å²	29	47 Å²	47	15%	0.152	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	108.9	176.4	-51.2	-179.6	0	0	0	108.3	V105 D121 L122 V123 V124 T162 A201	V105-L176 HydrophobicContact CG2-CD1 4.39Å; D121-L176 HydrophobicContact CB-CD1 4.31Å; L122-L176 PolarHBondContact O-N 3.42Å; V123-L176 VanDerWaalsContact CA-O 3.29Å; V123-L176 WeakPolarHBondContact CA-O 3.16Å; V123-L176 HydrophobicContact CG2-CB 4Å; V123-L176 HydrophobicContact CG2-CD1 4.12Å; V124-L176 PolarHBondContact N-O 2.93Å; T162-L176 HydrophobicContact CG2-CD2 4.44Å; T162-L176 WeakPolarHBondContact O-CA 3.48Å; L176-A201 HydrophobicContact CB-CB 3.97Å
177	I	98.7	Very high	97.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	136.3	-178.6	-63.9	-64	0	0	0	109.7	V124 L126 P130 V135 L138 T162 F164 I175 L193 L198	V124-I177 HydrophobicContact CB-CD1 4Å; V124-I177 HydrophobicContact CG1-CD1 4.3Å; L126-I177 HydrophobicContact CD1-CG2 3.69Å; L126-I177 HydrophobicContact CG-CG2 4.05Å; P130-I177 HydrophobicContact CB-CG2 3.91Å; V135-I177 HydrophobicContact CG1-CG1 4.33Å; V135-I177 HydrophobicContact CG2-CB 4.41Å; V135-I177 HydrophobicContact CG2-CG1 4.15Å; V135-I177 HydrophobicContact CG2-CG2 4.17Å; L138-I177 HydrophobicContact CD2-CD1 3.87Å; T162-I177 PolarHBondContact O-N 3.47Å; F164-I177 HydrophobicContact CE1-CD1 4.14Å; I175-I177 HydrophobicContact CG2-CD1 3.79Å; I175-I177 HydrophobicContact CG2-CG1 4.41Å; I177-L193 HydrophobicContact CB-CD1 3.85Å; I177-L193 HydrophobicContact CG2-CD1 3.89Å; I177-L198 WeakPolarHBondContact O-CD2 3.37Å
178	T	98.7	Very high	97.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	-176.6	165.3	-164.2	0	0	0	0	110.9	V123 V124 I125 L126 L198 A201 L202	V123-T178 HydrophobicContact CG1-CG2 3.71Å; V124-T178 PolarHBondContact O-N 3.33Å; I125-T178 HydrophobicContact CB-CG2 4.21Å; I125-T178 HydrophobicContact CG1-CG2 3.75Å; I125-T178 HydrophobicContact CG2-CG2 4.3Å; L126-T178 PolarHBondContact N-O 3.05Å; T178-L198 PolarHBondContact OG1-O 2.81Å; T178-A201 HydrophobicContact CG2-CB 4.39Å; T178-L202 HydrophobicContact CG2-CD2 3.77Å; T178-L202 HydrophobicContact CG2-CG 3.97Å; T178-L202 WeakPolarHBondContact OG1-CG 3.34Å
179	T	98.6	Very high	97.2	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	165.8	179.7	-168.5	0	0	0	0	111.1	L126 I128 P130 N183 L184	L126-T179 WeakPolarHBondContact O-CA 3.35Å; L126-T179 PolarHBondContact O-OG1 3.38Å; I128-T179 PolarHBondContact O-OG1 3.36Å; P130-T179 HydrophobicContact CG-CG2 4.18Å; T179-N183 HydrophobicContact CG2-CB 3.6Å; T179-N183 WeakPolarHBondContact OG1-CB 2.96Å; T179-N183 PolarHBondContact OG1-ND2 3.17Å; T179-L184 HydrophobicContact CG2-CD2 3.69Å; T179-L184 HydrophobicContact CG2-CG 4.2Å
180	V	97.6	Very high	97.1	Very high	29 Å²	29	59.5 Å²	59.5	18%	0.176	30%	0.303	C	S	.	.			trans	-63.1	149.5	178.2	-66.9	0	0	0	0	112.2	E100 I125 L126 P182 N183	E100-V180 HydrophobicContact CB-CG1 4.2Å; E100-V180 HydrophobicContact CG-CG1 4.09Å; I125-V180 HydrophobicContact CG2-CG1 3.99Å; L126-V180 PolarHBondContact O-N 3.03Å; V180-P182 VanDerWaalsContact C-N 3.34Å; V180-P182 VanDerWaalsContact O-N 3.12Å; V180-N183 HydrophobicContact CG2-CB 4.39Å; V180-N183 WeakPolarHBondContact O-CB 3.47Å; V180-N183 PolarHBondContact O-N 2.91Å
181	P	94.7	Very high	96.9	Very high	87 Å²	87	58.6 Å²	58.6	57%	0.565	30%	0.298	S	S	*	.	H	α-helix	trans	-51.6	-36.4	-175.6	-27.2	33.6	0	0	0	116.7	N183 L184	P181-N183 PolarHBondContact O-N 2.91Å; P181-L184 PolarHBondContact O-N 2.95Å
182	P	96.4	Very high	96.9	Very high	75 Å²	75	59.6 Å²	59.6	49%	0.487	30%	0.302	S	S	.	.	H	α-helix	trans	-59.8	-30.5	175.6	-26.1	36.2	0	0	0	114.2	V180	V180-P182 VanDerWaalsContact C-N 3.34Å; V180-P182 VanDerWaalsContact O-N 3.12Å
183	N	97.6	Very high	96.8	Very high	19 Å²	19	58.7 Å²	58.7	10%	0.102	30%	0.296	C	S	.	.	H	α-helix	trans	-79.7	-28.6	-178.3	-71.9	-12.1	0	0	0	112.3	K127 I128 L129 T179 V180 P181 R185 K186 L187	K127-N183 PolarHBondContact O-ND2 2.99Å; I128-N183 PolarHBondContact O-ND2 3.42Å; L129-N183 HydrophobicContact CD2-CB 3.87Å; T179-N183 HydrophobicContact CG2-CB 3.6Å; T179-N183 WeakPolarHBondContact OG1-CB 2.96Å; T179-N183 PolarHBondContact OG1-ND2 3.17Å; V180-N183 HydrophobicContact CG2-CB 4.39Å; V180-N183 WeakPolarHBondContact O-CB 3.47Å; V180-N183 PolarHBondContact O-N 2.91Å; P181-N183 PolarHBondContact O-N 2.91Å; N183-R185 PolarHBondContact O-N 3.38Å; N183-R185 VanDerWaalsContact O-N 3.12Å; N183-K186 CarbonylContact O-C 3.56Å; N183-K186 WeakPolarHBondContact O-CA 3.43Å; N183-K186 PolarHBondContact O-N 3.44Å; N183-L187 PolarHBondContact O-N 3.07Å
184	L	96.1	Very high	96.7	Very high	21 Å²	21	62.8 Å²	62.8	11%	0.11	32%	0.318	C	S	.	.	H	α-helix	trans	-59.5	-25.7	177.8	-62.1	176	0	0	0	113.2	T179 P181 K186 L187 L198 L202	T179-L184 HydrophobicContact CG2-CD2 3.69Å; T179-L184 HydrophobicContact CG2-CG 4.2Å; P181-L184 PolarHBondContact O-N 2.95Å; L184-K186 VanDerWaalsContact C-N 3.34Å; L184-L187 HydrophobicContact CD2-CD1 4.24Å; L184-L198 HydrophobicContact CD2-CB 3.99Å; L184-L198 HydrophobicContact CD2-CD1 4.07Å; L184-L202 HydrophobicContact CD1-CD1 3.79Å
185	R	94.9	Very high	96.6	Very high	225 Å²	225	63.3 Å²	63.3	85%	0.849	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-5.1	176.7	-59.3	-179.5	-171.9	151.4	2.2	113.7	N183	N183-R185 PolarHBondContact O-N 3.38Å; N183-R185 VanDerWaalsContact O-N 3.12Å
186	K	96.4	Very high	96.5	Very high	137 Å²	137	71 Å²	71	60%	0.596	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.7	15.8	-175.4	-58.3	178.2	-177.2	178.1	0	111.7	L129 N183 L184 D188	L129-K186 HydrophobicContact CD2-CB 4.28Å; N183-K186 CarbonylContact O-C 3.56Å; N183-K186 WeakPolarHBondContact O-CA 3.43Å; N183-K186 PolarHBondContact O-N 3.44Å; L184-K186 VanDerWaalsContact C-N 3.34Å; K186-D188 PolarHBondContact O-N 2.69Å
187	L	96.8	Very high	96.4	Very high	36 Å²	36	71 Å²	71	19%	0.188	36%	0.358	C	S	.	.			trans	-71.5	128.8	-178.6	-65.5	171.9	0	0	0	110	L129 P130 N183 L184 H192 I195 L198	L129-L187 HydrophobicContact CD2-CD2 4.2Å; P130-L187 HydrophobicContact CG-CD2 4.18Å; N183-L187 PolarHBondContact O-N 3.07Å; L184-L187 HydrophobicContact CD2-CD1 4.24Å; L187-H192 WeakPolarHBondContact CA-ND1 3.24Å; L187-H192 HydrophobicContact CD2-CB 3.84Å; L187-I195 HydrophobicContact CD1-CB 3.9Å; L187-I195 HydrophobicContact CD1-CD1 4.17Å; L187-I195 HydrophobicContact CD1-CG1 3.85Å; L187-L198 HydrophobicContact CD1-CD1 3.55Å; L187-L198 HydrophobicContact CD2-CD1 3.75Å; L187-L198 HydrophobicContact CG-CD1 4.31Å
188	D	95.8	Very high	96.4	Very high	65 Å²	65	71 Å²	71	35%	0.348	36%	0.358	S	S	.	.			trans	-94.3	117.7	163.6	-170.1	-33.6	0	0	0	108.8	K186 E190 L191 H192	K186-D188 PolarHBondContact O-N 2.69Å; D188-E190 PolarHBondContact O-N 3.37Å; D188-E190 PolarHBondContact OD1-N 3.08Å; D188-L191 HydrophobicContact CB-CB 4.28Å; D188-L191 HydrophobicContact CB-CD1 4.42Å; D188-L191 HydrophobicContact CB-CG 4.48Å; D188-L191 PolarHBondContact O-N 2.66Å; D188-H192 PolarHBondContact N-ND1 3Å; D188-H192 WeakPolarHBondContact O-CB 3.43Å; D188-H192 PolarHBondContact O-N 2.77Å
189	P	94.3	Very high	96.3	Very high	126 Å²	126	74.8 Å²	74.8	82%	0.818	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-20.8	179.4	-24	34.6	0	0	0	115.1
190	E	93.1	Very high	96.2	Very high	179 Å²	179	78.5 Å²	78.5	84%	0.836	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-23.4	179.6	-63.7	-174	178.7	0	0	112.7	D188	D188-E190 PolarHBondContact O-N 3.37Å; D188-E190 PolarHBondContact OD1-N 3.08Å
191	L	93.4	Very high	96.2	Very high	98 Å²	98	77.3 Å²	77.3	51%	0.513	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-26.4	-171.6	-60.3	177.2	0	0	0	113.8	T131 D188	T131-L191 WeakPolarHBondContact CA-O 3.45Å; D188-L191 HydrophobicContact CB-CB 4.28Å; D188-L191 HydrophobicContact CB-CD1 4.42Å; D188-L191 HydrophobicContact CB-CG 4.48Å; D188-L191 PolarHBondContact O-N 2.66Å
192	H	97.6	Very high	96.4	Very high	24 Å²	24	74.6 Å²	74.6	11%	0.111	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-112.1	159.7	-172.9	-53.9	140.8	0	0	0	112.8	L129 P130 L187 D188	L129-H192 WeakPolarHBondContact CB-NE2 3.33Å; P130-H192 WeakPolarHBondContact O-CA 3.4Å; L187-H192 WeakPolarHBondContact CA-ND1 3.24Å; L187-H192 HydrophobicContact CD2-CB 3.84Å; D188-H192 PolarHBondContact N-ND1 3Å; D188-H192 WeakPolarHBondContact O-CB 3.43Å; D188-H192 PolarHBondContact O-N 2.77Å
193	L	96.6	Very high	96.5	Very high	11 Å²	11	71.6 Å²	71.6	6%	0.058	36%	0.357	C	S	.	.			trans	-54.9	145.1	169.3	-66.8	-176	0	0	0	111.8	P130 L132 V135 I177 I195 L198	P130-L193 HydrophobicContact CB-CD1 4.33Å; P130-L193 HydrophobicContact CB-CG 4.44Å; P130-L193 PolarHBondContact O-N 2.94Å; L132-L193 HydrophobicContact CD2-CD2 3.64Å; V135-L193 HydrophobicContact CG2-CD1 3.89Å; V135-L193 HydrophobicContact CG2-CG 4.29Å; I177-L193 HydrophobicContact CB-CD1 3.85Å; I177-L193 HydrophobicContact CG2-CD1 3.89Å; L193-I195 PolarHBondContact O-N 3.22Å; L193-L198 HydrophobicContact CB-CD2 3.92Å; L193-L198 HydrophobicContact CB-CG 4.2Å; L193-L198 HydrophobicContact CD1-CD2 4.15Å; L193-L198 WeakPolarHBondContact O-CD1 3.44Å
194	D	97.3	Very high	96.5	Very high	86 Å²	86	71.6 Å²	71.6	46%	0.46	36%	0.36	S	S	.	.			trans	-55.9	137.2	-178.7	178.2	-92.2	0	0	0	111.9	K196 V197 L198	D194-K196 PolarHBondContact O-N 3.03Å; D194-K196 WeakPolarHBondContact OD1-CA 3.24Å; D194-K196 WeakPolarHBondContact OD1-CB 3.33Å; D194-K196 WeakPolarHBondContact OD1-CG 3.45Å; D194-K196 PolarHBondContact OD1-N 3.01Å; D194-V197 HydrophobicContact CB-CG2 4.18Å; D194-V197 WeakPolarHBondContact O-CB 3.47Å; D194-V197 PolarHBondContact O-N 2.93Å; D194-V197 PolarHBondContact OD1-N 2.99Å; D194-L198 WeakPolarHBondContact O-CG 3.4Å; D194-L198 PolarHBondContact O-N 3.2Å; D194-L198 VanDerWaalsContact O-N 3.15Å
195	I	96.8	Very high	96.7	Very high	83 Å²	83	71.8 Å²	71.8	43%	0.426	36%	0.361	S	S	.	.	H	α-helix	trans	-59.8	-32.8	-176.2	-168.8	169.4	0	0	0	112.6	L187 L193 L198 Q199	L187-I195 HydrophobicContact CD1-CB 3.9Å; L187-I195 HydrophobicContact CD1-CD1 4.17Å; L187-I195 HydrophobicContact CD1-CG1 3.85Å; L193-I195 PolarHBondContact O-N 3.22Å; I195-L198 PolarHBondContact O-N 3.4Å; I195-Q199 HydrophobicContact CG1-CG 4.24Å; I195-Q199 WeakPolarHBondContact O-CB 3.35Å; I195-Q199 WeakPolarHBondContact O-CG 3.45Å; I195-Q199 PolarHBondContact O-N 2.98Å
196	K	96	Very high	96.8	Very high	162 Å²	162	64.9 Å²	64.9	70%	0.704	34%	0.335	S	S	*	.	H	α-helix	trans	-69.3	-36.1	178.7	-55.6	175.2	177.4	171.9	0	110.8	D194 S200	D194-K196 PolarHBondContact O-N 3.03Å; D194-K196 WeakPolarHBondContact OD1-CA 3.24Å; D194-K196 WeakPolarHBondContact OD1-CB 3.33Å; D194-K196 WeakPolarHBondContact OD1-CG 3.45Å; D194-K196 PolarHBondContact OD1-N 3.01Å; K196-S200 WeakPolarHBondContact O-CB 3.14Å; K196-S200 PolarHBondContact O-N 3.13Å
197	V	96.9	Very high	96.9	Very high	29 Å²	29	59.6 Å²	59.6	18%	0.176	31%	0.312	C	S	.	.	H	α-helix	trans	-61.4	-51.5	173.3	168.9	0	0	0	0	110.3	T162 D194 Q199 S200 A201	T162-V197 HydrophobicContact CG2-CG1 4.16Å; D194-V197 HydrophobicContact CB-CG2 4.18Å; D194-V197 WeakPolarHBondContact O-CB 3.47Å; D194-V197 PolarHBondContact O-N 2.93Å; D194-V197 PolarHBondContact OD1-N 2.99Å; V197-Q199 VanDerWaalsContact C-N 3.32Å; V197-Q199 PolarHBondContact O-N 3.27Å; V197-S200 WeakPolarHBondContact O-CB 3.43Å; V197-S200 PolarHBondContact O-N 3.1Å; V197-S200 VanDerWaalsContact O-N 3.16Å; V197-A201 PolarHBondContact O-N 3.37Å
198	L	98.2	Very high	97	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61.2	-41	-179	-59.1	173.5	0	0	0	111.7	P130 I177 T178 L184 L187 L193 D194 I195 L202	P130-L198 HydrophobicContact CB-CD2 4.05Å; P130-L198 HydrophobicContact CG-CD1 3.68Å; P130-L198 HydrophobicContact CG-CD2 3.64Å; P130-L198 HydrophobicContact CG-CG 4.34Å; I177-L198 WeakPolarHBondContact O-CD2 3.37Å; T178-L198 PolarHBondContact OG1-O 2.81Å; L184-L198 HydrophobicContact CD2-CB 3.99Å; L184-L198 HydrophobicContact CD2-CD1 4.07Å; L187-L198 HydrophobicContact CD1-CD1 3.55Å; L187-L198 HydrophobicContact CD2-CD1 3.75Å; L187-L198 HydrophobicContact CG-CD1 4.31Å; L193-L198 HydrophobicContact CB-CD2 3.92Å; L193-L198 HydrophobicContact CB-CG 4.2Å; L193-L198 HydrophobicContact CD1-CD2 4.15Å; L193-L198 WeakPolarHBondContact O-CD1 3.44Å; D194-L198 WeakPolarHBondContact O-CG 3.4Å; D194-L198 PolarHBondContact O-N 3.2Å; D194-L198 VanDerWaalsContact O-N 3.15Å; I195-L198 PolarHBondContact O-N 3.4Å; L198-L202 WeakPolarHBondContact O-CG 3.34Å; L198-L202 PolarHBondContact O-N 3.03Å
199	Q	96.9	Very high	97.2	Very high	78 Å²	78	62.3 Å²	62.3	36%	0.364	32%	0.316	S	S	.	.	H	α-helix	trans	-68.7	-38.1	176	-72	-72	-0.7	0	0	112.4	I195 V197 L202 A203	I195-Q199 HydrophobicContact CG1-CG 4.24Å; I195-Q199 WeakPolarHBondContact O-CB 3.35Å; I195-Q199 WeakPolarHBondContact O-CG 3.45Å; I195-Q199 PolarHBondContact O-N 2.98Å; V197-Q199 VanDerWaalsContact C-N 3.32Å; V197-Q199 PolarHBondContact O-N 3.27Å; Q199-L202 PolarHBondContact O-N 3.25Å; Q199-A203 WeakPolarHBondContact O-CB 3.19Å; Q199-A203 PolarHBondContact O-N 3.32Å
200	S	97.2	Very high	97.4	Very high	79 Å²	79	57.7 Å²	57.7	55%	0.552	28%	0.282	S	S	*	.	H	α-helix	trans	-63.3	-41.3	176.4	-173.4	0	0	0	0	111.7	K196 V197 L202 A203 A204	K196-S200 WeakPolarHBondContact O-CB 3.14Å; K196-S200 PolarHBondContact O-N 3.13Å; V197-S200 WeakPolarHBondContact O-CB 3.43Å; V197-S200 PolarHBondContact O-N 3.1Å; V197-S200 VanDerWaalsContact O-N 3.16Å; S200-L202 PolarHBondContact O-N 3.41Å; S200-A203 WeakPolarHBondContact O-CB 3.4Å; S200-A203 PolarHBondContact O-N 3.07Å; S200-A204 PolarHBondContact O-N 3.12Å
201	A	98.4	Very high	97.6	Very high	4 Å²	4	49.3 Å²	49.3	3%	0.033	24%	0.243	C	C	.	.	H	α-helix	trans	-62	-41.5	173.1	0	0	0	0	0	112.2	V123 L176 T178 V197 A204 I205	V123-A201 HydrophobicContact CG1-CB 4.05Å; V123-A201 HydrophobicContact CG2-CB 4.25Å; V123-A201 WeakPolarHBondContact CG2-O 3.49Å; L176-A201 HydrophobicContact CB-CB 3.97Å; T178-A201 HydrophobicContact CG2-CB 4.39Å; V197-A201 PolarHBondContact O-N 3.37Å; A201-A204 WeakPolarHBondContact O-CB 3.46Å; A201-A204 PolarHBondContact O-N 3Å; A201-I205 PolarHBondContact O-N 3.46Å
202	L	98.2	Very high	97.9	Very high	29 Å²	29	49.5 Å²	49.5	15%	0.152	24%	0.241	C	C	.	.	H	α-helix	trans	-65.2	-38.3	173.2	-70.6	168.2	0	0	0	112.4	T178 L184 L198 Q199 S200 A204 I205 R206	T178-L202 HydrophobicContact CG2-CD2 3.77Å; T178-L202 HydrophobicContact CG2-CG 3.97Å; T178-L202 WeakPolarHBondContact OG1-CG 3.34Å; L184-L202 HydrophobicContact CD1-CD1 3.79Å; L198-L202 WeakPolarHBondContact O-CG 3.34Å; L198-L202 PolarHBondContact O-N 3.03Å; Q199-L202 PolarHBondContact O-N 3.25Å; S200-L202 PolarHBondContact O-N 3.41Å; L202-A204 VanDerWaalsContact C-N 3.34Å; L202-I205 PolarHBondContact O-N 2.85Å; L202-R206 PolarHBondContact O-N 3.28Å; L202-R206 PolarHBondContact O-NH1 2.94Å
203	A	98	Very high	97.9	Very high	13 Å²	13	54.1 Å²	54.1	11%	0.107	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-40.5	174.3	0	0	0	0	0	111	Q199 S200 I205 R206 H207	Q199-A203 WeakPolarHBondContact O-CB 3.19Å; Q199-A203 PolarHBondContact O-N 3.32Å; S200-A203 WeakPolarHBondContact O-CB 3.4Å; S200-A203 PolarHBondContact O-N 3.07Å; A203-I205 VanDerWaalsContact C-N 3.27Å; A203-I205 PolarHBondContact O-N 2.66Å; A203-R206 WeakPolarHBondContact O-CB 3.29Å; A203-R206 PolarHBondContact O-N 3.01Å; A203-H207 PolarHBondContact O-CD2 3.46Å; A203-H207 PolarHBondContact O-N 3.39Å
204	A	98.6	Very high	97.9	Very high	19 Å²	19	57 Å²	57	16%	0.157	28%	0.279	C	S	.	.	H	α-helix	trans	-59.1	-35.7	176.5	0	0	0	0	0	112.9	V105 V123 S200 A201 L202 A208	V105-A204 HydrophobicContact CB-CB 4.18Å; V105-A204 HydrophobicContact CG1-CB 4.43Å; V105-A204 HydrophobicContact CG2-CB 3.96Å; V123-A204 HydrophobicContact CG2-CB 4.31Å; S200-A204 PolarHBondContact O-N 3.12Å; A201-A204 WeakPolarHBondContact O-CB 3.46Å; A201-A204 PolarHBondContact O-N 3Å; L202-A204 VanDerWaalsContact C-N 3.34Å; A204-A208 WeakPolarHBondContact O-CB 3.44Å; A204-A208 PolarHBondContact O-N 2.67Å
205	I	98.7	Very high	97.9	Very high	24 Å²	24	53 Å²	53	12%	0.123	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-48.4	171.8	-63.9	173	0	0	0	110.7	R103 V105 V123 I125 A201 L202 A203 H207 A208 R209	R103-I205 HydrophobicContact CB-CD1 4.34Å; R103-I205 HydrophobicContact CB-CG1 4.09Å; R103-I205 HydrophobicContact CG-CD1 4.23Å; R103-I205 HydrophobicContact CG-CG1 4.33Å; R103-I205 HydrophobicContact CG-CG2 4.33Å; V105-I205 HydrophobicContact CG1-CG1 4.04Å; V123-I205 HydrophobicContact CB-CD1 3.92Å; V123-I205 HydrophobicContact CB-CG1 3.84Å; V123-I205 HydrophobicContact CG1-CD1 3.5Å; V123-I205 HydrophobicContact CG1-CG1 3.9Å; V123-I205 HydrophobicContact CG2-CG1 4.04Å; I125-I205 HydrophobicContact CD1-CD1 3.84Å; I125-I205 HydrophobicContact CG1-CD1 4.17Å; A201-I205 PolarHBondContact O-N 3.46Å; L202-I205 PolarHBondContact O-N 2.85Å; A203-I205 VanDerWaalsContact C-N 3.27Å; A203-I205 PolarHBondContact O-N 2.66Å; I205-H207 VanDerWaalsContact C-N 3.34Å; I205-H207 PolarHBondContact O-N 3.47Å; I205-A208 PolarHBondContact O-N 2.7Å; I205-R209 PolarHBondContact O-N 3.3Å
206	R	98.5	Very high	97.8	Very high	81 Å²	81	51.6 Å²	51.6	31%	0.306	26%	0.255	S	S	.	.	H	α-helix	trans	-60.1	-45.2	178.1	-64.5	-166.7	-65.1	-79	6.5	111.1	L202 A203 A208 R209 W210 C291 E292	L202-R206 PolarHBondContact O-N 3.28Å; L202-R206 PolarHBondContact O-NH1 2.94Å; A203-R206 WeakPolarHBondContact O-CB 3.29Å; A203-R206 PolarHBondContact O-N 3.01Å; R206-A208 PolarHBondContact O-N 2.77Å; R206-R209 PolarHBondContact O-N 3.19Å; R206-W210 WeakPolarHBondContact O-CB 3.36Å; R206-W210 PolarHBondContact O-N 3.47Å; R206-C291 HydrophobicContact CB-CB 3.86Å; R206-C291 WeakPolarHBondContact CD-O 3.25Å; R206-C291 PolarHBondContact NE-O 3.44Å; R206-E292 IonicContact CZ-OE1 3.79Å; R206-E292 IonicContact NE-OE1 3.98Å; R206-E292 IonicContact NH2-OE1 2.82Å; R206-E292 PolarHBondContact NH2-OE1 3.13Å; R206-E292 IonicContact NH2-OE2 3.85Å
207	H	98.7	Very high	97.8	Very high	26 Å²	26	48.3 Å²	48.3	12%	0.12	24%	0.242	C	C	.	.	H	α-helix	trans	-60.5	-44.9	177.2	-61.5	170.5	0	0	0	111.8	A203 I205 F211 W243	A203-H207 PolarHBondContact O-CD2 3.46Å; A203-H207 PolarHBondContact O-N 3.39Å; I205-H207 VanDerWaalsContact C-N 3.34Å; I205-H207 PolarHBondContact O-N 3.47Å; H207-F211 WeakPolarHBondContact O-CB 3.13Å; H207-F211 PolarHBondContact O-N 3.49Å; H207-W243 HydrophobicContact CB-CD2 4.33Å; H207-W243 HydrophobicContact CB-CE3 3.78Å; H207-W243 HydrophobicContact CB-CH2 3.95Å; H207-W243 HydrophobicContact CB-CZ2 4.47Å; H207-W243 HydrophobicContact CB-CZ3 3.58Å; H207-W243 AromaticContact CD2-CD2 3.7Å; H207-W243 AromaticContact CD2-CE2 3.37Å; H207-W243 AromaticContact CD2-CH2 3.74Å; H207-W243 AromaticContact CD2-CZ2 3.4Å; H207-W243 WeakPolarHBondContact CD2-CZ2 3.38Å; H207-W243 AromaticContact CD2-NE1 3.82Å; H207-W243 AromaticContact CE1-CD1 3.62Å; H207-W243 AromaticContact CE1-CD2 3.69Å; H207-W243 AromaticContact CE1-CE2 3.86Å; H207-W243 AromaticContact CE1-CG 3.54Å; H207-W243 AromaticContact CE1-NE1 3.78Å; H207-W243 AromaticContact CG-CD2 3.64Å; H207-W243 AromaticContact CG-CE2 3.82Å; H207-W243 AromaticContact CG-CE3 3.6Å; H207-W243 AromaticContact CG-CH2 3.93Å; H207-W243 AromaticContact CG-CZ2 3.96Å; H207-W243 AromaticContact CG-CZ3 3.76Å; H207-W243 AromaticContact ND1-CD2 3.63Å; H207-W243 AromaticContact ND1-CE3 3.85Å; H207-W243 AromaticContact ND1-CG 3.79Å; H207-W243 AromaticContact NE2-CD1 3.69Å; H207-W243 AromaticContact NE2-CD2 3.76Å; H207-W243 AromaticContact NE2-CE2 3.43Å; H207-W243 AromaticContact NE2-CG 3.91Å; H207-W243 AromaticContact NE2-CZ2 3.91Å; H207-W243 AromaticContact NE2-NE1 3.37Å; H207-W243 PolarHBondContact NE2-NE1 3.02Å
208	A	98.6	Very high	97.9	Very high	6 Å²	6	50.9 Å²	50.9	5%	0.05	26%	0.261	C	S	.	.	H	α-helix	trans	-62.9	-43.8	179	0	0	0	0	0	111.6	V105 K109 A204 I205 R206 F211 E212	V105-A208 HydrophobicContact CB-CB 4.11Å; V105-A208 HydrophobicContact CG1-CB 3.98Å; K109-A208 HydrophobicContact CG-CB 4.25Å; A204-A208 WeakPolarHBondContact O-CB 3.44Å; A204-A208 PolarHBondContact O-N 2.67Å; I205-A208 PolarHBondContact O-N 2.7Å; R206-A208 PolarHBondContact O-N 2.77Å; A208-F211 PolarHBondContact O-N 3.16Å; A208-E212 PolarHBondContact O-N 3.25Å
209	R	98.6	Very high	97.9	Very high	151 Å²	151	52.4 Å²	52.4	57%	0.57	27%	0.271	S	S	*	.	H	α-helix	trans	-63	-50.9	175.8	-179	-179.9	177.7	177.8	0.7	111.9	I205 R206 F211 E212 E213	I205-R209 PolarHBondContact O-N 3.3Å; R206-R209 PolarHBondContact O-N 3.19Å; R209-F211 PolarHBondContact O-N 3.35Å; R209-E212 PolarHBondContact O-N 3.21Å; R209-E213 WeakPolarHBondContact CG-OE1 3.19Å; R209-E213 IonicContact CZ-OE1 3.84Å; R209-E213 IonicContact NE-OE1 3.82Å; R209-E213 PolarHBondContact NE-OE1 2.8Å; R209-E213 IonicContact NH2-OE1 2.66Å; R209-E213 WeakPolarHBondContact O-CG 3.32Å; R209-E213 PolarHBondContact O-N 2.96Å; R209-E213 VanDerWaalsContact O-N 3.07Å
210	W	98.6	Very high	98	Very high	29 Å²	29	48.7 Å²	48.7	11%	0.11	25%	0.253	C	S	.	.	H	α-helix	trans	-57.3	-42	177.6	173.9	87.8	0	0	0	111.2	R206 E213 N214 A215 W243 L247 H250 P290 C291	R206-W210 WeakPolarHBondContact O-CB 3.36Å; R206-W210 PolarHBondContact O-N 3.47Å; W210-E213 PolarHBondContact O-N 2.88Å; W210-N214 VanDerWaalsContact CD1-ND2 3.3Å; W210-N214 HydrophobicContact CD2-CB 4.3Å; W210-N214 HydrophobicContact CZ2-CB 3.99Å; W210-N214 PolarHBondContact NE1-ND2 2.87Å; W210-N214 VanDerWaalsContact O-CB 3.31Å; W210-N214 WeakPolarHBondContact O-CB 3.25Å; W210-N214 PolarHBondContact O-N 3.23Å; W210-N214 PolarHBondContact O-ND2 3.35Å; W210-A215 HydrophobicContact CH2-CB 4.14Å; W210-A215 HydrophobicContact CZ3-CB 3.89Å; W210-W243 HydrophobicContact CB-CH2 4.42Å; W210-W243 AromaticContact CD2-CH2 3.81Å; W210-W243 HydrophobicContact CD2-CH2 3.81Å; W210-W243 AromaticContact CE3-CH2 3.34Å; W210-W243 HydrophobicContact CE3-CH2 3.34Å; W210-W243 HydrophobicContact CE3-CZ2 4.5Å; W210-W243 AromaticContact CE3-CZ3 3.67Å; W210-W243 HydrophobicContact CE3-CZ3 3.67Å; W210-W243 HydrophobicContact CG-CH2 4.27Å; W210-W243 AromaticContact CZ3-CH2 3.92Å; W210-W243 HydrophobicContact CZ3-CH2 3.92Å; W210-W243 AromaticContact CZ3-CZ3 3.98Å; W210-W243 HydrophobicContact CZ3-CZ3 3.98Å; W210-L247 HydrophobicContact CE3-CD2 4.38Å; W210-L247 HydrophobicContact CH2-CD2 3.49Å; W210-L247 VanDerWaalsContact CH2-CD2 3.49Å; W210-L247 HydrophobicContact CZ2-CD2 3.76Å; W210-L247 HydrophobicContact CZ3-CD2 3.82Å; W210-H250 HydrophobicContact CH2-CB 3.75Å; W210-H250 AromaticContact CH2-CG 3.58Å; W210-H250 AromaticContact CH2-ND1 3.78Å; W210-H250 AromaticContact CZ2-CE1 4Å; W210-H250 AromaticContact CZ2-CG 4Å; W210-H250 AromaticContact CZ2-ND1 3.78Å; W210-P290 HydrophobicContact CD2-CG 3.89Å; W210-P290 VanDerWaalsContact CE2-CG 3.48Å; W210-P290 HydrophobicContact CG-CB 4.42Å; W210-P290 HydrophobicContact CG-CG 3.95Å; W210-P290 HydrophobicContact CZ2-CG 4.06Å; W210-P290 VanDerWaalsContact NE1-CG 3.26Å; W210-C291 VanDerWaalsContact CB-SG 3.51Å
211	F	98.8	Very high	98	Very high	3 Å²	3	47.9 Å²	47.9	1%	0.013	24%	0.24	C	C	.	.	H	α-helix	trans	-64.1	-43.6	-179.7	-164.9	-78	0	0	0	111.9	K110 T112 H207 A208 R209 E213 A215 S216 K221 I224 D246	K110-F211 HydrophobicContact CB-CD1 3.82Å; K110-F211 HydrophobicContact CB-CD2 4.4Å; K110-F211 HydrophobicContact CB-CE1 3.77Å; K110-F211 HydrophobicContact CB-CE2 4.34Å; K110-F211 HydrophobicContact CB-CG 4.15Å; K110-F211 HydrophobicContact CB-CZ 4.05Å; K110-F211 HydrophobicContact CD-CB 4.33Å; K110-F211 HydrophobicContact CD-CD1 4.49Å; K110-F211 HydrophobicContact CD-CD2 3.8Å; K110-F211 HydrophobicContact CD-CE2 4.21Å; K110-F211 HydrophobicContact CD-CG 3.95Å; K110-F211 HydrophobicContact CG-CB 4.02Å; K110-F211 HydrophobicContact CG-CD1 3.75Å; K110-F211 HydrophobicContact CG-CD2 3.97Å; K110-F211 HydrophobicContact CG-CE1 4.2Å; K110-F211 HydrophobicContact CG-CE2 4.39Å; K110-F211 HydrophobicContact CG-CG 3.63Å; K110-F211 WeakPolarHBondContact O-CE1 3.4Å; T112-F211 HydrophobicContact CG2-CZ 3.95Å; H207-F211 WeakPolarHBondContact O-CB 3.13Å; H207-F211 PolarHBondContact O-N 3.49Å; A208-F211 PolarHBondContact O-N 3.16Å; R209-F211 PolarHBondContact O-N 3.35Å; F211-E213 VanDerWaalsContact C-N 3.32Å; F211-E213 PolarHBondContact O-N 2.91Å; F211-A215 HydrophobicContact CD1-CB 4.04Å; F211-A215 HydrophobicContact CD2-CB 3.69Å; F211-A215 HydrophobicContact CE1-CB 4.1Å; F211-A215 WeakPolarHBondContact CE1-O 3.41Å; F211-A215 HydrophobicContact CE2-CB 3.77Å; F211-A215 HydrophobicContact CG-CB 3.83Å; F211-A215 HydrophobicContact CZ-CB 3.97Å; F211-A215 CarbonylContact O-C 3.35Å; F211-A215 WeakPolarHBondContact O-CA 3.44Å; F211-A215 PolarHBondContact O-N 3.46Å; F211-S216 PolarHBondContact O-N 3.48Å; F211-K221 HydrophobicContact CE1-CG 4.11Å; F211-K221 HydrophobicContact CZ-CG 4.21Å; F211-I224 HydrophobicContact CE2-CD1 3.48Å; F211-I224 VanDerWaalsContact CE2-CD1 3.48Å; F211-I224 HydrophobicContact CZ-CD1 3.71Å; F211-D246 HydrophobicContact CD2-CB 4.23Å; F211-D246 HydrophobicContact CE2-CB 4.15Å
212	E	98.1	Very high	98.1	Very high	102 Å²	102	48.9 Å²	48.9	48%	0.477	25%	0.245	S	C	.	.	H	α-helix	trans	-60.1	-43.2	176.9	-176.7	162.5	-137.1	0	0	111.6	K109 A208 R209 S216	K109-E212 WeakPolarHBondContact CE-OE2 3.37Å; K109-E212 VanDerWaalsContact NZ-CD 3.32Å; K109-E212 IonicContact NZ-OE1 2.66Å; K109-E212 PolarHBondContact NZ-OE1 3.22Å; K109-E212 IonicContact NZ-OE2 3.26Å; K109-E212 PolarHBondContact NZ-OE2 3.2Å; A208-E212 PolarHBondContact O-N 3.25Å; R209-E212 PolarHBondContact O-N 3.21Å; E212-S216 WeakPolarHBondContact CA-OG 3.18Å; E212-S216 WeakPolarHBondContact O-CB 3.41Å; E212-S216 PolarHBondContact O-OG 3.37Å
213	E	97.9	Very high	98.1	Very high	122 Å²	122	47.5 Å²	47.5	57%	0.57	24%	0.238	S	C	*	.	H	α-helix	trans	-76.2	-32.3	-178.3	-67.7	172.4	-173	0	0	113.4	R209 W210 F211	R209-E213 WeakPolarHBondContact CG-OE1 3.19Å; R209-E213 IonicContact CZ-OE1 3.84Å; R209-E213 IonicContact NE-OE1 3.82Å; R209-E213 PolarHBondContact NE-OE1 2.8Å; R209-E213 IonicContact NH2-OE1 2.66Å; R209-E213 WeakPolarHBondContact O-CG 3.32Å; R209-E213 PolarHBondContact O-N 2.96Å; R209-E213 VanDerWaalsContact O-N 3.07Å; W210-E213 PolarHBondContact O-N 2.88Å; F211-E213 VanDerWaalsContact C-N 3.32Å; F211-E213 PolarHBondContact O-N 2.91Å
214	N	97.5	Very high	98.1	Very high	72 Å²	72	46.9 Å²	46.9	39%	0.385	23%	0.233	S	C	.	.	H	α-helix	trans	-120.9	-29.4	-167.3	-59.8	-89	0	0	0	114.7	W210 H250	W210-N214 VanDerWaalsContact CD1-ND2 3.3Å; W210-N214 HydrophobicContact CD2-CB 4.3Å; W210-N214 HydrophobicContact CZ2-CB 3.99Å; W210-N214 PolarHBondContact NE1-ND2 2.87Å; W210-N214 VanDerWaalsContact O-CB 3.31Å; W210-N214 WeakPolarHBondContact O-CB 3.25Å; W210-N214 PolarHBondContact O-N 3.23Å; W210-N214 PolarHBondContact O-ND2 3.35Å; N214-H250 PolarHBondContact O-CD2 3.31Å; N214-H250 PolarHBondContact O-NE2 3.4Å
215	A	97.3	Very high	98.1	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	-118.4	14.1	-169.6	0	0	0	0	0	113.9	W210 F211 Q217 V220 H250	W210-A215 HydrophobicContact CH2-CB 4.14Å; W210-A215 HydrophobicContact CZ3-CB 3.89Å; F211-A215 HydrophobicContact CD1-CB 4.04Å; F211-A215 HydrophobicContact CD2-CB 3.69Å; F211-A215 HydrophobicContact CE1-CB 4.1Å; F211-A215 WeakPolarHBondContact CE1-O 3.41Å; F211-A215 HydrophobicContact CE2-CB 3.77Å; F211-A215 HydrophobicContact CG-CB 3.83Å; F211-A215 HydrophobicContact CZ-CB 3.97Å; F211-A215 CarbonylContact O-C 3.35Å; F211-A215 WeakPolarHBondContact O-CA 3.44Å; F211-A215 PolarHBondContact O-N 3.46Å; A215-Q217 PolarHBondContact O-N 3Å; A215-Q217 VanDerWaalsContact O-N 3.08Å; A215-V220 HydrophobicContact CB-CG1 4.01Å; A215-H250 HydrophobicContact CB-CB 4.29Å
216	S	94.7	Very high	98.1	Very high	54 Å²	54	45.9 Å²	45.9	38%	0.378	22%	0.224	S	C	.	.			trans	-67.9	-5.7	-177.2	-80.1	0	0	0	0	115.9	F211 E212 K221	F211-S216 PolarHBondContact O-N 3.48Å; E212-S216 WeakPolarHBondContact CA-OG 3.18Å; E212-S216 WeakPolarHBondContact O-CB 3.41Å; E212-S216 PolarHBondContact O-OG 3.37Å; S216-K221 WeakPolarHBondContact O-CE 3.41Å; S216-K221 PolarHBondContact O-NZ 3.47Å; S216-K221 VanDerWaalsContact O-NZ 3.09Å
217	Q	96.4	Very high	98.2	Very high	93 Å²	93	42.4 Å²	42.4	44%	0.435	21%	0.211	S	C	.	.			trans	-61.8	140.9	179.1	-67.1	-65.3	-18.5	0	0	112.4	A215 T219 V220 K221 M254	A215-Q217 PolarHBondContact O-N 3Å; A215-Q217 VanDerWaalsContact O-N 3.08Å; Q217-T219 PolarHBondContact O-N 2.82Å; Q217-V220 HydrophobicContact CB-CB 4.4Å; Q217-V220 HydrophobicContact CB-CG2 3.99Å; Q217-V220 PolarHBondContact O-N 3.17Å; Q217-K221 PolarHBondContact O-N 3.38Å; Q217-M254 HydrophobicContact CG-CE 4.38Å; Q217-M254 HydrophobicContact CG-SD 4.02Å
218	S	97.4	Very high	98.2	Very high	84 Å²	84	43 Å²	43	59%	0.587	21%	0.213	S	C	*	.	H	α-helix	trans	-60.1	-45.2	-176.5	57.1	0	0	0	0	112.6	V220 K221 V222	S218-V220 VanDerWaalsContact C-N 3.29Å; S218-V220 PolarHBondContact O-N 3.37Å; S218-K221 PolarHBondContact O-N 3.33Å; S218-V222 WeakPolarHBondContact O-CG2 3.21Å; S218-V222 PolarHBondContact O-N 3.08Å
219	T	98.4	Very high	98.2	Very high	32 Å²	32	43.4 Å²	43.4	20%	0.196	22%	0.215	C	C	.	.	H	α-helix	trans	-60	-38	178.4	-51.8	0	0	0	0	112.2	Q217 V222 L223 V253 L264	Q217-T219 PolarHBondContact O-N 2.82Å; T219-V222 PolarHBondContact O-N 3.02Å; T219-L223 VanDerWaalsContact O-CB 3.26Å; T219-L223 WeakPolarHBondContact O-CB 3.49Å; T219-L223 PolarHBondContact O-N 3.08Å; T219-V253 HydrophobicContact CG2-CG1 4.26Å; T219-V253 HydrophobicContact CG2-CG2 4.03Å; T219-L264 HydrophobicContact CG2-CB 4.14Å; T219-L264 HydrophobicContact CG2-CD1 4.1Å
220	V	98.8	Very high	98.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-64	-48.8	177.6	175.5	0	0	0	0	110.4	A215 Q217 S218 V222 L223 I224 H250 V253 M254	A215-V220 HydrophobicContact CB-CG1 4.01Å; Q217-V220 HydrophobicContact CB-CB 4.4Å; Q217-V220 HydrophobicContact CB-CG2 3.99Å; Q217-V220 PolarHBondContact O-N 3.17Å; S218-V220 VanDerWaalsContact C-N 3.29Å; S218-V220 PolarHBondContact O-N 3.37Å; V220-V222 VanDerWaalsContact C-N 3.34Å; V220-V222 PolarHBondContact O-N 2.68Å; V220-L223 PolarHBondContact O-N 2.92Å; V220-I224 HydrophobicContact CG1-CD1 3.63Å; V220-I224 HydrophobicContact CG1-CG1 4.42Å; V220-I224 WeakPolarHBondContact O-CD1 3.44Å; V220-I224 VanDerWaalsContact O-CG1 3.27Å; V220-I224 WeakPolarHBondContact O-CG1 3.39Å; V220-I224 PolarHBondContact O-N 2.88Å; V220-H250 HydrophobicContact CG1-CB 4.28Å; V220-V253 HydrophobicContact CG2-CB 3.73Å; V220-V253 HydrophobicContact CG2-CG1 3.85Å; V220-V253 HydrophobicContact CG2-CG2 3.96Å; V220-M254 HydrophobicContact CG2-CG 4.18Å
221	K	98.7	Very high	98.2	Very high	61 Å²	61	38.5 Å²	38.5	27%	0.265	20%	0.197	S	C	.	.	H	α-helix	trans	-60.2	-42.9	178.9	-66.6	173.1	178.6	166.8	0	112.2	K110 T112 F211 S216 Q217 S218 R225	K110-K221 VanDerWaalsContact O-CE 3.3Å; K110-K221 WeakPolarHBondContact O-CE 3.19Å; T112-K221 HydrophobicContact CG2-CB 4.18Å; T112-K221 HydrophobicContact CG2-CG 4.26Å; F211-K221 HydrophobicContact CE1-CG 4.11Å; F211-K221 HydrophobicContact CZ-CG 4.21Å; S216-K221 WeakPolarHBondContact O-CE 3.41Å; S216-K221 PolarHBondContact O-NZ 3.47Å; S216-K221 VanDerWaalsContact O-NZ 3.09Å; Q217-K221 PolarHBondContact O-N 3.38Å; S218-K221 PolarHBondContact O-N 3.33Å; K221-R225 PolarHBondContact O-N 2.92Å
222	V	98.8	Very high	98.1	Very high	25 Å²	25	41.9 Å²	41.9	15%	0.152	23%	0.225	C	C	.	.	H	α-helix	trans	-64.3	-47.2	176.4	170.2	0	0	0	0	111.1	N61 S218 T219 V220 I224 R225 L226 L264	N61-V222 HydrophobicContact CB-CG1 3.79Å; S218-V222 WeakPolarHBondContact O-CG2 3.21Å; S218-V222 PolarHBondContact O-N 3.08Å; T219-V222 PolarHBondContact O-N 3.02Å; V220-V222 VanDerWaalsContact C-N 3.34Å; V220-V222 PolarHBondContact O-N 2.68Å; V222-I224 PolarHBondContact O-N 2.79Å; V222-R225 WeakPolarHBondContact O-CB 3.35Å; V222-R225 PolarHBondContact O-N 3.03Å; V222-L226 HydrophobicContact CG1-CD1 4Å; V222-L226 WeakPolarHBondContact O-CG 3.4Å; V222-L226 PolarHBondContact O-N 3.04Å; V222-L226 VanDerWaalsContact O-N 3.08Å; V222-L264 HydrophobicContact CB-CD1 4.4Å; V222-L264 HydrophobicContact CG1-CD1 3.83Å; V222-L264 HydrophobicContact CG1-CD2 3.49Å; V222-L264 VanDerWaalsContact CG1-CD2 3.49Å; V222-L264 HydrophobicContact CG1-CG 4.32Å
223	L	98.9	Very high	98.1	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.5	-45.3	179.1	179.6	58.8	0	0	0	111.6	T219 V220 R225 L226 L227 A252 V253 L264 A267 Y268	T219-L223 VanDerWaalsContact O-CB 3.26Å; T219-L223 WeakPolarHBondContact O-CB 3.49Å; T219-L223 PolarHBondContact O-N 3.08Å; V220-L223 PolarHBondContact O-N 2.92Å; L223-R225 VanDerWaalsContact C-N 3.31Å; L223-R225 PolarHBondContact O-N 3.11Å; L223-L226 CarbonylContact O-C 3.52Å; L223-L226 WeakPolarHBondContact O-CB 3.5Å; L223-L226 PolarHBondContact O-N 3.43Å; L223-L226 VanDerWaalsContact O-N 3.15Å; L223-L227 HydrophobicContact CD1-CD1 4.45Å; L223-L227 HydrophobicContact CD1-CG 4.21Å; L223-L227 HydrophobicContact CG-CD1 4.12Å; L223-L227 HydrophobicContact CG-CG 4.32Å; L223-L227 VanDerWaalsContact O-CG 3.31Å; L223-L227 WeakPolarHBondContact O-CG 3.2Å; L223-L227 PolarHBondContact O-N 3.33Å; L223-A252 HydrophobicContact CD2-CB 4.03Å; L223-V253 HydrophobicContact CD2-CG2 3.68Å; L223-L264 HydrophobicContact CB-CD1 3.95Å; L223-L264 HydrophobicContact CD1-CD1 4.4Å; L223-A267 HydrophobicContact CD2-CB 3.76Å; L223-Y268 HydrophobicContact CD1-CD2 3.77Å; L223-Y268 HydrophobicContact CD1-CG 4.3Å
224	I	98.9	Very high	98.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.7	-42.1	178.1	-69.4	162.4	0	0	0	111.3	T112 F211 V220 V222 L226 L227 K228 D246	T112-I224 HydrophobicContact CG2-CB 4.15Å; T112-I224 HydrophobicContact CG2-CD1 4.33Å; T112-I224 HydrophobicContact CG2-CG2 3.96Å; F211-I224 HydrophobicContact CE2-CD1 3.48Å; F211-I224 VanDerWaalsContact CE2-CD1 3.48Å; F211-I224 HydrophobicContact CZ-CD1 3.71Å; V220-I224 HydrophobicContact CG1-CD1 3.63Å; V220-I224 HydrophobicContact CG1-CG1 4.42Å; V220-I224 WeakPolarHBondContact O-CD1 3.44Å; V220-I224 VanDerWaalsContact O-CG1 3.27Å; V220-I224 WeakPolarHBondContact O-CG1 3.39Å; V220-I224 PolarHBondContact O-N 2.88Å; V222-I224 PolarHBondContact O-N 2.79Å; I224-L226 VanDerWaalsContact C-N 3.33Å; I224-L226 PolarHBondContact O-N 2.84Å; I224-L227 PolarHBondContact O-N 3.5Å; I224-K228 HydrophobicContact CG2-CD 4.47Å; I224-K228 WeakPolarHBondContact O-CG 3.33Å; I224-K228 PolarHBondContact O-N 3.28Å; I224-D246 HydrophobicContact CD1-CB 4.36Å; I224-D246 WeakPolarHBondContact CG2-OD1 3.32Å
225	R	98.8	Very high	98.1	Very high	21 Å²	21	33.9 Å²	33.9	8%	0.079	19%	0.192	C	C	.	.	H	α-helix	trans	-60	-44.6	175.9	-172.3	-179.1	-65.8	94.5	6.9	111.6	N61 L64 G111 M113 T114 K221 V222 L223 L227 K228 D229	N61-R225 WeakPolarHBondContact OD1-CD 3.49Å; N61-R225 PolarHBondContact OD1-NH1 2.85Å; L64-R225 HydrophobicContact CB-CG 4.04Å; G111-R225 PolarHBondContact O-NH2 3.47Å; M113-R225 PolarHBondContact O-NE 2.77Å; M113-R225 PolarHBondContact O-NH2 2.91Å; T114-R225 HydrophobicContact CG2-CG 3.76Å; K221-R225 PolarHBondContact O-N 2.92Å; V222-R225 WeakPolarHBondContact O-CB 3.35Å; V222-R225 PolarHBondContact O-N 3.03Å; L223-R225 VanDerWaalsContact C-N 3.31Å; L223-R225 PolarHBondContact O-N 3.11Å; R225-L227 VanDerWaalsContact C-N 3.33Å; R225-L227 PolarHBondContact O-N 3.25Å; R225-K228 PolarHBondContact O-N 3.32Å; R225-D229 PolarHBondContact O-N 3.18Å; R225-D229 VanDerWaalsContact O-N 3.16Å
226	L	98.9	Very high	98.2	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-65.7	-34.3	176.4	-67	167.7	0	0	0	112.4	L57 R60 N61 L64 V222 L223 I224 D229 L230 L264 Y268	L57-L226 HydrophobicContact CB-CD1 4.31Å; L57-L226 HydrophobicContact CD2-CD1 3.75Å; R60-L226 HydrophobicContact CB-CD2 3.94Å; R60-L226 HydrophobicContact CG-CD2 3.76Å; N61-L226 HydrophobicContact CB-CD2 4.28Å; N61-L226 HydrophobicContact CB-CG 4.45Å; L64-L226 HydrophobicContact CD1-CD2 4.11Å; V222-L226 HydrophobicContact CG1-CD1 4Å; V222-L226 WeakPolarHBondContact O-CG 3.4Å; V222-L226 PolarHBondContact O-N 3.04Å; V222-L226 VanDerWaalsContact O-N 3.08Å; L223-L226 CarbonylContact O-C 3.52Å; L223-L226 WeakPolarHBondContact O-CB 3.5Å; L223-L226 PolarHBondContact O-N 3.43Å; L223-L226 VanDerWaalsContact O-N 3.15Å; I224-L226 VanDerWaalsContact C-N 3.33Å; I224-L226 PolarHBondContact O-N 2.84Å; L226-D229 PolarHBondContact O-N 2.91Å; L226-L230 WeakPolarHBondContact O-CB 3.39Å; L226-L230 PolarHBondContact O-N 3.32Å; L226-L264 HydrophobicContact CD1-CD1 4.16Å; L226-L264 HydrophobicContact CD1-CD2 4.14Å; L226-L264 HydrophobicContact CD1-CG 4.42Å; L226-Y268 HydrophobicContact CB-CD2 4.29Å; L226-Y268 HydrophobicContact CB-CE2 3.95Å; L226-Y268 HydrophobicContact CD1-CD2 4.39Å
227	L	98.9	Very high	98.4	Very high	8 Å²	8	31.9 Å²	31.9	4%	0.042	18%	0.179	C	C	.	.	H	α-helix	trans	-70.9	-36.3	175.5	-69.3	175.4	0	0	0	112.4	L223 I224 R225 D229 L230 R231 L245 L248 C271	L223-L227 HydrophobicContact CD1-CD1 4.45Å; L223-L227 HydrophobicContact CD1-CG 4.21Å; L223-L227 HydrophobicContact CG-CD1 4.12Å; L223-L227 HydrophobicContact CG-CG 4.32Å; L223-L227 VanDerWaalsContact O-CG 3.31Å; L223-L227 WeakPolarHBondContact O-CG 3.2Å; L223-L227 PolarHBondContact O-N 3.33Å; I224-L227 PolarHBondContact O-N 3.5Å; R225-L227 VanDerWaalsContact C-N 3.33Å; R225-L227 PolarHBondContact O-N 3.25Å; L227-D229 VanDerWaalsContact C-N 3.34Å; L227-L230 HydrophobicContact CD2-CD2 4.22Å; L227-L230 PolarHBondContact O-N 2.9Å; L227-R231 WeakPolarHBondContact O-CB 3.11Å; L227-R231 PolarHBondContact O-N 3.37Å; L227-L245 HydrophobicContact CB-CD2 4.2Å; L227-L248 HydrophobicContact CD1-CD2 4.32Å; L227-L248 HydrophobicContact CD1-CG 4.46Å; L227-C271 HydrophobicContact CD2-CB 4.11Å
228	K	98.8	Very high	98.5	Very high	38 Å²	38	32.2 Å²	32.2	17%	0.165	18%	0.18	C	C	.	.	H	α-helix	trans	-60.8	-44.6	172.2	-71.8	175.9	-176.6	177.4	0	111.1	S107 T112 I224 R225 R231 A232 L245	S107-K228 PolarHBondContact OG-NZ 3.39Å; T112-K228 PolarHBondContact O-NZ 3.02Å; T112-K228 PolarHBondContact OG1-NZ 3.36Å; I224-K228 HydrophobicContact CG2-CD 4.47Å; I224-K228 WeakPolarHBondContact O-CG 3.33Å; I224-K228 PolarHBondContact O-N 3.28Å; R225-K228 PolarHBondContact O-N 3.32Å; K228-R231 PolarHBondContact O-N 2.79Å; K228-A232 PolarHBondContact O-N 3.01Å; K228-L245 HydrophobicContact CG-CD1 3.93Å
229	D	98.6	Very high	98.5	Very high	15 Å²	15	28.8 Å²	28.8	8%	0.08	16%	0.156	C	C	.	.	H	α-helix	trans	-65.2	-42.4	174.7	174.3	65.5	0	0	0	112.4	R60 L64 R225 L226 L227 R231 A232 R233	R60-D229 IonicContact CZ-OD1 3.71Å; R60-D229 IonicContact CZ-OD2 3.65Å; R60-D229 IonicContact NE-OD1 3.26Å; R60-D229 IonicContact NE-OD2 2.65Å; R60-D229 PolarHBondContact NE-OD2 2.97Å; R60-D229 IonicContact NH2-OD1 2.9Å; R60-D229 PolarHBondContact NH2-OD1 2.65Å; R60-D229 IonicContact NH2-OD2 2.81Å; R60-D229 PolarHBondContact NH2-OD2 3.05Å; L64-D229 HydrophobicContact CD1-CB 3.44Å; L64-D229 VanDerWaalsContact CD1-CB 3.44Å; L64-D229 HydrophobicContact CD2-CB 3.97Å; L64-D229 HydrophobicContact CG-CB 4.36Å; R225-D229 PolarHBondContact O-N 3.18Å; R225-D229 VanDerWaalsContact O-N 3.16Å; L226-D229 PolarHBondContact O-N 2.91Å; L227-D229 VanDerWaalsContact C-N 3.34Å; D229-R231 VanDerWaalsContact C-N 3.34Å; D229-R231 PolarHBondContact O-N 3.18Å; D229-A232 PolarHBondContact O-N 3.38Å; D229-R233 VanDerWaalsContact CG-NE 3.29Å; D229-R233 WeakPolarHBondContact O-CG 3.43Å; D229-R233 PolarHBondContact O-N 3Å; D229-R233 VanDerWaalsContact O-N 3.08Å; D229-R233 PolarHBondContact O-NE 2.87Å; D229-R233 IonicContact OD1-NE 3.59Å; D229-R233 PolarHBondContact OD1-NE 2.85Å; D229-R233 IonicContact OD2-CZ 3.65Å; D229-R233 VanDerWaalsContact OD2-CZ 3.26Å; D229-R233 IonicContact OD2-NE 3.76Å; D229-R233 PolarHBondContact OD2-NE 3Å; D229-R233 IonicContact OD2-NH2 2.74Å; D229-R233 PolarHBondContact OD2-NH2 3.08Å
230	L	98.7	Very high	98.6	Very high	5 Å²	5	27.4 Å²	27.4	3%	0.026	15%	0.148	C	C	.	.	H	α-helix	trans	-58.7	-46.3	174.3	-178.5	71.1	0	0	0	111.2	L226 L227 A232 R233 F234 F237 L272 L317 I329	L226-L230 WeakPolarHBondContact O-CB 3.39Å; L226-L230 PolarHBondContact O-N 3.32Å; L227-L230 HydrophobicContact CD2-CD2 4.22Å; L227-L230 PolarHBondContact O-N 2.9Å; L230-A232 VanDerWaalsContact C-N 3.33Å; L230-A232 PolarHBondContact O-N 2.89Å; L230-R233 PolarHBondContact O-N 2.84Å; L230-F234 HydrophobicContact CD1-CD2 3.42Å; L230-F234 VanDerWaalsContact CD1-CD2 3.42Å; L230-F234 HydrophobicContact CD1-CE2 3.64Å; L230-F234 HydrophobicContact CD1-CG 4.49Å; L230-F234 HydrophobicContact CG-CD2 4.26Å; L230-F234 PolarHBondContact O-N 2.99Å; L230-F237 HydrophobicContact CD1-CE2 4.39Å; L230-F237 HydrophobicContact CD2-CD2 4.13Å; L230-F237 HydrophobicContact CD2-CE2 3.7Å; L230-F237 HydrophobicContact CG-CD2 3.96Å; L230-F237 HydrophobicContact CG-CE2 3.85Å; L230-L272 HydrophobicContact CD2-CD2 4.08Å; L230-L317 HydrophobicContact CD1-CD1 4.14Å; L230-I329 HydrophobicContact CD1-CG2 3.91Å
231	R	98.6	Very high	98.6	Very high	72 Å²	72	29.9 Å²	29.9	27%	0.272	16%	0.163	S	C	.	.	H	α-helix	trans	-58.7	-42.8	175.6	171.4	179.4	-179.8	-72	1.2	112.2	L227 K228 D229 R233 F237 E238 L240 L245	L227-R231 WeakPolarHBondContact O-CB 3.11Å; L227-R231 PolarHBondContact O-N 3.37Å; K228-R231 PolarHBondContact O-N 2.79Å; D229-R231 VanDerWaalsContact C-N 3.34Å; D229-R231 PolarHBondContact O-N 3.18Å; R231-R233 VanDerWaalsContact C-N 3.31Å; R231-R233 PolarHBondContact O-N 3.43Å; R231-F237 HydrophobicContact CB-CB 4.18Å; R231-F237 HydrophobicContact CG-CB 4.28Å; R231-F237 WeakPolarHBondContact CG-O 3.47Å; R231-E238 PolarHBondContact NE-O 3.08Å; R231-E238 PolarHBondContact NH2-O 2.95Å; R231-E238 IonicContact NH2-OE1 2.77Å; R231-E238 PolarHBondContact NH2-OE1 3.02Å; R231-L240 WeakPolarHBondContact CD-O 3.45Å; R231-L240 PolarHBondContact NE-O 3.09Å; R231-L245 HydrophobicContact CB-CD1 4.44Å
232	A	97.6	Very high	98.5	Very high	75 Å²	75	31 Å²	31	62%	0.62	18%	0.176	S	C	*	.	H	α-helix	trans	-66	-34.3	-179.7	0	0	0	0	0	112.6	K228 D229 L230	K228-A232 PolarHBondContact O-N 3.01Å; D229-A232 PolarHBondContact O-N 3.38Å; L230-A232 VanDerWaalsContact C-N 3.33Å; L230-A232 PolarHBondContact O-N 2.89Å
233	R	97.9	Very high	98.5	Very high	40 Å²	40	30.9 Å²	30.9	15%	0.151	17%	0.173	C	C	.	.	H	α-helix	trans	-88.9	-23.4	-177.5	-67.9	-176.7	-67.3	94.7	-0.1	114.3	D229 L230 R231 I329 S337	D229-R233 VanDerWaalsContact CG-NE 3.29Å; D229-R233 WeakPolarHBondContact O-CG 3.43Å; D229-R233 PolarHBondContact O-N 3Å; D229-R233 VanDerWaalsContact O-N 3.08Å; D229-R233 PolarHBondContact O-NE 2.87Å; D229-R233 IonicContact OD1-NE 3.59Å; D229-R233 PolarHBondContact OD1-NE 2.85Å; D229-R233 IonicContact OD2-CZ 3.65Å; D229-R233 VanDerWaalsContact OD2-CZ 3.26Å; D229-R233 IonicContact OD2-NE 3.76Å; D229-R233 PolarHBondContact OD2-NE 3Å; D229-R233 IonicContact OD2-NH2 2.74Å; D229-R233 PolarHBondContact OD2-NH2 3.08Å; L230-R233 PolarHBondContact O-N 2.84Å; R231-R233 VanDerWaalsContact C-N 3.31Å; R231-R233 PolarHBondContact O-N 3.43Å; R233-I329 PolarHBondContact NH1-O 3.41Å; R233-I329 PolarHBondContact NH2-O 2.68Å; R233-S337 WeakPolarHBondContact O-CB 3.32Å
234	F	98.5	Very high	98.5	Very high	1 Å²	1	31 Å²	31	0%	0.004	17%	0.173	C	C	.	.			trans	-117.8	97.2	176.9	-68.7	-83.2	0	0	0	110	L230 G236 F237 T313 L317 A336 A340	L230-F234 HydrophobicContact CD1-CD2 3.42Å; L230-F234 VanDerWaalsContact CD1-CD2 3.42Å; L230-F234 HydrophobicContact CD1-CE2 3.64Å; L230-F234 HydrophobicContact CD1-CG 4.49Å; L230-F234 HydrophobicContact CG-CD2 4.26Å; L230-F234 PolarHBondContact O-N 2.99Å; F234-G236 PolarHBondContact O-N 2.84Å; F234-F237 HydrophobicContact CB-CD2 3.93Å; F234-F237 HydrophobicContact CB-CE2 4.34Å; F234-F237 PolarHBondContact O-N 2.68Å; F234-T313 HydrophobicContact CB-CG2 4.43Å; F234-L317 HydrophobicContact CD1-CD1 4.04Å; F234-L317 HydrophobicContact CD1-CD2 4.12Å; F234-L317 HydrophobicContact CD2-CD1 3.99Å; F234-L317 HydrophobicContact CE1-CD1 4.17Å; F234-L317 HydrophobicContact CE1-CD2 3.59Å; F234-L317 HydrophobicContact CE1-CG 4.47Å; F234-L317 HydrophobicContact CE2-CD1 4.1Å; F234-L317 HydrophobicContact CE2-CD2 4.5Å; F234-L317 HydrophobicContact CG-CD1 3.94Å; F234-L317 HydrophobicContact CZ-CD1 4.2Å; F234-L317 HydrophobicContact CZ-CD2 3.8Å; F234-A336 WeakPolarHBondContact CE1-O 3.46Å; F234-A336 HydrophobicContact CZ-CB 4.04Å; F234-A340 HydrophobicContact CD1-CB 4.11Å
235	P	97.7	Very high	98.5	Very high	87 Å²	87	31.1 Å²	31.1	57%	0.565	17%	0.174	S	C	*	.	G	3₁₀ helix	trans	-57.5	-22.2	-175.5	-27.3	35.5	0	0	0	114.7	F237 E238	P235-F237 PolarHBondContact O-N 2.8Å; P235-F237 VanDerWaalsContact O-N 3.08Å; P235-E238 WeakPolarHBondContact O-CB 3.43Å; P235-E238 PolarHBondContact O-N 2.92Å
236	G	98.4	Very high	98.5	Very high	10 Å²	10	30.3 Å²	30.3	10%	0.103	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-60.6	-16	173.1	0	0	0	0	0	114.5	F234 V310 T313	F234-G236 PolarHBondContact O-N 2.84Å; G236-V310 WeakPolarHBondContact O-CA 3.4Å; G236-V310 WeakPolarHBondContact O-CG2 3.49Å; G236-T313 WeakPolarHBondContact CA-OG1 3.31Å
237	F	98.8	Very high	98.5	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.009	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-98.4	0.7	172.8	-66.2	-42.1	0	0	0	114.5	L230 R231 F234 P235 P239 L240 L272 L275 V310 T313 A314 L317	L230-F237 HydrophobicContact CD1-CE2 4.39Å; L230-F237 HydrophobicContact CD2-CD2 4.13Å; L230-F237 HydrophobicContact CD2-CE2 3.7Å; L230-F237 HydrophobicContact CG-CD2 3.96Å; L230-F237 HydrophobicContact CG-CE2 3.85Å; R231-F237 HydrophobicContact CB-CB 4.18Å; R231-F237 HydrophobicContact CG-CB 4.28Å; R231-F237 WeakPolarHBondContact CG-O 3.47Å; F234-F237 HydrophobicContact CB-CD2 3.93Å; F234-F237 HydrophobicContact CB-CE2 4.34Å; F234-F237 PolarHBondContact O-N 2.68Å; P235-F237 PolarHBondContact O-N 2.8Å; P235-F237 VanDerWaalsContact O-N 3.08Å; F237-P239 VanDerWaalsContact O-N 3.16Å; F237-L240 HydrophobicContact CB-CD1 4.02Å; F237-L240 HydrophobicContact CD1-CD1 3.89Å; F237-L240 HydrophobicContact CG-CD1 4.17Å; F237-L240 WeakPolarHBondContact O-CB 3.47Å; F237-L240 PolarHBondContact O-N 3.12Å; F237-L272 HydrophobicContact CE2-CD2 4.47Å; F237-L272 HydrophobicContact CZ-CD2 4.11Å; F237-L275 HydrophobicContact CE1-CD1 4.05Å; F237-V310 HydrophobicContact CD1-CG1 4.17Å; F237-V310 HydrophobicContact CE1-CG1 4.37Å; F237-V310 WeakPolarHBondContact CE1-O 3.49Å; F237-T313 HydrophobicContact CD1-CG2 4.26Å; F237-T313 HydrophobicContact CD2-CG2 4.21Å; F237-T313 HydrophobicContact CE1-CG2 3.92Å; F237-T313 HydrophobicContact CE2-CG2 3.88Å; F237-T313 HydrophobicContact CG-CG2 4.4Å; F237-T313 HydrophobicContact CZ-CG2 3.72Å; F237-A314 HydrophobicContact CE1-CB 4Å; F237-A314 HydrophobicContact CZ-CB 4.07Å; F237-L317 HydrophobicContact CE2-CD1 3.62Å; F237-L317 HydrophobicContact CZ-CD1 4.06Å
238	E	98.4	Very high	98.5	Very high	100 Å²	100	30.1 Å²	30.1	47%	0.467	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.3	-41.2	176.5	-166.7	-67.4	137.9	0	0	112.5	R231 P235 L240	R231-E238 PolarHBondContact NE-O 3.08Å; R231-E238 PolarHBondContact NH2-O 2.95Å; R231-E238 IonicContact NH2-OE1 2.77Å; R231-E238 PolarHBondContact NH2-OE1 3.02Å; P235-E238 WeakPolarHBondContact O-CB 3.43Å; P235-E238 PolarHBondContact O-N 2.92Å; E238-L240 PolarHBondContact O-N 3.25Å
239	P	98.7	Very high	98.5	Very high	11 Å²	11	28.3 Å²	28.3	7%	0.071	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-16.3	-179.2	-25.9	37.9	0	0	0	115.5	F237 T241 M302 Q306 M309 V310	F237-P239 VanDerWaalsContact O-N 3.16Å; P239-T241 PolarHBondContact O-N 3.38Å; P239-T241 VanDerWaalsContact O-N 3.08Å; P239-M302 HydrophobicContact CB-CG 3.81Å; P239-M302 HydrophobicContact CB-SD 3.52Å; P239-M302 VanDerWaalsContact CB-SD 3.52Å; P239-Q306 HydrophobicContact CB-CB 3.77Å; P239-Q306 HydrophobicContact CB-CG 3.99Å; P239-Q306 HydrophobicContact CG-CB 3.62Å; P239-Q306 HydrophobicContact CG-CG 3.56Å; P239-M309 HydrophobicContact CG-CE 3.46Å; P239-M309 VanDerWaalsContact CG-CE 3.46Å; P239-V310 HydrophobicContact CB-CG2 4.22Å; P239-V310 HydrophobicContact CG-CG2 4.3Å
240	L	98.8	Very high	98.5	Very high	4 Å²	4	29.4 Å²	29.4	2%	0.021	17%	0.167	C	C	.	.			trans	-70.5	104.5	177.1	-61.8	177.5	0	0	0	110.2	R231 F237 E238 I244 L245 L275 F280 M302 V310	R231-L240 WeakPolarHBondContact CD-O 3.45Å; R231-L240 PolarHBondContact NE-O 3.09Å; F237-L240 HydrophobicContact CB-CD1 4.02Å; F237-L240 HydrophobicContact CD1-CD1 3.89Å; F237-L240 HydrophobicContact CG-CD1 4.17Å; F237-L240 WeakPolarHBondContact O-CB 3.47Å; F237-L240 PolarHBondContact O-N 3.12Å; E238-L240 PolarHBondContact O-N 3.25Å; L240-I244 HydrophobicContact CD2-CG2 3.69Å; L240-L245 HydrophobicContact CB-CD2 3.76Å; L240-L245 HydrophobicContact CB-CG 4.25Å; L240-L245 HydrophobicContact CD1-CD2 3.85Å; L240-L245 HydrophobicContact CG-CD2 4.42Å; L240-L275 HydrophobicContact CD1-CD1 4.27Å; L240-F280 HydrophobicContact CD2-CD2 3.92Å; L240-F280 HydrophobicContact CD2-CE2 3.84Å; L240-M302 HydrophobicContact CD2-CE 4.36Å; L240-M302 HydrophobicContact CD2-SD 4.21Å; L240-V310 HydrophobicContact CD1-CG1 4.37Å; L240-V310 HydrophobicContact CD2-CG1 3.98Å; L240-V310 HydrophobicContact CD2-CG2 4.22Å; L240-V310 HydrophobicContact CG-CG1 4.31Å; L240-V310 HydrophobicContact CG-CG2 4.13Å
241	T	98.4	Very high	98.5	Very high	52 Å²	52	29.8 Å²	29.8	32%	0.319	17%	0.17	S	C	.	.			trans	-64.7	158.1	177.4	74.7	0	0	0	0	111.5	P239 W243 I244 L245 V301	P239-T241 PolarHBondContact O-N 3.38Å; P239-T241 VanDerWaalsContact O-N 3.08Å; T241-W243 PolarHBondContact O-N 3.47Å; T241-W243 VanDerWaalsContact O-N 3.13Å; T241-I244 HydrophobicContact CG2-CD1 4.17Å; T241-I244 PolarHBondContact O-N 3.02Å; T241-I244 WeakPolarHBondContact OG1-CG1 3.35Å; T241-I244 PolarHBondContact OG1-N 3.42Å; T241-L245 PolarHBondContact O-N 3.34Å; T241-V301 HydrophobicContact CG2-CG2 4.21Å
242	P	98.4	Very high	98.5	Very high	85 Å²	85	26.3 Å²	26.3	55%	0.552	16%	0.157	S	C	*	.	H	α-helix	trans	-53	-35.6	175.2	-28.4	35.9	0	0	0	113.6	L245 D246	P242-L245 PolarHBondContact O-N 2.86Å; P242-D246 PolarHBondContact O-N 2.83Å
243	W	98.7	Very high	98.5	Very high	22 Å²	22	22.8 Å²	22.8	8%	0.083	13%	0.128	C	C	.	.	H	α-helix	trans	-70.6	-39.7	177.1	-178.5	-130.8	0	0	0	112.9	H207 W210 T241 L245 D246 L247 D289 P290 C291	H207-W243 HydrophobicContact CB-CD2 4.33Å; H207-W243 HydrophobicContact CB-CE3 3.78Å; H207-W243 HydrophobicContact CB-CH2 3.95Å; H207-W243 HydrophobicContact CB-CZ2 4.47Å; H207-W243 HydrophobicContact CB-CZ3 3.58Å; H207-W243 AromaticContact CD2-CD2 3.7Å; H207-W243 AromaticContact CD2-CE2 3.37Å; H207-W243 AromaticContact CD2-CH2 3.74Å; H207-W243 AromaticContact CD2-CZ2 3.4Å; H207-W243 WeakPolarHBondContact CD2-CZ2 3.38Å; H207-W243 AromaticContact CD2-NE1 3.82Å; H207-W243 AromaticContact CE1-CD1 3.62Å; H207-W243 AromaticContact CE1-CD2 3.69Å; H207-W243 AromaticContact CE1-CE2 3.86Å; H207-W243 AromaticContact CE1-CG 3.54Å; H207-W243 AromaticContact CE1-NE1 3.78Å; H207-W243 AromaticContact CG-CD2 3.64Å; H207-W243 AromaticContact CG-CE2 3.82Å; H207-W243 AromaticContact CG-CE3 3.6Å; H207-W243 AromaticContact CG-CH2 3.93Å; H207-W243 AromaticContact CG-CZ2 3.96Å; H207-W243 AromaticContact CG-CZ3 3.76Å; H207-W243 AromaticContact ND1-CD2 3.63Å; H207-W243 AromaticContact ND1-CE3 3.85Å; H207-W243 AromaticContact ND1-CG 3.79Å; H207-W243 AromaticContact NE2-CD1 3.69Å; H207-W243 AromaticContact NE2-CD2 3.76Å; H207-W243 AromaticContact NE2-CE2 3.43Å; H207-W243 AromaticContact NE2-CG 3.91Å; H207-W243 AromaticContact NE2-CZ2 3.91Å; H207-W243 AromaticContact NE2-NE1 3.37Å; H207-W243 PolarHBondContact NE2-NE1 3.02Å; W210-W243 HydrophobicContact CB-CH2 4.42Å; W210-W243 AromaticContact CD2-CH2 3.81Å; W210-W243 HydrophobicContact CD2-CH2 3.81Å; W210-W243 AromaticContact CE3-CH2 3.34Å; W210-W243 HydrophobicContact CE3-CH2 3.34Å; W210-W243 HydrophobicContact CE3-CZ2 4.5Å; W210-W243 AromaticContact CE3-CZ3 3.67Å; W210-W243 HydrophobicContact CE3-CZ3 3.67Å; W210-W243 HydrophobicContact CG-CH2 4.27Å; W210-W243 AromaticContact CZ3-CH2 3.92Å; W210-W243 HydrophobicContact CZ3-CH2 3.92Å; W210-W243 AromaticContact CZ3-CZ3 3.98Å; W210-W243 HydrophobicContact CZ3-CZ3 3.98Å; T241-W243 PolarHBondContact O-N 3.47Å; T241-W243 VanDerWaalsContact O-N 3.13Å; W243-L245 VanDerWaalsContact C-N 3.28Å; W243-L245 PolarHBondContact O-N 3.4Å; W243-D246 HydrophobicContact CE3-CB 3.9Å; W243-D246 HydrophobicContact CZ3-CB 4.2Å; W243-D246 PolarHBondContact O-N 3.06Å; W243-L247 HydrophobicContact CD2-CD1 4.21Å; W243-L247 HydrophobicContact CD2-CG 4.18Å; W243-L247 HydrophobicContact CE3-CG 4.45Å; W243-L247 HydrophobicContact CG-CD1 4.49Å; W243-L247 HydrophobicContact CH2-CD2 3.94Å; W243-L247 HydrophobicContact CH2-CG 4.33Å; W243-L247 HydrophobicContact CZ2-CD1 4.01Å; W243-L247 HydrophobicContact CZ2-CD2 3.84Å; W243-L247 HydrophobicContact CZ2-CG 4.04Å; W243-L247 HydrophobicContact CZ3-CD2 4.43Å; W243-L247 WeakPolarHBondContact O-CG 3.49Å; W243-L247 PolarHBondContact O-N 3.25Å; W243-D289 PolarHBondContact NE1-OD1 2.84Å; W243-D289 PolarHBondContact NE1-OD2 3.07Å; W243-P290 HydrophobicContact CH2-CG 4.46Å; W243-P290 HydrophobicContact CZ2-CG 4.11Å; W243-C291 HydrophobicContact CZ2-CB 4.2Å
244	I	98.8	Very high	98.5	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-61	-40.7	172.4	-67.4	171.3	0	0	0	110.4	L240 T241 L247 L248 F280 V298 V301	L240-I244 HydrophobicContact CD2-CG2 3.69Å; T241-I244 HydrophobicContact CG2-CD1 4.17Å; T241-I244 PolarHBondContact O-N 3.02Å; T241-I244 WeakPolarHBondContact OG1-CG1 3.35Å; T241-I244 PolarHBondContact OG1-N 3.42Å; I244-L247 PolarHBondContact O-N 3.42Å; I244-L248 WeakPolarHBondContact O-CB 3.43Å; I244-L248 PolarHBondContact O-N 2.82Å; I244-F280 HydrophobicContact CG2-CD2 4.4Å; I244-F280 HydrophobicContact CG2-CE2 3.4Å; I244-F280 VanDerWaalsContact CG2-CE2 3.4Å; I244-F280 HydrophobicContact CG2-CZ 3.65Å; I244-V298 HydrophobicContact CG1-CB 4.13Å; I244-V298 HydrophobicContact CG1-CG2 4.05Å; I244-V301 HydrophobicContact CD1-CG2 3.91Å
245	L	98.9	Very high	98.4	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.021	16%	0.156	C	C	.	.	H	α-helix	trans	-64.9	-39.3	176.6	-64.4	-175.5	0	0	0	112.6	L227 K228 R231 L240 T241 P242 W243 G249	L227-L245 HydrophobicContact CB-CD2 4.2Å; K228-L245 HydrophobicContact CG-CD1 3.93Å; R231-L245 HydrophobicContact CB-CD1 4.44Å; L240-L245 HydrophobicContact CB-CD2 3.76Å; L240-L245 HydrophobicContact CB-CG 4.25Å; L240-L245 HydrophobicContact CD1-CD2 3.85Å; L240-L245 HydrophobicContact CG-CD2 4.42Å; T241-L245 PolarHBondContact O-N 3.34Å; P242-L245 PolarHBondContact O-N 2.86Å; W243-L245 VanDerWaalsContact C-N 3.28Å; W243-L245 PolarHBondContact O-N 3.4Å; L245-G249 PolarHBondContact O-N 3.4Å
246	D	98.8	Very high	98.2	Very high	4 Å²	4	24.1 Å²	24.1	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-59.6	-48.9	175	-71	-24.2	0	0	0	111	K110 F211 I224 P242 W243 G249 H250	K110-D246 IonicContact NZ-OD2 3.61Å; K110-D246 PolarHBondContact NZ-OD2 2.9Å; F211-D246 HydrophobicContact CD2-CB 4.23Å; F211-D246 HydrophobicContact CE2-CB 4.15Å; I224-D246 HydrophobicContact CD1-CB 4.36Å; I224-D246 WeakPolarHBondContact CG2-OD1 3.32Å; P242-D246 PolarHBondContact O-N 2.83Å; W243-D246 HydrophobicContact CE3-CB 3.9Å; W243-D246 HydrophobicContact CZ3-CB 4.2Å; W243-D246 PolarHBondContact O-N 3.06Å; D246-G249 PolarHBondContact O-N 2.93Å; D246-H250 WeakPolarHBondContact O-CB 3.15Å; D246-H250 PolarHBondContact O-N 2.83Å
247	L	98.8	Very high	98	Very high	3 Å²	3	28 Å²	28	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-68.9	-39.4	-179.7	-68.5	176.8	0	0	0	112.8	W210 W243 I244 H250 S251 I287 P290 V298	W210-L247 HydrophobicContact CE3-CD2 4.38Å; W210-L247 HydrophobicContact CH2-CD2 3.49Å; W210-L247 VanDerWaalsContact CH2-CD2 3.49Å; W210-L247 HydrophobicContact CZ2-CD2 3.76Å; W210-L247 HydrophobicContact CZ3-CD2 3.82Å; W243-L247 HydrophobicContact CD2-CD1 4.21Å; W243-L247 HydrophobicContact CD2-CG 4.18Å; W243-L247 HydrophobicContact CE3-CG 4.45Å; W243-L247 HydrophobicContact CG-CD1 4.49Å; W243-L247 HydrophobicContact CH2-CD2 3.94Å; W243-L247 HydrophobicContact CH2-CG 4.33Å; W243-L247 HydrophobicContact CZ2-CD1 4.01Å; W243-L247 HydrophobicContact CZ2-CD2 3.84Å; W243-L247 HydrophobicContact CZ2-CG 4.04Å; W243-L247 HydrophobicContact CZ3-CD2 4.43Å; W243-L247 WeakPolarHBondContact O-CG 3.49Å; W243-L247 PolarHBondContact O-N 3.25Å; I244-L247 PolarHBondContact O-N 3.42Å; L247-H250 PolarHBondContact O-N 2.9Å; L247-S251 VanDerWaalsContact O-CB 3.24Å; L247-S251 WeakPolarHBondContact O-CB 3.4Å; L247-S251 PolarHBondContact O-N 2.87Å; L247-I287 HydrophobicContact CB-CD1 4.29Å; L247-I287 HydrophobicContact CB-CG2 4.1Å; L247-I287 HydrophobicContact CD1-CG2 4.14Å; L247-P290 HydrophobicContact CD2-CG 3.8Å; L247-V298 HydrophobicContact CD1-CB 4.3Å; L247-V298 HydrophobicContact CD1-CG1 3.53Å; L247-V298 HydrophobicContact CD1-CG2 4.19Å
248	L	98.9	Very high	97.6	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-63.3	-47	175.7	-179.8	64.8	0	0	0	110.8	L227 I244 S251 A252 C271 M274 L275 L279	L227-L248 HydrophobicContact CD1-CD2 4.32Å; L227-L248 HydrophobicContact CD1-CG 4.46Å; I244-L248 WeakPolarHBondContact O-CB 3.43Å; I244-L248 PolarHBondContact O-N 2.82Å; L248-S251 PolarHBondContact O-N 3.32Å; L248-A252 VanDerWaalsContact O-CB 3.3Å; L248-A252 WeakPolarHBondContact O-CB 3.45Å; L248-A252 PolarHBondContact O-N 2.94Å; L248-C271 HydrophobicContact CD2-CB 4.43Å; L248-C271 HydrophobicContact CG-CB 4.48Å; L248-M274 HydrophobicContact CD1-CE 3.62Å; L248-L275 HydrophobicContact CD2-CD1 3.93Å; L248-L275 HydrophobicContact CD2-CD2 4.33Å; L248-L275 HydrophobicContact CD2-CG 4.24Å; L248-L279 HydrophobicContact CD1-CD2 4.03Å
249	G	98.6	Very high	97.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.1	-44.6	177.1	0	0	0	0	0	112.2	L245 D246 V253	L245-G249 PolarHBondContact O-N 3.4Å; D246-G249 PolarHBondContact O-N 2.93Å; G249-V253 WeakPolarHBondContact O-CG2 3.45Å; G249-V253 PolarHBondContact O-N 3.5Å
250	H	98.6	Very high	96.9	Very high	39 Å²	39	42.3 Å²	42.3	18%	0.181	22%	0.22	C	C	.	.	H	α-helix	trans	-61.3	-50.1	173.7	168.9	-94	0	0	0	112	W210 N214 A215 V220 D246 L247 A252 V253 M254	W210-H250 HydrophobicContact CH2-CB 3.75Å; W210-H250 AromaticContact CH2-CG 3.58Å; W210-H250 AromaticContact CH2-ND1 3.78Å; W210-H250 AromaticContact CZ2-CE1 4Å; W210-H250 AromaticContact CZ2-CG 4Å; W210-H250 AromaticContact CZ2-ND1 3.78Å; N214-H250 PolarHBondContact O-CD2 3.31Å; N214-H250 PolarHBondContact O-NE2 3.4Å; A215-H250 HydrophobicContact CB-CB 4.29Å; V220-H250 HydrophobicContact CG1-CB 4.28Å; D246-H250 WeakPolarHBondContact O-CB 3.15Å; D246-H250 PolarHBondContact O-N 2.83Å; L247-H250 PolarHBondContact O-N 2.9Å; H250-A252 PolarHBondContact O-N 3.33Å; H250-V253 PolarHBondContact O-N 3.02Å; H250-M254 WeakPolarHBondContact O-CB 3.34Å; H250-M254 PolarHBondContact O-N 3.15Å
251	S	98.1	Very high	96.8	Very high	12 Å²	12	44.4 Å²	44.4	8%	0.084	23%	0.234	C	C	.	.	H	α-helix	trans	-59.8	-45.7	-179	-173.1	0	0	0	0	111.3	L247 L248 V253 N255 R270	L247-S251 VanDerWaalsContact O-CB 3.24Å; L247-S251 WeakPolarHBondContact O-CB 3.4Å; L247-S251 PolarHBondContact O-N 2.87Å; L248-S251 PolarHBondContact O-N 3.32Å; S251-V253 VanDerWaalsContact C-N 3.3Å; S251-V253 PolarHBondContact O-N 2.9Å; S251-N255 WeakPolarHBondContact O-CB 3.47Å; S251-N255 PolarHBondContact O-N 3.32Å; S251-R270 PolarHBondContact O-NH1 3.44Å
252	A	98.5	Very high	96.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-58.5	-41.1	179.5	0	0	0	0	0	112.5	L223 L248 H250 L262 A267 R270 C271 M274	L223-A252 HydrophobicContact CD2-CB 4.03Å; L248-A252 VanDerWaalsContact O-CB 3.3Å; L248-A252 WeakPolarHBondContact O-CB 3.45Å; L248-A252 PolarHBondContact O-N 2.94Å; H250-A252 PolarHBondContact O-N 3.33Å; A252-L262 VanDerWaalsContact O-CD1 3.29Å; A252-L262 WeakPolarHBondContact O-CD1 3.2Å; A252-A267 HydrophobicContact CB-CB 4.37Å; A252-R270 WeakPolarHBondContact O-CD 3.49Å; A252-R270 PolarHBondContact O-NH1 3.09Å; A252-C271 WeakPolarHBondContact CB-SG 3.46Å; A252-M274 HydrophobicContact CB-CE 3.69Å
253	V	98.6	Very high	96.7	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-81.7	-47.2	-178.1	178.6	0	0	0	0	112.1	T219 V220 L223 G249 H250 S251 N256 P261 L262 A267	T219-V253 HydrophobicContact CG2-CG1 4.26Å; T219-V253 HydrophobicContact CG2-CG2 4.03Å; V220-V253 HydrophobicContact CG2-CB 3.73Å; V220-V253 HydrophobicContact CG2-CG1 3.85Å; V220-V253 HydrophobicContact CG2-CG2 3.96Å; L223-V253 HydrophobicContact CD2-CG2 3.68Å; G249-V253 WeakPolarHBondContact O-CG2 3.45Å; G249-V253 PolarHBondContact O-N 3.5Å; H250-V253 PolarHBondContact O-N 3.02Å; S251-V253 VanDerWaalsContact C-N 3.3Å; S251-V253 PolarHBondContact O-N 2.9Å; V253-N256 PolarHBondContact O-ND2 3.33Å; V253-N256 VanDerWaalsContact O-ND2 3.12Å; V253-P261 HydrophobicContact CG1-CB 3.72Å; V253-L262 PolarHBondContact O-N 2.85Å; V253-A267 HydrophobicContact CG2-CB 3.62Å
254	M	97.2	Very high	96.7	Very high	47 Å²	47	42 Å²	42	23%	0.232	22%	0.221	C	C	.	.	H	α-helix	trans	-100.6	-28.8	-163.7	-60.5	-55.3	-63.1	0	0	114.2	Q217 V220 H250 N256 P261	Q217-M254 HydrophobicContact CG-CE 4.38Å; Q217-M254 HydrophobicContact CG-SD 4.02Å; V220-M254 HydrophobicContact CG2-CG 4.18Å; H250-M254 WeakPolarHBondContact O-CB 3.34Å; H250-M254 PolarHBondContact O-N 3.15Å; M254-N256 VanDerWaalsContact C-N 3.34Å; M254-N256 PolarHBondContact O-N 2.93Å; M254-P261 HydrophobicContact CE-CG 4.29Å; M254-P261 HydrophobicContact SD-CB 4.07Å; M254-P261 HydrophobicContact SD-CG 3.89Å
255	N	95.4	Very high	96.7	Very high	96 Å²	96	42.7 Å²	42.7	51%	0.513	23%	0.225	S	C	.	.			trans	-84.8	74.6	-174.7	-173.9	10	0	0	0	110.4	S251 R270	S251-N255 WeakPolarHBondContact O-CB 3.47Å; S251-N255 PolarHBondContact O-N 3.32Å; N255-R270 PolarHBondContact O-NH1 3.06Å; N255-R270 PolarHBondContact O-NH2 3.06Å
256	N	94.6	Very high	96.7	Very high	14 Å²	14	43.3 Å²	43.3	8%	0.075	23%	0.228	C	C	.	.	S	Bend	trans	-144.8	158.2	178.1	72.3	78.5	0	0	0	111.6	V253 M254 S258 R259 Q260 L262	V253-N256 PolarHBondContact O-ND2 3.33Å; V253-N256 VanDerWaalsContact O-ND2 3.12Å; M254-N256 VanDerWaalsContact C-N 3.34Å; M254-N256 PolarHBondContact O-N 2.93Å; N256-S258 PolarHBondContact O-N 3.45Å; N256-S258 WeakPolarHBondContact OD1-CB 3.45Å; N256-S258 PolarHBondContact OD1-N 3.4Å; N256-S258 PolarHBondContact OD1-OG 3.26Å; N256-R259 PolarHBondContact O-N 3.26Å; N256-R259 PolarHBondContact OD1-N 3.23Å; N256-Q260 PolarHBondContact ND2-O 2.85Å; N256-L262 HydrophobicContact CB-CD2 4.47Å
257	P	94	Very high	96.6	Very high	91 Å²	91	43.1 Å²	43.1	59%	0.591	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-28.5	-174.5	-25.7	35.3	0	0	0	114.7	Y35 V36 R259	Y35-P257 WeakPolarHBondContact O-CD 3.22Å; V36-P257 WeakPolarHBondContact O-CG 3.29Å; P257-R259 PolarHBondContact O-N 3.02Å
258	S	90.9	Very high	96.7	Very high	71 Å²	71	43 Å²	43	50%	0.497	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-18.1	179.8	82	0	0	0	0	113	N256 Q260	N256-S258 PolarHBondContact O-N 3.45Å; N256-S258 WeakPolarHBondContact OD1-CB 3.45Å; N256-S258 PolarHBondContact OD1-N 3.4Å; N256-S258 PolarHBondContact OD1-OG 3.26Å; S258-Q260 PolarHBondContact O-N 3.07Å; S258-Q260 PolarHBondContact OG-N 2.9Å
259	R	86.6	Confident	96.6	Very high	212 Å²	212	44.6 Å²	44.6	80%	0.8	23%	0.233	S	C	*	.			trans	54.5	14.4	-172.6	-55.9	-177	175.7	-173	-2.2	114.1	N256 P257	N256-R259 PolarHBondContact O-N 3.26Å; N256-R259 PolarHBondContact OD1-N 3.23Å; P257-R259 PolarHBondContact O-N 3.02Å
260	Q	94.4	Very high	96.6	Very high	130 Å²	130	44.6 Å²	44.6	61%	0.607	23%	0.233	S	C	*	.	S	Bend	trans	-99.8	146.4	170.1	-63.1	-55.9	-50.2	0	0	109.1	N256 S258 L262	N256-Q260 PolarHBondContact ND2-O 2.85Å; S258-Q260 PolarHBondContact O-N 3.07Å; S258-Q260 PolarHBondContact OG-N 2.9Å; Q260-L262 PolarHBondContact O-N 2.88Å
261	P	97.2	Very high	96.6	Very high	48 Å²	48	42.8 Å²	42.8	31%	0.312	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-56.9	126.5	173.5	-23.1	33.2	0	0	0	110.9	V253 M254	V253-P261 HydrophobicContact CG1-CB 3.72Å; M254-P261 HydrophobicContact CE-CG 4.29Å; M254-P261 HydrophobicContact SD-CB 4.07Å; M254-P261 HydrophobicContact SD-CG 3.89Å
262	L	97.8	Very high	96.7	Very high	27 Å²	27	42.3 Å²	42.3	14%	0.141	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-63.8	149.9	170	-62.1	-175.6	0	0	0	110.3	Y35 A252 V253 N256 Q260 V266 A267	Y35-L262 HydrophobicContact CD1-CD1 4.06Å; Y35-L262 HydrophobicContact CG-CD1 4.26Å; A252-L262 VanDerWaalsContact O-CD1 3.29Å; A252-L262 WeakPolarHBondContact O-CD1 3.2Å; V253-L262 PolarHBondContact O-N 2.85Å; N256-L262 HydrophobicContact CB-CD2 4.47Å; Q260-L262 PolarHBondContact O-N 2.88Å; L262-V266 HydrophobicContact CB-CB 4.45Å; L262-V266 HydrophobicContact CB-CG1 4.11Å; L262-V266 HydrophobicContact CD1-CG1 3.87Å; L262-V266 HydrophobicContact CD2-CG1 4.42Å; L262-V266 HydrophobicContact CG-CG1 4.36Å; L262-A267 HydrophobicContact CB-CB 4.29Å
263	S	97.8	Very high	96.7	Very high	60 Å²	60	45 Å²	45	42%	0.42	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-64.1	155.9	173.4	66	0	0	0	0	111	N265 V266 A267	S263-N265 WeakPolarHBondContact CB-OD1 3.2Å; S263-N265 PolarHBondContact O-N 3.49Å; S263-N265 PolarHBondContact OG-OD1 3.22Å; S263-V266 PolarHBondContact O-N 3.24Å; S263-V266 VanDerWaalsContact O-N 3.14Å; S263-V266 WeakPolarHBondContact OG-CG2 3.44Å; S263-A267 WeakPolarHBondContact O-CB 3.44Å; S263-A267 PolarHBondContact O-N 3.09Å
264	L	98.6	Very high	96.7	Very high	22 Å²	22	45.3 Å²	45.3	12%	0.115	24%	0.235	C	C	.	.	H	α-helix	trans	-59.3	-43.5	-171.5	-176.9	61.7	0	0	0	113.2	L57 L58 T219 V222 L223 L226 A267 Y268	L57-L264 HydrophobicContact CB-CD2 3.76Å; L57-L264 HydrophobicContact CB-CG 4.26Å; L57-L264 HydrophobicContact CD1-CG 4.2Å; L58-L264 HydrophobicContact CD2-CD2 4.06Å; T219-L264 HydrophobicContact CG2-CB 4.14Å; T219-L264 HydrophobicContact CG2-CD1 4.1Å; V222-L264 HydrophobicContact CB-CD1 4.4Å; V222-L264 HydrophobicContact CG1-CD1 3.83Å; V222-L264 HydrophobicContact CG1-CD2 3.49Å; V222-L264 VanDerWaalsContact CG1-CD2 3.49Å; V222-L264 HydrophobicContact CG1-CG 4.32Å; L223-L264 HydrophobicContact CB-CD1 3.95Å; L223-L264 HydrophobicContact CD1-CD1 4.4Å; L226-L264 HydrophobicContact CD1-CD1 4.16Å; L226-L264 HydrophobicContact CD1-CD2 4.14Å; L226-L264 HydrophobicContact CD1-CG 4.42Å; L264-A267 PolarHBondContact O-N 2.82Å; L264-Y268 VanDerWaalsContact O-CB 3.27Å; L264-Y268 WeakPolarHBondContact O-CB 3.37Å; L264-Y268 PolarHBondContact O-N 2.86Å
265	N	98.4	Very high	96.8	Very high	16 Å²	16	43.3 Å²	43.3	9%	0.086	23%	0.225	C	C	.	.	H	α-helix	trans	-61.3	-42.8	176.6	60.6	-50.7	0	0	0	112.4	E50 F53 S54 L57 S263 R269	E50-N265 PolarHBondContact OE2-ND2 3.02Å; F53-N265 HydrophobicContact CD1-CB 3.66Å; F53-N265 HydrophobicContact CE1-CB 3.8Å; F53-N265 HydrophobicContact CG-CB 4.49Å; S54-N265 WeakPolarHBondContact OG-CB 3.38Å; L57-N265 VanDerWaalsContact CD1-CA 3.44Å; L57-N265 HydrophobicContact CD1-CB 3.85Å; S263-N265 WeakPolarHBondContact CB-OD1 3.2Å; S263-N265 PolarHBondContact O-N 3.49Å; S263-N265 PolarHBondContact OG-OD1 3.22Å; N265-R269 WeakPolarHBondContact O-CB 3.39Å; N265-R269 PolarHBondContact O-N 3.48Å
266	V	98.1	Very high	96.9	Very high	16 Å²	16	39.6 Å²	39.6	10%	0.097	21%	0.208	C	C	.	.	H	α-helix	trans	-66.4	-48.4	178.3	173.3	0	0	0	0	110.5	Y35 M47 L262 S263 Y268 R269 R270	Y35-V266 HydrophobicContact CD1-CG1 3.96Å; Y35-V266 HydrophobicContact CE1-CG1 3.24Å; M47-V266 HydrophobicContact CE-CG2 4.46Å; L262-V266 HydrophobicContact CB-CB 4.45Å; L262-V266 HydrophobicContact CB-CG1 4.11Å; L262-V266 HydrophobicContact CD1-CG1 3.87Å; L262-V266 HydrophobicContact CD2-CG1 4.42Å; L262-V266 HydrophobicContact CG-CG1 4.36Å; S263-V266 PolarHBondContact O-N 3.24Å; S263-V266 VanDerWaalsContact O-N 3.14Å; S263-V266 WeakPolarHBondContact OG-CG2 3.44Å; V266-Y268 PolarHBondContact O-N 3.34Å; V266-R269 PolarHBondContact O-N 3.31Å; V266-R270 WeakPolarHBondContact O-CB 3.31Å; V266-R270 PolarHBondContact O-N 3.22Å
267	A	98.6	Very high	97.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.2	-38.2	179.6	0	0	0	0	0	112.4	L223 A252 V253 L262 S263 L264 R270 C271	L223-A267 HydrophobicContact CD2-CB 3.76Å; A252-A267 HydrophobicContact CB-CB 4.37Å; V253-A267 HydrophobicContact CG2-CB 3.62Å; L262-A267 HydrophobicContact CB-CB 4.29Å; S263-A267 WeakPolarHBondContact O-CB 3.44Å; S263-A267 PolarHBondContact O-N 3.09Å; L264-A267 PolarHBondContact O-N 2.82Å; A267-R270 WeakPolarHBondContact O-CB 3.48Å; A267-R270 PolarHBondContact O-N 3.16Å; A267-C271 PolarHBondContact O-N 2.83Å; A267-C271 PolarHBondContact O-SG 3.04Å; A267-C271 VanDerWaalsContact O-SG 3.39Å
268	Y	98.9	Very high	97.4	Very high	1 Å²	1	37 Å²	37	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-62.3	-48	175.1	-168.2	-80.4	0	0	0	111.7	F53 L57 L223 L226 L264 V266 R270 C271 L272 I329 L330	F53-Y268 AromaticContact CZ-CD1 3.84Å; F53-Y268 HydrophobicContact CZ-CD1 3.84Å; F53-Y268 HydrophobicContact CZ-CG 4.3Å; L57-Y268 HydrophobicContact CD2-CD1 4.41Å; L57-Y268 HydrophobicContact CD2-CD2 3.59Å; L57-Y268 HydrophobicContact CD2-CE2 4Å; L57-Y268 HydrophobicContact CD2-CG 3.82Å; L223-Y268 HydrophobicContact CD1-CD2 3.77Å; L223-Y268 HydrophobicContact CD1-CG 4.3Å; L226-Y268 HydrophobicContact CB-CD2 4.29Å; L226-Y268 HydrophobicContact CB-CE2 3.95Å; L226-Y268 HydrophobicContact CD1-CD2 4.39Å; L264-Y268 VanDerWaalsContact O-CB 3.27Å; L264-Y268 WeakPolarHBondContact O-CB 3.37Å; L264-Y268 PolarHBondContact O-N 2.86Å; V266-Y268 PolarHBondContact O-N 3.34Å; Y268-R270 VanDerWaalsContact C-N 3.3Å; Y268-R270 PolarHBondContact O-N 3.07Å; Y268-C271 WeakPolarHBondContact O-CB 3.27Å; Y268-C271 PolarHBondContact O-N 3.39Å; Y268-L272 HydrophobicContact CE1-CD1 4.33Å; Y268-L272 PolarHBondContact O-N 3.03Å; Y268-I329 HydrophobicContact CE1-CG2 4.13Å; Y268-L330 HydrophobicContact CE2-CD2 4.12Å
269	R	98.6	Very high	97.7	Very high	35 Å²	35	34.6 Å²	34.6	13%	0.132	18%	0.178	C	C	.	.	H	α-helix	trans	-59.1	-43.4	174.2	-179.1	-179	-64.9	-72.9	-0.2	111.1	E50 N265 V266 C271 L272 Q273 L321	E50-R269 IonicContact OE1-CZ 2.67Å; E50-R269 IonicContact OE1-NE 3.26Å; E50-R269 PolarHBondContact OE1-NE 2.96Å; E50-R269 IonicContact OE1-NH2 3.84Å; E50-R269 PolarHBondContact OE1-NH2 3.5Å; N265-R269 WeakPolarHBondContact O-CB 3.39Å; N265-R269 PolarHBondContact O-N 3.48Å; V266-R269 PolarHBondContact O-N 3.31Å; R269-C271 PolarHBondContact O-N 3.1Å; R269-L272 PolarHBondContact O-N 3.3Å; R269-Q273 HydrophobicContact CG-CG 4.44Å; R269-Q273 WeakPolarHBondContact O-CG 3.39Å; R269-Q273 PolarHBondContact O-N 3.41Å; R269-L321 HydrophobicContact CB-CD2 3.97Å; R269-L321 HydrophobicContact CG-CD2 3.99Å
270	R	98.6	Very high	98.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.5	-40.7	178.3	-174.9	175.3	-179.1	-163.9	5.3	112.7	D33 Y35 S251 A252 N255 V266 A267 Y268 L272 Q273 M274	D33-R270 IonicContact OD1-NE 3.73Å; D33-R270 PolarHBondContact OD1-NE 3.07Å; D33-R270 IonicContact OD1-NH2 3.88Å; D33-R270 IonicContact OD2-CZ 3.99Å; D33-R270 VanDerWaalsContact OD2-CZ 3.26Å; D33-R270 IonicContact OD2-NE 3.27Å; D33-R270 PolarHBondContact OD2-NE 2.79Å; D33-R270 IonicContact OD2-NH2 3.85Å; D33-R270 PolarHBondContact OD2-NH2 3.44Å; Y35-R270 HydrophobicContact CD2-CB 3.7Å; Y35-R270 HydrophobicContact CD2-CG 3.36Å; Y35-R270 HydrophobicContact CE2-CB 3.47Å; Y35-R270 VanDerWaalsContact CE2-CB 3.47Å; Y35-R270 HydrophobicContact CE2-CG 3.69Å; Y35-R270 HydrophobicContact CG-CG 4.19Å; S251-R270 PolarHBondContact O-NH1 3.44Å; A252-R270 WeakPolarHBondContact O-CD 3.49Å; A252-R270 PolarHBondContact O-NH1 3.09Å; N255-R270 PolarHBondContact O-NH1 3.06Å; N255-R270 PolarHBondContact O-NH2 3.06Å; V266-R270 WeakPolarHBondContact O-CB 3.31Å; V266-R270 PolarHBondContact O-N 3.22Å; A267-R270 WeakPolarHBondContact O-CB 3.48Å; A267-R270 PolarHBondContact O-N 3.16Å; Y268-R270 VanDerWaalsContact C-N 3.3Å; Y268-R270 PolarHBondContact O-N 3.07Å; R270-L272 VanDerWaalsContact C-N 3.32Å; R270-L272 PolarHBondContact O-N 2.74Å; R270-Q273 PolarHBondContact O-N 3.33Å; R270-M274 HydrophobicContact CG-CE 4.04Å; R270-M274 HydrophobicContact CG-CG 3.99Å; R270-M274 HydrophobicContact CG-SD 4.06Å; R270-M274 WeakPolarHBondContact O-CB 3.45Å; R270-M274 WeakPolarHBondContact O-CG 3.46Å; R270-M274 PolarHBondContact O-N 3.03Å
271	C	98.8	Very high	98.5	Very high	1 Å²	1	21 Å²	21	1%	0.007	13%	0.125	C	C	.	.	H	α-helix	trans	-54	-49.6	174.4	-72.9	0	0	0	0	111.6	L227 L248 A252 A267 Y268 R269 L275	L227-C271 HydrophobicContact CD2-CB 4.11Å; L248-C271 HydrophobicContact CD2-CB 4.43Å; L248-C271 HydrophobicContact CG-CB 4.48Å; A252-C271 WeakPolarHBondContact CB-SG 3.46Å; A267-C271 PolarHBondContact O-N 2.83Å; A267-C271 PolarHBondContact O-SG 3.04Å; A267-C271 VanDerWaalsContact O-SG 3.39Å; Y268-C271 WeakPolarHBondContact O-CB 3.27Å; Y268-C271 PolarHBondContact O-N 3.39Å; R269-C271 PolarHBondContact O-N 3.1Å; C271-L275 WeakPolarHBondContact O-CG 3.37Å; C271-L275 PolarHBondContact O-N 3.38Å; C271-L275 VanDerWaalsContact O-N 3.15Å
272	L	98.9	Very high	98.4	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-63.8	-41.9	177.7	-64.2	179.4	0	0	0	111.7	L230 F237 Y268 R269 R270 A276 L317 V318 L321	L230-L272 HydrophobicContact CD2-CD2 4.08Å; F237-L272 HydrophobicContact CE2-CD2 4.47Å; F237-L272 HydrophobicContact CZ-CD2 4.11Å; Y268-L272 HydrophobicContact CE1-CD1 4.33Å; Y268-L272 PolarHBondContact O-N 3.03Å; R269-L272 PolarHBondContact O-N 3.3Å; R270-L272 VanDerWaalsContact C-N 3.32Å; R270-L272 PolarHBondContact O-N 2.74Å; L272-A276 WeakPolarHBondContact O-CB 3.46Å; L272-A276 PolarHBondContact O-N 3.38Å; L272-L317 HydrophobicContact CD1-CB 4.21Å; L272-L317 HydrophobicContact CD2-CB 4.24Å; L272-V318 HydrophobicContact CB-CB 4.18Å; L272-V318 HydrophobicContact CB-CG2 4.27Å; L272-L321 HydrophobicContact CD1-CB 4.47Å; L272-L321 HydrophobicContact CD1-CD2 3.91Å
273	Q	98.8	Very high	98.2	Very high	57 Å²	57	22.9 Å²	22.9	27%	0.266	14%	0.144	S	C	.	.	H	α-helix	trans	-65.1	-44.5	179.3	-74.3	178	-12.9	0	0	113	R269 R270 A276 A277 V318	R269-Q273 HydrophobicContact CG-CG 4.44Å; R269-Q273 WeakPolarHBondContact O-CG 3.39Å; R269-Q273 PolarHBondContact O-N 3.41Å; R270-Q273 PolarHBondContact O-N 3.33Å; Q273-A276 PolarHBondContact O-N 3.05Å; Q273-A277 VanDerWaalsContact O-CB 3.23Å; Q273-A277 WeakPolarHBondContact O-CB 3.3Å; Q273-A277 PolarHBondContact O-N 3.37Å; Q273-V318 HydrophobicContact CG-CG2 3.57Å
274	M	98.7	Very high	98.2	Very high	6 Å²	6	20.1 Å²	20.1	3%	0.03	13%	0.125	C	C	.	.	H	α-helix	trans	-62.2	-45.5	177.8	-70.4	-175.2	-60	0	0	111.1	L248 A252 R270 A277 G278 L279	L248-M274 HydrophobicContact CD1-CE 3.62Å; A252-M274 HydrophobicContact CB-CE 3.69Å; R270-M274 HydrophobicContact CG-CE 4.04Å; R270-M274 HydrophobicContact CG-CG 3.99Å; R270-M274 HydrophobicContact CG-SD 4.06Å; R270-M274 WeakPolarHBondContact O-CB 3.45Å; R270-M274 WeakPolarHBondContact O-CG 3.46Å; R270-M274 PolarHBondContact O-N 3.03Å; M274-A277 PolarHBondContact O-N 3.1Å; M274-G278 PolarHBondContact O-N 3.41Å; M274-L279 HydrophobicContact CB-CB 4.25Å; M274-L279 HydrophobicContact CB-CD2 4.03Å; M274-L279 WeakPolarHBondContact O-CB 3.41Å; M274-L279 PolarHBondContact O-N 2.97Å; M274-L279 HydrophobicContact SD-CD2 4.45Å
275	L	98.9	Very high	98	Very high	6 Å²	6	20.9 Å²	20.9	3%	0.031	13%	0.13	C	C	.	.	H	α-helix	trans	-63.6	-44.3	176.3	-68	177.3	0	0	0	111.4	F237 L240 L248 C271 A277 G278 F280 V310 C311 A314	F237-L275 HydrophobicContact CE1-CD1 4.05Å; L240-L275 HydrophobicContact CD1-CD1 4.27Å; L248-L275 HydrophobicContact CD2-CD1 3.93Å; L248-L275 HydrophobicContact CD2-CD2 4.33Å; L248-L275 HydrophobicContact CD2-CG 4.24Å; C271-L275 WeakPolarHBondContact O-CG 3.37Å; C271-L275 PolarHBondContact O-N 3.38Å; C271-L275 VanDerWaalsContact O-N 3.15Å; L275-A277 VanDerWaalsContact C-N 3.3Å; L275-A277 PolarHBondContact O-N 3.22Å; L275-G278 PolarHBondContact O-N 3.05Å; L275-F280 HydrophobicContact CD2-CD2 3.41Å; L275-F280 VanDerWaalsContact CD2-CD2 3.41Å; L275-F280 HydrophobicContact CD2-CE2 3.61Å; L275-F280 HydrophobicContact CD2-CG 4.23Å; L275-V310 HydrophobicContact CD1-CG1 4.36Å; L275-V310 HydrophobicContact CD2-CG1 3.99Å; L275-C311 PolarHBondContact O-SG 3.13Å; L275-A314 HydrophobicContact CB-CB 3.42Å; L275-A314 VanDerWaalsContact CB-CB 3.42Å; L275-A314 HydrophobicContact CD1-CB 4.38Å
276	A	98.8	Very high	97.9	Very high	18 Å²	18	20.7 Å²	20.7	15%	0.149	13%	0.132	C	C	.	.	H	α-helix	trans	-64.9	-32.5	178.6	0	0	0	0	0	113.3	L272 Q273 G278 A314 Q315 V318	L272-A276 WeakPolarHBondContact O-CB 3.46Å; L272-A276 PolarHBondContact O-N 3.38Å; Q273-A276 PolarHBondContact O-N 3.05Å; A276-G278 PolarHBondContact O-N 2.63Å; A276-A314 HydrophobicContact CB-CB 4.21Å; A276-Q315 HydrophobicContact CB-CB 4.32Å; A276-Q315 HydrophobicContact CB-CG 3.77Å; A276-Q315 WeakPolarHBondContact O-CG 3.33Å; A276-Q315 PolarHBondContact O-NE2 3.08Å; A276-V318 HydrophobicContact CB-CG1 4.04Å
277	A	98.6	Very high	97.9	Very high	45 Å²	45	21 Å²	21	37%	0.372	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	2.2	174.7	0	0	0	0	0	113.3	P31 F32 Q273 M274 L275	P31-A277 WeakPolarHBondContact CB-O 3.21Å; F32-A277 VanDerWaalsContact O-CB 3.27Å; F32-A277 WeakPolarHBondContact O-CB 3.36Å; Q273-A277 VanDerWaalsContact O-CB 3.23Å; Q273-A277 WeakPolarHBondContact O-CB 3.3Å; Q273-A277 PolarHBondContact O-N 3.37Å; M274-A277 PolarHBondContact O-N 3.1Å; L275-A277 VanDerWaalsContact C-N 3.3Å; L275-A277 PolarHBondContact O-N 3.22Å
278	G	98.4	Very high	97.9	Very high	5 Å²	5	24 Å²	24	5%	0.052	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.3	28.4	173.7	0	0	0	0	0	114.7	M274 L275 A276 F280 L281	M274-G278 PolarHBondContact O-N 3.41Å; L275-G278 PolarHBondContact O-N 3.05Å; A276-G278 PolarHBondContact O-N 2.63Å; G278-F280 PolarHBondContact O-N 2.8Å; G278-L281 PolarHBondContact O-N 3.32Å
279	L	98.6	Very high	97.8	Very high	21 Å²	21	24.3 Å²	24.3	11%	0.11	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-36.9	175.2	179.5	65.7	0	0	0	112.1	L248 M274 S284 G286 I287	L248-L279 HydrophobicContact CD1-CD2 4.03Å; M274-L279 HydrophobicContact CB-CB 4.25Å; M274-L279 HydrophobicContact CB-CD2 4.03Å; M274-L279 WeakPolarHBondContact O-CB 3.41Å; M274-L279 PolarHBondContact O-N 2.97Å; M274-L279 HydrophobicContact SD-CD2 4.45Å; L279-S284 VanDerWaalsContact O-CB 3.31Å; L279-S284 WeakPolarHBondContact O-CB 3.41Å; L279-S284 PolarHBondContact O-OG 2.89Å; L279-G286 WeakPolarHBondContact O-CA 3.3Å; L279-I287 HydrophobicContact CD2-CD1 4.13Å; L279-I287 HydrophobicContact CD2-CG1 4.26Å
280	F	98.6	Very high	97.8	Very high	5 Å²	5	25.6 Å²	25.6	2%	0.022	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111	25	-178.3	-64.1	-24.6	0	0	0	114.1	L240 I244 L275 G278 I287 V298 H299 M302 Q307	L240-F280 HydrophobicContact CD2-CD2 3.92Å; L240-F280 HydrophobicContact CD2-CE2 3.84Å; I244-F280 HydrophobicContact CG2-CD2 4.4Å; I244-F280 HydrophobicContact CG2-CE2 3.4Å; I244-F280 VanDerWaalsContact CG2-CE2 3.4Å; I244-F280 HydrophobicContact CG2-CZ 3.65Å; L275-F280 HydrophobicContact CD2-CD2 3.41Å; L275-F280 VanDerWaalsContact CD2-CD2 3.41Å; L275-F280 HydrophobicContact CD2-CE2 3.61Å; L275-F280 HydrophobicContact CD2-CG 4.23Å; G278-F280 PolarHBondContact O-N 2.8Å; F280-I287 HydrophobicContact CE1-CB 4.49Å; F280-I287 HydrophobicContact CE1-CD1 4.17Å; F280-I287 HydrophobicContact CE1-CG1 4.22Å; F280-I287 HydrophobicContact CZ-CD1 4.05Å; F280-V298 HydrophobicContact CE1-CG2 4.4Å; F280-H299 HydrophobicContact CB-CB 3.62Å; F280-H299 HydrophobicContact CD1-CB 3.44Å; F280-H299 VanDerWaalsContact CD1-CB 3.44Å; F280-H299 AromaticContact CD1-CG 3.72Å; F280-H299 AromaticContact CD1-ND1 3.76Å; F280-H299 HydrophobicContact CD2-CB 4.26Å; F280-H299 HydrophobicContact CE1-CB 4.14Å; F280-H299 HydrophobicContact CG-CB 3.52Å; F280-H299 PolarHBondContact O-CD2 2.72Å; F280-M302 HydrophobicContact CB-CE 3.94Å; F280-M302 HydrophobicContact CD2-CE 3.98Å; F280-M302 HydrophobicContact CG-CE 4.17Å; F280-Q307 WeakPolarHBondContact O-CB 3.28Å; F280-Q307 WeakPolarHBondContact O-CG 3.33Å; F280-Q307 PolarHBondContact O-OE1 3.33Å
281	L	98.1	Very high	97.8	Very high	52 Å²	52	26.4 Å²	26.4	27%	0.272	17%	0.172	S	C	.	.	S	Bend	trans	-91.9	162.7	174.5	-73.2	-177.1	0	0	0	112.8	G278 S284 Q307 C311	G278-L281 PolarHBondContact O-N 3.32Å; L281-S284 WeakPolarHBondContact O-CB 3.47Å; L281-S284 PolarHBondContact O-N 2.93Å; L281-S284 VanDerWaalsContact O-N 3.1Å; L281-Q307 HydrophobicContact CD2-CB 4.39Å; L281-C311 HydrophobicContact CD1-CB 4.32Å; L281-C311 HydrophobicContact CD2-CB 3.84Å; L281-C311 HydrophobicContact CG-CB 4.12Å
282	P	96.1	Very high	97.5	Very high	82 Å²	82	30 Å²	30	53%	0.532	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	140.1	172.8	-27.4	37.9	0	0	0	112.5	S284 L304	P282-S284 PolarHBondContact O-N 2.85Å; P282-L304 HydrophobicContact CB-CD2 4.48Å; P282-L304 HydrophobicContact CG-CD2 3.51Å
283	G	93.3	Very high	97	Very high	32 Å²	32	35.3 Å²	35.3	33%	0.33	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.5	-24.2	-174.4	0	0	0	0	0	114.2	H29	H29-G283 WeakPolarHBondContact CB-O 3.43Å; H29-G283 PolarHBondContact N-O 3.34Å
284	S	96.9	Very high	96.6	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.014	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-68.1	142.3	177.3	-179.1	0	0	0	0	112.4	H29 P31 L279 L281 P282 G286 R297	H29-S284 CarbonylContact O-C 3.48Å; H29-S284 WeakPolarHBondContact O-CA 3.33Å; P31-S284 VanDerWaalsContact CD-OG 3.31Å; P31-S284 WeakPolarHBondContact CD-OG 3.12Å; P31-S284 WeakPolarHBondContact CG-OG 3.37Å; L279-S284 VanDerWaalsContact O-CB 3.31Å; L279-S284 WeakPolarHBondContact O-CB 3.41Å; L279-S284 PolarHBondContact O-OG 2.89Å; L281-S284 WeakPolarHBondContact O-CB 3.47Å; L281-S284 PolarHBondContact O-N 2.93Å; L281-S284 VanDerWaalsContact O-N 3.1Å; P282-S284 PolarHBondContact O-N 2.85Å; S284-G286 PolarHBondContact O-N 2.86Å; S284-G286 PolarHBondContact OG-N 3.15Å; S284-R297 WeakPolarHBondContact O-CD 3.35Å; S284-R297 PolarHBondContact O-NH1 3.46Å
285	V	95.4	Very high	96.2	Very high	37 Å²	37	42 Å²	42	22%	0.224	28%	0.277	C	S	.	.			trans	-64.6	-25.5	164.1	-64.4	0	0	0	0	112.3	P28 H29 I30 R297	P28-V285 HydrophobicContact CB-CG1 3.34Å; H29-V285 PolarHBondContact O-N 3.34Å; I30-V285 HydrophobicContact CB-CG2 4.4Å; I30-V285 HydrophobicContact CG1-CG1 4.31Å; I30-V285 HydrophobicContact CG1-CG2 3.88Å; V285-R297 VanDerWaalsContact O-CD 3.25Å; V285-R297 WeakPolarHBondContact O-CD 3.5Å; V285-R297 VanDerWaalsContact O-CG 3.25Å; V285-R297 WeakPolarHBondContact O-CG 3.31Å
286	G	97	Very high	96	Very high	12 Å²	12	45.7 Å²	45.7	12%	0.124	29%	0.293	C	S	.	.			trans	54.8	-143.7	-173.8	0	0	0	0	0	112.8	L279 S284	L279-G286 WeakPolarHBondContact O-CA 3.3Å; S284-G286 PolarHBondContact O-N 2.86Å; S284-G286 PolarHBondContact OG-N 3.15Å
287	I	98.1	Very high	95.9	Very high	23 Å²	23	47.7 Å²	47.7	12%	0.118	30%	0.297	C	S	.	.			trans	-104.1	124.7	169.7	-62.4	165.7	0	0	0	107.6	L247 L279 F280 V298	L247-I287 HydrophobicContact CB-CD1 4.29Å; L247-I287 HydrophobicContact CB-CG2 4.1Å; L247-I287 HydrophobicContact CD1-CG2 4.14Å; L279-I287 HydrophobicContact CD2-CD1 4.13Å; L279-I287 HydrophobicContact CD2-CG1 4.26Å; F280-I287 HydrophobicContact CE1-CB 4.49Å; F280-I287 HydrophobicContact CE1-CD1 4.17Å; F280-I287 HydrophobicContact CE1-CG1 4.22Å; F280-I287 HydrophobicContact CZ-CD1 4.05Å; I287-V298 HydrophobicContact CB-CG2 4.02Å; I287-V298 WeakPolarHBondContact O-CG2 3.17Å; I287-V298 PolarHBondContact O-N 3.34Å
288	T	97.4	Very high	95.9	Very high	62 Å²	62	45.8 Å²	45.8	38%	0.38	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-70.9	133.3	170.1	-55.4	0	0	0	0	109.2	P290 N295 F296	T288-P290 VanDerWaalsContact O-CD 3.28Å; T288-P290 WeakPolarHBondContact O-CD 3.31Å; T288-N295 HydrophobicContact CG2-CB 4.49Å; T288-F296 CarbonylContact C-O 3.55Å; T288-F296 WeakPolarHBondContact CA-O 3.32Å
289	D	98.1	Very high	95.8	Very high	8 Å²	8	45.5 Å²	45.5	4%	0.043	28%	0.278	C	S	.	.			trans	-68.2	115.9	175.8	-161.1	-43.3	0	0	0	110.2	W243 C291 E292 F296 V298	W243-D289 PolarHBondContact NE1-OD1 2.84Å; W243-D289 PolarHBondContact NE1-OD2 3.07Å; D289-C291 PolarHBondContact O-N 3.4Å; D289-C291 WeakPolarHBondContact OD1-CA 3.38Å; D289-C291 WeakPolarHBondContact OD1-CB 3.25Å; D289-C291 PolarHBondContact OD1-N 3.06Å; D289-E292 HydrophobicContact CB-CB 4.12Å; D289-E292 HydrophobicContact CB-CG 4.18Å; D289-F296 HydrophobicContact CB-CB 4.38Å; D289-F296 HydrophobicContact CB-CD1 3.87Å; D289-F296 PolarHBondContact N-O 3.03Å; D289-V298 HydrophobicContact CB-CG1 3.51Å
290	P	97.8	Very high	95.7	Very high	62 Å²	62	47.1 Å²	47.1	40%	0.403	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-8.1	-179.6	32.8	-35.8	0	0	0	113.1	W210 W243 L247 T288	W210-P290 HydrophobicContact CD2-CG 3.89Å; W210-P290 VanDerWaalsContact CE2-CG 3.48Å; W210-P290 HydrophobicContact CG-CB 4.42Å; W210-P290 HydrophobicContact CG-CG 3.95Å; W210-P290 HydrophobicContact CZ2-CG 4.06Å; W210-P290 VanDerWaalsContact NE1-CG 3.26Å; W243-P290 HydrophobicContact CH2-CG 4.46Å; W243-P290 HydrophobicContact CZ2-CG 4.11Å; L247-P290 HydrophobicContact CD2-CG 3.8Å; T288-P290 VanDerWaalsContact O-CD 3.28Å; T288-P290 WeakPolarHBondContact O-CD 3.31Å
291	C	97.5	Very high	95.6	Very high	18 Å²	18	50.9 Å²	50.9	12%	0.122	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-3.4	-177.7	-67.7	0	0	0	0	113.7	R206 W210 W243 D289	R206-C291 HydrophobicContact CB-CB 3.86Å; R206-C291 WeakPolarHBondContact CD-O 3.25Å; R206-C291 PolarHBondContact NE-O 3.44Å; W210-C291 VanDerWaalsContact CB-SG 3.51Å; W243-C291 HydrophobicContact CZ2-CB 4.2Å; D289-C291 PolarHBondContact O-N 3.4Å; D289-C291 WeakPolarHBondContact OD1-CA 3.38Å; D289-C291 WeakPolarHBondContact OD1-CB 3.25Å; D289-C291 PolarHBondContact OD1-N 3.06Å
292	E	94.3	Very high	95.7	Very high	75 Å²	75	48.8 Å²	48.8	35%	0.35	30%	0.301	S	S	.	.	S	Bend	trans	-112.4	152.2	177.3	-66.1	-57	144.4	0	0	111.4	R206 D289 F296	R206-E292 IonicContact CZ-OE1 3.79Å; R206-E292 IonicContact NE-OE1 3.98Å; R206-E292 IonicContact NH2-OE1 2.82Å; R206-E292 PolarHBondContact NH2-OE1 3.13Å; R206-E292 IonicContact NH2-OE2 3.85Å; D289-E292 HydrophobicContact CB-CB 4.12Å; D289-E292 HydrophobicContact CB-CG 4.18Å; E292-F296 HydrophobicContact CB-CB 4.16Å; E292-F296 HydrophobicContact CG-CD1 4.47Å
293	S	88.6	Confident	95.8	Very high	114 Å²	114	48.6 Å²	48.6	80%	0.797	30%	0.298	S	S	*	.	S	Bend	trans	-74.4	143.5	174.9	60.7	0	0	0	0	111.5
294	G	90	Very high	96	Very high	59 Å²	59	51 Å²	51	61%	0.608	30%	0.303	S	S	*	.	S	Bend	trans	82.5	-162.2	-178.1	0	0	0	0	0	112.5
295	N	90.1	Very high	96.1	Very high	144 Å²	144	55.2 Å²	55.2	77%	0.77	32%	0.323	S	S	*	.			trans	-103.3	54.4	-179	-67.3	-41.1	0	0	0	111	T288 R297	T288-N295 HydrophobicContact CG2-CB 4.49Å; N295-R297 PolarHBondContact O-N 3.34Å
296	F	94.6	Very high	96.2	Very high	84 Å²	84	56.2 Å²	56.2	37%	0.368	33%	0.325	S	S	.	.			trans	-66.5	123.3	179.2	-177.1	-103.4	0	0	0	110.2	T288 D289 E292 V301	T288-F296 CarbonylContact C-O 3.55Å; T288-F296 WeakPolarHBondContact CA-O 3.32Å; D289-F296 HydrophobicContact CB-CB 4.38Å; D289-F296 HydrophobicContact CB-CD1 3.87Å; D289-F296 PolarHBondContact N-O 3.03Å; E292-F296 HydrophobicContact CB-CB 4.16Å; E292-F296 HydrophobicContact CG-CD1 4.47Å; F296-V301 HydrophobicContact CE1-CG1 4.37Å; F296-V301 HydrophobicContact CZ-CG1 3.99Å
297	R	96.3	Very high	96.3	Very high	60 Å²	60	56.2 Å²	56.2	23%	0.226	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-91.1	114.6	-179.1	-61.2	-174.6	-66.5	133.1	8.1	108.9	S284 V285 N295 H299 T300	S284-R297 WeakPolarHBondContact O-CD 3.35Å; S284-R297 PolarHBondContact O-NH1 3.46Å; V285-R297 VanDerWaalsContact O-CD 3.25Å; V285-R297 WeakPolarHBondContact O-CD 3.5Å; V285-R297 VanDerWaalsContact O-CG 3.25Å; V285-R297 WeakPolarHBondContact O-CG 3.31Å; N295-R297 PolarHBondContact O-N 3.34Å; R297-H299 PolarHBondContact NH1-CE1 3.07Å; R297-H299 VanDerWaalsContact NH1-CE1 3.3Å; R297-H299 PolarHBondContact NH1-NE2 2.83Å; R297-H299 PolarHBondContact O-N 3.12Å; R297-T300 HydrophobicContact CB-CG2 3.92Å; R297-T300 PolarHBondContact O-N 2.99Å; R297-T300 PolarHBondContact O-OG1 3.24Å
298	V	97.8	Very high	96.3	Very high	4 Å²	4	56 Å²	56	2%	0.024	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-60.2	-25.7	-168.8	-63	0	0	0	0	115.1	I244 L247 F280 I287 D289 T300 V301	I244-V298 HydrophobicContact CG1-CB 4.13Å; I244-V298 HydrophobicContact CG1-CG2 4.05Å; L247-V298 HydrophobicContact CD1-CB 4.3Å; L247-V298 HydrophobicContact CD1-CG1 3.53Å; L247-V298 HydrophobicContact CD1-CG2 4.19Å; F280-V298 HydrophobicContact CE1-CG2 4.4Å; I287-V298 HydrophobicContact CB-CG2 4.02Å; I287-V298 WeakPolarHBondContact O-CG2 3.17Å; I287-V298 PolarHBondContact O-N 3.34Å; D289-V298 HydrophobicContact CB-CG1 3.51Å; V298-T300 VanDerWaalsContact C-N 3.29Å; V298-T300 PolarHBondContact O-N 3.18Å; V298-V301 WeakPolarHBondContact O-CG2 3.33Å
299	H	97.7	Very high	96.4	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-76.9	-11.7	-179.7	68.3	-85.1	0	0	0	114.2	F280 R297 V301 M302	F280-H299 HydrophobicContact CB-CB 3.62Å; F280-H299 HydrophobicContact CD1-CB 3.44Å; F280-H299 VanDerWaalsContact CD1-CB 3.44Å; F280-H299 AromaticContact CD1-CG 3.72Å; F280-H299 AromaticContact CD1-ND1 3.76Å; F280-H299 HydrophobicContact CD2-CB 4.26Å; F280-H299 HydrophobicContact CE1-CB 4.14Å; F280-H299 HydrophobicContact CG-CB 3.52Å; F280-H299 PolarHBondContact O-CD2 2.72Å; R297-H299 PolarHBondContact NH1-CE1 3.07Å; R297-H299 VanDerWaalsContact NH1-CE1 3.3Å; R297-H299 PolarHBondContact NH1-NE2 2.83Å; R297-H299 PolarHBondContact O-N 3.12Å; H299-V301 PolarHBondContact O-N 3.49Å; H299-V301 VanDerWaalsContact O-N 3.17Å; H299-M302 HydrophobicContact CB-CE 3.54Å; H299-M302 WeakPolarHBondContact O-CB 3.15Å; H299-M302 PolarHBondContact O-N 3.39Å
300	T	96.8	Very high	96.4	Very high	55 Å²	55	55.4 Å²	55.4	34%	0.337	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-73.9	-3.3	-179.3	60.7	0	0	0	0	113.2	R297 V298	R297-T300 HydrophobicContact CB-CG2 3.92Å; R297-T300 PolarHBondContact O-N 2.99Å; R297-T300 PolarHBondContact O-OG1 3.24Å; V298-T300 VanDerWaalsContact C-N 3.29Å; V298-T300 PolarHBondContact O-N 3.18Å
301	V	96.8	Very high	96.5	Very high	84 Å²	84	52.7 Å²	52.7	51%	0.509	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-71.8	-19.6	165.8	-53.9	0	0	0	0	112.3	T241 I244 F296 V298 H299	T241-V301 HydrophobicContact CG2-CG2 4.21Å; I244-V301 HydrophobicContact CD1-CG2 3.91Å; F296-V301 HydrophobicContact CE1-CG1 4.37Å; F296-V301 HydrophobicContact CZ-CG1 3.99Å; V298-V301 WeakPolarHBondContact O-CG2 3.33Å; H299-V301 PolarHBondContact O-N 3.49Å; H299-V301 VanDerWaalsContact O-N 3.17Å
302	M	98.4	Very high	96.5	Very high	7 Å²	7	53.5 Å²	53.5	3%	0.034	30%	0.298	C	S	.	.	S	Bend	trans	-88	141.3	174.8	-60.3	-177	-70.7	0	0	110.2	P239 L240 F280 H299 Q306 Q307 V310	P239-M302 HydrophobicContact CB-CG 3.81Å; P239-M302 HydrophobicContact CB-SD 3.52Å; P239-M302 VanDerWaalsContact CB-SD 3.52Å; L240-M302 HydrophobicContact CD2-CE 4.36Å; L240-M302 HydrophobicContact CD2-SD 4.21Å; F280-M302 HydrophobicContact CB-CE 3.94Å; F280-M302 HydrophobicContact CD2-CE 3.98Å; F280-M302 HydrophobicContact CG-CE 4.17Å; H299-M302 HydrophobicContact CB-CE 3.54Å; H299-M302 WeakPolarHBondContact O-CB 3.15Å; H299-M302 PolarHBondContact O-N 3.39Å; M302-Q306 HydrophobicContact CB-CB 3.95Å; M302-Q307 HydrophobicContact CB-CG 3.96Å; M302-Q307 HydrophobicContact CE-CG 4.23Å; M302-Q307 PolarHBondContact O-NE2 3.39Å; M302-V310 HydrophobicContact SD-CG2 4.06Å
303	T	98.3	Very high	96.8	Very high	78 Å²	78	50 Å²	50	48%	0.479	28%	0.282	S	S	.	.			trans	-63.6	162.6	169.6	66.3	0	0	0	0	111.2	E305 Q306 Q307	T303-E305 PolarHBondContact O-N 3.31Å; T303-Q306 PolarHBondContact O-N 3.5Å; T303-Q306 VanDerWaalsContact O-N 3.14Å; T303-Q306 WeakPolarHBondContact OG1-CB 3.4Å; T303-Q306 VanDerWaalsContact OG1-CG 3.24Å; T303-Q306 WeakPolarHBondContact OG1-CG 3.38Å; T303-Q306 PolarHBondContact OG1-N 2.89Å; T303-Q306 PolarHBondContact OG1-OE1 3.47Å; T303-Q307 WeakPolarHBondContact O-CG 3.47Å; T303-Q307 PolarHBondContact O-N 2.87Å
304	L	98	Very high	97.2	Very high	83 Å²	83	44.6 Å²	44.6	44%	0.435	24%	0.244	S	C	.	.	H	α-helix	trans	-59.3	-37.8	177.1	-62.8	177.3	0	0	0	112.2	P282 Q307 D308 Y358	P282-L304 HydrophobicContact CB-CD2 4.48Å; P282-L304 HydrophobicContact CG-CD2 3.51Å; L304-Q307 PolarHBondContact O-N 2.95Å; L304-D308 PolarHBondContact O-N 3.46Å; L304-Y358 HydrophobicContact CB-CD2 3.68Å; L304-Y358 HydrophobicContact CB-CE2 3.38Å; L304-Y358 HydrophobicContact CD1-CE2 3.88Å; L304-Y358 HydrophobicContact CG-CE2 4.28Å
305	E	98.3	Very high	97.7	Very high	91 Å²	91	45.1 Å²	45.1	43%	0.425	23%	0.231	S	C	.	.	H	α-helix	trans	-64.4	-42.2	174.9	-173.4	168.4	-160.6	0	0	112.1	T303 D308 M309 K356 Y358	T303-E305 PolarHBondContact O-N 3.31Å; E305-D308 PolarHBondContact O-N 3.37Å; E305-M309 WeakPolarHBondContact O-CB 3.13Å; E305-M309 PolarHBondContact O-N 2.82Å; E305-K356 IonicContact OE1-NZ 2.84Å; E305-K356 PolarHBondContact OE1-NZ 2.84Å; E305-Y358 HydrophobicContact CB-CD1 3.49Å; E305-Y358 VanDerWaalsContact CB-CD1 3.49Å; E305-Y358 HydrophobicContact CB-CE1 3.73Å; E305-Y358 HydrophobicContact CB-CG 4.2Å; E305-Y358 HydrophobicContact CG-CD1 3.88Å; E305-Y358 HydrophobicContact CG-CE1 4.39Å
306	Q	98.7	Very high	98.1	Very high	58 Å²	58	38.3 Å²	38.3	27%	0.271	19%	0.194	S	C	.	.	H	α-helix	trans	-66.7	-37.6	176.1	-75.4	172.1	-33.7	0	0	112.2	P239 M302 T303 M309 V310	P239-Q306 HydrophobicContact CB-CB 3.77Å; P239-Q306 HydrophobicContact CB-CG 3.99Å; P239-Q306 HydrophobicContact CG-CB 3.62Å; P239-Q306 HydrophobicContact CG-CG 3.56Å; M302-Q306 HydrophobicContact CB-CB 3.95Å; T303-Q306 PolarHBondContact O-N 3.5Å; T303-Q306 VanDerWaalsContact O-N 3.14Å; T303-Q306 WeakPolarHBondContact OG1-CB 3.4Å; T303-Q306 VanDerWaalsContact OG1-CG 3.24Å; T303-Q306 WeakPolarHBondContact OG1-CG 3.38Å; T303-Q306 PolarHBondContact OG1-N 2.89Å; T303-Q306 PolarHBondContact OG1-OE1 3.47Å; Q306-M309 PolarHBondContact O-N 2.89Å; Q306-V310 WeakPolarHBondContact O-CG2 3.32Å; Q306-V310 PolarHBondContact O-N 3.37Å
307	Q	98.8	Very high	98.3	Very high	11 Å²	11	34.3 Å²	34.3	5%	0.051	18%	0.177	C	C	.	.	H	α-helix	trans	-62.4	-44.7	175.2	-71.5	172.9	35.4	0	0	111.5	F280 L281 M302 T303 L304 C311	F280-Q307 WeakPolarHBondContact O-CB 3.28Å; F280-Q307 WeakPolarHBondContact O-CG 3.33Å; F280-Q307 PolarHBondContact O-OE1 3.33Å; L281-Q307 HydrophobicContact CD2-CB 4.39Å; M302-Q307 HydrophobicContact CB-CG 3.96Å; M302-Q307 HydrophobicContact CE-CG 4.23Å; M302-Q307 PolarHBondContact O-NE2 3.39Å; T303-Q307 WeakPolarHBondContact O-CG 3.47Å; T303-Q307 PolarHBondContact O-N 2.87Å; L304-Q307 PolarHBondContact O-N 2.95Å; Q307-C311 WeakPolarHBondContact O-CB 3.26Å; Q307-C311 PolarHBondContact O-N 3.3Å; Q307-C311 VanDerWaalsContact O-N 3.08Å
308	D	98.8	Very high	98.4	Very high	19 Å²	19	32.5 Å²	32.5	10%	0.102	17%	0.172	C	C	.	.	H	α-helix	trans	-60.1	-48.6	173.4	-178.1	39.8	0	0	0	111.1	L304 E305 V310 C311 F312 K356 A357 Y358	L304-D308 PolarHBondContact O-N 3.46Å; E305-D308 PolarHBondContact O-N 3.37Å; D308-V310 PolarHBondContact O-N 2.98Å; D308-C311 CarbonylContact O-C 3.56Å; D308-C311 WeakPolarHBondContact O-CA 3.45Å; D308-C311 WeakPolarHBondContact O-CB 3.46Å; D308-C311 PolarHBondContact O-N 3.47Å; D308-F312 WeakPolarHBondContact O-CD1 3.48Å; D308-F312 PolarHBondContact O-N 3.37Å; D308-K356 WeakPolarHBondContact OD2-CA 3.36Å; D308-K356 WeakPolarHBondContact OD2-CG 3.32Å; D308-A357 PolarHBondContact OD2-N 3.27Å; D308-Y358 WeakPolarHBondContact OD2-CB 3.4Å; D308-Y358 PolarHBondContact OD2-N 2.58Å
309	M	98.7	Very high	98.4	Very high	57 Å²	57	36 Å²	36	28%	0.281	19%	0.185	S	C	.	.	H	α-helix	trans	-55.9	-47.5	178	-172.6	175.8	66	0	0	114	P239 E305 Q306 C311 F312 T313	P239-M309 HydrophobicContact CG-CE 3.46Å; P239-M309 VanDerWaalsContact CG-CE 3.46Å; E305-M309 WeakPolarHBondContact O-CB 3.13Å; E305-M309 PolarHBondContact O-N 2.82Å; Q306-M309 PolarHBondContact O-N 2.89Å; M309-C311 VanDerWaalsContact C-N 3.3Å; M309-C311 PolarHBondContact O-N 3.45Å; M309-F312 HydrophobicContact CB-CE1 3.98Å; M309-F312 HydrophobicContact CB-CZ 3.94Å; M309-F312 HydrophobicContact CG-CE1 4.28Å; M309-F312 HydrophobicContact CG-CE2 4.23Å; M309-F312 HydrophobicContact CG-CZ 3.72Å; M309-T313 VanDerWaalsContact O-CB 3.24Å; M309-T313 WeakPolarHBondContact O-CB 3.35Å; M309-T313 PolarHBondContact O-N 2.85Å; M309-T313 PolarHBondContact O-OG1 3.15Å
310	V	98.9	Very high	98.5	Very high	1 Å²	1	36 Å²	36	1%	0.006	19%	0.185	C	C	.	.	H	α-helix	trans	-60.2	-43.1	174.6	166.7	0	0	0	0	110.6	G236 F237 P239 L240 L275 M302 Q306 D308 A314	G236-V310 WeakPolarHBondContact O-CA 3.4Å; G236-V310 WeakPolarHBondContact O-CG2 3.49Å; F237-V310 HydrophobicContact CD1-CG1 4.17Å; F237-V310 HydrophobicContact CE1-CG1 4.37Å; F237-V310 WeakPolarHBondContact CE1-O 3.49Å; P239-V310 HydrophobicContact CB-CG2 4.22Å; P239-V310 HydrophobicContact CG-CG2 4.3Å; L240-V310 HydrophobicContact CD1-CG1 4.37Å; L240-V310 HydrophobicContact CD2-CG1 3.98Å; L240-V310 HydrophobicContact CD2-CG2 4.22Å; L240-V310 HydrophobicContact CG-CG1 4.31Å; L240-V310 HydrophobicContact CG-CG2 4.13Å; L275-V310 HydrophobicContact CD1-CG1 4.36Å; L275-V310 HydrophobicContact CD2-CG1 3.99Å; M302-V310 HydrophobicContact SD-CG2 4.06Å; Q306-V310 WeakPolarHBondContact O-CG2 3.32Å; Q306-V310 PolarHBondContact O-N 3.37Å; D308-V310 PolarHBondContact O-N 2.98Å; V310-A314 WeakPolarHBondContact O-CB 3.27Å; V310-A314 PolarHBondContact O-N 2.89Å; V310-A314 VanDerWaalsContact O-N 3.09Å
311	C	98.9	Very high	98.5	Very high	5 Å²	5	33.6 Å²	33.6	3%	0.034	17%	0.17	C	C	.	.	H	α-helix	trans	-66.7	-53.8	-177.6	-168.3	0	0	0	0	112	L275 L281 Q307 D308 M309 T313 A314 Q315	L275-C311 PolarHBondContact O-SG 3.13Å; L281-C311 HydrophobicContact CD1-CB 4.32Å; L281-C311 HydrophobicContact CD2-CB 3.84Å; L281-C311 HydrophobicContact CG-CB 4.12Å; Q307-C311 WeakPolarHBondContact O-CB 3.26Å; Q307-C311 PolarHBondContact O-N 3.3Å; Q307-C311 VanDerWaalsContact O-N 3.08Å; D308-C311 CarbonylContact O-C 3.56Å; D308-C311 WeakPolarHBondContact O-CA 3.45Å; D308-C311 WeakPolarHBondContact O-CB 3.46Å; D308-C311 PolarHBondContact O-N 3.47Å; M309-C311 VanDerWaalsContact C-N 3.3Å; M309-C311 PolarHBondContact O-N 3.45Å; C311-T313 VanDerWaalsContact C-N 3.27Å; C311-T313 PolarHBondContact O-N 3.37Å; C311-A314 WeakPolarHBondContact O-CB 3.37Å; C311-A314 PolarHBondContact O-N 3.29Å; C311-A314 VanDerWaalsContact O-N 3.12Å; C311-Q315 VanDerWaalsContact O-CG 3.31Å; C311-Q315 WeakPolarHBondContact O-CG 3.43Å; C311-Q315 PolarHBondContact O-N 3.44Å
312	F	98.7	Very high	98.6	Very high	34 Å²	34	33.1 Å²	33.1	15%	0.149	17%	0.17	C	C	.	.	H	α-helix	trans	-67.1	-30	-177.8	71.6	-122.2	0	0	0	112.3	D308 M309 Q315 T316 S354 K356	D308-F312 WeakPolarHBondContact O-CD1 3.48Å; D308-F312 PolarHBondContact O-N 3.37Å; M309-F312 HydrophobicContact CB-CE1 3.98Å; M309-F312 HydrophobicContact CB-CZ 3.94Å; M309-F312 HydrophobicContact CG-CE1 4.28Å; M309-F312 HydrophobicContact CG-CE2 4.23Å; M309-F312 HydrophobicContact CG-CZ 3.72Å; F312-Q315 PolarHBondContact O-N 3.07Å; F312-T316 PolarHBondContact O-N 2.82Å; F312-T316 PolarHBondContact O-OG1 3.34Å; F312-S354 WeakPolarHBondContact CD2-O 3.3Å; F312-K356 HydrophobicContact CE1-CB 3.92Å; F312-K356 HydrophobicContact CE1-CG 4.49Å
313	T	98.9	Very high	98.5	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.018	18%	0.184	C	C	.	.	H	α-helix	trans	-63.1	-48.2	171.4	-58.6	0	0	0	0	110.3	F234 G236 F237 M309 C311 Q315 T316 L317 A340	F234-T313 HydrophobicContact CB-CG2 4.43Å; G236-T313 WeakPolarHBondContact CA-OG1 3.31Å; F237-T313 HydrophobicContact CD1-CG2 4.26Å; F237-T313 HydrophobicContact CD2-CG2 4.21Å; F237-T313 HydrophobicContact CE1-CG2 3.92Å; F237-T313 HydrophobicContact CE2-CG2 3.88Å; F237-T313 HydrophobicContact CG-CG2 4.4Å; F237-T313 HydrophobicContact CZ-CG2 3.72Å; M309-T313 VanDerWaalsContact O-CB 3.24Å; M309-T313 WeakPolarHBondContact O-CB 3.35Å; M309-T313 PolarHBondContact O-N 2.85Å; M309-T313 PolarHBondContact O-OG1 3.15Å; C311-T313 VanDerWaalsContact C-N 3.27Å; C311-T313 PolarHBondContact O-N 3.37Å; T313-Q315 PolarHBondContact O-N 3.44Å; T313-T316 PolarHBondContact O-N 3.18Å; T313-L317 HydrophobicContact CG2-CD1 4.34Å; T313-L317 WeakPolarHBondContact O-CG 3.24Å; T313-L317 PolarHBondContact O-N 3.47Å; T313-A340 HydrophobicContact CG2-CB 4.41Å
314	A	98.9	Very high	98.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.3	-39.7	176.2	0	0	0	0	0	112.9	F237 L275 A276 V310 C311 T316 L317 V318	F237-A314 HydrophobicContact CE1-CB 4Å; F237-A314 HydrophobicContact CZ-CB 4.07Å; L275-A314 HydrophobicContact CB-CB 3.42Å; L275-A314 VanDerWaalsContact CB-CB 3.42Å; L275-A314 HydrophobicContact CD1-CB 4.38Å; A276-A314 HydrophobicContact CB-CB 4.21Å; V310-A314 WeakPolarHBondContact O-CB 3.27Å; V310-A314 PolarHBondContact O-N 2.89Å; V310-A314 VanDerWaalsContact O-N 3.09Å; C311-A314 WeakPolarHBondContact O-CB 3.37Å; C311-A314 PolarHBondContact O-N 3.29Å; C311-A314 VanDerWaalsContact O-N 3.12Å; A314-T316 VanDerWaalsContact C-N 3.27Å; A314-T316 PolarHBondContact O-N 3.47Å; A314-L317 PolarHBondContact O-N 3.27Å; A314-V318 WeakPolarHBondContact O-CB 3.36Å; A314-V318 PolarHBondContact O-N 3.34Å
315	Q	98.9	Very high	98.4	Very high	70 Å²	70	30.4 Å²	30.4	33%	0.327	16%	0.161	S	C	.	.	H	α-helix	trans	-61.3	-34.8	175.5	-71.3	172.9	-1.9	0	0	112.7	A276 C311 F312 T313 V318 R319 S354	A276-Q315 HydrophobicContact CB-CB 4.32Å; A276-Q315 HydrophobicContact CB-CG 3.77Å; A276-Q315 WeakPolarHBondContact O-CG 3.33Å; A276-Q315 PolarHBondContact O-NE2 3.08Å; C311-Q315 VanDerWaalsContact O-CG 3.31Å; C311-Q315 WeakPolarHBondContact O-CG 3.43Å; C311-Q315 PolarHBondContact O-N 3.44Å; F312-Q315 PolarHBondContact O-N 3.07Å; T313-Q315 PolarHBondContact O-N 3.44Å; Q315-V318 WeakPolarHBondContact O-CG1 3.26Å; Q315-R319 WeakPolarHBondContact O-CG 3.18Å; Q315-R319 PolarHBondContact O-NE 3.11Å; Q315-S354 VanDerWaalsContact CB-OG 3.32Å; Q315-S354 WeakPolarHBondContact CB-OG 3.32Å; Q315-S354 PolarHBondContact OE1-OG 3.07Å; Q315-S354 VanDerWaalsContact OE1-OG 3.1Å
316	T	98.8	Very high	98.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-71.1	-51.9	174.8	-56.7	0	0	0	0	110.5	F312 T313 A314 V318 R319 V320 L339 P353 S354	F312-T316 PolarHBondContact O-N 2.82Å; F312-T316 PolarHBondContact O-OG1 3.34Å; T313-T316 PolarHBondContact O-N 3.18Å; A314-T316 VanDerWaalsContact C-N 3.27Å; A314-T316 PolarHBondContact O-N 3.47Å; T316-V318 VanDerWaalsContact C-N 3.32Å; T316-V318 PolarHBondContact O-N 2.67Å; T316-R319 WeakPolarHBondContact O-CB 3.41Å; T316-R319 PolarHBondContact O-N 3.31Å; T316-R319 VanDerWaalsContact O-N 3.12Å; T316-V320 PolarHBondContact O-N 2.83Å; T316-L339 WeakPolarHBondContact CG2-O 3.44Å; T316-P353 HydrophobicContact CG2-CB 4Å; T316-P353 HydrophobicContact CG2-CG 4.32Å; T316-S354 PolarHBondContact OG1-N 3Å
317	L	98.8	Very high	98.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-67.4	-29.6	-176.2	-62.4	-174.4	0	0	0	113.6	L230 F234 F237 L272 T313 A314 R319 V320 L321 I329	L230-L317 HydrophobicContact CD1-CD1 4.14Å; F234-L317 HydrophobicContact CD1-CD1 4.04Å; F234-L317 HydrophobicContact CD1-CD2 4.12Å; F234-L317 HydrophobicContact CD2-CD1 3.99Å; F234-L317 HydrophobicContact CE1-CD1 4.17Å; F234-L317 HydrophobicContact CE1-CD2 3.59Å; F234-L317 HydrophobicContact CE1-CG 4.47Å; F234-L317 HydrophobicContact CE2-CD1 4.1Å; F234-L317 HydrophobicContact CE2-CD2 4.5Å; F234-L317 HydrophobicContact CG-CD1 3.94Å; F234-L317 HydrophobicContact CZ-CD1 4.2Å; F234-L317 HydrophobicContact CZ-CD2 3.8Å; F237-L317 HydrophobicContact CE2-CD1 3.62Å; F237-L317 HydrophobicContact CZ-CD1 4.06Å; L272-L317 HydrophobicContact CD1-CB 4.21Å; L272-L317 HydrophobicContact CD2-CB 4.24Å; T313-L317 HydrophobicContact CG2-CD1 4.34Å; T313-L317 WeakPolarHBondContact O-CG 3.24Å; T313-L317 PolarHBondContact O-N 3.47Å; A314-L317 PolarHBondContact O-N 3.27Å; L317-R319 VanDerWaalsContact C-N 3.29Å; L317-R319 PolarHBondContact O-N 3.48Å; L317-V320 PolarHBondContact O-N 3.01Å; L317-L321 VanDerWaalsContact O-CB 3.26Å; L317-L321 WeakPolarHBondContact O-CB 3.16Å; L317-L321 PolarHBondContact O-N 3.21Å; L317-I329 HydrophobicContact CB-CD1 4.46Å; L317-I329 HydrophobicContact CD2-CG1 4.38Å; L317-I329 WeakPolarHBondContact O-CD1 3.41Å
318	V	98.5	Very high	98.3	Very high	22 Å²	22	32.2 Å²	32.2	13%	0.133	16%	0.163	C	C	.	.	H	α-helix	trans	-66.7	-33.3	175.1	79.3	0	0	0	0	111.5	L272 Q273 A276 A314 Q315 T316 S322	L272-V318 HydrophobicContact CB-CB 4.18Å; L272-V318 HydrophobicContact CB-CG2 4.27Å; Q273-V318 HydrophobicContact CG-CG2 3.57Å; A276-V318 HydrophobicContact CB-CG1 4.04Å; A314-V318 WeakPolarHBondContact O-CB 3.36Å; A314-V318 PolarHBondContact O-N 3.34Å; Q315-V318 WeakPolarHBondContact O-CG1 3.26Å; T316-V318 VanDerWaalsContact C-N 3.32Å; T316-V318 PolarHBondContact O-N 2.67Å; V318-S322 WeakPolarHBondContact O-CB 3.39Å; V318-S322 PolarHBondContact O-N 3.42Å; V318-S322 VanDerWaalsContact O-N 3.07Å; V318-S322 PolarHBondContact O-OG 3.2Å
319	R	98.6	Very high	98.3	Very high	78 Å²	78	31.4 Å²	31.4	29%	0.294	16%	0.158	S	C	.	.	H	α-helix	trans	-72.2	-47	174.5	-69.3	178.5	-70	131.4	-8.9	110.7	Q315 T316 L317 L321 S322 H323 V351 T352 S354	Q315-R319 WeakPolarHBondContact O-CG 3.18Å; Q315-R319 PolarHBondContact O-NE 3.11Å; T316-R319 WeakPolarHBondContact O-CB 3.41Å; T316-R319 PolarHBondContact O-N 3.31Å; T316-R319 VanDerWaalsContact O-N 3.12Å; L317-R319 VanDerWaalsContact C-N 3.29Å; L317-R319 PolarHBondContact O-N 3.48Å; R319-L321 VanDerWaalsContact C-N 3.3Å; R319-L321 PolarHBondContact O-N 2.91Å; R319-S322 WeakPolarHBondContact O-CA 3.42Å; R319-S322 WeakPolarHBondContact O-CB 3.43Å; R319-S322 PolarHBondContact O-N 3.13Å; R319-H323 PolarHBondContact O-CD2 3.01Å; R319-H323 PolarHBondContact O-N 2.93Å; R319-H323 VanDerWaalsContact O-N 3.13Å; R319-V351 HydrophobicContact CB-CG1 4.2Å; R319-T352 PolarHBondContact NH1-O 2.95Å; R319-T352 PolarHBondContact NH2-O 2.67Å; R319-S354 VanDerWaalsContact NH2-N 3.12Å; R319-S354 PolarHBondContact NH2-OG 3.18Å
320	V	98.4	Very high	98.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-54.7	-45.6	172.6	173.5	0	0	0	0	111.4	T316 L317 S322 H323 G324 G325 I329 L339 W346 V351	T316-V320 PolarHBondContact O-N 2.83Å; L317-V320 PolarHBondContact O-N 3.01Å; V320-S322 VanDerWaalsContact C-N 3.28Å; V320-S322 PolarHBondContact O-N 3.33Å; V320-H323 CarbonylContact O-C 3.51Å; V320-H323 PolarHBondContact O-N 3.05Å; V320-H323 VanDerWaalsContact O-N 3.13Å; V320-G324 PolarHBondContact O-N 2.84Å; V320-G325 PolarHBondContact O-N 3Å; V320-I329 HydrophobicContact CB-CD1 4.1Å; V320-I329 HydrophobicContact CG1-CD1 3.76Å; V320-I329 HydrophobicContact CG1-CG1 3.98Å; V320-L339 HydrophobicContact CG1-CD1 4.15Å; V320-W346 HydrophobicContact CG1-CH2 4.16Å; V320-W346 HydrophobicContact CG1-CZ2 3.58Å; V320-V351 HydrophobicContact CG2-CG1 4.08Å
321	L	98.3	Very high	98.2	Very high	4 Å²	4	29.4 Å²	29.4	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-62.9	-35.4	177.6	-177.9	62.3	0	0	0	112.1	F53 R269 L272 L317 R319 H323 G324 I329	F53-L321 HydrophobicContact CE1-CD1 4.23Å; F53-L321 HydrophobicContact CE2-CD1 4.18Å; F53-L321 HydrophobicContact CZ-CD1 3.89Å; F53-L321 HydrophobicContact CZ-CD2 4.47Å; R269-L321 HydrophobicContact CB-CD2 3.97Å; R269-L321 HydrophobicContact CG-CD2 3.99Å; L272-L321 HydrophobicContact CD1-CB 4.47Å; L272-L321 HydrophobicContact CD1-CD2 3.91Å; L317-L321 VanDerWaalsContact O-CB 3.26Å; L317-L321 WeakPolarHBondContact O-CB 3.16Å; L317-L321 PolarHBondContact O-N 3.21Å; R319-L321 VanDerWaalsContact C-N 3.3Å; R319-L321 PolarHBondContact O-N 2.91Å; L321-H323 PolarHBondContact O-N 3.16Å; L321-G324 PolarHBondContact O-N 2.83Å; L321-I329 HydrophobicContact CB-CD1 3.73Å; L321-I329 HydrophobicContact CD1-CD1 4.35Å
322	S	97.4	Very high	98.1	Very high	74 Å²	74	31.3 Å²	31.3	52%	0.517	16%	0.161	S	C	.	.	H	α-helix	trans	-70.2	-22.2	177.8	-58.2	0	0	0	0	112.8	V318 R319 V320	V318-S322 WeakPolarHBondContact O-CB 3.39Å; V318-S322 PolarHBondContact O-N 3.42Å; V318-S322 VanDerWaalsContact O-N 3.07Å; V318-S322 PolarHBondContact O-OG 3.2Å; R319-S322 WeakPolarHBondContact O-CA 3.42Å; R319-S322 WeakPolarHBondContact O-CB 3.43Å; R319-S322 PolarHBondContact O-N 3.13Å; V320-S322 VanDerWaalsContact C-N 3.28Å; V320-S322 PolarHBondContact O-N 3.33Å
323	H	97.6	Very high	98	Very high	70 Å²	70	33.5 Å²	33.5	32%	0.324	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	24	173.9	-60.4	-62.7	0	0	0	113.4	R319 V320 L321 G325 W346	R319-H323 PolarHBondContact O-CD2 3.01Å; R319-H323 PolarHBondContact O-N 2.93Å; R319-H323 VanDerWaalsContact O-N 3.13Å; V320-H323 CarbonylContact O-C 3.51Å; V320-H323 PolarHBondContact O-N 3.05Å; V320-H323 VanDerWaalsContact O-N 3.13Å; L321-H323 PolarHBondContact O-N 3.16Å; H323-G325 VanDerWaalsContact C-N 3.32Å; H323-G325 PolarHBondContact O-N 2.83Å; H323-W346 HydrophobicContact CB-CB 3.54Å; H323-W346 HydrophobicContact CB-CG 3.87Å
324	G	96.5	Very high	97.7	Very high	41 Å²	41	35.9 Å²	35.9	42%	0.423	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	79	7.6	173.7	0	0	0	0	0	115.2	V320 L321 Y326	V320-G324 PolarHBondContact O-N 2.84Å; L321-G324 PolarHBondContact O-N 2.83Å; G324-Y326 WeakPolarHBondContact O-CD1 3.29Å; G324-Y326 WeakPolarHBondContact O-CE1 3.36Å; G324-Y326 PolarHBondContact O-N 2.88Å
325	G	97.5	Very high	97.5	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.01	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	21.1	-178.5	0	0	0	0	0	116.1	V320 H323 R327 K328 I329	V320-G325 PolarHBondContact O-N 3Å; H323-G325 VanDerWaalsContact C-N 3.32Å; H323-G325 PolarHBondContact O-N 2.83Å; G325-R327 VanDerWaalsContact C-N 3.32Å; G325-R327 PolarHBondContact O-N 2.65Å; G325-K328 PolarHBondContact O-N 3.36Å; G325-I329 WeakPolarHBondContact O-CG1 3.33Å; G325-I329 PolarHBondContact O-N 3.33Å
326	Y	98.1	Very high	97.4	Very high	55 Å²	55	37.5 Å²	37.5	22%	0.216	21%	0.209	C	C	.	.	H	α-helix	trans	-62.4	-34.1	-175	57.9	-92.5	0	0	0	113.3	F53 C56 G324 I329 L330	F53-Y326 HydrophobicContact CB-CD1 4.36Å; F53-Y326 HydrophobicContact CB-CD2 4.31Å; F53-Y326 HydrophobicContact CB-CG 4.24Å; F53-Y326 VanDerWaalsContact CD2-CB 3.48Å; F53-Y326 AromaticContact CD2-CD2 3.9Å; F53-Y326 HydrophobicContact CD2-CD2 3.9Å; F53-Y326 AromaticContact CD2-CG 3.73Å; F53-Y326 HydrophobicContact CD2-CG 3.73Å; F53-Y326 HydrophobicContact CE2-CG 4.46Å; F53-Y326 HydrophobicContact CG-CG 4.23Å; C56-Y326 HydrophobicContact CB-CD2 4.15Å; C56-Y326 HydrophobicContact CB-CE2 4.25Å; G324-Y326 WeakPolarHBondContact O-CD1 3.29Å; G324-Y326 WeakPolarHBondContact O-CE1 3.36Å; G324-Y326 PolarHBondContact O-N 2.88Å; Y326-I329 PolarHBondContact O-N 2.99Å; Y326-L330 VanDerWaalsContact O-CB 3.3Å; Y326-L330 WeakPolarHBondContact O-CB 3.16Å; Y326-L330 WeakPolarHBondContact O-CG 3.39Å; Y326-L330 PolarHBondContact O-N 3.27Å
327	R	98.2	Very high	97.3	Very high	101 Å²	101	39.2 Å²	39.2	38%	0.381	22%	0.221	S	C	.	.	H	α-helix	trans	-66.3	-39.8	-180	-56.1	-172.6	93.9	-126.5	11.6	111.8	G325 L330 G331 M332 E333	G325-R327 VanDerWaalsContact C-N 3.32Å; G325-R327 PolarHBondContact O-N 2.65Å; R327-L330 PolarHBondContact O-N 2.9Å; R327-G331 PolarHBondContact O-N 2.87Å; R327-M332 HydrophobicContact CB-CB 4.44Å; R327-M332 WeakPolarHBondContact O-CB 3.31Å; R327-M332 PolarHBondContact O-N 3.46Å; R327-E333 HydrophobicContact CB-CG 4.12Å; R327-E333 WeakPolarHBondContact CB-OE1 3.46Å; R327-E333 WeakPolarHBondContact CD-OE1 3.27Å; R327-E333 IonicContact CZ-OE1 3.36Å; R327-E333 IonicContact NE-OE1 2.68Å; R327-E333 IonicContact NH1-OE1 3.35Å; R327-E333 PolarHBondContact NH1-OE1 3.04Å
328	K	98	Very high	97.1	Very high	42 Å²	42	42.7 Å²	42.7	18%	0.183	23%	0.234	C	C	.	.	H	α-helix	trans	-65.3	-49.2	171.3	-72.1	-77.4	178.4	179.7	0	111.2	G325 L330 G331 E333 A336 L339 W346	G325-K328 PolarHBondContact O-N 3.36Å; K328-L330 PolarHBondContact O-N 3.43Å; K328-G331 PolarHBondContact O-N 3.3Å; K328-E333 HydrophobicContact CD-CB 3.79Å; K328-E333 VanDerWaalsContact CE-OE2 3.25Å; K328-E333 WeakPolarHBondContact CE-OE2 3.34Å; K328-E333 HydrophobicContact CG-CB 4.38Å; K328-E333 PolarHBondContact NZ-O 3.12Å; K328-A336 HydrophobicContact CB-CB 4.13Å; K328-A336 HydrophobicContact CD-CB 4.44Å; K328-A336 WeakPolarHBondContact O-CB 3.49Å; K328-L339 HydrophobicContact CB-CD1 3.69Å; K328-L339 HydrophobicContact CG-CD1 4.35Å; K328-W346 HydrophobicContact CB-CH2 4.24Å; K328-W346 HydrophobicContact CG-CH2 3.92Å
329	I	98.4	Very high	97.1	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-58.1	-33.2	177.7	-68	171.4	0	0	0	111.8	L230 R233 Y268 L317 V320 L321 G325 Y326 G331	L230-I329 HydrophobicContact CD1-CG2 3.91Å; R233-I329 PolarHBondContact NH1-O 3.41Å; R233-I329 PolarHBondContact NH2-O 2.68Å; Y268-I329 HydrophobicContact CE1-CG2 4.13Å; L317-I329 HydrophobicContact CB-CD1 4.46Å; L317-I329 HydrophobicContact CD2-CG1 4.38Å; L317-I329 WeakPolarHBondContact O-CD1 3.41Å; V320-I329 HydrophobicContact CB-CD1 4.1Å; V320-I329 HydrophobicContact CG1-CD1 3.76Å; V320-I329 HydrophobicContact CG1-CG1 3.98Å; L321-I329 HydrophobicContact CB-CD1 3.73Å; L321-I329 HydrophobicContact CD1-CD1 4.35Å; G325-I329 WeakPolarHBondContact O-CG1 3.33Å; G325-I329 PolarHBondContact O-N 3.33Å; Y326-I329 PolarHBondContact O-N 2.99Å; I329-G331 VanDerWaalsContact C-N 3.33Å
330	L	98.4	Very high	96.9	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	4.4	178	-67.1	173.9	0	0	0	114.2	F53 C56 L57 R60 Y268 Y326 R327 K328 M332	F53-L330 HydrophobicContact CD2-CD1 4.33Å; F53-L330 HydrophobicContact CE2-CD1 4.13Å; C56-L330 HydrophobicContact CB-CD1 3.77Å; L57-L330 HydrophobicContact CD2-CD1 4.04Å; L57-L330 HydrophobicContact CD2-CD2 3.63Å; L57-L330 HydrophobicContact CD2-CG 4.45Å; L57-L330 HydrophobicContact CG-CD1 4.13Å; R60-L330 WeakPolarHBondContact CD-O 3.23Å; R60-L330 HydrophobicContact CG-CB 4.4Å; R60-L330 PolarHBondContact NE-O 2.87Å; R60-L330 VanDerWaalsContact NE-O 3.08Å; Y268-L330 HydrophobicContact CE2-CD2 4.12Å; Y326-L330 VanDerWaalsContact O-CB 3.3Å; Y326-L330 WeakPolarHBondContact O-CB 3.16Å; Y326-L330 WeakPolarHBondContact O-CG 3.39Å; Y326-L330 PolarHBondContact O-N 3.27Å; R327-L330 PolarHBondContact O-N 2.9Å; K328-L330 PolarHBondContact O-N 3.43Å; L330-M332 VanDerWaalsContact C-N 3.27Å; L330-M332 HydrophobicContact CB-CG 3.97Å; L330-M332 HydrophobicContact CB-SD 4.27Å; L330-M332 HydrophobicContact CD1-SD 4.48Å; L330-M332 PolarHBondContact O-N 2.83Å
331	G	97.3	Very high	96.8	Very high	16 Å²	16	44.9 Å²	44.9	17%	0.165	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	25.9	178.2	0	0	0	0	0	113.7	R327 K328 I329	R327-G331 PolarHBondContact O-N 2.87Å; K328-G331 PolarHBondContact O-N 3.3Å; I329-G331 VanDerWaalsContact C-N 3.33Å
332	M	97	Very high	96.7	Very high	44 Å²	44	49.9 Å²	49.9	22%	0.217	28%	0.275	C	S	.	.	S	Bend	trans	-89.6	-4.5	-179.8	-54.7	-175.6	87.4	0	0	112.9	C56 K59 R327 L330	C56-M332 HydrophobicContact CB-CE 4.44Å; C56-M332 HydrophobicContact CB-SD 3.66Å; K59-M332 HydrophobicContact CB-CE 4.22Å; K59-M332 HydrophobicContact CD-CE 3.64Å; K59-M332 HydrophobicContact CG-CE 3.92Å; R327-M332 HydrophobicContact CB-CB 4.44Å; R327-M332 WeakPolarHBondContact O-CB 3.31Å; R327-M332 PolarHBondContact O-N 3.46Å; L330-M332 VanDerWaalsContact C-N 3.27Å; L330-M332 HydrophobicContact CB-CG 3.97Å; L330-M332 HydrophobicContact CB-SD 4.27Å; L330-M332 HydrophobicContact CD1-SD 4.48Å; L330-M332 PolarHBondContact O-N 2.83Å
333	E	95.6	Very high	96.7	Very high	80 Å²	80	52.7 Å²	52.7	37%	0.374	28%	0.281	S	S	.	.	S	Bend	trans	-134.7	43.1	-174.5	-67.3	-179.2	-177.5	0	0	111.6	R327 K328	R327-E333 HydrophobicContact CB-CG 4.12Å; R327-E333 WeakPolarHBondContact CB-OE1 3.46Å; R327-E333 WeakPolarHBondContact CD-OE1 3.27Å; R327-E333 IonicContact CZ-OE1 3.36Å; R327-E333 IonicContact NE-OE1 2.68Å; R327-E333 IonicContact NH1-OE1 3.35Å; R327-E333 PolarHBondContact NH1-OE1 3.04Å; K328-E333 HydrophobicContact CD-CB 3.79Å; K328-E333 VanDerWaalsContact CE-OE2 3.25Å; K328-E333 WeakPolarHBondContact CE-OE2 3.34Å; K328-E333 HydrophobicContact CG-CB 4.38Å; K328-E333 PolarHBondContact NZ-O 3.12Å
334	G	93.4	Very high	96.7	Very high	53 Å²	53	50 Å²	50	55%	0.546	27%	0.27	S	S	.	.	S	Bend	trans	80.6	-162	-178.5	0	0	0	0	0	113.2
335	D	94.8	Very high	96.7	Very high	101 Å²	101	52.7 Å²	52.7	54%	0.54	28%	0.279	S	S	.	.			trans	-59.8	142.2	171.1	-178.7	35.4	0	0	0	110.3	S337 Y338	D335-S337 WeakPolarHBondContact OD1-CB 3.46Å; D335-S337 PolarHBondContact OD1-N 3.27Å; D335-S337 PolarHBondContact OD1-OG 3.14Å; D335-S337 VanDerWaalsContact OD1-OG 3.1Å; D335-S337 PolarHBondContact OD2-OG 2.69Å; D335-Y338 VanDerWaalsContact O-CE1 3.3Å; D335-Y338 WeakPolarHBondContact O-CE1 3.2Å
336	A	96.1	Very high	96.7	Very high	3 Å²	3	54.9 Å²	54.9	3%	0.025	29%	0.287	C	S	.	.			trans	-135.9	5.4	179.6	0	0	0	0	0	111.8	F234 K328 Y338 L339	F234-A336 WeakPolarHBondContact CE1-O 3.46Å; F234-A336 HydrophobicContact CZ-CB 4.04Å; K328-A336 HydrophobicContact CB-CB 4.13Å; K328-A336 HydrophobicContact CD-CB 4.44Å; K328-A336 WeakPolarHBondContact O-CB 3.49Å; A336-Y338 PolarHBondContact O-N 2.77Å; A336-L339 HydrophobicContact CB-CD1 4.09Å; A336-L339 VanDerWaalsContact O-CB 3.29Å; A336-L339 WeakPolarHBondContact O-CB 3.44Å; A336-L339 WeakPolarHBondContact O-CG 3.41Å; A336-L339 PolarHBondContact O-N 3.33Å
337	S	95.4	Very high	96.5	Very high	36 Å²	36	60.3 Å²	60.3	25%	0.252	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-57	-34.8	-179.2	67.9	0	0	0	0	112.1	R233 D335 L339 A340	R233-S337 WeakPolarHBondContact O-CB 3.32Å; D335-S337 WeakPolarHBondContact OD1-CB 3.46Å; D335-S337 PolarHBondContact OD1-N 3.27Å; D335-S337 PolarHBondContact OD1-OG 3.14Å; D335-S337 VanDerWaalsContact OD1-OG 3.1Å; D335-S337 PolarHBondContact OD2-OG 2.69Å; S337-L339 PolarHBondContact O-N 3.43Å; S337-L339 VanDerWaalsContact O-N 3.12Å; S337-A340 PolarHBondContact O-N 3.11Å
338	Y	96.5	Very high	96.4	Very high	74 Å²	74	58.7 Å²	58.7	29%	0.29	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-56	-27	175.3	71.5	-92.4	0	0	0	113.4	D335 A336 A340 I341 E342	D335-Y338 VanDerWaalsContact O-CE1 3.3Å; D335-Y338 WeakPolarHBondContact O-CE1 3.2Å; A336-Y338 PolarHBondContact O-N 2.77Å; Y338-A340 PolarHBondContact O-N 2.94Å; Y338-A340 VanDerWaalsContact O-N 3.1Å; Y338-I341 WeakPolarHBondContact O-CG1 3.29Å; Y338-I341 PolarHBondContact O-N 3.25Å; Y338-E342 WeakPolarHBondContact O-CB 3.36Å; Y338-E342 PolarHBondContact O-N 2.97Å
339	L	97	Very high	96.3	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.01	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-63.3	-18.9	178.2	-65.3	178.1	0	0	0	113.5	T316 V320 K328 A336 S337 W346	T316-L339 WeakPolarHBondContact CG2-O 3.44Å; V320-L339 HydrophobicContact CG1-CD1 4.15Å; K328-L339 HydrophobicContact CB-CD1 3.69Å; K328-L339 HydrophobicContact CG-CD1 4.35Å; A336-L339 HydrophobicContact CB-CD1 4.09Å; A336-L339 VanDerWaalsContact O-CB 3.29Å; A336-L339 WeakPolarHBondContact O-CB 3.44Å; A336-L339 WeakPolarHBondContact O-CG 3.41Å; A336-L339 PolarHBondContact O-N 3.33Å; S337-L339 PolarHBondContact O-N 3.43Å; S337-L339 VanDerWaalsContact O-N 3.12Å; L339-W346 HydrophobicContact CD1-CZ2 4.09Å; L339-W346 HydrophobicContact CD2-CZ2 3.99Å
340	A	95.3	Very high	96.3	Very high	13 Å²	13	65 Å²	65	11%	0.107	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-86.4	-9.3	176.3	0	0	0	0	0	113.5	F234 T313 S337 Y338 P353	F234-A340 HydrophobicContact CD1-CB 4.11Å; T313-A340 HydrophobicContact CG2-CB 4.41Å; S337-A340 PolarHBondContact O-N 3.11Å; Y338-A340 PolarHBondContact O-N 2.94Å; Y338-A340 VanDerWaalsContact O-N 3.1Å; A340-P353 WeakPolarHBondContact O-CB 3.5Å
341	I	95.4	Very high	96.3	Very high	131 Å²	131	65 Å²	65	67%	0.672	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.7	-22.9	-172.8	55	164.8	0	0	0	114	Y338	Y338-I341 WeakPolarHBondContact O-CG1 3.29Å; Y338-I341 PolarHBondContact O-N 3.25Å
342	E	96.4	Very high	96.4	Very high	109 Å²	109	67.6 Å²	67.6	51%	0.509	38%	0.384	S	S	.	.	S	Bend	trans	-112.6	148.2	-179.8	-68.8	176.2	-166.6	0	0	112.3	Y338 P353	Y338-E342 WeakPolarHBondContact O-CB 3.36Å; Y338-E342 PolarHBondContact O-N 2.97Å; E342-P353 VanDerWaalsContact C-CG 3.48Å; E342-P353 WeakPolarHBondContact O-CD 3.32Å; E342-P353 WeakPolarHBondContact O-CG 3.34Å
343	M	97.3	Very high	96.4	Very high	133 Å²	133	66.2 Å²	66.2	66%	0.655	38%	0.378	S	S	*	.			trans	-60.6	138.1	170.3	-72.4	-175.8	-78.6	0	0	110.7	V351 T352	M343-V351 WeakPolarHBondContact CA-O 3.36Å; M343-T352 HydrophobicContact CG-CG2 4.21Å
344	S	97.6	Very high	96.6	Very high	13 Å²	13	63.7 Å²	63.7	9%	0.091	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	156.2	176.1	56.2	0	0	0	0	111.3	W346 I350 V351	S344-W346 PolarHBondContact OG-NE1 3.19Å; S344-I350 WeakPolarHBondContact O-CA 3.49Å; S344-V351 PolarHBondContact N-O 3.33Å; S344-V351 VanDerWaalsContact N-O 3.08Å; S344-V351 PolarHBondContact O-N 3.03Å
345	T	97.5	Very high	96.7	Very high	98 Å²	98	68.7 Å²	68.7	60%	0.601	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	130.4	178.6	-52.8	0	0	0	0	110.5	V349	T345-V349 CarbonylContact C-O 3.6Å; T345-V349 WeakPolarHBondContact CA-O 3.07Å
346	W	96.6	Very high	96.9	Very high	46 Å²	46	69.1 Å²	69.1	17%	0.174	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	107.4	-177.2	-58.5	89.4	0	0	0	109.1	V320 H323 K328 L339 S344 G348 V349	V320-W346 HydrophobicContact CG1-CH2 4.16Å; V320-W346 HydrophobicContact CG1-CZ2 3.58Å; H323-W346 HydrophobicContact CB-CB 3.54Å; H323-W346 HydrophobicContact CB-CG 3.87Å; K328-W346 HydrophobicContact CB-CH2 4.24Å; K328-W346 HydrophobicContact CG-CH2 3.92Å; L339-W346 HydrophobicContact CD1-CZ2 4.09Å; L339-W346 HydrophobicContact CD2-CZ2 3.99Å; S344-W346 PolarHBondContact OG-NE1 3.19Å; W346-G348 PolarHBondContact O-N 3.4Å; W346-G348 VanDerWaalsContact O-N 3.15Å; W346-V349 PolarHBondContact N-O 3.19Å; W346-V349 WeakPolarHBondContact O-CB 3.21Å; W346-V349 PolarHBondContact O-N 3.25Å
347	D	93.9	Very high	96.9	Very high	170 Å²	170	72.6 Å²	72.6	91%	0.909	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	42.2	-177.3	-61.7	-22.8	0	0	0	113.6	V349	D347-V349 VanDerWaalsContact C-N 3.31Å; D347-V349 PolarHBondContact O-N 3.13Å
348	G	95.4	Very high	97	Very high	67 Å²	67	73.6 Å²	73.6	69%	0.691	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	-4.3	-178.5	0	0	0	0	0	115.2	W346	W346-G348 PolarHBondContact O-N 3.4Å; W346-G348 VanDerWaalsContact O-N 3.15Å
349	V	97.8	Very high	97	Very high	62 Å²	62	78.1 Å²	78.1	38%	0.376	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	125.3	172.9	-175.1	0	0	0	0	110.3	T345 W346 D347	T345-V349 CarbonylContact C-O 3.6Å; T345-V349 WeakPolarHBondContact CA-O 3.07Å; W346-V349 PolarHBondContact N-O 3.19Å; W346-V349 WeakPolarHBondContact O-CB 3.21Å; W346-V349 PolarHBondContact O-N 3.25Å; D347-V349 VanDerWaalsContact C-N 3.31Å; D347-V349 PolarHBondContact O-N 3.13Å
350	I	98.1	Very high	96.8	Very high	112 Å²	112	84.9 Å²	84.9	57%	0.574	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	125	174.4	-59.6	172.7	0	0	0	109	S344	S344-I350 WeakPolarHBondContact O-CA 3.49Å
351	V	98.3	Very high	96.5	Very high	3 Å²	3	88.2 Å²	88.2	2%	0.018	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	108.5	173.2	178.5	0	0	0	0	108.2	R319 V320 M343 S344	R319-V351 HydrophobicContact CB-CG1 4.2Å; V320-V351 HydrophobicContact CG2-CG1 4.08Å; M343-V351 WeakPolarHBondContact CA-O 3.36Å; S344-V351 PolarHBondContact N-O 3.33Å; S344-V351 VanDerWaalsContact N-O 3.08Å; S344-V351 PolarHBondContact O-N 3.03Å
352	T	98.4	Very high	96	Very high	70 Å²	70	87.9 Å²	87.9	43%	0.429	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-87.1	122.9	171.2	-52.2	0	0	0	0	109.7	R319 M343	R319-T352 PolarHBondContact NH1-O 2.95Å; R319-T352 PolarHBondContact NH2-O 2.67Å; M343-T352 HydrophobicContact CG-CG2 4.21Å
353	P	98.4	Very high	95.2	Very high	15 Å²	15	90.2 Å²	90.2	10%	0.097	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-52.8	143.9	176.3	-28.1	36.1	0	0	0	112.9	T316 A340 E342	T316-P353 HydrophobicContact CG2-CB 4Å; T316-P353 HydrophobicContact CG2-CG 4.32Å; A340-P353 WeakPolarHBondContact O-CB 3.5Å; E342-P353 VanDerWaalsContact C-CG 3.48Å; E342-P353 WeakPolarHBondContact O-CD 3.32Å; E342-P353 WeakPolarHBondContact O-CG 3.34Å
354	S	98.4	Very high	93.8	Very high	26 Å²	26	92.5 Å²	92.5	18%	0.182	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-69.7	138.4	170.6	-65.2	0	0	0	0	108.7	F312 Q315 T316 R319	F312-S354 WeakPolarHBondContact CD2-O 3.3Å; Q315-S354 VanDerWaalsContact CB-OG 3.32Å; Q315-S354 WeakPolarHBondContact CB-OG 3.32Å; Q315-S354 PolarHBondContact OE1-OG 3.07Å; Q315-S354 VanDerWaalsContact OE1-OG 3.1Å; T316-S354 PolarHBondContact OG1-N 3Å; R319-S354 VanDerWaalsContact NH2-N 3.12Å; R319-S354 PolarHBondContact NH2-OG 3.18Å
355	E	96.6	Very high	91.7	Very high	158 Å²	158	99.1 Å²	99.1	74%	0.738	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-101.6	163.5	-174.9	-64.1	179	-172.8	0	0	111.8	A357	E355-A357 PolarHBondContact O-N 3.37Å
356	K	97.6	Very high	89.7	Confident	110 Å²	110	102.8 Å²	102.8	48%	0.478	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-57.4	127.6	174.3	178.3	177.1	170	176.3	0	110.3	E305 D308 F312 Y358	E305-K356 IonicContact OE1-NZ 2.84Å; E305-K356 PolarHBondContact OE1-NZ 2.84Å; D308-K356 WeakPolarHBondContact OD2-CA 3.36Å; D308-K356 WeakPolarHBondContact OD2-CG 3.32Å; F312-K356 HydrophobicContact CE1-CB 3.92Å; F312-K356 HydrophobicContact CE1-CG 4.49Å; K356-Y358 WeakPolarHBondContact CE-O 3.33Å
357	A	97.3	Very high	87.5	Confident	77 Å²	77	107.1 Å²	107.1	64%	0.636	56%	0.555	S	S	*	*			trans	-109	-17.4	175	0	0	0	0	0	112.7	D308 E355 E359	D308-A357 PolarHBondContact OD2-N 3.27Å; E355-A357 PolarHBondContact O-N 3.37Å; A357-E359 PolarHBondContact O-N 3.04Å
358	Y	97.1	Very high	85.3	Confident	57 Å²	57	105.6 Å²	105.6	22%	0.224	54%	0.542	C	S	.	.			trans	-70.6	127.1	177.7	174.5	-101.8	0	0	0	111.8	L304 E305 D308 K356	L304-Y358 HydrophobicContact CB-CD2 3.68Å; L304-Y358 HydrophobicContact CB-CE2 3.38Å; L304-Y358 HydrophobicContact CD1-CE2 3.88Å; L304-Y358 HydrophobicContact CG-CE2 4.28Å; E305-Y358 HydrophobicContact CB-CD1 3.49Å; E305-Y358 VanDerWaalsContact CB-CD1 3.49Å; E305-Y358 HydrophobicContact CB-CE1 3.73Å; E305-Y358 HydrophobicContact CB-CG 4.2Å; E305-Y358 HydrophobicContact CG-CD1 3.88Å; E305-Y358 HydrophobicContact CG-CE1 4.39Å; D308-Y358 WeakPolarHBondContact OD2-CB 3.4Å; D308-Y358 PolarHBondContact OD2-N 2.58Å; K356-Y358 WeakPolarHBondContact CE-O 3.33Å
359	E	96.3	Very high	83	Confident	169 Å²	169	107.6 Å²	107.6	79%	0.79	54%	0.537	S	S	*	.			trans	-111.9	135	171.5	-64.5	-178.7	174.6	0	0	109.9	A357	A357-E359 PolarHBondContact O-N 3.04Å
360	K	93.1	Very high	80.3	Confident	144 Å²	144	111.1 Å²	111.1	63%	0.626	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-67	128.8	175.6	-167.7	-172.2	179.5	-166.1	0	108.2	E363	K360-E363 IonicContact NZ-OE1 3.02Å; K360-E363 PolarHBondContact NZ-OE1 2.99Å
361	P	89.6	Confident	77.8	Confident	83 Å²	83	109.2 Å²	109.2	54%	0.539	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-56.1	145.7	172	-23.6	33.1	0	0	0	110.9	E363	P361-E363 PolarHBondContact O-N 3.39Å
362	P	85.4	Confident	75.4	Confident	123 Å²	123	116 Å²	116	80%	0.799	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-58.1	137.5	172.9	24.7	-32.3	0	0	0	109.5	R364	P362-R364 PolarHBondContact O-N 3.19Å; P362-R364 VanDerWaalsContact O-N 3.11Å
363	E	78.4	Confident	72.9	Confident	159 Å²	159	121 Å²	121	74%	0.743	60%	0.604	S	S	*	*			trans	-62	114.3	173.8	-70	174	-174.7	0	0	107.7	K360 P361 K365	K360-E363 IonicContact NZ-OE1 3.02Å; K360-E363 PolarHBondContact NZ-OE1 2.99Å; P361-E363 PolarHBondContact O-N 3.39Å; E363-K365 PolarHBondContact O-N 3.25Å
364	R	67.9	Low	70.3	Confident	181 Å²	181	128.2 Å²	128.2	68%	0.683	64%	0.637	S	S	*	*			trans	-64.5	122.4	169.4	-75.4	-175.4	-179.6	172.5	-1	106.7	P362 E366	P362-R364 PolarHBondContact O-N 3.19Å; P362-R364 VanDerWaalsContact O-N 3.11Å; R364-E366 PolarHBondContact O-N 2.61Å
365	K	54.8	Low	67.4	Low	151 Å²	151	130.6 Å²	130.6	66%	0.657	67%	0.665	S	S	*	*			trans	-63.4	130.2	165.9	-72.7	-176.2	171.3	-169	0	107.3	E363 E367 E368	E363-K365 PolarHBondContact O-N 3.25Å; K365-E367 HydrophobicContact CB-CB 4.46Å; K365-E367 PolarHBondContact O-N 3.17Å; K365-E368 PolarHBondContact O-N 3.29Å
366	E	53.7	Low	64.6	Low	175 Å²	175	126.2 Å²	126.2	82%	0.818	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	-14.8	176.9	-66.5	174.5	156	0	0	112.8	R364 E368 D369	R364-E366 PolarHBondContact O-N 2.61Å; E366-E368 VanDerWaalsContact C-N 3.31Å; E366-E368 PolarHBondContact O-N 2.89Å; E366-D369 PolarHBondContact O-N 3.06Å
367	E	50.6	Low	62	Low	138 Å²	138	129 Å²	129	65%	0.645	68%	0.682	S	S	*	*	H	α-helix	trans	-64.3	-22.6	178.6	-64.9	174.9	163.9	0	0	114.9	K365	K365-E367 HydrophobicContact CB-CB 4.46Å; K365-E367 PolarHBondContact O-N 3.17Å
368	E	48.2	Very low	59.3	Low	138 Å²	138	128.7 Å²	128.7	65%	0.645	69%	0.687	S	S	*	*	H	α-helix	trans	-81.7	-20.7	-179.2	-77.3	-174.3	171.2	0	0	113.8	K365 E366	K365-E368 PolarHBondContact O-N 3.29Å; E366-E368 VanDerWaalsContact C-N 3.31Å; E366-E368 PolarHBondContact O-N 2.89Å
369	D	46.9	Very low	56.3	Low	108 Å²	108	135.4 Å²	135.4	58%	0.578	72%	0.721	S	S	*	*	H	α-helix	trans	-84.6	-29.7	178.7	-73.6	-27.4	0	0	0	111.7	E366	E366-D369 PolarHBondContact O-N 3.06Å
370	E	42	Very low	53.4	Low	137 Å²	137	135.1 Å²	135.1	64%	0.64	73%	0.725	S	S	*	*	H	α-helix	trans	-73.6	-34.1	172.5	-70.6	-174.8	168	0	0	112.4	L372 E373 E374	E370-L372 PolarHBondContact O-N 2.85Å; E370-E373 PolarHBondContact O-N 3.34Å; E370-E374 PolarHBondContact O-N 3.44Å
371	A	45.5	Very low	50.5	Low	71 Å²	71	137.1 Å²	137.1	59%	0.587	74%	0.736	S	S	*	*	H	α-helix	trans	-69.6	-18.8	178.7	0	0	0	0	0	113.9
372	L	47.1	Very low	47.8	Very low	147 Å²	147	138.4 Å²	138.4	77%	0.77	75%	0.747	S	S	*	*	H	α-helix	trans	-90.8	-19.5	174.7	-76.9	163.9	0	0	0	113	E370	E370-L372 PolarHBondContact O-N 2.85Å
373	E	46.8	Very low	45.2	Very low	175 Å²	175	141.8 Å²	141.8	82%	0.818	76%	0.755	S	S	*	*	H	α-helix	trans	-91	-27.1	173.4	-74	-164.4	160.8	0	0	113.1	E370	E370-E373 PolarHBondContact O-N 3.34Å
374	E	42.2	Very low	43.1	Very low	166 Å²	166	142.8 Å²	142.8	78%	0.776	76%	0.759	S	S	*	*	S	Bend	trans	-89.9	-8.7	-179.8	-72.2	-163.8	154	0	0	115.5	E370 G376	E370-E374 PolarHBondContact O-N 3.44Å; E374-G376 VanDerWaalsContact C-N 3.29Å; E374-G376 PolarHBondContact O-N 2.94Å
375	G	38.7	Very low	41.5	Very low	75 Å²	75	140.8 Å²	140.8	77%	0.773	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	9.1	-179	0	0	0	0	0	116.1
376	G	38.5	Very low	40.4	Very low	67 Å²	67	141.7 Å²	141.7	69%	0.691	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	-12.7	-168.2	0	0	0	0	0	117	E374	E374-G376 VanDerWaalsContact C-N 3.29Å; E374-G376 PolarHBondContact O-N 2.94Å
377	D	41.2	Very low	39.4	Very low	167 Å²	167	141.6 Å²	141.6	89%	0.893	77%	0.774	S	S	*	*	S	Bend	trans	-133.1	110.9	-173.5	-105.7	-10.6	0	0	0	111.1
378	G	40.7	Very low	38.6	Very low	72 Å²	72	145.2 Å²	145.2	74%	0.742	78%	0.783	S	S	*	*			trans	130.4	78.3	162.8	0	0	0	0	0	114.4
379	E	33.8	Very low	37.9	Very low	198 Å²	198	146.7 Å²	146.7	93%	0.925	79%	0.787	S	S	*	*			trans	-166.9	78	143.8	-107.6	174.6	-150.5	0	0	108.4
380	D	35.4	Very low	37.4	Very low	163 Å²	163	149.6 Å²	149.6	87%	0.872	80%	0.797	S	S	*	*			trans	-134	87.1	165.3	-145.1	7.4	0	0	0	106.3
381	E	32.8	Very low	36.9	Very low	185 Å²	185	148.5 Å²	148.5	86%	0.864	81%	0.805	S	S	*	*			trans	-167.7	126.8	151.9	-109.8	175.4	-158.4	0	0	112.6
382	S	32.3	Very low	36.6	Very low	111 Å²	111	150.6 Å²	150.6	78%	0.776	82%	0.815	S	S	*	*			trans	78.8	103	161.4	75	0	0	0	0	119.1
383	M	32.3	Very low	36	Very low	193 Å²	193	156.5 Å²	156.5	95%	0.951	84%	0.839	S	S	*	*				-155	139.9	118.5	-107.7	-176.9	-138	0	0	111.9
384	E	32.8	Very low	35.5	Very low	181 Å²	181	155.6 Å²	155.6	85%	0.846	84%	0.84	S	S	*	*			trans	-68.3	150.3	-159.2	-67.7	162.5	141.7	0	0	115.1	Q386	E384-Q386 PolarHBondContact O-N 3.21Å
385	T	35.2	Very low	35.1	Very low	139 Å²	139	155 Å²	155	85%	0.853	84%	0.843	S	S	*	*			trans	-57.4	123.3	162.3	41.2	0	0	0	0	111.4
386	Q	31.9	Very low	34.9	Very low	170 Å²	170	159.4 Å²	159.4	79%	0.794	85%	0.847	S	S	*	*			trans	-115.3	113.5	155.7	-83.1	-174.1	-10.7	0	0	109.8	E384	E384-Q386 PolarHBondContact O-N 3.21Å
387	E	33.5	Very low	34.7	Very low	173 Å²	173	164.9 Å²	164.9	81%	0.808	86%	0.856	S	S	*	*			trans	-58.8	131.6	162.9	-69.7	177.6	144.8	0	0	109.7
388	Y	33.2	Very low	34.3	Very low	213 Å²	213	164.8 Å²	164.8	84%	0.835	85%	0.854	S	S	*	*			trans	-121.3	118.1	157.4	-101	-87.3	0	0	0	109.4
389	F	32.5	Very low	33.9	Very low	169 Å²	169	170.9 Å²	170.9	74%	0.741	86%	0.862	S	S	*	*			trans	-67.3	147.6	170.9	-103.4	-98.6	0	0	0	112
390	E	36.8	Very low	33.9	Very low	169 Å²	169	169 Å²	169	79%	0.79	86%	0.857	S	S	*	*			trans	-3.2	137.4	155.9	-62.5	174.8	148.8	0	0	120.1
391	S	32.3	Very low	33.8	Very low	115 Å²	115	169.5 Å²	169.5	80%	0.804	86%	0.856	S	S	*	*				-167.8	126.4	114	59.5	0	0	0	0	113.2
392	S	38.3	Very low	33.9	Very low	114 Å²	114	168.2 Å²	168.2	80%	0.797	86%	0.855	S	S	*	*			trans	-17.1	135.8	155.3	-19.2	0	0	0	0	118.8
393	E	35.6	Very low	34	Very low	271 Å²	271	173.4 Å²	173.4	100%	1.266	86%	0.862	S	S	*	*				-164.6	0	94.6	-100.6	-173.7	159.2	0	0	111.1

Retrieved 393 of 393 residues in 71.2 ms (Link to these results)

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