A0A3B5QIW1_XIPMA Loading...

Estrogen-related receptor beta

AlphaFold DB , UniProt , Accession A0A3B5QIW1, Species XIPMA (Xiphophorus maculatus, Southern platyfish), Gene n/a, Length 477 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	41.8	Very low	37.9	Very low	238 Å²	238	142.4 Å²	142.4	100%	1.172	78%	0.781	S	S	*	*				0	119.8	0	-74.6	172.4	171.4	0	0	105.4
2	D	27.5	Very low	38.6	Very low	153 Å²	153	140.5 Å²	140.5	82%	0.818	77%	0.768	S	S	*	*			trans	-138.1	144.8	167.3	-106.2	-58.9	0	0	0	107.5
3	I	39.1	Very low	39.4	Very low	171 Å²	171	133.2 Å²	133.2	88%	0.877	73%	0.733	S	S	*	*			trans	-133.3	78.7	-171.6	-55.5	177.7	0	0	0	107.3
4	S	34.5	Very low	40.4	Very low	98 Å²	98	133.3 Å²	133.3	69%	0.685	72%	0.719	S	S	*	*			trans	-157.5	10.5	-173.1	45.4	0	0	0	0	116.1	L6	S4-L6 PolarHBondContact O-N 3.21Å
5	E	34.9	Very low	41.2	Very low	188 Å²	188	132 Å²	132	88%	0.879	71%	0.706	S	S	*	*			trans	-95.6	74.9	161.5	-75.4	-166.4	134.6	0	0	110.8	C7	E5-C7 PolarHBondContact O-N 3.35Å; E5-C7 VanDerWaalsContact O-N 3.15Å
6	L	39.3	Very low	42.1	Very low	165 Å²	165	126.5 Å²	126.5	86%	0.864	68%	0.677	S	S	*	*			trans	-69.9	99.8	157.3	-85.9	163.3	0	0	0	107.8	S4 L8	S4-L6 PolarHBondContact O-N 3.21Å; L6-L8 PolarHBondContact O-N 3.22Å
7	C	37.6	Very low	43.1	Very low	119 Å²	119	122.5 Å²	122.5	80%	0.804	65%	0.653	S	S	*	*			trans	-62	99.1	168.5	-71.8	0	0	0	0	109.3	E5	E5-C7 PolarHBondContact O-N 3.35Å; E5-C7 VanDerWaalsContact O-N 3.15Å
8	L	37.8	Very low	44	Very low	157 Å²	157	118.1 Å²	118.1	82%	0.822	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-62.8	128.4	162.8	-71.6	168	0	0	0	107.6	L6	L6-L8 PolarHBondContact O-N 3.22Å
9	P	41.5	Very low	44.8	Very low	64 Å²	64	115.1 Å²	115.1	42%	0.416	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-60.7	141.1	179.1	-21.1	31.8	0	0	0	111.2	Y14	P9-Y14 HydrophobicContact CB-CD2 4.26Å; P9-Y14 HydrophobicContact CB-CE2 3.68Å; P9-Y14 HydrophobicContact CG-CE2 4.01Å
10	D	40.7	Very low	45.9	Very low	112 Å²	112	109.4 Å²	109.4	60%	0.599	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-56.4	140.6	-177	-122.2	-41.8	0	0	0	111	L12 S13 Y14	D10-L12 PolarHBondContact O-N 2.81Å; D10-S13 WeakPolarHBondContact O-CA 3.25Å; D10-S13 VanDerWaalsContact O-CB 3.25Å; D10-S13 WeakPolarHBondContact O-CB 3.36Å; D10-S13 PolarHBondContact O-N 2.78Å; D10-Y14 PolarHBondContact O-N 3.38Å
11	P	41.9	Very low	47	Very low	101 Å²	101	105.4 Å²	105.4	66%	0.656	57%	0.57	S	S	*	*	H	α-helix	trans	-57.2	-25	178.3	-27.2	36.3	0	0	0	113.8	H15	P11-H15 PolarHBondContact O-N 2.91Å
12	L	46.1	Very low	48.4	Very low	120 Å²	120	100.1 Å²	100.1	63%	0.628	54%	0.54	S	S	*	.	H	α-helix	trans	-69.6	-37	172.3	-66.9	170.8	0	0	0	112.5	D10 H15 N16	D10-L12 PolarHBondContact O-N 2.81Å; L12-H15 PolarHBondContact O-N 2.96Å; L12-N16 VanDerWaalsContact O-CG 3.29Å; L12-N16 PolarHBondContact O-N 3.33Å; L12-N16 PolarHBondContact O-OD1 3.14Å
13	S	49.3	Very low	50.6	Low	45 Å²	45	93.8 Å²	93.8	32%	0.315	51%	0.508	S	S	.	.	H	α-helix	trans	-61.1	-49	176.2	-175.5	0	0	0	0	110.7	D10 H15 N16 Q17	D10-S13 WeakPolarHBondContact O-CA 3.25Å; D10-S13 VanDerWaalsContact O-CB 3.25Å; D10-S13 WeakPolarHBondContact O-CB 3.36Å; D10-S13 PolarHBondContact O-N 2.78Å; S13-H15 VanDerWaalsContact C-N 3.31Å; S13-H15 PolarHBondContact O-N 3.14Å; S13-N16 PolarHBondContact O-N 3.37Å; S13-Q17 WeakPolarHBondContact O-CB 3.32Å; S13-Q17 PolarHBondContact O-N 3.19Å
14	Y	53.4	Low	52.3	Low	135 Å²	135	85.7 Å²	85.7	53%	0.529	47%	0.466	S	S	.	.	H	α-helix	trans	-59.3	-38.2	174.2	-77.2	-72.1	0	0	0	113.2	P9 D10 A18	P9-Y14 HydrophobicContact CB-CD2 4.26Å; P9-Y14 HydrophobicContact CB-CE2 3.68Å; P9-Y14 HydrophobicContact CG-CE2 4.01Å; D10-Y14 PolarHBondContact O-N 3.38Å; Y14-A18 WeakPolarHBondContact O-CB 3.4Å; Y14-A18 PolarHBondContact O-N 3.3Å
15	H	53.1	Low	54.3	Low	114 Å²	114	84.7 Å²	84.7	53%	0.528	45%	0.451	S	S	.	.	H	α-helix	trans	-66.9	-43.2	177.3	-167.3	77.4	0	0	0	111.9	P11 L12 S13 A18 L19	P11-H15 PolarHBondContact O-N 2.91Å; L12-H15 PolarHBondContact O-N 2.96Å; S13-H15 VanDerWaalsContact C-N 3.31Å; S13-H15 PolarHBondContact O-N 3.14Å; H15-A18 PolarHBondContact O-N 2.98Å; H15-L19 WeakPolarHBondContact O-CG 3.49Å; H15-L19 PolarHBondContact O-N 2.91Å
16	N	54.7	Low	56.4	Low	44 Å²	44	83 Å²	83	24%	0.235	44%	0.437	C	S	.	.	H	α-helix	trans	-71	-38.9	-180	-65.4	-0.4	0	0	0	111.3	L12 S13 A18 L19 L20 E474	L12-N16 VanDerWaalsContact O-CG 3.29Å; L12-N16 PolarHBondContact O-N 3.33Å; L12-N16 PolarHBondContact O-OD1 3.14Å; S13-N16 PolarHBondContact O-N 3.37Å; N16-A18 VanDerWaalsContact C-N 3.29Å; N16-A18 PolarHBondContact O-N 2.91Å; N16-L19 PolarHBondContact O-N 2.99Å; N16-L20 WeakPolarHBondContact O-CB 3.27Å; N16-L20 PolarHBondContact O-N 3.29Å; N16-E474 PolarHBondContact ND2-OE2 3.15Å
17	Q	59.4	Low	58.2	Low	58 Å²	58	77 Å²	77	27%	0.271	40%	0.403	S	S	.	.	H	α-helix	trans	-56.2	-42.2	167.5	-101.4	-176.4	-7.8	0	0	111.7	S13 L19 S21	S13-Q17 WeakPolarHBondContact O-CB 3.32Å; S13-Q17 PolarHBondContact O-N 3.19Å; Q17-L19 VanDerWaalsContact C-N 3.34Å; Q17-L19 PolarHBondContact O-N 3.35Å; Q17-S21 WeakPolarHBondContact O-CA 3.36Å; Q17-S21 WeakPolarHBondContact O-CB 3.46Å; Q17-S21 PolarHBondContact O-N 2.88Å
18	A	59	Low	60.1	Low	43 Å²	43	71.8 Å²	71.8	36%	0.355	37%	0.368	S	S	.	.	H	α-helix	trans	-73.8	-18.9	178.9	0	0	0	0	0	114.6	Y14 H15 N16 K22	Y14-A18 WeakPolarHBondContact O-CB 3.4Å; Y14-A18 PolarHBondContact O-N 3.3Å; H15-A18 PolarHBondContact O-N 2.98Å; N16-A18 VanDerWaalsContact C-N 3.29Å; N16-A18 PolarHBondContact O-N 2.91Å; A18-K22 WeakPolarHBondContact O-CD 3.23Å; A18-K22 WeakPolarHBondContact O-CE 3.45Å; A18-K22 WeakPolarHBondContact O-CG 3.22Å
19	L	60.3	Low	61.7	Low	62 Å²	62	66.5 Å²	66.5	33%	0.325	34%	0.343	S	S	.	.	H	α-helix	trans	-85.4	-48.2	171.6	-72.9	175.2	0	0	0	111.4	H15 N16 Q17 S21 K22 S23	H15-L19 WeakPolarHBondContact O-CG 3.49Å; H15-L19 PolarHBondContact O-N 2.91Å; N16-L19 PolarHBondContact O-N 2.99Å; Q17-L19 VanDerWaalsContact C-N 3.34Å; Q17-L19 PolarHBondContact O-N 3.35Å; L19-S21 VanDerWaalsContact C-N 3.26Å; L19-S21 PolarHBondContact O-N 2.85Å; L19-K22 PolarHBondContact O-N 3.46Å; L19-K22 VanDerWaalsContact O-N 3.13Å; L19-S23 PolarHBondContact O-N 2.66Å; L19-S23 VanDerWaalsContact O-N 3.07Å
20	L	65.6	Low	62.3	Low	0 Å²	0	69.9 Å²	69.9	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-59.2	-39.4	173.5	177.7	58.2	0	0	0	111.6	N16 K22 S23 L24 Q321 L468 E471 M472 A475	N16-L20 WeakPolarHBondContact O-CB 3.27Å; N16-L20 PolarHBondContact O-N 3.29Å; L20-K22 PolarHBondContact O-N 3.08Å; L20-S23 WeakPolarHBondContact O-CB 3.43Å; L20-S23 PolarHBondContact O-N 2.77Å; L20-S23 VanDerWaalsContact O-N 3.17Å; L20-L24 HydrophobicContact CD1-CD1 3.95Å; L20-L24 HydrophobicContact CD1-CD2 4.38Å; L20-L24 HydrophobicContact CD1-CG 3.82Å; L20-L24 HydrophobicContact CD2-CD1 4.43Å; L20-L24 HydrophobicContact CG-CD1 3.95Å; L20-L24 HydrophobicContact CG-CG 4.23Å; L20-L24 WeakPolarHBondContact O-CG 3.5Å; L20-L24 PolarHBondContact O-N 3.4Å; L20-Q321 HydrophobicContact CD2-CG 3.74Å; L20-L468 HydrophobicContact CD1-CD1 4.34Å; L20-E471 HydrophobicContact CB-CB 3.95Å; L20-E471 HydrophobicContact CB-CG 4.47Å; L20-E471 HydrophobicContact CD1-CB 3.57Å; L20-E471 WeakPolarHBondContact CD2-O 3.45Å; L20-E471 HydrophobicContact CG-CB 4.19Å; L20-M472 HydrophobicContact CD1-CG 4.1Å; L20-M472 HydrophobicContact CD1-SD 3.55Å; L20-M472 VanDerWaalsContact CD1-SD 3.55Å; L20-M472 HydrophobicContact CD2-SD 4.03Å; L20-M472 HydrophobicContact CG-SD 4.37Å; L20-A475 HydrophobicContact CD2-CB 3.36Å
21	S	68.5	Low	62.5	Low	26 Å²	26	73.1 Å²	73.1	18%	0.182	38%	0.379	C	S	.	.	H	α-helix	trans	-49.5	-57.6	171.8	169.5	0	0	0	0	109.9	Q17 L19 S23 L24 E25 M317	Q17-S21 WeakPolarHBondContact O-CA 3.36Å; Q17-S21 WeakPolarHBondContact O-CB 3.46Å; Q17-S21 PolarHBondContact O-N 2.88Å; L19-S21 VanDerWaalsContact C-N 3.26Å; L19-S21 PolarHBondContact O-N 2.85Å; S21-S23 VanDerWaalsContact C-N 3.28Å; S21-S23 PolarHBondContact O-N 3.42Å; S21-L24 CarbonylContact O-C 3.59Å; S21-L24 PolarHBondContact O-N 2.59Å; S21-E25 WeakPolarHBondContact O-CB 3.32Å; S21-E25 VanDerWaalsContact O-CG 3.24Å; S21-E25 WeakPolarHBondContact O-CG 3.38Å; S21-E25 PolarHBondContact O-N 2.86Å; S21-M317 WeakPolarHBondContact OG-CE 3.28Å
22	K	72.6	Confident	62.9	Low	127 Å²	127	69.2 Å²	69.2	55%	0.552	36%	0.356	S	S	*	.	H	α-helix	trans	-61.7	-32.1	-180	-67.2	163.5	-171.3	161.9	0	113.7	A18 L19 L20 R26	A18-K22 WeakPolarHBondContact O-CD 3.23Å; A18-K22 WeakPolarHBondContact O-CE 3.45Å; A18-K22 WeakPolarHBondContact O-CG 3.22Å; L19-K22 PolarHBondContact O-N 3.46Å; L19-K22 VanDerWaalsContact O-N 3.13Å; L20-K22 PolarHBondContact O-N 3.08Å; K22-R26 WeakPolarHBondContact O-CB 3.11Å; K22-R26 PolarHBondContact O-N 2.97Å
23	S	73.6	Confident	62.8	Low	21 Å²	21	67 Å²	67	15%	0.147	35%	0.347	C	S	.	.	H	α-helix	trans	-65.9	-49.9	172	-74.2	0	0	0	0	111.2	L19 L20 S21 R26 F27 E471	L19-S23 PolarHBondContact O-N 2.66Å; L19-S23 VanDerWaalsContact O-N 3.07Å; L20-S23 WeakPolarHBondContact O-CB 3.43Å; L20-S23 PolarHBondContact O-N 2.77Å; L20-S23 VanDerWaalsContact O-N 3.17Å; S21-S23 VanDerWaalsContact C-N 3.28Å; S21-S23 PolarHBondContact O-N 3.42Å; S23-R26 WeakPolarHBondContact O-CB 3.4Å; S23-R26 PolarHBondContact O-N 3.37Å; S23-F27 WeakPolarHBondContact O-CD2 3.37Å; S23-F27 PolarHBondContact O-N 3.48Å; S23-E471 WeakPolarHBondContact CB-OE2 3.35Å; S23-E471 PolarHBondContact OG-OE2 3.15Å
24	L	75.3	Confident	62.5	Low	0 Å²	0	70.6 Å²	70.6	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-70.7	-43	-179.9	-65	175.3	0	0	0	112.4	L20 S21 R26 F27 L28 I299 M317 Q321 L468 M472	L20-L24 HydrophobicContact CD1-CD1 3.95Å; L20-L24 HydrophobicContact CD1-CD2 4.38Å; L20-L24 HydrophobicContact CD1-CG 3.82Å; L20-L24 HydrophobicContact CD2-CD1 4.43Å; L20-L24 HydrophobicContact CG-CD1 3.95Å; L20-L24 HydrophobicContact CG-CG 4.23Å; L20-L24 WeakPolarHBondContact O-CG 3.5Å; L20-L24 PolarHBondContact O-N 3.4Å; S21-L24 CarbonylContact O-C 3.59Å; S21-L24 PolarHBondContact O-N 2.59Å; L24-R26 PolarHBondContact O-N 3.47Å; L24-F27 PolarHBondContact O-N 3.41Å; L24-L28 HydrophobicContact CB-CD1 4.31Å; L24-L28 VanDerWaalsContact O-CB 3.29Å; L24-L28 WeakPolarHBondContact O-CB 3.48Å; L24-L28 WeakPolarHBondContact O-CG 3.42Å; L24-L28 PolarHBondContact O-N 3.05Å; L24-I299 HydrophobicContact CD2-CD1 3.61Å; L24-I299 HydrophobicContact CD2-CG1 4.15Å; L24-M317 HydrophobicContact CB-CG 3.65Å; L24-M317 HydrophobicContact CB-SD 3.65Å; L24-M317 HydrophobicContact CD1-CB 3.95Å; L24-M317 HydrophobicContact CD1-CG 4Å; L24-M317 HydrophobicContact CG-CG 4.49Å; L24-Q321 HydrophobicContact CD1-CG 3.87Å; L24-L468 HydrophobicContact CD2-CD1 4.36Å; L24-M472 HydrophobicContact CD1-SD 4.19Å; L24-M472 HydrophobicContact CD2-SD 4.06Å
25	E	76.2	Confident	61.9	Low	77 Å²	77	71.6 Å²	71.6	36%	0.36	37%	0.372	S	S	.	.	H	α-helix	trans	-49	-43.6	171.2	-75.4	179.7	154.6	0	0	110.7	S21 L28 S29 L313 M317	S21-E25 WeakPolarHBondContact O-CB 3.32Å; S21-E25 VanDerWaalsContact O-CG 3.24Å; S21-E25 WeakPolarHBondContact O-CG 3.38Å; S21-E25 PolarHBondContact O-N 2.86Å; E25-L28 PolarHBondContact O-N 3.47Å; E25-S29 VanDerWaalsContact O-CB 3.23Å; E25-S29 WeakPolarHBondContact O-CB 3.34Å; E25-S29 PolarHBondContact O-N 3.37Å; E25-S29 PolarHBondContact O-OG 2.96Å; E25-L313 HydrophobicContact CB-CD2 4.44Å; E25-L313 HydrophobicContact CG-CD2 3.98Å; E25-L313 HydrophobicContact CG-CG 4.42Å; E25-M317 HydrophobicContact CB-SD 4.48Å; E25-M317 HydrophobicContact CG-CE 4.27Å; E25-M317 HydrophobicContact CG-SD 3.78Å
26	R	77.8	Confident	61.6	Low	154 Å²	154	68.5 Å²	68.5	58%	0.581	36%	0.361	S	S	*	.	H	α-helix	trans	-66	-40.7	179.4	-168.9	-175.8	-162.4	-173.7	8.5	112.9	K22 S23 L24	K22-R26 WeakPolarHBondContact O-CB 3.11Å; K22-R26 PolarHBondContact O-N 2.97Å; S23-R26 WeakPolarHBondContact O-CB 3.4Å; S23-R26 PolarHBondContact O-N 3.37Å; L24-R26 PolarHBondContact O-N 3.47Å
27	F	76.9	Confident	61	Low	38 Å²	38	67.2 Å²	67.2	17%	0.167	36%	0.356	C	S	.	.	H	α-helix	trans	-75.5	-35.7	176.6	-70.8	-65	0	0	0	112.4	S23 L24 A32 V296 I299 K303 L468	S23-F27 WeakPolarHBondContact O-CD2 3.37Å; S23-F27 PolarHBondContact O-N 3.48Å; L24-F27 PolarHBondContact O-N 3.41Å; F27-A32 WeakPolarHBondContact O-CB 3.44Å; F27-V296 HydrophobicContact CD1-CG1 4.5Å; F27-V296 HydrophobicContact CE1-CG1 4.01Å; F27-V296 HydrophobicContact CE1-CG2 4.22Å; F27-V296 HydrophobicContact CZ-CG2 3.98Å; F27-I299 HydrophobicContact CB-CG2 3.62Å; F27-I299 HydrophobicContact CD2-CD1 4.28Å; F27-K303 WeakPolarHBondContact O-CE 3.43Å; F27-K303 PolarHBondContact O-NZ 2.83Å; F27-L468 HydrophobicContact CE2-CD1 4.38Å; F27-L468 HydrophobicContact CE2-CD2 4.01Å; F27-L468 HydrophobicContact CZ-CD2 4.5Å
28	L	78.1	Confident	60.3	Low	10 Å²	10	70.1 Å²	70.1	5%	0.052	37%	0.369	C	S	.	.	H	α-helix	trans	-80.7	-29.5	-176.3	-71.3	171.2	0	0	0	113.3	L24 E25 I299 K303 F308 L313 Q316 M317 L320	L24-L28 HydrophobicContact CB-CD1 4.31Å; L24-L28 VanDerWaalsContact O-CB 3.29Å; L24-L28 WeakPolarHBondContact O-CB 3.48Å; L24-L28 WeakPolarHBondContact O-CG 3.42Å; L24-L28 PolarHBondContact O-N 3.05Å; E25-L28 PolarHBondContact O-N 3.47Å; L28-I299 HydrophobicContact CD2-CG2 3.88Å; L28-I299 HydrophobicContact CG-CG2 4.07Å; L28-K303 VanDerWaalsContact CA-CE 3.49Å; L28-K303 HydrophobicContact CD2-CG 4.45Å; L28-K303 WeakPolarHBondContact O-CE 2.98Å; L28-K303 PolarHBondContact O-NZ 3.18Å; L28-F308 HydrophobicContact CD2-CE1 4.21Å; L28-L313 HydrophobicContact CB-CD1 3.61Å; L28-L313 HydrophobicContact CD1-CD1 3.8Å; L28-L313 HydrophobicContact CG-CD1 4.37Å; L28-Q316 HydrophobicContact CD1-CB 4Å; L28-M317 HydrophobicContact CD1-CG 3.38Å; L28-M317 HydrophobicContact CD1-SD 4.24Å; L28-L320 HydrophobicContact CD1-CD1 4.15Å; L28-L320 HydrophobicContact CD2-CD1 4.02Å; L28-L320 HydrophobicContact CG-CD1 4.48Å
29	S	72.1	Confident	59.5	Low	45 Å²	45	74 Å²	74	32%	0.315	38%	0.378	S	S	.	.	S	Bend	trans	-45.2	143.8	-179.5	-79.2	0	0	0	0	114.2	E25 M31 A32 K303	E25-S29 VanDerWaalsContact O-CB 3.23Å; E25-S29 WeakPolarHBondContact O-CB 3.34Å; E25-S29 PolarHBondContact O-N 3.37Å; E25-S29 PolarHBondContact O-OG 2.96Å; S29-M31 PolarHBondContact O-N 3.11Å; S29-M31 VanDerWaalsContact O-N 3.14Å; S29-A32 WeakPolarHBondContact O-CB 3.24Å; S29-A32 PolarHBondContact O-N 2.74Å; S29-K303 PolarHBondContact O-NZ 3.02Å; S29-K303 VanDerWaalsContact O-NZ 3.15Å
30	P	53.3	Low	59	Low	135 Å²	135	77 Å²	77	88%	0.877	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-23.3	-179.4	-26.8	35.6	0	0	0	115.5	A32	P30-A32 VanDerWaalsContact C-N 3.31Å
31	M	46.3	Very low	58.1	Low	180 Å²	180	78.9 Å²	78.9	89%	0.887	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-10.6	175.2	-70.6	-171.5	175.4	0	0	113.9	S29 T33	S29-M31 PolarHBondContact O-N 3.11Å; S29-M31 VanDerWaalsContact O-N 3.14Å; M31-T33 PolarHBondContact O-N 2.74Å
32	A	48.4	Very low	56.9	Low	20 Å²	20	81.9 Å²	81.9	17%	0.165	41%	0.408	C	S	.	.			trans	-83.1	92.5	175	0	0	0	0	0	110.3	F27 S29 P30 T36 K303	F27-A32 WeakPolarHBondContact O-CB 3.44Å; S29-A32 WeakPolarHBondContact O-CB 3.24Å; S29-A32 PolarHBondContact O-N 2.74Å; P30-A32 VanDerWaalsContact C-N 3.31Å; A32-T36 WeakPolarHBondContact CA-OG1 3.46Å; A32-K303 PolarHBondContact O-NZ 3.47Å
33	T	44.5	Very low	55.6	Low	72 Å²	72	79.4 Å²	79.4	44%	0.442	40%	0.401	S	S	.	.			trans	-71.5	164.3	168.9	67.8	0	0	0	0	111.2	M31 E35 T36 S37	M31-T33 PolarHBondContact O-N 2.74Å; T33-E35 PolarHBondContact O-N 3.35Å; T33-E35 PolarHBondContact OG1-N 2.97Å; T33-T36 PolarHBondContact N-OG1 2.87Å; T33-T36 PolarHBondContact O-N 3.24Å; T33-T36 PolarHBondContact O-OG1 3.19Å; T33-T36 PolarHBondContact OG1-N 3.05Å; T33-T36 PolarHBondContact OG1-OG1 3.39Å; T33-S37 PolarHBondContact O-N 2.76Å
34	L	43.8	Very low	54.6	Low	122 Å²	122	82.3 Å²	82.3	64%	0.639	41%	0.409	S	S	*	.	H	α-helix	trans	-58.8	-33.6	173.6	-145.1	78.9	0	0	0	111.9	T36 S37 H38	L34-T36 VanDerWaalsContact C-N 3.35Å; L34-T36 PolarHBondContact O-N 3.28Å; L34-S37 PolarHBondContact O-N 3.32Å; L34-H38 WeakPolarHBondContact O-CB 3.23Å; L34-H38 PolarHBondContact O-N 3.38Å
35	E	39.8	Very low	53	Low	155 Å²	155	87.7 Å²	87.7	72%	0.724	44%	0.435	S	S	*	.	H	α-helix	trans	-61.2	-39.9	173.8	-62.4	179.3	129.8	0	0	111.8	T33 H38 F39	T33-E35 PolarHBondContact O-N 3.35Å; T33-E35 PolarHBondContact OG1-N 2.97Å; E35-H38 PolarHBondContact O-N 3.06Å; E35-F39 WeakPolarHBondContact O-CB 3.17Å; E35-F39 PolarHBondContact O-N 2.82Å
36	T	47.5	Very low	51.1	Low	49 Å²	49	86 Å²	86	30%	0.301	44%	0.435	S	S	.	.	H	α-helix	trans	-60.7	-45.5	173.7	11.9	0	0	0	0	112.1	A32 T33 L34 H38 F39 W40	A32-T36 WeakPolarHBondContact CA-OG1 3.46Å; T33-T36 PolarHBondContact N-OG1 2.87Å; T33-T36 PolarHBondContact O-N 3.24Å; T33-T36 PolarHBondContact O-OG1 3.19Å; T33-T36 PolarHBondContact OG1-N 3.05Å; T33-T36 PolarHBondContact OG1-OG1 3.39Å; L34-T36 VanDerWaalsContact C-N 3.35Å; L34-T36 PolarHBondContact O-N 3.28Å; T36-H38 VanDerWaalsContact C-N 3.34Å; T36-H38 PolarHBondContact O-N 3.42Å; T36-F39 PolarHBondContact O-N 3.05Å; T36-W40 WeakPolarHBondContact O-CB 3.38Å; T36-W40 VanDerWaalsContact O-CD1 3.23Å; T36-W40 PolarHBondContact O-N 2.91Å
37	S	42.1	Very low	49.3	Very low	18 Å²	18	80.7 Å²	80.7	13%	0.126	42%	0.423	C	S	.	.	H	α-helix	trans	-63.3	-41.1	178	-60.5	0	0	0	0	111.9	T33 L34 W40 L41	T33-S37 PolarHBondContact O-N 2.76Å; L34-S37 PolarHBondContact O-N 3.32Å; S37-W40 PolarHBondContact O-N 3.23Å; S37-L41 WeakPolarHBondContact O-CG 3.43Å; S37-L41 PolarHBondContact O-N 2.84Å
38	H	45.3	Very low	47.5	Very low	118 Å²	118	84.7 Å²	84.7	55%	0.546	45%	0.447	S	S	.	.	H	α-helix	trans	-68.2	-37	176.1	-165.9	-105.3	0	0	0	112.5	L34 E35 T36 L41 L42	L34-H38 WeakPolarHBondContact O-CB 3.23Å; L34-H38 PolarHBondContact O-N 3.38Å; E35-H38 PolarHBondContact O-N 3.06Å; T36-H38 VanDerWaalsContact C-N 3.34Å; T36-H38 PolarHBondContact O-N 3.42Å; H38-L41 PolarHBondContact O-N 3.02Å; H38-L42 WeakPolarHBondContact O-CB 3.24Å; H38-L42 WeakPolarHBondContact O-CG 3.35Å; H38-L42 PolarHBondContact O-N 3.16Å
39	F	42.7	Very low	45.3	Very low	124 Å²	124	92.5 Å²	92.5	54%	0.544	48%	0.483	S	S	.	.	H	α-helix	trans	-70.7	-30.7	174.6	-171.7	-115.3	0	0	0	111.9	E35 T36 N43	E35-F39 WeakPolarHBondContact O-CB 3.17Å; E35-F39 PolarHBondContact O-N 2.82Å; T36-F39 PolarHBondContact O-N 3.05Å; F39-N43 WeakPolarHBondContact CD1-ND2 3.29Å; F39-N43 WeakPolarHBondContact CE1-ND2 3.32Å; F39-N43 WeakPolarHBondContact CE2-ND2 3.14Å; F39-N43 WeakPolarHBondContact CG-ND2 3.06Å; F39-N43 WeakPolarHBondContact CZ-ND2 3.4Å; F39-N43 VanDerWaalsContact O-CB 3.29Å; F39-N43 WeakPolarHBondContact O-CB 3.12Å; F39-N43 PolarHBondContact O-N 3.29Å; F39-N43 PolarHBondContact O-ND2 3.48Å
40	W	49	Very low	43.5	Very low	127 Å²	127	99.2 Å²	99.2	48%	0.481	50%	0.501	S	S	.	.	H	α-helix	trans	-68.1	-42.1	169.5	-91.3	94.4	0	0	0	112	T36 S37 R44	T36-W40 WeakPolarHBondContact O-CB 3.38Å; T36-W40 VanDerWaalsContact O-CD1 3.23Å; T36-W40 PolarHBondContact O-N 2.91Å; S37-W40 PolarHBondContact O-N 3.23Å; W40-R44 WeakPolarHBondContact O-CB 3.13Å; W40-R44 PolarHBondContact O-N 2.86Å
41	L	47	Very low	42.3	Very low	38 Å²	38	100.6 Å²	100.6	20%	0.199	50%	0.496	C	S	.	.	H	α-helix	trans	-60.8	-48.5	172.2	-73.1	162.4	0	0	0	111.6	S37 H38 R44 M45 R293	S37-L41 WeakPolarHBondContact O-CG 3.43Å; S37-L41 PolarHBondContact O-N 2.84Å; H38-L41 PolarHBondContact O-N 3.02Å; L41-R44 PolarHBondContact O-N 3.43Å; L41-M45 PolarHBondContact O-N 3.45Å; L41-M45 VanDerWaalsContact O-N 3.09Å; L41-R293 HydrophobicContact CD2-CB 4.1Å; L41-R293 HydrophobicContact CD2-CG 3.74Å
42	L	43.4	Very low	41.5	Very low	89 Å²	89	100.2 Å²	100.2	47%	0.466	50%	0.497	S	S	.	.	H	α-helix	trans	-62.8	-46.9	178.6	-77.1	166.3	0	0	0	113.3	H38 R44 M45 A46	H38-L42 WeakPolarHBondContact O-CB 3.24Å; H38-L42 WeakPolarHBondContact O-CG 3.35Å; H38-L42 PolarHBondContact O-N 3.16Å; L42-R44 PolarHBondContact O-N 3.25Å; L42-M45 PolarHBondContact O-N 2.81Å; L42-A46 WeakPolarHBondContact O-CB 3.37Å; L42-A46 PolarHBondContact O-N 3.46Å
43	N	45.1	Very low	40.8	Very low	76 Å²	76	105.3 Å²	105.3	41%	0.406	53%	0.528	S	S	.	.	H	α-helix	trans	-65.2	-27.5	179.1	-79.4	-56.2	0	0	0	112.7	F39 A46 A47	F39-N43 WeakPolarHBondContact CD1-ND2 3.29Å; F39-N43 WeakPolarHBondContact CE1-ND2 3.32Å; F39-N43 WeakPolarHBondContact CE2-ND2 3.14Å; F39-N43 WeakPolarHBondContact CG-ND2 3.06Å; F39-N43 WeakPolarHBondContact CZ-ND2 3.4Å; F39-N43 VanDerWaalsContact O-CB 3.29Å; F39-N43 WeakPolarHBondContact O-CB 3.12Å; F39-N43 PolarHBondContact O-N 3.29Å; F39-N43 PolarHBondContact O-ND2 3.48Å; N43-A46 CarbonylContact O-C 3.49Å; N43-A46 PolarHBondContact O-N 3.25Å; N43-A47 PolarHBondContact O-N 3.47Å
44	R	51.4	Low	39.9	Very low	81 Å²	81	107.7 Å²	107.7	31%	0.306	55%	0.548	S	S	.	.	H	α-helix	trans	-73.4	-46.2	175.5	-161.3	-178.4	-156.8	157.6	-2.2	111.4	W40 L41 L42 A46 A47 D292 H466	W40-R44 WeakPolarHBondContact O-CB 3.13Å; W40-R44 PolarHBondContact O-N 2.86Å; L41-R44 PolarHBondContact O-N 3.43Å; L42-R44 PolarHBondContact O-N 3.25Å; R44-A46 PolarHBondContact O-N 2.95Å; R44-A47 VanDerWaalsContact O-CB 3.26Å; R44-A47 WeakPolarHBondContact O-CB 3.42Å; R44-A47 PolarHBondContact O-N 3.05Å; R44-D292 IonicContact CZ-OD2 3.45Å; R44-D292 IonicContact NH1-OD2 3.19Å; R44-D292 PolarHBondContact NH1-OD2 3.17Å; R44-D292 IonicContact NH2-OD2 3.15Å; R44-D292 PolarHBondContact NH2-OD2 2.9Å; R44-H466 PolarHBondContact NE-CD2 2.91Å; R44-H466 PolarHBondContact NE-NE2 2.64Å; R44-H466 VanDerWaalsContact NH2-CB 3.26Å; R44-H466 PolarHBondContact NH2-CD2 3.26Å; R44-H466 PolarHBondContact NH2-NE2 2.81Å
45	M	41.9	Very low	39.3	Very low	113 Å²	113	107.6 Å²	107.6	56%	0.557	56%	0.557	S	S	*	*	H	α-helix	trans	-58.5	-28.8	170.2	-71.6	178.4	160.8	0	0	112.5	L41 L42 A47	L41-M45 PolarHBondContact O-N 3.45Å; L41-M45 VanDerWaalsContact O-N 3.09Å; L42-M45 PolarHBondContact O-N 2.81Å; M45-A47 VanDerWaalsContact C-N 3.34Å
46	A	37.6	Very low	38.7	Very low	43 Å²	43	106.1 Å²	106.1	36%	0.355	56%	0.563	S	S	.	*	H	α-helix	trans	-87.7	9.9	173.7	0	0	0	0	0	114.9	L42 N43 R44 R50	L42-A46 WeakPolarHBondContact O-CB 3.37Å; L42-A46 PolarHBondContact O-N 3.46Å; N43-A46 CarbonylContact O-C 3.49Å; N43-A46 PolarHBondContact O-N 3.25Å; R44-A46 PolarHBondContact O-N 2.95Å; A46-R50 PolarHBondContact O-NE 3.33Å; A46-R50 PolarHBondContact O-NH2 2.88Å
47	A	38.4	Very low	37.6	Very low	41 Å²	41	106.8 Å²	106.8	34%	0.339	58%	0.579	S	S	.	*	H	α-helix	trans	-98.4	-43.6	176.4	0	0	0	0	0	112.3	N43 R44 M45 E49 R50	N43-A47 PolarHBondContact O-N 3.47Å; R44-A47 VanDerWaalsContact O-CB 3.26Å; R44-A47 WeakPolarHBondContact O-CB 3.42Å; R44-A47 PolarHBondContact O-N 3.05Å; M45-A47 VanDerWaalsContact C-N 3.34Å; A47-E49 VanDerWaalsContact C-N 3.27Å; A47-E49 PolarHBondContact O-N 2.69Å; A47-R50 PolarHBondContact O-N 3.35Å
48	D	39.5	Very low	37	Very low	122 Å²	122	112 Å²	112	65%	0.652	62%	0.616	S	S	*	*	H	α-helix	trans	-64.3	-29.3	-176	-65	-50.7	0	0	0	113.3	R50	D48-R50 PolarHBondContact O-N 2.85Å
49	E	32.7	Very low	36.2	Very low	175 Å²	175	116.7 Å²	116.7	82%	0.818	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	-6	169.8	-83.4	-85.8	119.4	0	0	114.7	A47	A47-E49 VanDerWaalsContact C-N 3.27Å; A47-E49 PolarHBondContact O-N 2.69Å
50	R	33.4	Very low	35.6	Very low	186 Å²	186	117.9 Å²	117.9	70%	0.702	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.7	24.6	-170	-72	-174.4	-73.4	167.4	-3.5	116	A46 A47 D48	A46-R50 PolarHBondContact O-NE 3.33Å; A46-R50 PolarHBondContact O-NH2 2.88Å; A47-R50 PolarHBondContact O-N 3.35Å; D48-R50 PolarHBondContact O-N 2.85Å
51	H	29	Very low	34.6	Very low	163 Å²	163	120.2 Å²	120.2	76%	0.755	65%	0.654	S	S	*	*			trans	-118	67.7	175.9	-77.1	-5.7	0	0	0	114.8	P53	H51-P53 WeakPolarHBondContact O-CD 3.28Å
52	L	29.8	Very low	33.7	Very low	173 Å²	173	124 Å²	124	91%	0.906	68%	0.679	S	S	*	*			trans	-102.4	102.6	158.4	-84.9	168.2	0	0	0	110.4	S54	L52-S54 PolarHBondContact O-N 3.39Å
53	P	33.2	Very low	32.9	Very low	127 Å²	127	128.4 Å²	128.4	83%	0.825	70%	0.697	S	S	*	*			trans	-81.8	93.3	176	31.7	-32.8	0	0	0	111.3	H51	H51-P53 WeakPolarHBondContact O-CD 3.28Å
54	S	26.4	Very low	32.7	Very low	122 Å²	122	129.9 Å²	129.9	85%	0.853	71%	0.711	S	S	*	*			trans	-75.3	140.8	166.7	-170.8	0	0	0	0	111	L52	L52-S54 PolarHBondContact O-N 3.39Å
55	S	29.9	Very low	31.5	Very low	119 Å²	119	131.4 Å²	131.4	83%	0.832	73%	0.734	S	S	*	*			trans	-84.1	122	-178	179.8	0	0	0	0	112.7
56	C	26.4	Very low	31.1	Very low	125 Å²	125	131.3 Å²	131.3	85%	0.845	75%	0.745	S	S	*	*			trans	-166.6	149.6	131.1	-161	0	0	0	0	109.8
57	G	25.9	Very low	31.2	Very low	63 Å²	63	135.4 Å²	135.4	65%	0.649	77%	0.767	S	S	*	*			trans	-117.2	163.8	179.5	0	0	0	0	0	114.1
58	S	28.5	Very low	30.7	Very low	128 Å²	128	138.5 Å²	138.5	90%	0.895	79%	0.787	S	S	*	*			trans	-161.2	156.4	161.9	-84.1	0	0	0	0	111.6
59	Y	28.4	Very low	30.3	Very low	215 Å²	215	137.9 Å²	137.9	84%	0.843	79%	0.792	S	S	*	*			trans	-94.6	161.5	-161.7	-82.6	-104.6	0	0	0	115.4
60	I	31.6	Very low	30.3	Very low	150 Å²	150	135.6 Å²	135.6	77%	0.769	79%	0.789	S	S	*	*			trans	72.7	133.4	146.2	-77.3	161.9	0	0	0	115.3
61	K	27.3	Very low	30.2	Very low	175 Å²	175	133.1 Å²	133.1	76%	0.761	79%	0.789	S	S	*	*			cis	-163.8	155.8	24.3	-143.2	176.1	178.5	-178.5	0	113.2
62	T	27.9	Very low	30.1	Very low	119 Å²	119	132.1 Å²	132.1	73%	0.73	79%	0.789	S	S	*	*			trans	26.4	133.5	148.3	55.5	0	0	0	0	124.1
63	E	27.1	Very low	30	Very low	180 Å²	180	129.1 Å²	129.1	84%	0.841	78%	0.778	S	S	*	*			trans	-50.2	177.8	147.4	-67.3	-163	126.5	0	0	114.6
64	P	39.8	Very low	29.8	Very low	107 Å²	107	128.9 Å²	128.9	70%	0.695	77%	0.774	S	S	*	*			cis	-148	-175.2	19.3	46.4	-26.5	0	0	0	119.7
65	S	26.7	Very low	29.9	Very low	113 Å²	113	127.4 Å²	127.4	79%	0.79	76%	0.764	S	S	*	*			trans	79.8	125.9	147.2	-62.3	0	0	0	0	121.9
66	S	33.7	Very low	29.9	Very low	112 Å²	112	130 Å²	130	78%	0.783	76%	0.762	S	S	*	*			trans	-68.1	172.6	155.8	-42.5	0	0	0	0	112.1
67	P	39.5	Very low	30.1	Very low	128 Å²	128	132.4 Å²	132.4	83%	0.831	76%	0.761	S	S	*	*				-145.6	169	98.5	38.9	-23.7	0	0	0	117.2
68	S	28.4	Very low	30.6	Very low	106 Å²	106	135 Å²	135	74%	0.741	77%	0.769	S	S	*	*			trans	-63.8	167.7	-173.4	-43	0	0	0	0	119.1
69	S	31.4	Very low	31.5	Very low	110 Å²	110	134.3 Å²	134.3	77%	0.769	76%	0.761	S	S	*	*			trans	69.3	163.7	147.7	69.4	0	0	0	0	117.6
70	V	31.4	Very low	31.7	Very low	126 Å²	126	129.9 Å²	129.9	76%	0.764	76%	0.762	S	S	*	*			cis	-144.4	163.4	25.2	-105.8	0	0	0	0	115
71	I	31.7	Very low	31.6	Very low	135 Å²	135	126.1 Å²	126.1	69%	0.692	76%	0.76	S	S	*	*			trans	-31.5	149.3	162.5	47.7	170.4	0	0	0	119.1
72	D	26.4	Very low	31.9	Very low	141 Å²	141	124.5 Å²	124.5	75%	0.754	76%	0.76	S	S	*	*				178.8	178.6	105.5	-97.7	-33.3	0	0	0	112.5
73	T	28.3	Very low	32.4	Very low	110 Å²	110	123.2 Å²	123.2	68%	0.675	76%	0.756	S	S	*	*				-162.9	173.5	-66.1	-76.4	0	0	0	0	108.6
74	V	28.5	Very low	32.6	Very low	123 Å²	123	121.1 Å²	121.1	75%	0.745	75%	0.75	S	S	*	*			trans	89.8	87.7	164.7	-163.8	0	0	0	0	120.6
75	S	28.4	Very low	32.4	Very low	91 Å²	91	119.7 Å²	119.7	64%	0.636	75%	0.748	S	S	*	*				59.7	140.1	115.6	-46.1	0	0	0	0	126.6
76	H	30.6	Very low	32.6	Very low	173 Å²	173	120.2 Å²	120.2	80%	0.801	75%	0.751	S	S	*	*			trans	68.5	148.7	162.1	-51.1	-58.1	0	0	0	116.3
77	H	29.9	Very low	32.4	Very low	176 Å²	176	119 Å²	119	82%	0.815	76%	0.756	S	S	*	*			cis	-163.8	161.5	36.1	42.8	-78.8	0	0	0	111.8
78	S	36.4	Very low	31.9	Very low	117 Å²	117	116.5 Å²	116.5	82%	0.818	75%	0.754	S	S	*	*			trans	-106.6	158.6	170.1	-51.4	0	0	0	0	111
79	P	48.9	Very low	32.1	Very low	113 Å²	113	122.7 Å²	122.7	73%	0.734	76%	0.763	S	S	*	*				-150.5	145.9	110.1	36.9	-20	0	0	0	118
80	S	31.6	Very low	32	Very low	122 Å²	122	123.6 Å²	123.6	85%	0.853	76%	0.764	S	S	*	*			trans	31.4	138.5	132.3	-47.6	0	0	0	0	124.7
81	G	30.3	Very low	31.8	Very low	71 Å²	71	123.5 Å²	123.5	73%	0.732	77%	0.768	S	S	*	*			trans	143.7	135.6	143.2	0	0	0	0	0	114.7
82	N	33.7	Very low	31.6	Very low	141 Å²	141	122.5 Å²	122.5	75%	0.754	77%	0.769	S	S	*	*			cis	174.8	149.1	-17.5	-127.5	72.8	0	0	0	107
83	S	37.1	Very low	31.8	Very low	93 Å²	93	124.1 Å²	124.1	65%	0.65	77%	0.774	S	S	*	*			trans	64.1	169.5	153.5	-71.5	0	0	0	0	118
84	D	32.2	Very low	31.8	Very low	135 Å²	135	125.4 Å²	125.4	72%	0.722	78%	0.777	S	S	*	*			cis	-164.9	170.9	-34.4	-106.9	114	0	0	0	108
85	A	34.9	Very low	31.7	Very low	78 Å²	78	123.2 Å²	123.2	65%	0.645	77%	0.767	S	S	*	*			cis	-153.4	141.3	-1.2	0	0	0	0	0	112
86	S	32.2	Very low	31.6	Very low	123 Å²	123	126.9 Å²	126.9	86%	0.86	77%	0.774	S	S	*	*				27	134.3	123.9	-51.4	0	0	0	0	122.5
87	G	27.6	Very low	31.6	Very low	86 Å²	86	124.4 Å²	124.4	89%	0.887	78%	0.776	S	S	*	*			trans	166.2	117.1	159.7	0	0	0	0	0	114.7
88	G	29.2	Very low	31.6	Very low	77 Å²	77	124 Å²	124	79%	0.794	78%	0.78	S	S	*	*			trans	-157.6	169.6	176.2	0	0	0	0	0	112.6
89	Y	32.3	Very low	31.1	Very low	235 Å²	235	122.1 Å²	122.1	92%	0.922	78%	0.779	S	S	*	*			trans	-152.7	163.6	174.3	58.9	-93.5	0	0	0	112.8
90	V	30.1	Very low	30.2	Very low	130 Å²	130	124.5 Å²	124.5	79%	0.788	78%	0.784	S	S	*	*			trans	-130.9	146.8	-171.6	172	0	0	0	0	109.3
91	S	27.6	Very low	30	Very low	123 Å²	123	126 Å²	126	86%	0.86	78%	0.783	S	S	*	*			trans	-172.9	168.9	151	-107.9	0	0	0	0	113.1
92	T	28.3	Very low	30	Very low	115 Å²	115	127.8 Å²	127.8	71%	0.706	78%	0.784	S	S	*	*			trans	-139.9	167.1	-159.3	53	0	0	0	0	115.3
93	M	30	Very low	30.8	Very low	175 Å²	175	126.8 Å²	126.8	86%	0.862	79%	0.785	S	S	*	*			trans	73.3	163.5	168.7	-48	-159.3	174	0	0	115.8
94	N	27.5	Very low	31.4	Very low	137 Å²	137	127.5 Å²	127.5	73%	0.733	79%	0.788	S	S	*	*			cis	-155.8	158.9	16.5	-160.9	17.6	0	0	0	116
95	S	26.8	Very low	31.3	Very low	77 Å²	77	129 Å²	129	54%	0.538	79%	0.792	S	S	.	*			trans	53.3	127.5	149	-72.8	0	0	0	0	127.1
96	H	27.2	Very low	31.1	Very low	168 Å²	168	135.2 Å²	135.2	78%	0.778	81%	0.805	S	S	*	*			trans	55.8	130.5	130.6	-62.5	-60.9	0	0	0	125.1
97	S	30.7	Very low	31	Very low	121 Å²	121	135.2 Å²	135.2	85%	0.846	80%	0.8	S	S	*	*				-172.2	167.6	109.1	32	0	0	0	0	112.6
98	N	28.5	Very low	31.7	Very low	168 Å²	168	137 Å²	137	90%	0.898	80%	0.796	S	S	*	*			trans	-100.6	163	-167.7	-65.2	-22.2	0	0	0	113.8
99	G	26	Very low	31.7	Very low	77 Å²	77	137.3 Å²	137.3	79%	0.794	80%	0.799	S	S	*	*			trans	-175.5	117.2	163.3	0	0	0	0	0	113.4
100	L	30.8	Very low	31.4	Very low	162 Å²	162	130.1 Å²	130.1	85%	0.848	80%	0.797	S	S	*	*			trans	-98.2	155.3	168.3	-70	165.6	0	0	0	109.4
101	D	27.5	Very low	31.3	Very low	155 Å²	155	133 Å²	133	83%	0.829	81%	0.807	S	S	*	*				175.2	160.8	119	-89.7	-15.6	0	0	0	115.1
102	S	28.9	Very low	31.3	Very low	108 Å²	108	131.1 Å²	131.1	76%	0.755	81%	0.807	S	S	*	*			trans	-158.8	175.4	171.1	-69.9	0	0	0	0	105.6
103	P	52.1	Low	31.4	Very low	120 Å²	120	131 Å²	131	78%	0.779	82%	0.817	S	S	*	*			cis	-131.2	-132.4	11.5	36.3	-10.4	0	0	0	109
104	P	48.4	Very low	31.2	Very low	107 Å²	107	126.6 Å²	126.6	70%	0.695	82%	0.817	S	S	*	*			cis	-134.5	167.7	-20.1	32	-10.1	0	0	0	118.2
105	M	30.8	Very low	31.3	Very low	167 Å²	167	125.7 Å²	125.7	82%	0.823	82%	0.822	S	S	*	*			trans	14.1	138.6	143.8	-56.4	-61.8	-176.8	0	0	122
106	F	29.8	Very low	31.2	Very low	208 Å²	208	128.5 Å²	128.5	91%	0.912	84%	0.84	S	S	*	*				-165	150.9	111.7	-112.1	-75.4	0	0	0	113
107	T	30.5	Very low	31.3	Very low	123 Å²	123	131.8 Å²	131.8	76%	0.755	85%	0.846	S	S	*	*			trans	-120.8	-169.7	169.1	51.6	0	0	0	0	107.6
108	P	42.3	Very low	31.2	Very low	124 Å²	124	135.4 Å²	135.4	81%	0.805	85%	0.846	S	S	*	*			cis	-143.3	-177.6	6.2	45	-26	0	0	0	117.6
109	G	29.5	Very low	31.1	Very low	83 Å²	83	138.2 Å²	138.2	86%	0.856	84%	0.844	S	S	*	*			trans	100.8	144.3	140.8	0	0	0	0	0	118.5
110	G	27	Very low	31.2	Very low	85 Å²	85	145 Å²	145	88%	0.876	85%	0.847	S	S	*	*			trans	147.6	102.2	169.8	0	0	0	0	0	114.4
111	L	27.8	Very low	31.1	Very low	189 Å²	189	145.3 Å²	145.3	99%	0.99	85%	0.849	S	S	*	*			trans	-96.1	155.3	171.1	-70.2	160.5	0	0	0	110.4
112	G	27.6	Very low	31.1	Very low	84 Å²	84	145.6 Å²	145.6	87%	0.866	85%	0.851	S	S	*	*			trans	167	108.5	167.3	0	0	0	0	0	114.9
113	A	28.9	Very low	31.2	Very low	112 Å²	112	145.7 Å²	145.7	93%	0.926	85%	0.851	S	S	*	*			trans	-103.3	150.7	168.8	0	0	0	0	0	110.5
114	G	27	Very low	30.1	Very low	84 Å²	84	144.8 Å²	144.8	87%	0.866	85%	0.847	S	S	*	*			trans	-174.8	103.2	177.1	0	0	0	0	0	113.1
115	S	29	Very low	29.2	Very low	118 Å²	118	144.4 Å²	144.4	83%	0.825	85%	0.847	S	S	*	*			trans	-108.8	134.8	171.7	179.8	0	0	0	0	109.7
116	C	25.9	Very low	29.2	Very low	136 Å²	136	142.4 Å²	142.4	92%	0.919	84%	0.844	S	S	*	*			trans	-151.1	140.1	168.4	-120.9	0	0	0	0	112.2
117	R	28.8	Very low	29.4	Very low	237 Å²	237	139.4 Å²	139.4	89%	0.894	84%	0.836	S	S	*	*			trans	-116.1	139.1	179.4	-68.2	175.1	170.2	-179.9	-4.1	110.6
118	K	28.9	Very low	29.6	Very low	197 Å²	197	141.9 Å²	141.9	86%	0.857	84%	0.841	S	S	*	*			trans	174.1	155.8	155.6	-101.1	165.5	-178	-177.5	0	107.3
119	R	25.2	Very low	29	Very low	227 Å²	227	144.6 Å²	144.6	86%	0.857	84%	0.843	S	S	*	*			cis	-164.2	160.1	-31.6	-120.9	-170.6	-169.9	-174	2.2	104.7
120	Y	28.6	Very low	29.2	Very low	220 Å²	220	147.3 Å²	147.3	86%	0.863	84%	0.838	S	S	*	*			trans	-75	151.7	167.5	-90.1	-108.9	0	0	0	110.7
121	D	29.3	Very low	29.3	Very low	167 Å²	167	146.5 Å²	146.5	89%	0.893	82%	0.819	S	S	*	*			trans	-153.5	165.7	141	-87.5	-46.6	0	0	0	107.9
122	D	27.7	Very low	29.8	Very low	162 Å²	162	142.7 Å²	142.7	87%	0.866	81%	0.808	S	S	*	*			trans	-132.8	-178.3	-155	-169.9	19	0	0	0	113.7
123	C	30.9	Very low	30.5	Very low	110 Å²	110	145.9 Å²	145.9	74%	0.743	80%	0.804	S	S	*	*			trans	106.3	90.2	158.2	-153.5	0	0	0	0	119.5
124	S	28.3	Very low	30.6	Very low	101 Å²	101	146.7 Å²	146.7	71%	0.706	79%	0.787	S	S	*	*				56.3	136.5	117.3	-150.6	0	0	0	0	124.6
125	S	29.8	Very low	30.9	Very low	98 Å²	98	147.7 Å²	147.7	69%	0.685	78%	0.779	S	S	*	*				118.1	143.2	127.8	77.5	0	0	0	0	120.9
126	T	31.2	Very low	31	Very low	126 Å²	126	151.1 Å²	151.1	77%	0.773	78%	0.782	S	S	*	*			trans	62	127.7	172.2	57.4	0	0	0	0	117.5
127	I	34.2	Very low	31.6	Very low	145 Å²	145	150.9 Å²	150.9	74%	0.744	76%	0.763	S	S	*	*			cis	104.5	106.9	35.3	-74.2	171.1	0	0	0	112.1
128	M	33	Very low	31.8	Very low	175 Å²	175	145 Å²	145	86%	0.862	75%	0.747	S	S	*	*			trans	55.6	148.9	153.6	-65.2	169.3	177.6	0	0	118.9
129	E	31.2	Very low	32.2	Very low	180 Å²	180	142.3 Å²	142.3	84%	0.841	74%	0.741	S	S	*	*			cis	-153	170.4	10.7	-142.7	172.8	157.1	0	0	112.9
130	D	32	Very low	32.8	Very low	141 Å²	141	137 Å²	137	75%	0.754	73%	0.73	S	S	*	*			trans	69.8	167.3	156.3	-163.7	47.3	0	0	0	122.7
131	S	30.8	Very low	33.5	Very low	68 Å²	68	131.2 Å²	131.2	48%	0.476	72%	0.721	S	S	.	*			trans	83	55.9	157.4	-80.7	0	0	0	0	118.6	I133	S131-I133 PolarHBondContact O-N 3.01Å
132	S	38.5	Very low	34.4	Very low	109 Å²	109	129.9 Å²	129.9	76%	0.762	71%	0.713	S	S	*	*				40.5	-9.9	120.4	64.6	0	0	0	0	123.9
133	I	41.5	Very low	35.7	Very low	151 Å²	151	125.4 Å²	125.4	77%	0.774	69%	0.693	S	S	*	*			trans	-99.7	14	-170.5	-49.7	180	0	0	0	111.8	S131	S131-I133 PolarHBondContact O-N 3.01Å
134	K	31.5	Very low	37.4	Very low	129 Å²	129	125.5 Å²	125.5	56%	0.561	68%	0.681	S	S	*	*			trans	-115.8	16.2	-166.3	-64.1	-167.5	134.4	-172.6	0	115.9	E136 Y137	K134-E136 PolarHBondContact O-N 2.94Å; K134-Y137 HydrophobicContact CB-CD1 4.45Å; K134-Y137 HydrophobicContact CB-CE1 3.62Å; K134-Y137 HydrophobicContact CD-CE1 3.99Å; K134-Y137 WeakPolarHBondContact CD-OH 3.46Å; K134-Y137 VanDerWaalsContact CE-OH 3.28Å; K134-Y137 WeakPolarHBondContact CE-OH 3.2Å; K134-Y137 HydrophobicContact CG-CE1 3.79Å; K134-Y137 PolarHBondContact NZ-OH 3.2Å
135	C	33.2	Very low	40	Very low	105 Å²	105	127.7 Å²	127.7	71%	0.709	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-20.3	-171.9	-72.1	0	0	0	0	116.6
136	E	30.4	Very low	43	Very low	189 Å²	189	127.7 Å²	127.7	88%	0.883	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-27.9	-176.6	-78.5	-164.4	119	0	0	115.3	K134	K134-E136 PolarHBondContact O-N 2.94Å
137	Y	37.9	Very low	46.1	Very low	131 Å²	131	121.8 Å²	121.8	51%	0.514	63%	0.629	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.8	-19.4	-176.1	77.8	-98.7	0	0	0	114.3	K134 L139	K134-Y137 HydrophobicContact CB-CD1 4.45Å; K134-Y137 HydrophobicContact CB-CE1 3.62Å; K134-Y137 HydrophobicContact CD-CE1 3.99Å; K134-Y137 WeakPolarHBondContact CD-OH 3.46Å; K134-Y137 VanDerWaalsContact CE-OH 3.28Å; K134-Y137 WeakPolarHBondContact CE-OH 3.2Å; K134-Y137 HydrophobicContact CG-CE1 3.79Å; K134-Y137 PolarHBondContact NZ-OH 3.2Å; Y137-L139 VanDerWaalsContact C-N 3.31Å; Y137-L139 PolarHBondContact O-N 3.35Å
138	M	33	Very low	49	Very low	113 Å²	113	119.8 Å²	119.8	56%	0.557	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	2.3	-173.7	-72.6	-66.4	-77.6	0	0	115.2
139	L	37.6	Very low	51.9	Low	142 Å²	142	111.5 Å²	111.5	74%	0.743	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	1.8	177.4	-65.9	179.5	0	0	0	114.7	Y137	Y137-L139 VanDerWaalsContact C-N 3.31Å; Y137-L139 PolarHBondContact O-N 3.35Å
140	N	37.2	Very low	54.9	Low	115 Å²	115	103.2 Å²	103.2	62%	0.615	54%	0.541	S	S	*	.	S	Bend	trans	-97.5	-7.9	-177.3	-89.7	-48.5	0	0	0	115.7	K144	N140-K144 PolarHBondContact OD1-NZ 2.75Å
141	S	43.3	Very low	57.8	Low	98 Å²	98	98.9 Å²	98.9	69%	0.685	53%	0.529	S	S	*	.	S	Bend	trans	-90.3	-8.2	-175.3	52.8	0	0	0	0	115.2
142	L	48.5	Very low	60.8	Low	139 Å²	139	96.6 Å²	96.6	73%	0.728	51%	0.512	S	S	*	.	S	Bend	trans	-80	129.2	176.1	-159.5	73.9	0	0	0	110.4	K144	L142-K144 PolarHBondContact O-N 3.23Å
143	P	56.1	Low	63.4	Low	68 Å²	68	95.9 Å²	95.9	44%	0.442	50%	0.498	S	S	.	.			trans	-54.9	111.4	179	-28.7	36	0	0	0	112.3	R145 Y240	P143-R145 PolarHBondContact O-N 3.18Å; P143-Y240 HydrophobicContact CB-CE1 4.28Å; P143-Y240 HydrophobicContact CB-CE2 4.27Å
144	K	66.3	Low	65.9	Low	112 Å²	112	89.5 Å²	89.5	49%	0.487	47%	0.468	S	S	.	.			trans	-68.8	91.9	-176.6	-70.8	174.6	-177.3	169.4	0	109.5	N140 L142 L146	N140-K144 PolarHBondContact OD1-NZ 2.75Å; L142-K144 PolarHBondContact O-N 3.23Å; K144-L146 PolarHBondContact O-N 3.2Å
145	R	81.8	Confident	68.7	Low	148 Å²	148	86.6 Å²	86.6	56%	0.558	46%	0.464	S	S	*	.			trans	-49	131.5	-178.7	-62.8	-173.9	-176	-131.2	-2.7	110.2	P143 A154 Y157	P143-R145 PolarHBondContact O-N 3.18Å; R145-A154 HydrophobicContact CB-CB 4.34Å; R145-A154 VanDerWaalsContact O-CB 3.26Å; R145-A154 WeakPolarHBondContact O-CB 3.28Å; R145-A154 PolarHBondContact O-N 3.38Å; R145-Y157 PolarHBondContact NH1-OH 3.16Å
146	L	93.7	Very high	71.4	Confident	98 Å²	98	82.9 Å²	82.9	51%	0.513	44%	0.443	S	S	.	.	B	Isolated β-bridge	trans	-93.7	150.2	-179.1	-59.3	-177.5	0	0	0	111.4	K144 L148	K144-L146 PolarHBondContact O-N 3.2Å; L146-L148 PolarHBondContact O-N 2.94Å
147	C	96.1	Very high	74.2	Confident	1 Å²	1	81.1 Å²	81.1	1%	0.007	43%	0.43	C	S	.	.			trans	-75.5	112.1	176.5	174.3	0	0	0	0	110.1	V149 C150 G151 D152 A162 S163 C164	C147-V149 PolarHBondContact O-N 2.83Å; C147-C150 PolarHBondContact O-N 3.44Å; C147-C150 VanDerWaalsContact SG-SG 3.69Å; C147-G151 PolarHBondContact O-N 3.48Å; C147-D152 WeakPolarHBondContact CB-O 3.2Å; C147-D152 PolarHBondContact N-O 3.32Å; C147-A162 WeakPolarHBondContact CA-O 3.44Å; C147-S163 VanDerWaalsContact SG-CA 3.57Å; C147-C164 HydrophobicContact CB-CB 3.96Å; C147-C164 PolarHBondContact SG-N 3.32Å; C147-C164 VanDerWaalsContact SG-N 3.35Å; C147-C164 VanDerWaalsContact SG-SG 3.63Å
148	L	94.3	Very high	76.8	Confident	104 Å²	104	76.2 Å²	76.2	55%	0.545	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-16.5	-175.5	-56.3	-174.7	0	0	0	114.1	L146 V161 A162 V210	L146-L148 PolarHBondContact O-N 2.94Å; L148-V161 HydrophobicContact CB-CG1 4.2Å; L148-V161 HydrophobicContact CD1-CG1 3.95Å; L148-V161 HydrophobicContact CG-CG1 4.33Å; L148-A162 PolarHBondContact N-O 3.22Å; L148-A162 VanDerWaalsContact N-O 3.17Å; L148-V210 HydrophobicContact CB-CB 4.28Å; L148-V210 HydrophobicContact CB-CG1 4.24Å; L148-V210 HydrophobicContact CB-CG2 4.47Å
149	V	95.6	Very high	79.7	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.006	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-32.1	174.1	-177	0	0	0	0	113	C147 C167 I191 R203 K206 V210 M212	C147-V149 PolarHBondContact O-N 2.83Å; V149-C167 HydrophobicContact CB-CB 4.32Å; V149-C167 HydrophobicContact CG1-CB 4.4Å; V149-C167 HydrophobicContact CG2-CB 4.46Å; V149-I191 HydrophobicContact CG1-CG2 4.34Å; V149-I191 WeakPolarHBondContact O-CG2 3.09Å; V149-R203 HydrophobicContact CG1-CG 4.39Å; V149-K206 HydrophobicContact CG1-CG 4.25Å; V149-V210 HydrophobicContact CG2-CG2 3.65Å; V149-M212 HydrophobicContact CG2-SD 4.12Å
150	C	94.4	Very high	82.1	Confident	6 Å²	6	68.1 Å²	68.1	4%	0.041	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-154.5	4.5	-167.3	70.1	0	0	0	0	118.1	C147 D152 I191 T192 K193 R196	C147-C150 PolarHBondContact O-N 3.44Å; C147-C150 VanDerWaalsContact SG-SG 3.69Å; C150-D152 PolarHBondContact O-N 3.05Å; C150-I191 WeakPolarHBondContact CA-O 3.4Å; C150-I191 HydrophobicContact CB-CG2 4Å; C150-T192 CarbonylContact O-C 3.35Å; C150-T192 WeakPolarHBondContact O-CA 3.43Å; C150-K193 PolarHBondContact O-N 2.76Å; C150-R196 HydrophobicContact CB-CB 4.37Å; C150-R196 PolarHBondContact SG-NH1 2.96Å
151	G	91.8	Very high	84.6	Confident	49 Å²	49	63 Å²	63	51%	0.505	35%	0.352	S	S	.	.	S	Bend	trans	71.9	2.3	178.5	0	0	0	0	0	116.3	C147	C147-G151 PolarHBondContact O-N 3.48Å
152	D	94.7	Very high	87	Confident	20 Å²	20	58.9 Å²	58.9	11%	0.107	32%	0.324	C	S	.	.	S	Bend	trans	-73.7	160.9	170.9	-160.3	2.5	0	0	0	111.3	C147 C150 A154 C164 K193 R196	C147-D152 WeakPolarHBondContact CB-O 3.2Å; C147-D152 PolarHBondContact N-O 3.32Å; C150-D152 PolarHBondContact O-N 3.05Å; D152-A154 PolarHBondContact O-N 3.07Å; D152-C164 HydrophobicContact CB-CB 4.18Å; D152-K193 HydrophobicContact CB-CB 4.18Å; D152-K193 HydrophobicContact CB-CD 4.03Å; D152-K193 HydrophobicContact CB-CG 4.04Å; D152-K193 VanDerWaalsContact OD1-CD 3.29Å; D152-K193 WeakPolarHBondContact OD1-CD 3.43Å; D152-K193 WeakPolarHBondContact OD1-CE 3.39Å; D152-K193 IonicContact OD1-NZ 3.37Å; D152-K193 PolarHBondContact OD1-NZ 2.99Å; D152-K193 IonicContact OD2-NZ 3.4Å; D152-R196 VanDerWaalsContact CB-NH1 3.32Å; D152-R196 IonicContact OD2-CZ 4Å; D152-R196 IonicContact OD2-NH1 2.77Å; D152-R196 PolarHBondContact OD2-NH1 3.4Å; D152-R196 IonicContact OD2-NH2 2.66Å; D152-R196 PolarHBondContact OD2-NH2 3.37Å
153	I	92.3	Very high	89.3	Confident	95 Å²	95	52.3 Å²	52.3	49%	0.487	29%	0.289	S	S	.	.	B	Isolated β-bridge	trans	-62.5	128.3	-179.7	-58.6	173.5	0	0	0	109.6	C164	I153-C164 WeakPolarHBondContact O-CB 3.33Å
154	A	93.9	Very high	91.2	Very high	16 Å²	16	49.2 Å²	49.2	13%	0.132	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-80.1	136.1	176.9	0	0	0	0	0	111.1	R145 D152 G156 S163	R145-A154 HydrophobicContact CB-CB 4.34Å; R145-A154 VanDerWaalsContact O-CB 3.26Å; R145-A154 WeakPolarHBondContact O-CB 3.28Å; R145-A154 PolarHBondContact O-N 3.38Å; D152-A154 PolarHBondContact O-N 3.07Å; A154-G156 VanDerWaalsContact C-N 3.34Å; A154-S163 VanDerWaalsContact CA-O 3.32Å; A154-S163 WeakPolarHBondContact CA-O 3.19Å; A154-S163 WeakPolarHBondContact CB-O 3.43Å
155	S	91.3	Very high	92.6	Very high	68 Å²	68	48.2 Å²	48.2	48%	0.476	27%	0.266	S	S	.	.			trans	-86.2	-8.7	173.2	50.9	0	0	0	0	112.7	H158 S163 E165	S155-H158 PolarHBondContact OG-NE2 2.74Å; S155-S163 PolarHBondContact N-O 3.24Å; S155-S163 PolarHBondContact OG-O 2.95Å; S155-E165 WeakPolarHBondContact CB-OE1 3.38Å; S155-E165 PolarHBondContact OG-OE1 2.75Å
156	G	88.6	Confident	93.3	Very high	27 Å²	27	43.2 Å²	43.2	28%	0.278	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	156	-161.7	-179.5	0	0	0	0	0	111.7	A154 A162 S163	A154-G156 VanDerWaalsContact C-N 3.34Å; G156-A162 WeakPolarHBondContact O-CA 3.3Å; G156-S163 PolarHBondContact O-N 3.49Å
157	Y	90.6	Very high	93.5	Very high	152 Å²	152	38.5 Å²	38.5	60%	0.596	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	126	168.3	-72.2	-98.8	0	0	0	109.5	R145 G160 V161 A162	R145-Y157 PolarHBondContact NH1-OH 3.16Å; Y157-G160 WeakPolarHBondContact CD1-O 3.47Å; Y157-V161 WeakPolarHBondContact CA-O 3.44Å; Y157-A162 HydrophobicContact CD1-CB 4.4Å; Y157-A162 HydrophobicContact CE1-CB 4.12Å
158	H	92.8	Very high	93.5	Very high	28 Å²	28	41.1 Å²	41.1	13%	0.13	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	132.9	173.9	-50.1	-76.1	0	0	0	108.2	S155 G160 V161 S163 E165 K168 M212	S155-H158 PolarHBondContact OG-NE2 2.74Å; H158-G160 PolarHBondContact O-N 3.39Å; H158-V161 PolarHBondContact N-O 3.37Å; H158-V161 PolarHBondContact O-N 2.78Å; H158-S163 PolarHBondContact CD2-O 3.27Å; H158-S163 PolarHBondContact CD2-OG 3.2Å; H158-E165 IonicContact CE1-OE1 3.64Å; H158-E165 PolarHBondContact CE1-OE1 3.37Å; H158-E165 IonicContact NE2-OE1 2.78Å; H158-E165 PolarHBondContact NE2-OE1 3.1Å; H158-K168 HydrophobicContact CB-CB 4.01Å; H158-K168 HydrophobicContact CB-CD 4.36Å; H158-K168 HydrophobicContact CB-CG 3.86Å; H158-K168 PolarHBondContact CE1-NZ 2.91Å; H158-K168 WeakPolarHBondContact ND1-CD 3.42Å; H158-K168 WeakPolarHBondContact ND1-CE 3.28Å; H158-M212 WeakPolarHBondContact O-CE 3.43Å
159	Y	93.3	Very high	93.6	Very high	41 Å²	41	38.4 Å²	38.4	16%	0.161	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	38.3	-177.6	-44.2	-60.3	0	0	0	113.3	K168 F171 K172 M212 L213 G216 V217	Y159-K168 HydrophobicContact CE2-CB 4.45Å; Y159-K168 HydrophobicContact CE2-CG 4Å; Y159-F171 HydrophobicContact CD2-CB 4.44Å; Y159-F171 AromaticContact CD2-CD1 3.5Å; Y159-F171 HydrophobicContact CD2-CD1 3.5Å; Y159-F171 HydrophobicContact CD2-CE1 4.18Å; Y159-F171 HydrophobicContact CD2-CG 4.31Å; Y159-F171 AromaticContact CE2-CD1 3.99Å; Y159-F171 HydrophobicContact CE2-CD1 3.99Å; Y159-F171 AromaticContact CG-CD1 3.86Å; Y159-F171 HydrophobicContact CG-CD1 3.86Å; Y159-F171 HydrophobicContact CG-CE1 4.07Å; Y159-K172 WeakPolarHBondContact OH-CB 3.48Å; Y159-M212 HydrophobicContact CD2-CE 4.07Å; Y159-M212 WeakPolarHBondContact O-CA 3.44Å; Y159-L213 PolarHBondContact O-N 3.15Å; Y159-G216 WeakPolarHBondContact CD1-O 3.49Å; Y159-G216 VanDerWaalsContact CE1-O 3.32Å; Y159-G216 WeakPolarHBondContact CE1-O 3.26Å; Y159-V217 HydrophobicContact CD1-CG2 3.83Å; Y159-V217 HydrophobicContact CE1-CB 4.47Å; Y159-V217 HydrophobicContact CE1-CG2 3.62Å; Y159-V217 HydrophobicContact CE2-CG2 4.49Å; Y159-V217 HydrophobicContact CG-CG2 4.38Å
160	G	87.1	Confident	93.8	Very high	44 Å²	44	38.7 Å²	38.7	45%	0.454	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.5	-17.8	-177.6	0	0	0	0	0	115.6	Y157 H158	Y157-G160 WeakPolarHBondContact CD1-O 3.47Å; H158-G160 PolarHBondContact O-N 3.39Å
161	V	91.1	Very high	93.9	Very high	9 Å²	9	38.4 Å²	38.4	6%	0.055	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	138.5	-164.9	-167.8	0	0	0	0	113.7	L148 Y157 H158 S163 V210 G211 M212	L148-V161 HydrophobicContact CB-CG1 4.2Å; L148-V161 HydrophobicContact CD1-CG1 3.95Å; L148-V161 HydrophobicContact CG-CG1 4.33Å; Y157-V161 WeakPolarHBondContact CA-O 3.44Å; H158-V161 PolarHBondContact N-O 3.37Å; H158-V161 PolarHBondContact O-N 2.78Å; V161-S163 PolarHBondContact O-N 2.87Å; V161-S163 VanDerWaalsContact O-N 3.08Å; V161-S163 PolarHBondContact O-OG 3.5Å; V161-V210 HydrophobicContact CG1-CB 4.35Å; V161-V210 HydrophobicContact CG1-CG2 3.9Å; V161-V210 WeakPolarHBondContact CG2-O 3.49Å; V161-G211 VanDerWaalsContact CG2-O 3.27Å; V161-G211 WeakPolarHBondContact CG2-O 3.25Å; V161-M212 HydrophobicContact CB-CE 4.45Å; V161-M212 HydrophobicContact CB-CG 3.99Å; V161-M212 HydrophobicContact CG2-CB 4.37Å; V161-M212 HydrophobicContact CG2-CG 3.68Å
162	A	93.4	Very high	94	Very high	11 Å²	11	40.4 Å²	40.4	9%	0.091	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	110.5	170.8	0	0	0	0	0	110.8	C147 L148 G156 Y157	C147-A162 WeakPolarHBondContact CA-O 3.44Å; L148-A162 PolarHBondContact N-O 3.22Å; L148-A162 VanDerWaalsContact N-O 3.17Å; G156-A162 WeakPolarHBondContact O-CA 3.3Å; Y157-A162 HydrophobicContact CD1-CB 4.4Å; Y157-A162 HydrophobicContact CE1-CB 4.12Å
163	S	95.4	Very high	94.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	157.9	-168.9	52.3	0	0	0	0	114.5	C147 A154 S155 G156 H158 V161 M212	C147-S163 VanDerWaalsContact SG-CA 3.57Å; A154-S163 VanDerWaalsContact CA-O 3.32Å; A154-S163 WeakPolarHBondContact CA-O 3.19Å; A154-S163 WeakPolarHBondContact CB-O 3.43Å; S155-S163 PolarHBondContact N-O 3.24Å; S155-S163 PolarHBondContact OG-O 2.95Å; G156-S163 PolarHBondContact O-N 3.49Å; H158-S163 PolarHBondContact CD2-O 3.27Å; H158-S163 PolarHBondContact CD2-OG 3.2Å; V161-S163 PolarHBondContact O-N 2.87Å; V161-S163 VanDerWaalsContact O-N 3.08Å; V161-S163 PolarHBondContact O-OG 3.5Å; S163-M212 VanDerWaalsContact OG-CE 3.24Å; S163-M212 WeakPolarHBondContact OG-CE 3.27Å
164	C	96.8	Very high	94.2	Very high	4 Å²	4	42.8 Å²	42.8	3%	0.027	23%	0.231	C	C	.	.			trans	-86	154.4	176.3	66.5	0	0	0	0	111.1	C147 D152 I153 A166 C167 K168 R196	C147-C164 HydrophobicContact CB-CB 3.96Å; C147-C164 PolarHBondContact SG-N 3.32Å; C147-C164 VanDerWaalsContact SG-N 3.35Å; C147-C164 VanDerWaalsContact SG-SG 3.63Å; D152-C164 HydrophobicContact CB-CB 4.18Å; I153-C164 WeakPolarHBondContact O-CB 3.33Å; C164-A166 PolarHBondContact O-N 2.94Å; C164-A166 VanDerWaalsContact O-N 3.11Å; C164-C167 PolarHBondContact O-N 2.83Å; C164-K168 PolarHBondContact O-N 3.37Å; C164-R196 PolarHBondContact SG-NH1 2.89Å
165	E	96.3	Very high	94.2	Very high	91 Å²	91	43.5 Å²	43.5	43%	0.425	23%	0.232	S	C	.	.	H	α-helix	trans	-50.9	-37.4	177.1	-68.1	-59.1	121.2	0	0	112.9	S155 H158 C167 K168 A169	S155-E165 WeakPolarHBondContact CB-OE1 3.38Å; S155-E165 PolarHBondContact OG-OE1 2.75Å; H158-E165 IonicContact CE1-OE1 3.64Å; H158-E165 PolarHBondContact CE1-OE1 3.37Å; H158-E165 IonicContact NE2-OE1 2.78Å; H158-E165 PolarHBondContact NE2-OE1 3.1Å; E165-C167 VanDerWaalsContact C-N 3.33Å; E165-C167 PolarHBondContact O-N 3.32Å; E165-K168 PolarHBondContact O-N 3.08Å; E165-K168 WeakPolarHBondContact OE1-CD 3.34Å; E165-K168 IonicContact OE1-NZ 2.81Å; E165-K168 PolarHBondContact OE1-NZ 3.04Å; E165-K168 VanDerWaalsContact OE2-CD 3.23Å; E165-K168 WeakPolarHBondContact OE2-CD 3.5Å; E165-K168 WeakPolarHBondContact OE2-CE 3.35Å; E165-K168 IonicContact OE2-NZ 3.78Å; E165-K168 PolarHBondContact OE2-NZ 2.97Å; E165-A169 VanDerWaalsContact O-CB 3.25Å; E165-A169 WeakPolarHBondContact O-CB 3.41Å; E165-A169 PolarHBondContact O-N 2.82Å
166	A	96.4	Very high	94.2	Very high	42 Å²	42	43.9 Å²	43.9	35%	0.347	23%	0.227	S	C	.	.	H	α-helix	trans	-65.7	-30.2	179.4	0	0	0	0	0	113.8	C164 F170 R203	C164-A166 PolarHBondContact O-N 2.94Å; C164-A166 VanDerWaalsContact O-N 3.11Å; A166-F170 WeakPolarHBondContact O-CB 3.34Å; A166-F170 PolarHBondContact O-N 3.16Å; A166-R203 VanDerWaalsContact C-NH2 3.28Å; A166-R203 PolarHBondContact O-NH2 3.36Å
167	C	97.5	Very high	94.2	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-86.6	-39.6	175.8	-72.6	0	0	0	0	112	V149 C164 E165 A169 F170 F171 R203	V149-C167 HydrophobicContact CB-CB 4.32Å; V149-C167 HydrophobicContact CG1-CB 4.4Å; V149-C167 HydrophobicContact CG2-CB 4.46Å; C164-C167 PolarHBondContact O-N 2.83Å; E165-C167 VanDerWaalsContact C-N 3.33Å; E165-C167 PolarHBondContact O-N 3.32Å; C167-A169 PolarHBondContact O-N 2.89Å; C167-F170 PolarHBondContact O-N 3.39Å; C167-F171 WeakPolarHBondContact O-CB 3.4Å; C167-F171 PolarHBondContact O-N 2.72Å; C167-R203 PolarHBondContact SG-NH2 2.98Å
168	K	96.9	Very high	94.1	Very high	55 Å²	55	44 Å²	44	24%	0.239	24%	0.243	C	C	.	.	H	α-helix	trans	-51.4	-52.5	167.8	170.8	-158.4	-167.7	179.8	0	111.9	H158 Y159 C164 E165 F170 F171 K172	H158-K168 HydrophobicContact CB-CB 4.01Å; H158-K168 HydrophobicContact CB-CD 4.36Å; H158-K168 HydrophobicContact CB-CG 3.86Å; H158-K168 PolarHBondContact CE1-NZ 2.91Å; H158-K168 WeakPolarHBondContact ND1-CD 3.42Å; H158-K168 WeakPolarHBondContact ND1-CE 3.28Å; Y159-K168 HydrophobicContact CE2-CB 4.45Å; Y159-K168 HydrophobicContact CE2-CG 4Å; C164-K168 PolarHBondContact O-N 3.37Å; E165-K168 PolarHBondContact O-N 3.08Å; E165-K168 WeakPolarHBondContact OE1-CD 3.34Å; E165-K168 IonicContact OE1-NZ 2.81Å; E165-K168 PolarHBondContact OE1-NZ 3.04Å; E165-K168 VanDerWaalsContact OE2-CD 3.23Å; E165-K168 WeakPolarHBondContact OE2-CD 3.5Å; E165-K168 WeakPolarHBondContact OE2-CE 3.35Å; E165-K168 IonicContact OE2-NZ 3.78Å; E165-K168 PolarHBondContact OE2-NZ 2.97Å; K168-F170 VanDerWaalsContact C-N 3.3Å; K168-F170 PolarHBondContact O-N 3.17Å; K168-F171 PolarHBondContact O-N 3.35Å; K168-K172 WeakPolarHBondContact O-CB 3.16Å; K168-K172 PolarHBondContact O-N 3.2Å
169	A	96.3	Very high	94.1	Very high	47 Å²	47	46 Å²	46	39%	0.388	25%	0.254	S	S	.	.	H	α-helix	trans	-73.8	-17.1	-179.7	0	0	0	0	0	114.1	E165 C167 R173	E165-A169 VanDerWaalsContact O-CB 3.25Å; E165-A169 WeakPolarHBondContact O-CB 3.41Å; E165-A169 PolarHBondContact O-N 2.82Å; C167-A169 PolarHBondContact O-N 2.89Å; A169-R173 WeakPolarHBondContact O-CG 3.49Å; A169-R173 PolarHBondContact O-NE 3.23Å
170	F	97.9	Very high	94	Very high	8 Å²	8	52.3 Å²	52.3	4%	0.035	29%	0.285	C	S	.	.	H	α-helix	trans	-78.1	-54.4	169.7	171.4	-104.3	0	0	0	110.4	A166 C167 K168 K172 R173 T174 Y181 Q200 R203 F204	A166-F170 WeakPolarHBondContact O-CB 3.34Å; A166-F170 PolarHBondContact O-N 3.16Å; C167-F170 PolarHBondContact O-N 3.39Å; K168-F170 VanDerWaalsContact C-N 3.3Å; K168-F170 PolarHBondContact O-N 3.17Å; F170-K172 VanDerWaalsContact C-N 3.35Å; F170-K172 PolarHBondContact O-N 3.15Å; F170-R173 PolarHBondContact O-N 2.86Å; F170-R173 VanDerWaalsContact O-N 3.14Å; F170-T174 PolarHBondContact O-N 2.86Å; F170-T174 PolarHBondContact O-OG1 3.48Å; F170-Y181 AromaticContact CE2-CE2 3.85Å; F170-Y181 HydrophobicContact CE2-CE2 3.85Å; F170-Y181 AromaticContact CE2-CZ 3.99Å; F170-Y181 HydrophobicContact CZ-CD2 4.34Å; F170-Y181 AromaticContact CZ-CE2 3.59Å; F170-Y181 HydrophobicContact CZ-CE2 3.59Å; F170-Q200 HydrophobicContact CE2-CB 4.19Å; F170-Q200 HydrophobicContact CE2-CG 4.44Å; F170-Q200 HydrophobicContact CZ-CB 4.21Å; F170-Q200 WeakPolarHBondContact CZ-O 3.31Å; F170-R203 HydrophobicContact CD1-CG 3.93Å; F170-R203 HydrophobicContact CE1-CB 3.96Å; F170-R203 HydrophobicContact CE1-CG 3.62Å; F170-R203 HydrophobicContact CZ-CB 4.2Å; F170-R203 HydrophobicContact CZ-CG 4.22Å; F170-F204 HydrophobicContact CE1-CB 3.89Å; F170-F204 HydrophobicContact CZ-CB 4.07Å
171	F	97.1	Very high	94.4	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-56.5	-46.4	178.9	-170.5	-99.7	0	0	0	111.9	Y159 C167 K168 R173 T174 I175 F204 C207 L208 M212 L213 K214 V217	Y159-F171 HydrophobicContact CD2-CB 4.44Å; Y159-F171 AromaticContact CD2-CD1 3.5Å; Y159-F171 HydrophobicContact CD2-CD1 3.5Å; Y159-F171 HydrophobicContact CD2-CE1 4.18Å; Y159-F171 HydrophobicContact CD2-CG 4.31Å; Y159-F171 AromaticContact CE2-CD1 3.99Å; Y159-F171 HydrophobicContact CE2-CD1 3.99Å; Y159-F171 AromaticContact CG-CD1 3.86Å; Y159-F171 HydrophobicContact CG-CD1 3.86Å; Y159-F171 HydrophobicContact CG-CE1 4.07Å; C167-F171 WeakPolarHBondContact O-CB 3.4Å; C167-F171 PolarHBondContact O-N 2.72Å; K168-F171 PolarHBondContact O-N 3.35Å; F171-R173 VanDerWaalsContact C-N 3.35Å; F171-R173 PolarHBondContact O-N 3Å; F171-T174 PolarHBondContact O-N 3.26Å; F171-I175 HydrophobicContact CD1-CG1 4.3Å; F171-I175 HydrophobicContact CE1-CG1 3.99Å; F171-I175 HydrophobicContact CE2-CG1 4.45Å; F171-I175 HydrophobicContact CZ-CD1 4.32Å; F171-I175 HydrophobicContact CZ-CG1 4.07Å; F171-I175 WeakPolarHBondContact O-CG1 3.25Å; F171-I175 PolarHBondContact O-N 2.98Å; F171-F204 AromaticContact CD2-CD2 3.99Å; F171-F204 HydrophobicContact CD2-CD2 3.99Å; F171-F204 AromaticContact CD2-CE2 3.77Å; F171-F204 HydrophobicContact CD2-CE2 3.77Å; F171-F204 HydrophobicContact CE2-CD2 4.26Å; F171-F204 AromaticContact CE2-CE2 3.7Å; F171-F204 HydrophobicContact CE2-CE2 3.7Å; F171-C207 HydrophobicContact CD2-CB 3.58Å; F171-C207 HydrophobicContact CE2-CB 4.03Å; F171-L208 HydrophobicContact CE2-CD2 3.78Å; F171-L208 HydrophobicContact CE2-CG 4.39Å; F171-L208 HydrophobicContact CZ-CD2 4.12Å; F171-M212 HydrophobicContact CB-SD 4.23Å; F171-M212 HydrophobicContact CD1-CB 4.36Å; F171-M212 HydrophobicContact CD2-CB 4.01Å; F171-M212 HydrophobicContact CD2-SD 4.23Å; F171-M212 HydrophobicContact CE1-CB 4.05Å; F171-M212 HydrophobicContact CE2-CB 3.67Å; F171-M212 HydrophobicContact CG-CB 4.34Å; F171-M212 HydrophobicContact CG-SD 4.13Å; F171-M212 HydrophobicContact CZ-CB 3.7Å; F171-M212 WeakPolarHBondContact CZ-O 3.45Å; F171-L213 WeakPolarHBondContact CE1-O 3.09Å; F171-K214 HydrophobicContact CZ-CG 4.27Å; F171-V217 HydrophobicContact CD1-CG2 3.82Å; F171-V217 HydrophobicContact CE1-CG2 3.76Å
172	K	94.9	Very high	94.6	Very high	90 Å²	90	58.2 Å²	58.2	39%	0.391	31%	0.311	S	S	.	.	H	α-helix	trans	-53.9	-47.6	175.6	-173.9	175.4	175.5	177.7	0	112.7	Y159 K168 F170 Q176 V217	Y159-K172 WeakPolarHBondContact OH-CB 3.48Å; K168-K172 WeakPolarHBondContact O-CB 3.16Å; K168-K172 PolarHBondContact O-N 3.2Å; F170-K172 VanDerWaalsContact C-N 3.35Å; F170-K172 PolarHBondContact O-N 3.15Å; K172-Q176 HydrophobicContact CG-CG 4.26Å; K172-Q176 VanDerWaalsContact O-CB 3.32Å; K172-Q176 WeakPolarHBondContact O-CB 3.09Å; K172-Q176 WeakPolarHBondContact O-CG 3.44Å; K172-Q176 PolarHBondContact O-N 3.03Å; K172-V217 HydrophobicContact CG-CG1 4.1Å
173	R	95.4	Very high	94.6	Very high	164 Å²	164	58.7 Å²	58.7	62%	0.619	31%	0.314	S	S	*	.	H	α-helix	trans	-71.5	-34.6	-177.7	-73.7	-175.1	-65	158.2	4.8	112.5	A169 F170 F171 G177	A169-R173 WeakPolarHBondContact O-CG 3.49Å; A169-R173 PolarHBondContact O-NE 3.23Å; F170-R173 PolarHBondContact O-N 2.86Å; F170-R173 VanDerWaalsContact O-N 3.14Å; F171-R173 VanDerWaalsContact C-N 3.35Å; F171-R173 PolarHBondContact O-N 3Å; R173-G177 PolarHBondContact O-N 3.28Å
174	T	95.6	Very high	94.4	Very high	2 Å²	2	64.3 Å²	64.3	1%	0.012	35%	0.35	C	S	.	.	H	α-helix	trans	-63.2	-47.8	176.1	-46.6	0	0	0	0	110.4	F170 F171 N178 I179 Y181 F204	F170-T174 PolarHBondContact O-N 2.86Å; F170-T174 PolarHBondContact O-OG1 3.48Å; F171-T174 PolarHBondContact O-N 3.26Å; T174-N178 WeakPolarHBondContact O-CA 3.08Å; T174-N178 PolarHBondContact O-N 3.31Å; T174-I179 HydrophobicContact CG2-CB 4.33Å; T174-I179 VanDerWaalsContact CG2-O 3.27Å; T174-I179 WeakPolarHBondContact CG2-O 3.43Å; T174-I179 PolarHBondContact O-N 2.72Å; T174-Y181 HydrophobicContact CG2-CD2 4.1Å; T174-Y181 HydrophobicContact CG2-CE2 3.45Å; T174-Y181 VanDerWaalsContact CG2-CE2 3.45Å; T174-F204 HydrophobicContact CG2-CD1 4Å; T174-F204 HydrophobicContact CG2-CD2 3.58Å; T174-F204 HydrophobicContact CG2-CE1 3.98Å; T174-F204 HydrophobicContact CG2-CE2 3.58Å; T174-F204 HydrophobicContact CG2-CG 3.8Å; T174-F204 HydrophobicContact CG2-CZ 3.78Å
175	I	93.8	Very high	94.1	Very high	30 Å²	30	66.9 Å²	66.9	15%	0.154	37%	0.372	C	S	.	.	H	α-helix	trans	-70.8	-49.1	178.8	-57.5	-62.2	0	0	0	112	F171 G177 N178 F204 K214 V217	F171-I175 HydrophobicContact CD1-CG1 4.3Å; F171-I175 HydrophobicContact CE1-CG1 3.99Å; F171-I175 HydrophobicContact CE2-CG1 4.45Å; F171-I175 HydrophobicContact CZ-CD1 4.32Å; F171-I175 HydrophobicContact CZ-CG1 4.07Å; F171-I175 WeakPolarHBondContact O-CG1 3.25Å; F171-I175 PolarHBondContact O-N 2.98Å; I175-G177 VanDerWaalsContact C-N 3.27Å; I175-G177 PolarHBondContact O-N 2.91Å; I175-N178 PolarHBondContact O-N 3.04Å; I175-N178 VanDerWaalsContact O-N 3.14Å; I175-F204 HydrophobicContact CD1-CE2 3.83Å; I175-F204 HydrophobicContact CD1-CZ 3.63Å; I175-F204 HydrophobicContact CG1-CE2 4.35Å; I175-K214 HydrophobicContact CD1-CB 4.12Å; I175-K214 HydrophobicContact CD1-CD 4.04Å; I175-K214 HydrophobicContact CD1-CG 3.77Å; I175-V217 HydrophobicContact CB-CB 4.09Å; I175-V217 HydrophobicContact CB-CG1 4.04Å; I175-V217 HydrophobicContact CB-CG2 4.11Å; I175-V217 HydrophobicContact CG1-CG2 4.16Å; I175-V217 HydrophobicContact CG2-CB 3.82Å; I175-V217 HydrophobicContact CG2-CG1 4Å; I175-V217 HydrophobicContact CG2-CG2 4.29Å
176	Q	90.9	Very high	93.8	Very high	77 Å²	77	67.7 Å²	67.7	36%	0.36	38%	0.383	S	S	.	.	H	α-helix	trans	-68.2	-23.1	-178.2	-70.8	-168.3	-37.2	0	0	114.3	K172 V217 R218	K172-Q176 HydrophobicContact CG-CG 4.26Å; K172-Q176 VanDerWaalsContact O-CB 3.32Å; K172-Q176 WeakPolarHBondContact O-CB 3.09Å; K172-Q176 WeakPolarHBondContact O-CG 3.44Å; K172-Q176 PolarHBondContact O-N 3.03Å; Q176-V217 HydrophobicContact CG-CG1 3.5Å; Q176-R218 PolarHBondContact NE2-O 3.3Å
177	G	88.3	Confident	93.4	Very high	50 Å²	50	70.7 Å²	70.7	52%	0.515	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	2.9	174.1	0	0	0	0	0	114.2	R173 I175 I179	R173-G177 PolarHBondContact O-N 3.28Å; I175-G177 VanDerWaalsContact C-N 3.27Å; I175-G177 PolarHBondContact O-N 2.91Å; G177-I179 PolarHBondContact O-N 2.69Å
178	N	88.6	Confident	93.2	Very high	132 Å²	132	78.7 Å²	78.7	71%	0.706	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.6	47.8	-169.4	-162.2	61.9	0	0	0	113.2	T174 I175 E180	T174-N178 WeakPolarHBondContact O-CA 3.08Å; T174-N178 PolarHBondContact O-N 3.31Å; I175-N178 PolarHBondContact O-N 3.04Å; I175-N178 VanDerWaalsContact O-N 3.14Å; N178-E180 PolarHBondContact O-N 3.47Å
179	I	92.8	Very high	93.1	Very high	69 Å²	69	78.1 Å²	78.1	35%	0.354	43%	0.433	S	S	.	.			trans	-86.7	114.7	-169.2	-45.2	179	0	0	0	109.9	T174 G177 Y181	T174-I179 HydrophobicContact CG2-CB 4.33Å; T174-I179 VanDerWaalsContact CG2-O 3.27Å; T174-I179 WeakPolarHBondContact CG2-O 3.43Å; T174-I179 PolarHBondContact O-N 2.72Å; G177-I179 PolarHBondContact O-N 2.69Å; I179-Y181 HydrophobicContact CB-CE1 4.3Å; I179-Y181 HydrophobicContact CG2-CD1 3.98Å; I179-Y181 HydrophobicContact CG2-CE1 3.42Å; I179-Y181 VanDerWaalsContact CG2-CE1 3.42Å
180	E	92.4	Very high	93	Very high	173 Å²	173	81.1 Å²	81.1	81%	0.808	44%	0.439	S	S	*	.			trans	-84	147.6	170	-62	-172.7	173.9	0	0	110.9	N178	N178-E180 PolarHBondContact O-N 3.47Å
181	Y	95.6	Very high	92.9	Very high	60 Å²	60	81.8 Å²	81.8	24%	0.235	44%	0.442	C	S	.	.			trans	-136.4	120.1	-176.5	-63	-51.5	0	0	0	110.7	F170 T174 I179 Q200 A201 F204	F170-Y181 AromaticContact CE2-CE2 3.85Å; F170-Y181 HydrophobicContact CE2-CE2 3.85Å; F170-Y181 AromaticContact CE2-CZ 3.99Å; F170-Y181 HydrophobicContact CZ-CD2 4.34Å; F170-Y181 AromaticContact CZ-CE2 3.59Å; F170-Y181 HydrophobicContact CZ-CE2 3.59Å; T174-Y181 HydrophobicContact CG2-CD2 4.1Å; T174-Y181 HydrophobicContact CG2-CE2 3.45Å; T174-Y181 VanDerWaalsContact CG2-CE2 3.45Å; I179-Y181 HydrophobicContact CB-CE1 4.3Å; I179-Y181 HydrophobicContact CG2-CD1 3.98Å; I179-Y181 HydrophobicContact CG2-CE1 3.42Å; I179-Y181 VanDerWaalsContact CG2-CE1 3.42Å; Y181-Q200 HydrophobicContact CD1-CB 3.85Å; Y181-Q200 HydrophobicContact CD2-CB 3.98Å; Y181-Q200 HydrophobicContact CE1-CB 3.9Å; Y181-Q200 HydrophobicContact CE2-CB 4.03Å; Y181-Q200 HydrophobicContact CG-CB 3.9Å; Y181-Q200 PolarHBondContact OH-OE1 3.27Å; Y181-A201 VanDerWaalsContact O-CB 3.23Å; Y181-A201 WeakPolarHBondContact O-CB 3.49Å; Y181-F204 HydrophobicContact CD2-CB 4.01Å; Y181-F204 HydrophobicContact CD2-CG 4.48Å; Y181-F204 HydrophobicContact CE2-CB 4.28Å
182	S	93.5	Very high	92.8	Very high	117 Å²	117	84 Å²	84	82%	0.818	46%	0.456	S	S	*	.			trans	-84.7	144	166	-52.8	0	0	0	0	110.7
183	C	95.1	Very high	92.8	Very high	22 Å²	22	85.2 Å²	85.2	15%	0.149	46%	0.461	C	S	.	.			trans	-85.3	133.4	169.9	-174.2	0	0	0	0	110	A185 N187 C189 C199 A201 C202	C183-A185 PolarHBondContact O-N 3.19Å; C183-A185 VanDerWaalsContact O-N 3.08Å; C183-A185 PolarHBondContact SG-N 3.14Å; C183-A185 PolarHBondContact SG-O 2.98Å; C183-N187 HydrophobicContact CB-CB 4.47Å; C183-N187 WeakPolarHBondContact CB-OD1 3.41Å; C183-C189 VanDerWaalsContact SG-SG 3.63Å; C183-C199 VanDerWaalsContact SG-SG 3.61Å; C183-A201 HydrophobicContact CB-CB 3.99Å; C183-C202 PolarHBondContact SG-SG 3.31Å
184	P	89.8	Confident	92.7	Very high	118 Å²	118	88.5 Å²	88.5	77%	0.766	47%	0.474	S	S	*	.	S	Bend	trans	-77.8	20	173.2	35	-37.8	0	0	0	113.2
185	A	90.6	Very high	92.6	Very high	58 Å²	58	94.5 Å²	94.5	48%	0.479	50%	0.496	S	S	.	.	S	Bend	trans	-161.3	-170.6	-172.4	0	0	0	0	0	109.1	C183 N187	C183-A185 PolarHBondContact O-N 3.19Å; C183-A185 VanDerWaalsContact O-N 3.08Å; C183-A185 PolarHBondContact SG-N 3.14Å; C183-A185 PolarHBondContact SG-O 2.98Å; A185-N187 PolarHBondContact O-N 3.05Å
186	T	90.3	Very high	92.6	Very high	107 Å²	107	94.8 Å²	94.8	66%	0.656	50%	0.495	S	S	*	.	S	Bend	trans	-64.6	15	-170.8	61.5	0	0	0	0	117.7	E188	T186-E188 PolarHBondContact O-N 3.25Å
187	N	89.2	Confident	92.8	Very high	106 Å²	106	100 Å²	100	57%	0.567	52%	0.517	S	S	*	.	S	Bend	trans	62.9	5	-170.5	-65.7	-67.3	0	0	0	116.4	C183 A185 C202	C183-N187 HydrophobicContact CB-CB 4.47Å; C183-N187 WeakPolarHBondContact CB-OD1 3.41Å; A185-N187 PolarHBondContact O-N 3.05Å; N187-C202 PolarHBondContact O-SG 2.9Å
188	E	92.4	Very high	93.1	Very high	167 Å²	167	102.1 Å²	102.1	78%	0.78	52%	0.524	S	S	*	.			trans	-103.9	18.7	-174.6	-64.3	-177.4	128.8	0	0	114.8	T186 E190	T186-E188 PolarHBondContact O-N 3.25Å; E188-E190 PolarHBondContact O-N 2.95Å
189	C	94.1	Very high	93.5	Very high	44 Å²	44	96.1 Å²	96.1	30%	0.297	49%	0.492	S	S	.	.			trans	-61.9	123	-174.3	-51.2	0	0	0	0	113.3	C183 I191 C199 C202	C183-C189 VanDerWaalsContact SG-SG 3.63Å; C189-I191 VanDerWaalsContact O-CD1 3.28Å; C189-I191 WeakPolarHBondContact O-CD1 3.07Å; C189-I191 WeakPolarHBondContact O-CG1 3.48Å; C189-I191 PolarHBondContact O-N 3.29Å; C189-C199 HydrophobicContact CB-CB 3.94Å; C189-C202 HydrophobicContact CB-CB 3.79Å
190	E	94	Very high	93.7	Very high	109 Å²	109	97.6 Å²	97.6	51%	0.509	50%	0.497	S	S	.	.			trans	-63.4	124.5	178	-174.1	-143.5	87.4	0	0	112.7	E188 T192 R195	E188-E190 PolarHBondContact O-N 2.95Å; E190-T192 HydrophobicContact CG-CG2 4.32Å; E190-T192 WeakPolarHBondContact OE1-CG2 3.4Å; E190-T192 PolarHBondContact OE1-OG1 2.79Å; E190-R195 IonicContact OE1-CZ 2.59Å; E190-R195 IonicContact OE1-NE 3.69Å; E190-R195 PolarHBondContact OE1-NE 2.79Å; E190-R195 IonicContact OE1-NH2 2.74Å; E190-R195 PolarHBondContact OE1-NH2 2.93Å; E190-R195 IonicContact OE2-CZ 3.17Å; E190-R195 IonicContact OE2-NH2 2.74Å; E190-R195 PolarHBondContact OE2-NH2 3.07Å
191	I	96.7	Very high	93.9	Very high	22 Å²	22	89.8 Å²	89.8	11%	0.113	46%	0.463	C	S	.	.			trans	-101.7	105	-175.8	-50.8	-56.8	0	0	0	111	V149 C150 C189 R196 C202 R203 K206	V149-I191 HydrophobicContact CG1-CG2 4.34Å; V149-I191 WeakPolarHBondContact O-CG2 3.09Å; C150-I191 WeakPolarHBondContact CA-O 3.4Å; C150-I191 HydrophobicContact CB-CG2 4Å; C189-I191 VanDerWaalsContact O-CD1 3.28Å; C189-I191 WeakPolarHBondContact O-CD1 3.07Å; C189-I191 WeakPolarHBondContact O-CG1 3.48Å; C189-I191 PolarHBondContact O-N 3.29Å; I191-R196 HydrophobicContact CG2-CB 3.9Å; I191-C202 HydrophobicContact CD1-CB 3.99Å; I191-R203 HydrophobicContact CD1-CB 3.97Å; I191-R203 HydrophobicContact CG1-CB 4.43Å; I191-R203 HydrophobicContact CG2-CB 4.44Å; I191-R203 HydrophobicContact CG2-CG 4.1Å; I191-K206 HydrophobicContact CG1-CB 4.18Å; I191-K206 HydrophobicContact CG1-CG 4.44Å
192	T	95.3	Very high	94	Very high	46 Å²	46	87.3 Å²	87.3	28%	0.282	45%	0.454	S	S	.	.			trans	-124.7	166.4	174.4	51.6	0	0	0	0	111.9	C150 E190 R194 R195 R196	C150-T192 CarbonylContact O-C 3.35Å; C150-T192 WeakPolarHBondContact O-CA 3.43Å; E190-T192 HydrophobicContact CG-CG2 4.32Å; E190-T192 WeakPolarHBondContact OE1-CG2 3.4Å; E190-T192 PolarHBondContact OE1-OG1 2.79Å; T192-R194 CarbonylContact O-C 3.6Å; T192-R194 PolarHBondContact O-N 3.44Å; T192-R195 PolarHBondContact O-N 2.86Å; T192-R195 PolarHBondContact OG1-N 3.34Å; T192-R196 VanDerWaalsContact O-CB 3.24Å; T192-R196 WeakPolarHBondContact O-CB 3.23Å; T192-R196 WeakPolarHBondContact O-CG 3.35Å; T192-R196 PolarHBondContact O-N 2.99Å
193	K	93.6	Very high	94.2	Very high	117 Å²	117	82.7 Å²	82.7	51%	0.509	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.1	-37.1	176.1	-177.2	174.9	-176.3	156.4	0	113.2	C150 D152 R196	C150-K193 PolarHBondContact O-N 2.76Å; D152-K193 HydrophobicContact CB-CB 4.18Å; D152-K193 HydrophobicContact CB-CD 4.03Å; D152-K193 HydrophobicContact CB-CG 4.04Å; D152-K193 VanDerWaalsContact OD1-CD 3.29Å; D152-K193 WeakPolarHBondContact OD1-CD 3.43Å; D152-K193 WeakPolarHBondContact OD1-CE 3.39Å; D152-K193 IonicContact OD1-NZ 3.37Å; D152-K193 PolarHBondContact OD1-NZ 2.99Å; D152-K193 IonicContact OD2-NZ 3.4Å; K193-R196 PolarHBondContact O-NE 3.37Å
194	R	94	Very high	94.3	Very high	232 Å²	232	83.3 Å²	83.3	88%	0.875	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-54.1	174.5	-64.8	-169.8	-74.8	179.7	-2.4	112.4	T192	T192-R194 CarbonylContact O-C 3.6Å; T192-R194 PolarHBondContact O-N 3.44Å
195	R	92.8	Very high	94.6	Very high	128 Å²	128	83.4 Å²	83.4	48%	0.483	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-4.5	-171.3	-65.3	-163.1	-79.3	-162.3	-7.8	116.4	E190 T192 K197 S198	E190-R195 IonicContact OE1-CZ 2.59Å; E190-R195 IonicContact OE1-NE 3.69Å; E190-R195 PolarHBondContact OE1-NE 2.79Å; E190-R195 IonicContact OE1-NH2 2.74Å; E190-R195 PolarHBondContact OE1-NH2 2.93Å; E190-R195 IonicContact OE2-CZ 3.17Å; E190-R195 IonicContact OE2-NH2 2.74Å; E190-R195 PolarHBondContact OE2-NH2 3.07Å; T192-R195 PolarHBondContact O-N 2.86Å; T192-R195 PolarHBondContact OG1-N 3.34Å; R195-K197 PolarHBondContact O-N 3.01Å; R195-S198 WeakPolarHBondContact O-CB 3.43Å; R195-S198 PolarHBondContact O-N 3.31Å; R195-S198 PolarHBondContact O-OG 2.94Å
196	R	94.6	Very high	94.9	Very high	37 Å²	37	84.7 Å²	84.7	14%	0.14	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	6.6	178.6	69.5	179.9	177.6	-167.9	-4.1	116.5	C150 D152 C164 I191 T192 K193 R203	C150-R196 HydrophobicContact CB-CB 4.37Å; C150-R196 PolarHBondContact SG-NH1 2.96Å; D152-R196 VanDerWaalsContact CB-NH1 3.32Å; D152-R196 IonicContact OD2-CZ 4Å; D152-R196 IonicContact OD2-NH1 2.77Å; D152-R196 PolarHBondContact OD2-NH1 3.4Å; D152-R196 IonicContact OD2-NH2 2.66Å; D152-R196 PolarHBondContact OD2-NH2 3.37Å; C164-R196 PolarHBondContact SG-NH1 2.89Å; I191-R196 HydrophobicContact CG2-CB 3.9Å; T192-R196 VanDerWaalsContact O-CB 3.24Å; T192-R196 WeakPolarHBondContact O-CB 3.23Å; T192-R196 WeakPolarHBondContact O-CG 3.35Å; T192-R196 PolarHBondContact O-N 2.99Å; K193-R196 PolarHBondContact O-NE 3.37Å; R196-R203 WeakPolarHBondContact O-CD 3.43Å; R196-R203 PolarHBondContact O-NH1 3.46Å
197	K	94.8	Very high	95.2	Very high	186 Å²	186	79.6 Å²	79.6	81%	0.809	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-21.2	167	-70.5	-172.5	178	-176.9	0	112.7	R195	R195-K197 PolarHBondContact O-N 3.01Å
198	S	94.7	Very high	95.5	Very high	94 Å²	94	77.1 Å²	77.1	66%	0.657	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-29.7	-169.1	-52.6	0	0	0	0	114.1	R195	R195-S198 WeakPolarHBondContact O-CB 3.43Å; R195-S198 PolarHBondContact O-N 3.31Å; R195-S198 PolarHBondContact O-OG 2.94Å
199	C	97	Very high	95.5	Very high	7 Å²	7	77.6 Å²	77.6	5%	0.047	36%	0.36	C	S	.	.			trans	-139.4	128.4	169.1	-176.8	0	0	0	0	110.3	C183 C189 C202 R203	C183-C199 VanDerWaalsContact SG-SG 3.61Å; C189-C199 HydrophobicContact CB-CB 3.94Å; C199-C202 HydrophobicContact CB-CB 4.26Å; C199-C202 PolarHBondContact SG-N 3.43Å; C199-C202 PolarHBondContact SG-SG 2.89Å; C199-R203 WeakPolarHBondContact O-CB 3.41Å
200	Q	96.9	Very high	95.4	Very high	99 Å²	99	77.1 Å²	77.1	46%	0.463	36%	0.356	S	S	.	.	H	α-helix	trans	-86.4	-38	179.6	-57.3	-171.3	36.6	0	0	111.1	F170 Y181 R203 F204	F170-Q200 HydrophobicContact CE2-CB 4.19Å; F170-Q200 HydrophobicContact CE2-CG 4.44Å; F170-Q200 HydrophobicContact CZ-CB 4.21Å; F170-Q200 WeakPolarHBondContact CZ-O 3.31Å; Y181-Q200 HydrophobicContact CD1-CB 3.85Å; Y181-Q200 HydrophobicContact CD2-CB 3.98Å; Y181-Q200 HydrophobicContact CE1-CB 3.9Å; Y181-Q200 HydrophobicContact CE2-CB 4.03Å; Y181-Q200 HydrophobicContact CG-CB 3.9Å; Y181-Q200 PolarHBondContact OH-OE1 3.27Å; Q200-R203 PolarHBondContact O-N 3.31Å; Q200-F204 PolarHBondContact O-N 3.04Å
201	A	97.1	Very high	95.3	Very high	10 Å²	10	73.8 Å²	73.8	8%	0.083	35%	0.351	C	S	.	.	H	α-helix	trans	-56.6	-60.6	175.8	0	0	0	0	0	112.4	Y181 C183 R203 F204 M205	Y181-A201 VanDerWaalsContact O-CB 3.23Å; Y181-A201 WeakPolarHBondContact O-CB 3.49Å; C183-A201 HydrophobicContact CB-CB 3.99Å; A201-R203 PolarHBondContact O-N 2.75Å; A201-R203 VanDerWaalsContact O-N 3.16Å; A201-F204 PolarHBondContact O-N 3.36Å; A201-M205 WeakPolarHBondContact O-CB 3.48Å; A201-M205 PolarHBondContact O-N 3.23Å
202	C	96.9	Very high	95.2	Very high	7 Å²	7	73 Å²	73	5%	0.047	35%	0.346	C	S	.	.	H	α-helix	trans	-58.7	-32	179.2	-56	0	0	0	0	112.3	C183 N187 C189 I191 C199 K206	C183-C202 PolarHBondContact SG-SG 3.31Å; N187-C202 PolarHBondContact O-SG 2.9Å; C189-C202 HydrophobicContact CB-CB 3.79Å; I191-C202 HydrophobicContact CD1-CB 3.99Å; C199-C202 HydrophobicContact CB-CB 4.26Å; C199-C202 PolarHBondContact SG-N 3.43Å; C199-C202 PolarHBondContact SG-SG 2.89Å; C202-K206 WeakPolarHBondContact O-CB 3.29Å; C202-K206 PolarHBondContact O-N 3.33Å
203	R	97.9	Very high	94.9	Very high	20 Å²	20	73.3 Å²	73.3	8%	0.075	35%	0.346	C	S	.	.	H	α-helix	trans	-70.3	-42.9	175.4	-174.3	176.6	-178.9	-163.1	-9.3	112.6	V149 A166 C167 F170 I191 R196 C199 Q200 A201 K206 C207	V149-R203 HydrophobicContact CG1-CG 4.39Å; A166-R203 VanDerWaalsContact C-NH2 3.28Å; A166-R203 PolarHBondContact O-NH2 3.36Å; C167-R203 PolarHBondContact SG-NH2 2.98Å; F170-R203 HydrophobicContact CD1-CG 3.93Å; F170-R203 HydrophobicContact CE1-CB 3.96Å; F170-R203 HydrophobicContact CE1-CG 3.62Å; F170-R203 HydrophobicContact CZ-CB 4.2Å; F170-R203 HydrophobicContact CZ-CG 4.22Å; I191-R203 HydrophobicContact CD1-CB 3.97Å; I191-R203 HydrophobicContact CG1-CB 4.43Å; I191-R203 HydrophobicContact CG2-CB 4.44Å; I191-R203 HydrophobicContact CG2-CG 4.1Å; R196-R203 WeakPolarHBondContact O-CD 3.43Å; R196-R203 PolarHBondContact O-NH1 3.46Å; C199-R203 WeakPolarHBondContact O-CB 3.41Å; Q200-R203 PolarHBondContact O-N 3.31Å; A201-R203 PolarHBondContact O-N 2.75Å; A201-R203 VanDerWaalsContact O-N 3.16Å; R203-K206 PolarHBondContact O-N 3.35Å; R203-C207 PolarHBondContact O-N 3.08Å; R203-C207 PolarHBondContact O-SG 2.83Å
204	F	97.7	Very high	94.7	Very high	35 Å²	35	73 Å²	73	15%	0.154	35%	0.345	C	S	.	.	H	α-helix	trans	-69.3	-42.9	177.5	-178.4	-121.7	0	0	0	111.1	F170 F171 T174 I175 Y181 Q200 A201 K206 C207 L208	F170-F204 HydrophobicContact CE1-CB 3.89Å; F170-F204 HydrophobicContact CZ-CB 4.07Å; F171-F204 AromaticContact CD2-CD2 3.99Å; F171-F204 HydrophobicContact CD2-CD2 3.99Å; F171-F204 AromaticContact CD2-CE2 3.77Å; F171-F204 HydrophobicContact CD2-CE2 3.77Å; F171-F204 HydrophobicContact CE2-CD2 4.26Å; F171-F204 AromaticContact CE2-CE2 3.7Å; F171-F204 HydrophobicContact CE2-CE2 3.7Å; T174-F204 HydrophobicContact CG2-CD1 4Å; T174-F204 HydrophobicContact CG2-CD2 3.58Å; T174-F204 HydrophobicContact CG2-CE1 3.98Å; T174-F204 HydrophobicContact CG2-CE2 3.58Å; T174-F204 HydrophobicContact CG2-CG 3.8Å; T174-F204 HydrophobicContact CG2-CZ 3.78Å; I175-F204 HydrophobicContact CD1-CE2 3.83Å; I175-F204 HydrophobicContact CD1-CZ 3.63Å; I175-F204 HydrophobicContact CG1-CE2 4.35Å; Y181-F204 HydrophobicContact CD2-CB 4.01Å; Y181-F204 HydrophobicContact CD2-CG 4.48Å; Y181-F204 HydrophobicContact CE2-CB 4.28Å; Q200-F204 PolarHBondContact O-N 3.04Å; A201-F204 PolarHBondContact O-N 3.36Å; F204-K206 VanDerWaalsContact C-N 3.3Å; F204-K206 PolarHBondContact O-N 3.26Å; F204-C207 WeakPolarHBondContact O-CB 3.47Å; F204-C207 PolarHBondContact O-N 3.48Å; F204-C207 VanDerWaalsContact O-N 3.07Å; F204-L208 HydrophobicContact CD1-CD1 4.33Å; F204-L208 HydrophobicContact CE1-CD1 3.92Å; F204-L208 HydrophobicContact CZ-CD1 4.06Å; F204-L208 HydrophobicContact CZ-CG 4.44Å; F204-L208 PolarHBondContact O-N 3.41Å
205	M	96.1	Very high	94.2	Very high	121 Å²	121	67.9 Å²	67.9	60%	0.596	33%	0.331	S	S	*	.	H	α-helix	trans	-56.1	-43.8	170.3	-168.2	62.2	74.2	0	0	111.3	A201 C207 L208 K209	A201-M205 WeakPolarHBondContact O-CB 3.48Å; A201-M205 PolarHBondContact O-N 3.23Å; M205-C207 PolarHBondContact O-N 2.82Å; M205-L208 PolarHBondContact O-N 3.15Å; M205-K209 VanDerWaalsContact O-CB 3.3Å; M205-K209 WeakPolarHBondContact O-CB 3.17Å; M205-K209 PolarHBondContact O-N 3.28Å
206	K	96.6	Very high	93.5	Very high	84 Å²	84	62.6 Å²	62.6	37%	0.365	32%	0.316	S	S	.	.	H	α-helix	trans	-64.8	-36.1	174.6	-174.5	63.9	174.5	-176	0	112.9	V149 I191 C202 R203 F204 K209 V210	V149-K206 HydrophobicContact CG1-CG 4.25Å; I191-K206 HydrophobicContact CG1-CB 4.18Å; I191-K206 HydrophobicContact CG1-CG 4.44Å; C202-K206 WeakPolarHBondContact O-CB 3.29Å; C202-K206 PolarHBondContact O-N 3.33Å; R203-K206 PolarHBondContact O-N 3.35Å; F204-K206 VanDerWaalsContact C-N 3.3Å; F204-K206 PolarHBondContact O-N 3.26Å; K206-K209 PolarHBondContact O-N 3.31Å; K206-V210 HydrophobicContact CD-CG1 4.28Å; K206-V210 WeakPolarHBondContact O-CG1 3.4Å; K206-V210 WeakPolarHBondContact O-CG2 3.45Å; K206-V210 PolarHBondContact O-N 3.37Å; K206-V210 VanDerWaalsContact O-N 3.15Å
207	C	95.9	Very high	92.9	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-60	-48.5	172.6	-67.7	0	0	0	0	111.5	F171 R203 F204 M205 V210 M212	F171-C207 HydrophobicContact CD2-CB 3.58Å; F171-C207 HydrophobicContact CE2-CB 4.03Å; R203-C207 PolarHBondContact O-N 3.08Å; R203-C207 PolarHBondContact O-SG 2.83Å; F204-C207 WeakPolarHBondContact O-CB 3.47Å; F204-C207 PolarHBondContact O-N 3.48Å; F204-C207 VanDerWaalsContact O-N 3.07Å; M205-C207 PolarHBondContact O-N 2.82Å; C207-V210 WeakPolarHBondContact O-CG2 3.45Å; C207-V210 PolarHBondContact O-N 3.01Å; C207-M212 HydrophobicContact CB-CB 4.25Å; C207-M212 HydrophobicContact CB-CG 4.2Å; C207-M212 HydrophobicContact CB-SD 3.73Å; C207-M212 VanDerWaalsContact O-CB 3.28Å; C207-M212 WeakPolarHBondContact O-CB 3.42Å; C207-M212 WeakPolarHBondContact O-CG 3.17Å; C207-M212 PolarHBondContact O-N 3.2Å
208	L	95.7	Very high	92.1	Very high	54 Å²	54	58.8 Å²	58.8	28%	0.283	30%	0.298	S	S	.	.	H	α-helix	trans	-64	-45.1	177.4	-63.6	172.6	0	0	0	111.2	F171 F204 M205 V210 G211 K214	F171-L208 HydrophobicContact CE2-CD2 3.78Å; F171-L208 HydrophobicContact CE2-CG 4.39Å; F171-L208 HydrophobicContact CZ-CD2 4.12Å; F204-L208 HydrophobicContact CD1-CD1 4.33Å; F204-L208 HydrophobicContact CE1-CD1 3.92Å; F204-L208 HydrophobicContact CZ-CD1 4.06Å; F204-L208 HydrophobicContact CZ-CG 4.44Å; F204-L208 PolarHBondContact O-N 3.41Å; M205-L208 PolarHBondContact O-N 3.15Å; L208-V210 PolarHBondContact O-N 3.09Å; L208-V210 VanDerWaalsContact O-N 3.16Å; L208-G211 PolarHBondContact O-N 3.05Å; L208-K214 HydrophobicContact CD2-CD 4.32Å; L208-K214 HydrophobicContact CD2-CG 3.81Å
209	K	93.7	Very high	90.7	Very high	177 Å²	177	60.1 Å²	60.1	77%	0.77	30%	0.297	S	S	*	.	H	α-helix	trans	-64.7	-16.1	179.4	-172.1	164.7	-176.7	169.2	0	114.6	M205 K206	M205-K209 VanDerWaalsContact O-CB 3.3Å; M205-K209 WeakPolarHBondContact O-CB 3.17Å; M205-K209 PolarHBondContact O-N 3.28Å; K206-K209 PolarHBondContact O-N 3.31Å
210	V	91.4	Very high	88.9	Confident	35 Å²	35	64.1 Å²	64.1	21%	0.212	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	9.6	170.1	-56.7	0	0	0	0	113.7	L148 V149 V161 K206 C207 L208 M212	L148-V210 HydrophobicContact CB-CB 4.28Å; L148-V210 HydrophobicContact CB-CG1 4.24Å; L148-V210 HydrophobicContact CB-CG2 4.47Å; V149-V210 HydrophobicContact CG2-CG2 3.65Å; V161-V210 HydrophobicContact CG1-CB 4.35Å; V161-V210 HydrophobicContact CG1-CG2 3.9Å; V161-V210 WeakPolarHBondContact CG2-O 3.49Å; K206-V210 HydrophobicContact CD-CG1 4.28Å; K206-V210 WeakPolarHBondContact O-CG1 3.4Å; K206-V210 WeakPolarHBondContact O-CG2 3.45Å; K206-V210 PolarHBondContact O-N 3.37Å; K206-V210 VanDerWaalsContact O-N 3.15Å; C207-V210 WeakPolarHBondContact O-CG2 3.45Å; C207-V210 PolarHBondContact O-N 3.01Å; L208-V210 PolarHBondContact O-N 3.09Å; L208-V210 VanDerWaalsContact O-N 3.16Å; V210-M212 HydrophobicContact CG2-CG 4.37Å
211	G	91.1	Very high	87.1	Confident	39 Å²	39	71.4 Å²	71.4	40%	0.402	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.1	23.4	174.5	0	0	0	0	0	115.7	V161 L208 L213	V161-G211 VanDerWaalsContact CG2-O 3.27Å; V161-G211 WeakPolarHBondContact CG2-O 3.25Å; L208-G211 PolarHBondContact O-N 3.05Å; G211-L213 PolarHBondContact O-N 3Å
212	M	94.8	Very high	85	Confident	5 Å²	5	76.5 Å²	76.5	3%	0.025	37%	0.371	C	S	.	.			trans	-70.8	113.2	174.4	-67.1	-165	118.3	0	0	110.8	V149 H158 Y159 V161 S163 F171 C207 V210 K214	V149-M212 HydrophobicContact CG2-SD 4.12Å; H158-M212 WeakPolarHBondContact O-CE 3.43Å; Y159-M212 HydrophobicContact CD2-CE 4.07Å; Y159-M212 WeakPolarHBondContact O-CA 3.44Å; V161-M212 HydrophobicContact CB-CE 4.45Å; V161-M212 HydrophobicContact CB-CG 3.99Å; V161-M212 HydrophobicContact CG2-CB 4.37Å; V161-M212 HydrophobicContact CG2-CG 3.68Å; S163-M212 VanDerWaalsContact OG-CE 3.24Å; S163-M212 WeakPolarHBondContact OG-CE 3.27Å; F171-M212 HydrophobicContact CB-SD 4.23Å; F171-M212 HydrophobicContact CD1-CB 4.36Å; F171-M212 HydrophobicContact CD2-CB 4.01Å; F171-M212 HydrophobicContact CD2-SD 4.23Å; F171-M212 HydrophobicContact CE1-CB 4.05Å; F171-M212 HydrophobicContact CE2-CB 3.67Å; F171-M212 HydrophobicContact CG-CB 4.34Å; F171-M212 HydrophobicContact CG-SD 4.13Å; F171-M212 HydrophobicContact CZ-CB 3.7Å; F171-M212 WeakPolarHBondContact CZ-O 3.45Å; C207-M212 HydrophobicContact CB-CB 4.25Å; C207-M212 HydrophobicContact CB-CG 4.2Å; C207-M212 HydrophobicContact CB-SD 3.73Å; C207-M212 VanDerWaalsContact O-CB 3.28Å; C207-M212 WeakPolarHBondContact O-CB 3.42Å; C207-M212 WeakPolarHBondContact O-CG 3.17Å; C207-M212 PolarHBondContact O-N 3.2Å; V210-M212 HydrophobicContact CG2-CG 4.37Å; M212-K214 PolarHBondContact O-N 2.77Å
213	L	89.3	Confident	82.4	Confident	53 Å²	53	88 Å²	88	28%	0.277	41%	0.413	S	S	.	.			trans	-73.1	118.6	-174.3	-61.1	-174.3	0	0	0	111.8	Y159 F171 G211 E215 G216 Y229	Y159-L213 PolarHBondContact O-N 3.15Å; F171-L213 WeakPolarHBondContact CE1-O 3.09Å; G211-L213 PolarHBondContact O-N 3Å; L213-E215 WeakPolarHBondContact CB-OE1 3.23Å; L213-G216 PolarHBondContact O-N 2.86Å; L213-G216 VanDerWaalsContact O-N 3.16Å; L213-Y229 HydrophobicContact CD1-CD1 3.88Å; L213-Y229 HydrophobicContact CD1-CE1 3.45Å; L213-Y229 VanDerWaalsContact CD1-CE1 3.45Å
214	K	89.3	Confident	80.1	Confident	110 Å²	110	90.6 Å²	90.6	48%	0.478	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-63.5	-44	-179.4	-65	-170.7	178.6	179.9	0	110.9	F171 I175 L208 M212 G216 V217	F171-K214 HydrophobicContact CZ-CG 4.27Å; I175-K214 HydrophobicContact CD1-CB 4.12Å; I175-K214 HydrophobicContact CD1-CD 4.04Å; I175-K214 HydrophobicContact CD1-CG 3.77Å; L208-K214 HydrophobicContact CD2-CD 4.32Å; L208-K214 HydrophobicContact CD2-CG 3.81Å; M212-K214 PolarHBondContact O-N 2.77Å; K214-G216 PolarHBondContact O-N 3.02Å; K214-V217 WeakPolarHBondContact O-CB 3.34Å; K214-V217 PolarHBondContact O-N 2.79Å
215	E	83.4	Confident	77.6	Confident	124 Å²	124	92.5 Å²	92.5	58%	0.579	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-64	-15.1	176.4	73.9	-75.2	-175.6	0	0	113.6	L213 V217	L213-E215 WeakPolarHBondContact CB-OE1 3.23Å; E215-V217 PolarHBondContact O-N 2.65Å
216	G	79.3	Confident	75.5	Confident	17 Å²	17	98.7 Å²	98.7	18%	0.175	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-71.2	-10.3	168.6	0	0	0	0	0	114	Y159 L213 K214 Y229	Y159-G216 WeakPolarHBondContact CD1-O 3.49Å; Y159-G216 VanDerWaalsContact CE1-O 3.32Å; Y159-G216 WeakPolarHBondContact CE1-O 3.26Å; L213-G216 PolarHBondContact O-N 2.86Å; L213-G216 VanDerWaalsContact O-N 3.16Å; K214-G216 PolarHBondContact O-N 3.02Å; G216-Y229 WeakPolarHBondContact CA-OH 3.5Å; G216-Y229 PolarHBondContact N-OH 3.26Å
217	V	82	Confident	73.3	Confident	9 Å²	9	100.3 Å²	100.3	6%	0.055	50%	0.501	C	S	.	.	S	Bend	trans	-98.5	94.7	177	-175.4	0	0	0	0	109.7	Y159 F171 K172 I175 Q176 K214 E215 L219	Y159-V217 HydrophobicContact CD1-CG2 3.83Å; Y159-V217 HydrophobicContact CE1-CB 4.47Å; Y159-V217 HydrophobicContact CE1-CG2 3.62Å; Y159-V217 HydrophobicContact CE2-CG2 4.49Å; Y159-V217 HydrophobicContact CG-CG2 4.38Å; F171-V217 HydrophobicContact CD1-CG2 3.82Å; F171-V217 HydrophobicContact CE1-CG2 3.76Å; K172-V217 HydrophobicContact CG-CG1 4.1Å; I175-V217 HydrophobicContact CB-CB 4.09Å; I175-V217 HydrophobicContact CB-CG1 4.04Å; I175-V217 HydrophobicContact CB-CG2 4.11Å; I175-V217 HydrophobicContact CG1-CG2 4.16Å; I175-V217 HydrophobicContact CG2-CB 3.82Å; I175-V217 HydrophobicContact CG2-CG1 4Å; I175-V217 HydrophobicContact CG2-CG2 4.29Å; Q176-V217 HydrophobicContact CG-CG1 3.5Å; K214-V217 WeakPolarHBondContact O-CB 3.34Å; K214-V217 PolarHBondContact O-N 2.79Å; E215-V217 PolarHBondContact O-N 2.65Å; V217-L219 PolarHBondContact O-N 2.67Å
218	R	77.1	Confident	70.8	Confident	134 Å²	134	110.1 Å²	110.1	51%	0.506	54%	0.544	S	S	.	.			trans	-55.8	132.6	170.2	-65.5	-169.8	64	96.6	12.7	110.7	Q176 D220	Q176-R218 PolarHBondContact NE2-O 3.3Å; R218-D220 IonicContact CZ-OD2 3.02Å; R218-D220 IonicContact NE-OD2 3.82Å; R218-D220 IonicContact NH2-OD2 2.67Å; R218-D220 PolarHBondContact NH2-OD2 2.87Å
219	L	65.3	Low	68.5	Low	122 Å²	122	112.2 Å²	112.2	64%	0.639	55%	0.549	S	S	*	.			trans	-78.8	-39.9	176.2	-64.1	175.5	0	0	0	111.5	V217	V217-L219 PolarHBondContact O-N 2.67Å
220	D	60	Low	65.8	Low	92 Å²	92	113.6 Å²	113.6	49%	0.492	56%	0.555	S	S	.	*	S	Bend	trans	-62.1	140.8	179	-32.3	-59.3	0	0	0	112.1	R218 V222	R218-D220 IonicContact CZ-OD2 3.02Å; R218-D220 IonicContact NE-OD2 3.82Å; R218-D220 IonicContact NH2-OD2 2.67Å; R218-D220 PolarHBondContact NH2-OD2 2.87Å; D220-V222 HydrophobicContact CB-CG2 3.98Å; D220-V222 PolarHBondContact O-N 2.9Å
221	R	58.7	Low	63.5	Low	251 Å²	251	121.1 Å²	121.1	95%	0.947	58%	0.579	S	S	*	*			trans	-79.9	9.3	177.7	-61.9	-178.8	-179.3	172.4	1.2	113.8
222	V	52.9	Low	60.7	Low	117 Å²	117	129.9 Å²	129.9	71%	0.709	60%	0.6	S	S	*	*			trans	-66.1	131.4	-176.3	-171	0	0	0	0	111	D220 G224	D220-V222 HydrophobicContact CB-CG2 3.98Å; D220-V222 PolarHBondContact O-N 2.9Å; V222-G224 PolarHBondContact O-N 3.42Å
223	R	42.4	Very low	57.9	Low	249 Å²	249	135 Å²	135	94%	0.94	63%	0.627	S	S	*	*			trans	-95.9	82.9	-166.4	-171.9	-177.4	-177.8	169.8	0.1	112.6
224	G	49.6	Very low	55.2	Low	75 Å²	75	138.9 Å²	138.9	77%	0.773	65%	0.648	S	S	*	*			trans	155.5	133.2	165.3	0	0	0	0	0	114.6	V222	V222-G224 PolarHBondContact O-N 3.42Å
225	G	45.8	Very low	52.5	Low	74 Å²	74	138.7 Å²	138.7	76%	0.763	66%	0.656	S	S	*	*			trans	152.8	116	173.9	0	0	0	0	0	113	Q227	G225-Q227 PolarHBondContact O-N 3.01Å
226	R	52.3	Low	50.2	Low	252 Å²	252	141.1 Å²	141.1	95%	0.951	67%	0.667	S	S	*	*			trans	-84.4	94.6	168.5	-79.4	-174.8	174.1	-180	-0.9	108.9	K228	R226-K228 PolarHBondContact O-N 2.87Å
227	Q	48.7	Very low	47.9	Very low	117 Å²	117	147.8 Å²	147.8	55%	0.547	70%	0.699	S	S	.	*			trans	-62	98.6	176.1	-158.9	90.3	-0	0	0	110.2	G225 Y229	G225-Q227 PolarHBondContact O-N 3.01Å; Q227-Y229 HydrophobicContact CB-CE2 4.45Å; Q227-Y229 HydrophobicContact CG-CD2 4.21Å; Q227-Y229 HydrophobicContact CG-CE2 3.8Å; Q227-Y229 PolarHBondContact O-N 3.25Å; Q227-Y229 VanDerWaalsContact O-N 3.1Å
228	K	44.8	Very low	45.7	Very low	206 Å²	206	154.1 Å²	154.1	90%	0.896	73%	0.733	S	S	*	*			trans	-73.9	94.2	174.3	-98.4	-172.5	174.6	179.8	0	109.6	R226 K230	R226-K228 PolarHBondContact O-N 2.87Å; K228-K230 PolarHBondContact O-N 2.91Å
229	Y	46.5	Very low	43.8	Very low	98 Å²	98	152.9 Å²	152.9	38%	0.384	74%	0.742	S	S	.	*			trans	-67.5	122.4	163.2	-82.9	-88.2	0	0	0	109.7	L213 G216 Q227 R231	L213-Y229 HydrophobicContact CD1-CD1 3.88Å; L213-Y229 HydrophobicContact CD1-CE1 3.45Å; L213-Y229 VanDerWaalsContact CD1-CE1 3.45Å; G216-Y229 WeakPolarHBondContact CA-OH 3.5Å; G216-Y229 PolarHBondContact N-OH 3.26Å; Q227-Y229 HydrophobicContact CB-CE2 4.45Å; Q227-Y229 HydrophobicContact CG-CD2 4.21Å; Q227-Y229 HydrophobicContact CG-CE2 3.8Å; Q227-Y229 PolarHBondContact O-N 3.25Å; Q227-Y229 VanDerWaalsContact O-N 3.1Å; Y229-R231 PolarHBondContact O-N 3.47Å
230	K	37.3	Very low	42.7	Very low	206 Å²	206	154.5 Å²	154.5	90%	0.896	74%	0.741	S	S	*	*			trans	-70.3	110.4	173.9	-174.8	179.5	179.9	-177.3	0	108.1	K228	K228-K230 PolarHBondContact O-N 2.91Å
231	R	42.6	Very low	41.9	Very low	194 Å²	194	159 Å²	159	73%	0.732	76%	0.764	S	S	*	*			trans	-62.2	135.2	170	-70.7	-175.9	-76	158.3	-3.5	109.1	Y229 L233	Y229-R231 PolarHBondContact O-N 3.47Å; R231-L233 HydrophobicContact CB-CD1 3.85Å
232	R	32.9	Very low	40.6	Very low	223 Å²	223	150 Å²	150	84%	0.842	75%	0.749	S	S	*	*			trans	-67.3	128.6	140.6	-79.9	-166.3	175.5	-145.4	2.4	106.4
233	L	36.7	Very low	40.1	Very low	111 Å²	111	153.4 Å²	153.4	58%	0.581	76%	0.762	S	S	*	*			trans	-95.7	100.4	162.4	-92.2	78.4	0	0	0	106.3	R231	R231-L233 HydrophobicContact CB-CD1 3.85Å
234	D	30.6	Very low	39.6	Very low	135 Å²	135	147.3 Å²	147.3	72%	0.722	75%	0.753	S	S	*	*			trans	-102.6	106.6	152.4	-61.3	-68	0	0	0	103.9
235	T	33.5	Very low	38.9	Very low	106 Å²	106	151 Å²	151	65%	0.65	75%	0.754	S	S	*	*			trans	-126.7	74.8	-169.8	-58.5	0	0	0	0	109.9
236	E	34.9	Very low	38.5	Very low	175 Å²	175	152.6 Å²	152.6	82%	0.818	75%	0.751	S	S	*	*			trans	-139	73.8	162.7	-94.1	-57.1	122.1	0	0	107.9
237	N	31.5	Very low	37.9	Very low	158 Å²	158	145.6 Å²	145.6	85%	0.845	74%	0.738	S	S	*	*			trans	174.2	127.6	152.1	-102	-67.6	0	0	0	111.5
238	N	35.8	Very low	37.5	Very low	141 Å²	141	144.1 Å²	144.1	75%	0.754	74%	0.739	S	S	*	*			trans	-115.3	101.4	172.2	179.2	22.5	0	0	0	110.2	Y240	N238-Y240 PolarHBondContact O-N 3.19Å
239	P	38.2	Very low	37.7	Very low	108 Å²	108	140.2 Å²	140.2	70%	0.701	73%	0.732	S	S	*	*			trans	-89.7	65.5	-165.9	36.2	-37.4	0	0	0	113.3
240	Y	41.1	Very low	38.1	Very low	156 Å²	156	140.5 Å²	140.5	61%	0.612	74%	0.736	S	S	*	*			trans	-144.2	65.2	171.9	-88.1	-70.3	0	0	0	113.6	P143 N238	P143-Y240 HydrophobicContact CB-CE1 4.28Å; P143-Y240 HydrophobicContact CB-CE2 4.27Å; N238-Y240 PolarHBondContact O-N 3.19Å
241	L	44.3	Very low	39.3	Very low	186 Å²	186	135.7 Å²	135.7	97%	0.974	72%	0.715	S	S	*	*	S	Bend	trans	178.6	97.6	137.9	-99.4	164.6	0	0	0	109.7
242	G	31.5	Very low	40.6	Very low	62 Å²	62	132.4 Å²	132.4	64%	0.639	72%	0.719	S	S	*	*			trans	176.9	118	176.6	0	0	0	0	0	112.4	T244	G242-T244 PolarHBondContact O-N 2.66Å
243	L	40.9	Very low	42.8	Very low	189 Å²	189	124.4 Å²	124.4	99%	0.99	69%	0.692	S	S	*	*			trans	-86.8	60.6	163.4	-79.6	169.3	0	0	0	109.3
244	T	33.3	Very low	45	Very low	122 Å²	122	120.3 Å²	120.3	75%	0.748	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-76	145.3	157.9	39.2	0	0	0	0	108.5	G242	G242-T244 PolarHBondContact O-N 2.66Å
245	L	34.5	Very low	47.7	Very low	151 Å²	151	123 Å²	123	79%	0.791	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-57.1	152	163.2	-73.7	82.3	0	0	0	108.2
246	P	36.1	Very low	50.5	Low	109 Å²	109	119.8 Å²	119.8	71%	0.708	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-52	132	167.2	24.4	-33.7	0	0	0	108
247	P	40	Very low	53.3	Low	104 Å²	104	111.4 Å²	111.4	68%	0.675	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-53.6	139.5	173.3	24.8	-33.6	0	0	0	107.5	T249	P247-T249 PolarHBondContact O-N 3.38Å
248	P	40.8	Very low	56.3	Low	86 Å²	86	106.1 Å²	106.1	56%	0.558	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-52.9	117.8	-174.8	22.2	-33	0	0	0	107.7	K250	P248-K250 VanDerWaalsContact C-N 3.31Å; P248-K250 PolarHBondContact O-N 3.19Å
249	T	48.8	Very low	58.9	Low	124 Å²	124	103.8 Å²	103.8	76%	0.761	58%	0.576	S	S	*	*			trans	-66.3	98.4	-178.1	48.8	0	0	0	0	106.7	P247 K251	P247-T249 PolarHBondContact O-N 3.38Å; T249-K251 PolarHBondContact O-N 3.09Å
250	K	54.2	Low	61.7	Low	105 Å²	105	98.6 Å²	98.6	46%	0.457	54%	0.543	S	S	.	.			trans	-34	110.4	179.5	-96.7	-161.3	166.6	-164.6	0	108.1	P248 E381	P248-K250 VanDerWaalsContact C-N 3.31Å; P248-K250 PolarHBondContact O-N 3.19Å; K250-E381 IonicContact NZ-OE1 2.74Å; K250-E381 PolarHBondContact NZ-OE1 3.01Å; K250-E381 IonicContact NZ-OE2 3.56Å; K250-E381 PolarHBondContact NZ-OE2 2.58Å
251	K	62.8	Low	64.2	Low	104 Å²	104	93 Å²	93	45%	0.452	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-61	154.6	-168.3	-55.5	-174.2	-163.6	155	0	108.5	T249 L253 Q425	T249-K251 PolarHBondContact O-N 3.09Å; K251-L253 PolarHBondContact O-N 3.39Å; K251-Q425 PolarHBondContact O-NE2 3.36Å
252	P	70	Confident	66.5	Low	125 Å²	125	90.2 Å²	90.2	81%	0.812	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-50.7	134.3	172.3	22.9	-35.1	0	0	0	110.5
253	L	79.2	Confident	69.4	Low	56 Å²	56	88.2 Å²	88.2	29%	0.293	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-57.1	152	-179.4	-62.5	178.4	0	0	0	111.3	K251 S258 L261 E383 F421	K251-L253 PolarHBondContact O-N 3.39Å; L253-S258 WeakPolarHBondContact CB-OG 3.35Å; L253-L261 HydrophobicContact CD1-CD1 3.62Å; L253-E383 HydrophobicContact CD1-CG 4.36Å; L253-E383 HydrophobicContact CD2-CG 4.23Å; L253-F421 HydrophobicContact CD2-CD2 3.81Å; L253-F421 HydrophobicContact CD2-CE2 3.58Å
254	T	83.7	Confident	71.9	Confident	24 Å²	24	80.7 Å²	80.7	15%	0.147	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-61.8	154.5	171.6	70	0	0	0	0	110.2	I256 V257 S258 D420	T254-I256 PolarHBondContact O-N 2.87Å; T254-V257 PolarHBondContact O-N 3.39Å; T254-V257 WeakPolarHBondContact OG1-CB 3.38Å; T254-V257 VanDerWaalsContact OG1-CG2 3.23Å; T254-V257 WeakPolarHBondContact OG1-CG2 3.29Å; T254-V257 PolarHBondContact OG1-N 2.82Å; T254-S258 VanDerWaalsContact O-CB 3.31Å; T254-S258 WeakPolarHBondContact O-CB 3.44Å; T254-S258 PolarHBondContact O-N 2.75Å; T254-S258 PolarHBondContact O-OG 2.69Å; T254-D420 HydrophobicContact CG2-CB 3.52Å
255	K	87.3	Confident	74.6	Confident	191 Å²	191	76.8 Å²	76.8	83%	0.83	43%	0.428	S	S	*	.	H	α-helix	trans	-59.5	-37.8	179.4	-68.5	-179.2	-178.9	174.9	0	112	H259	K255-H259 WeakPolarHBondContact O-CB 3.49Å; K255-H259 PolarHBondContact O-N 2.94Å
256	I	92.5	Very high	77.1	Confident	39 Å²	39	78.5 Å²	78.5	20%	0.2	43%	0.431	C	S	.	.	H	α-helix	trans	-67.5	-53.7	179.9	-68.1	170.7	0	0	0	110.3	T254 S258 H259 L260 P306 A413 L414 A417	T254-I256 PolarHBondContact O-N 2.87Å; I256-S258 VanDerWaalsContact C-N 3.28Å; I256-S258 PolarHBondContact O-N 3.43Å; I256-H259 PolarHBondContact O-N 3.13Å; I256-L260 HydrophobicContact CG2-CD1 3.94Å; I256-L260 HydrophobicContact CG2-CG 4.33Å; I256-L260 WeakPolarHBondContact O-CG 3.38Å; I256-L260 PolarHBondContact O-N 3.07Å; I256-P306 HydrophobicContact CG1-CB 4.45Å; I256-P306 HydrophobicContact CG1-CG 4.42Å; I256-A413 HydrophobicContact CD1-CB 4.3Å; I256-L414 HydrophobicContact CG2-CD2 4.01Å; I256-A417 HydrophobicContact CB-CB 3.76Å; I256-A417 HydrophobicContact CD1-CB 4.02Å; I256-A417 HydrophobicContact CG1-CB 4.47Å; I256-A417 HydrophobicContact CG2-CB 3.72Å
257	V	94	Very high	79.5	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	43%	0.425	C	S	.	.	H	α-helix	trans	-59.2	-41	177.9	176.2	0	0	0	0	111.3	T254 H259 L260 L261 E383 F421	T254-V257 PolarHBondContact O-N 3.39Å; T254-V257 WeakPolarHBondContact OG1-CB 3.38Å; T254-V257 VanDerWaalsContact OG1-CG2 3.23Å; T254-V257 WeakPolarHBondContact OG1-CG2 3.29Å; T254-V257 PolarHBondContact OG1-N 2.82Å; V257-H259 VanDerWaalsContact C-N 3.29Å; V257-H259 PolarHBondContact O-N 3.11Å; V257-L260 PolarHBondContact O-N 3.24Å; V257-L261 WeakPolarHBondContact O-CB 3.46Å; V257-L261 WeakPolarHBondContact O-CG 3.26Å; V257-L261 PolarHBondContact O-N 3.15Å; V257-E383 HydrophobicContact CG1-CB 3.76Å; V257-E383 HydrophobicContact CG1-CG 3.83Å; V257-F421 HydrophobicContact CG1-CD2 4.15Å; V257-F421 HydrophobicContact CG2-CB 4.25Å
258	S	92.8	Very high	81.8	Confident	47 Å²	47	75.9 Å²	75.9	33%	0.329	40%	0.4	S	S	.	.	H	α-helix	trans	-60.2	-37.3	175.1	-56	0	0	0	0	112.8	L253 T254 I256 V262	L253-S258 WeakPolarHBondContact CB-OG 3.35Å; T254-S258 VanDerWaalsContact O-CB 3.31Å; T254-S258 WeakPolarHBondContact O-CB 3.44Å; T254-S258 PolarHBondContact O-N 2.75Å; T254-S258 PolarHBondContact O-OG 2.69Å; I256-S258 VanDerWaalsContact C-N 3.28Å; I256-S258 PolarHBondContact O-N 3.43Å; S258-V262 WeakPolarHBondContact O-CG2 3.36Å
259	H	92.3	Very high	84.3	Confident	91 Å²	91	77.6 Å²	77.6	42%	0.421	40%	0.396	S	S	.	.	H	α-helix	trans	-75.5	-44.4	178.7	-161.4	86.8	0	0	0	111.3	K255 I256 V257 L261 V262 A263 H304 P306	K255-H259 WeakPolarHBondContact O-CB 3.49Å; K255-H259 PolarHBondContact O-N 2.94Å; I256-H259 PolarHBondContact O-N 3.13Å; V257-H259 VanDerWaalsContact C-N 3.29Å; V257-H259 PolarHBondContact O-N 3.11Å; H259-L261 VanDerWaalsContact C-N 3.31Å; H259-L261 PolarHBondContact O-N 2.84Å; H259-V262 PolarHBondContact O-N 3.07Å; H259-V262 VanDerWaalsContact O-N 3.07Å; H259-A263 WeakPolarHBondContact O-CB 3.22Å; H259-A263 PolarHBondContact O-N 3.27Å; H259-H304 PolarHBondContact CD2-O 3.26Å; H259-H304 PolarHBondContact NE2-O 3.38Å; H259-P306 HydrophobicContact CB-CG 4.28Å
260	L	95.3	Very high	86.4	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-59.7	-38.6	176.2	-66.3	176.2	0	0	0	112.2	I256 V257 V262 A263 E264 I305 V386 A390 L414	I256-L260 HydrophobicContact CG2-CD1 3.94Å; I256-L260 HydrophobicContact CG2-CG 4.33Å; I256-L260 WeakPolarHBondContact O-CG 3.38Å; I256-L260 PolarHBondContact O-N 3.07Å; V257-L260 PolarHBondContact O-N 3.24Å; L260-V262 VanDerWaalsContact C-N 3.27Å; L260-V262 PolarHBondContact O-N 2.92Å; L260-A263 PolarHBondContact O-N 2.87Å; L260-E264 WeakPolarHBondContact O-CB 3.47Å; L260-E264 PolarHBondContact O-N 3.31Å; L260-I305 HydrophobicContact CD2-CB 4.46Å; L260-I305 HydrophobicContact CD2-CG1 3.98Å; L260-I305 HydrophobicContact CD2-CG2 4.41Å; L260-V386 HydrophobicContact CB-CB 4.11Å; L260-V386 HydrophobicContact CB-CG2 3.73Å; L260-A390 HydrophobicContact CD1-CB 3.93Å; L260-A390 HydrophobicContact CD2-CB 4.07Å; L260-L414 HydrophobicContact CD1-CD2 4.3Å
261	L	93.9	Very high	88.2	Confident	37 Å²	37	73.1 Å²	73.1	19%	0.194	37%	0.37	C	S	.	.	H	α-helix	trans	-60.3	-33	174.2	-83	-177.3	0	0	0	114.2	L253 V257 H259 K382 E383 V386	L253-L261 HydrophobicContact CD1-CD1 3.62Å; V257-L261 WeakPolarHBondContact O-CB 3.46Å; V257-L261 WeakPolarHBondContact O-CG 3.26Å; V257-L261 PolarHBondContact O-N 3.15Å; H259-L261 VanDerWaalsContact C-N 3.31Å; H259-L261 PolarHBondContact O-N 2.84Å; L261-K382 HydrophobicContact CD2-CB 4.29Å; L261-K382 HydrophobicContact CD2-CD 3.85Å; L261-K382 HydrophobicContact CD2-CG 3.98Å; L261-E383 HydrophobicContact CD1-CG 3.91Å; L261-E383 HydrophobicContact CD2-CG 4.12Å; L261-E383 HydrophobicContact CG-CG 4.24Å; L261-V386 HydrophobicContact CD2-CG2 4.19Å; L261-V386 HydrophobicContact CG-CG2 4.44Å
262	V	92.7	Very high	89.5	Confident	128 Å²	128	70.2 Å²	70.2	78%	0.776	36%	0.362	S	S	*	.	H	α-helix	trans	-89.4	-30.9	-178.1	172.7	0	0	0	0	111.5	S258 H259 L260	S258-V262 WeakPolarHBondContact O-CG2 3.36Å; H259-V262 PolarHBondContact O-N 3.07Å; H259-V262 VanDerWaalsContact O-N 3.07Å; L260-V262 VanDerWaalsContact C-N 3.27Å; L260-V262 PolarHBondContact O-N 2.92Å
263	A	92.6	Very high	90.4	Very high	21 Å²	21	67.5 Å²	67.5	17%	0.174	34%	0.34	C	S	.	.	H	α-helix	trans	-75.6	-24.1	174	0	0	0	0	0	113.2	H259 L260 H304	H259-A263 WeakPolarHBondContact O-CB 3.22Å; H259-A263 PolarHBondContact O-N 3.27Å; L260-A263 PolarHBondContact O-N 2.87Å; A263-H304 HydrophobicContact CB-CB 3.64Å
264	E	92.9	Very high	90.8	Very high	31 Å²	31	70.7 Å²	70.7	15%	0.145	36%	0.364	C	S	.	.	S	Bend	trans	-57	125.2	-176.5	-178.6	60.1	-173.1	0	0	111.9	L260 W301 F385 V386 K389	L260-E264 WeakPolarHBondContact O-CB 3.47Å; L260-E264 PolarHBondContact O-N 3.31Å; E264-W301 PolarHBondContact OE2-NE1 3.45Å; E264-F385 WeakPolarHBondContact OE1-CE1 3.35Å; E264-V386 HydrophobicContact CB-CG1 3.88Å; E264-V386 HydrophobicContact CG-CG1 3.78Å; E264-K389 IonicContact OE1-NZ 3.4Å; E264-K389 PolarHBondContact OE1-NZ 3.2Å; E264-K389 IonicContact OE2-NZ 3.67Å; E264-K389 PolarHBondContact OE2-NZ 2.98Å
265	P	90	Very high	91	Very high	40 Å²	40	75.1 Å²	75.1	26%	0.26	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-63.2	162.6	-168.2	-26.2	36.4	0	0	0	116	V297 W301	P265-V297 HydrophobicContact CB-CG1 3.42Å; P265-V297 VanDerWaalsContact CB-CG1 3.42Å; P265-V297 HydrophobicContact CG-CG1 3.52Å; P265-W301 HydrophobicContact CG-CB 4.02Å; P265-W301 HydrophobicContact CG-CG 4.24Å
266	E	87.1	Confident	91	Very high	186 Å²	186	69.1 Å²	69.1	87%	0.869	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-68.9	161.9	170.4	-62.2	-162.7	164.9	0	0	112.6	I268	E266-I268 PolarHBondContact O-N 3.33Å
267	K	87.6	Confident	90.7	Very high	130 Å²	130	72.1 Å²	72.1	57%	0.565	39%	0.389	S	S	*	.			trans	-65.9	116	-178.4	-73.5	164	166.8	-81.3	0	111.2	E347	K267-E347 HydrophobicContact CB-CG 3.82Å; K267-E347 HydrophobicContact CD-CG 4.15Å; K267-E347 HydrophobicContact CG-CG 4.18Å; K267-E347 WeakPolarHBondContact CG-OE1 3.39Å; K267-E347 IonicContact NZ-OE1 2.71Å; K267-E347 PolarHBondContact NZ-OE1 2.74Å; K267-E347 IonicContact NZ-OE2 2.69Å; K267-E347 PolarHBondContact NZ-OE2 3.12Å
268	I	87.2	Confident	90.4	Very high	29 Å²	29	78.5 Å²	78.5	15%	0.149	42%	0.419	C	S	.	.			trans	-81.3	146.1	170.2	-170.5	163	0	0	0	112	E266 L290 R293 E294 R335	E266-I268 PolarHBondContact O-N 3.33Å; I268-L290 HydrophobicContact CD1-CD1 3.83Å; I268-L290 HydrophobicContact CG1-CD1 3.81Å; I268-L290 HydrophobicContact CG2-CD1 3.98Å; I268-R293 HydrophobicContact CD1-CB 3.74Å; I268-E294 HydrophobicContact CD1-CB 4.31Å; I268-R335 PolarHBondContact O-NH1 3.09Å
269	Y	92.9	Very high	90.4	Very high	122 Å²	122	78.1 Å²	78.1	48%	0.478	42%	0.416	S	S	.	.			trans	-110.6	140.3	175	-64.2	-94.8	0	0	0	110.5	R293 E347 D348	Y269-R293 PolarHBondContact O-NH1 3.31Å; Y269-E347 HydrophobicContact CD1-CB 3.88Å; Y269-E347 HydrophobicContact CE1-CB 3.59Å; Y269-E347 HydrophobicContact CE1-CG 4.11Å; Y269-D348 WeakPolarHBondContact CA-OD1 3.48Å; Y269-D348 HydrophobicContact CD1-CB 4.15Å
270	A	93.6	Very high	90.4	Very high	2 Å²	2	77.4 Å²	77.4	2%	0.017	42%	0.416	C	S	.	.			trans	-71.5	-41.1	179	0	0	0	0	0	112	T286 L290 R293 A346 D348 Y349	A270-T286 HydrophobicContact CB-CG2 3.9Å; A270-L290 HydrophobicContact CB-CD2 4.35Å; A270-R293 PolarHBondContact O-NH2 3.33Å; A270-A346 HydrophobicContact CB-CB 3.78Å; A270-D348 PolarHBondContact N-OD1 2.75Å; A270-D348 PolarHBondContact N-OD2 3.38Å; A270-Y349 HydrophobicContact CB-CD2 4.32Å; A270-Y349 HydrophobicContact CB-CG 4Å
271	M	91.9	Very high	90.3	Very high	132 Å²	132	80.4 Å²	80.4	65%	0.65	43%	0.431	S	S	*	.			trans	53.8	56.8	-175.7	-56.8	-63.6	-60.8	0	0	112.9	D348	M271-D348 PolarHBondContact N-OD2 2.77Å
272	P	90.3	Very high	90.3	Very high	44 Å²	44	79.6 Å²	79.6	29%	0.286	43%	0.426	S	S	.	.			trans	-59.6	138.8	178.5	26.2	-34.7	0	0	0	111.6	P274 T286 Y349	P272-P274 WeakPolarHBondContact O-CD 3.34Å; P272-T286 HydrophobicContact CB-CG2 3.95Å; P272-Y349 HydrophobicContact CB-CE2 4.45Å; P272-Y349 HydrophobicContact CG-CD2 4.27Å
273	D	88.1	Confident	90.4	Very high	67 Å²	67	73.5 Å²	73.5	36%	0.358	39%	0.389	S	S	.	.			trans	-61.3	117.6	-179	-175.8	-12.8	0	0	0	111.2	T275 M276 K282	D273-T275 VanDerWaalsContact CG-OG1 3.27Å; D273-T275 PolarHBondContact O-N 3.18Å; D273-T275 WeakPolarHBondContact OD1-CA 3.23Å; D273-T275 VanDerWaalsContact OD1-CB 3.31Å; D273-T275 WeakPolarHBondContact OD1-CB 3.14Å; D273-T275 WeakPolarHBondContact OD1-CG2 3.37Å; D273-T275 PolarHBondContact OD1-N 3.23Å; D273-T275 PolarHBondContact OD1-OG1 3.22Å; D273-T275 PolarHBondContact OD2-OG1 3.34Å; D273-T275 VanDerWaalsContact OD2-OG1 3.12Å; D273-M276 HydrophobicContact CB-CB 4.35Å; D273-M276 HydrophobicContact CB-CG 4.12Å; D273-K282 WeakPolarHBondContact O-CE 3.28Å; D273-K282 PolarHBondContact O-NZ 3.36Å
274	P	87.6	Confident	90.5	Very high	123 Å²	123	73.1 Å²	73.1	80%	0.799	38%	0.384	S	S	*	.	S	Bend	trans	-74.1	-12.8	179.4	32.3	-36.7	0	0	0	113.4	P272	P272-P274 WeakPolarHBondContact O-CD 3.34Å
275	T	88.8	Confident	90.7	Very high	118 Å²	118	72.5 Å²	72.5	72%	0.724	38%	0.382	S	S	*	.	S	Bend	trans	-85.6	-25	178.2	77	0	0	0	0	112.7	D273	D273-T275 VanDerWaalsContact CG-OG1 3.27Å; D273-T275 PolarHBondContact O-N 3.18Å; D273-T275 WeakPolarHBondContact OD1-CA 3.23Å; D273-T275 VanDerWaalsContact OD1-CB 3.31Å; D273-T275 WeakPolarHBondContact OD1-CB 3.14Å; D273-T275 WeakPolarHBondContact OD1-CG2 3.37Å; D273-T275 PolarHBondContact OD1-N 3.23Å; D273-T275 PolarHBondContact OD1-OG1 3.22Å; D273-T275 PolarHBondContact OD2-OG1 3.34Å; D273-T275 VanDerWaalsContact OD2-OG1 3.12Å
276	M	86.3	Confident	90.9	Very high	65 Å²	65	71.2 Å²	71.2	32%	0.32	37%	0.374	S	S	.	.	S	Bend	trans	-76.3	134.8	177	-73.7	-166.3	75.9	0	0	112.2	D273 K282	D273-M276 HydrophobicContact CB-CB 4.35Å; D273-M276 HydrophobicContact CB-CG 4.12Å; M276-K282 HydrophobicContact CB-CB 4.39Å; M276-K282 HydrophobicContact CB-CD 3.78Å; M276-K282 HydrophobicContact CB-CG 3.92Å; M276-K282 HydrophobicContact CE-CB 4.22Å; M276-K282 WeakPolarHBondContact O-CD 3.41Å; M276-K282 WeakPolarHBondContact O-CE 3.44Å; M276-K282 PolarHBondContact O-NZ 3.15Å; M276-K282 HydrophobicContact SD-CG 4.43Å
277	P	87.5	Confident	91.4	Very high	102 Å²	102	62.7 Å²	62.7	66%	0.662	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-68.2	147.7	173.4	30.7	-35.3	0	0	0	111.2	S279 K282	P277-S279 PolarHBondContact O-N 2.86Å; P277-S279 PolarHBondContact O-OG 3.3Å; P277-K282 WeakPolarHBondContact O-CD 3.36Å
278	E	88.1	Confident	91.8	Very high	133 Å²	133	56.5 Å²	56.5	62%	0.621	31%	0.307	S	S	*	.	S	Bend	trans	-64.8	124	-176.2	-149.6	54	-127.9	0	0	111.4	K282	E278-K282 WeakPolarHBondContact OE2-CE 3.49Å; E278-K282 IonicContact OE2-NZ 2.94Å; E278-K282 PolarHBondContact OE2-NZ 3.29Å
279	S	91.9	Very high	92.2	Very high	39 Å²	39	56.9 Å²	56.9	27%	0.273	31%	0.31	S	S	.	.	S	Bend	trans	-165.2	158.8	-166.6	50.8	0	0	0	0	111.4	P277 I281 K282 A283	P277-S279 PolarHBondContact O-N 2.86Å; P277-S279 PolarHBondContact O-OG 3.3Å; S279-I281 VanDerWaalsContact C-N 3.31Å; S279-I281 PolarHBondContact O-N 2.81Å; S279-K282 PolarHBondContact O-N 3.17Å; S279-K282 VanDerWaalsContact OG-CB 3.26Å; S279-K282 WeakPolarHBondContact OG-CB 3.37Å; S279-K282 PolarHBondContact OG-N 3.22Å; S279-A283 PolarHBondContact O-N 2.79Å
280	D	92.4	Very high	92.4	Very high	76 Å²	76	51.4 Å²	51.4	41%	0.406	29%	0.289	S	S	.	.	H	α-helix	trans	-54.3	-46.5	170	63.4	-35.1	0	0	0	111.5	K282 A283 L284	D280-K282 PolarHBondContact O-N 3Å; D280-A283 PolarHBondContact O-N 3.23Å; D280-L284 WeakPolarHBondContact O-CB 3.43Å; D280-L284 VanDerWaalsContact O-CG 3.24Å; D280-L284 WeakPolarHBondContact O-CG 3.1Å; D280-L284 PolarHBondContact O-N 2.91Å
281	I	93.3	Very high	92.5	Very high	64 Å²	64	52 Å²	52	33%	0.328	29%	0.293	S	S	.	.	H	α-helix	trans	-60.6	-44.9	179	-62	175.2	0	0	0	111.4	S279 T285	S279-I281 VanDerWaalsContact C-N 3.31Å; S279-I281 PolarHBondContact O-N 2.81Å; I281-T285 VanDerWaalsContact O-CB 3.31Å; I281-T285 WeakPolarHBondContact O-CB 3.33Å; I281-T285 PolarHBondContact O-N 2.9Å; I281-T285 PolarHBondContact O-OG1 3.49Å
282	K	93.8	Very high	92.6	Very high	19 Å²	19	45.7 Å²	45.7	8%	0.083	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-46.4	177.7	178.9	-172.2	177.9	178.4	0	111.8	D273 M276 P277 E278 S279 D280 T285 T286	D273-K282 WeakPolarHBondContact O-CE 3.28Å; D273-K282 PolarHBondContact O-NZ 3.36Å; M276-K282 HydrophobicContact CB-CB 4.39Å; M276-K282 HydrophobicContact CB-CD 3.78Å; M276-K282 HydrophobicContact CB-CG 3.92Å; M276-K282 HydrophobicContact CE-CB 4.22Å; M276-K282 WeakPolarHBondContact O-CD 3.41Å; M276-K282 WeakPolarHBondContact O-CE 3.44Å; M276-K282 PolarHBondContact O-NZ 3.15Å; M276-K282 HydrophobicContact SD-CG 4.43Å; P277-K282 WeakPolarHBondContact O-CD 3.36Å; E278-K282 WeakPolarHBondContact OE2-CE 3.49Å; E278-K282 IonicContact OE2-NZ 2.94Å; E278-K282 PolarHBondContact OE2-NZ 3.29Å; S279-K282 PolarHBondContact O-N 3.17Å; S279-K282 VanDerWaalsContact OG-CB 3.26Å; S279-K282 WeakPolarHBondContact OG-CB 3.37Å; S279-K282 PolarHBondContact OG-N 3.22Å; D280-K282 PolarHBondContact O-N 3Å; K282-T285 PolarHBondContact O-N 3.09Å; K282-T286 WeakPolarHBondContact O-CB 3.47Å; K282-T286 PolarHBondContact O-N 3.22Å; K282-T286 PolarHBondContact O-OG1 2.77Å
283	A	94.8	Very high	92.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64	-46.6	179.2	0	0	0	0	0	112	S279 D280 T285 T286 L287 Y349 T359	S279-A283 PolarHBondContact O-N 2.79Å; D280-A283 PolarHBondContact O-N 3.23Å; A283-T285 PolarHBondContact O-N 3.5Å; A283-T286 PolarHBondContact O-N 3.38Å; A283-L287 WeakPolarHBondContact O-CG 3.29Å; A283-L287 PolarHBondContact O-N 3.48Å; A283-Y349 WeakPolarHBondContact CA-OH 3.48Å; A283-Y349 VanDerWaalsContact CB-OH 3.28Å; A283-Y349 WeakPolarHBondContact CB-OH 3.33Å; A283-T359 HydrophobicContact CB-CG2 3.37Å
284	L	95.3	Very high	93.2	Very high	14 Å²	14	42.8 Å²	42.8	7%	0.073	24%	0.241	C	C	.	.	H	α-helix	trans	-65.5	-38.1	178.6	-66.9	177.7	0	0	0	112.2	D280 L287 C288 L361 I457 V463	D280-L284 WeakPolarHBondContact O-CB 3.43Å; D280-L284 VanDerWaalsContact O-CG 3.24Å; D280-L284 WeakPolarHBondContact O-CG 3.1Å; D280-L284 PolarHBondContact O-N 2.91Å; L284-L287 PolarHBondContact O-N 3.21Å; L284-C288 PolarHBondContact O-N 3.46Å; L284-C288 PolarHBondContact O-SG 2.95Å; L284-L361 HydrophobicContact CD2-CD1 4.27Å; L284-L361 HydrophobicContact CD2-CD2 3.75Å; L284-L361 HydrophobicContact CD2-CG 4.08Å; L284-I457 HydrophobicContact CD1-CD1 3.87Å; L284-I457 HydrophobicContact CD1-CG1 4.26Å; L284-I457 HydrophobicContact CD1-CG2 4.4Å; L284-I457 HydrophobicContact CD2-CD1 3.69Å; L284-I457 HydrophobicContact CG-CD1 4.31Å; L284-V463 HydrophobicContact CB-CG1 4.09Å; L284-V463 HydrophobicContact CB-CG2 3.79Å; L284-V463 HydrophobicContact CD1-CG2 4.11Å
285	T	95.3	Very high	93.6	Very high	18 Å²	18	37 Å²	37	11%	0.11	20%	0.203	C	C	.	.	H	α-helix	trans	-60.6	-52.8	172.8	-56.9	0	0	0	0	110.5	I281 K282 A283 L287 C288 D289 P464	I281-T285 VanDerWaalsContact O-CB 3.31Å; I281-T285 WeakPolarHBondContact O-CB 3.33Å; I281-T285 PolarHBondContact O-N 2.9Å; I281-T285 PolarHBondContact O-OG1 3.49Å; K282-T285 PolarHBondContact O-N 3.09Å; A283-T285 PolarHBondContact O-N 3.5Å; T285-L287 PolarHBondContact O-N 3.04Å; T285-C288 PolarHBondContact O-N 3.3Å; T285-D289 WeakPolarHBondContact CG2-OD2 3.38Å; T285-D289 PolarHBondContact O-N 3.06Å; T285-P464 HydrophobicContact CG2-CG 3.86Å
286	T	96	Very high	93.8	Very high	12 Å²	12	31.7 Å²	31.7	7%	0.074	17%	0.171	C	C	.	.	H	α-helix	trans	-53	-42.5	177.8	-56.8	0	0	0	0	111.9	A270 P272 K282 A283 L290 Y349	A270-T286 HydrophobicContact CB-CG2 3.9Å; P272-T286 HydrophobicContact CB-CG2 3.95Å; K282-T286 WeakPolarHBondContact O-CB 3.47Å; K282-T286 PolarHBondContact O-N 3.22Å; K282-T286 PolarHBondContact O-OG1 2.77Å; A283-T286 PolarHBondContact O-N 3.38Å; T286-L290 VanDerWaalsContact O-CB 3.22Å; T286-L290 WeakPolarHBondContact O-CB 3.5Å; T286-L290 PolarHBondContact O-N 3.05Å; T286-Y349 HydrophobicContact CG2-CD2 4.18Å; T286-Y349 HydrophobicContact CG2-CE2 4.03Å
287	L	96.7	Very high	94.1	Very high	8 Å²	8	31 Å²	31	4%	0.042	17%	0.17	C	C	.	.	H	α-helix	trans	-71.4	-36.5	178.2	-71	172.6	0	0	0	113.4	A283 L284 T285 A291 Y345 Y349 M351 L361 F454	A283-L287 WeakPolarHBondContact O-CG 3.29Å; A283-L287 PolarHBondContact O-N 3.48Å; L284-L287 PolarHBondContact O-N 3.21Å; T285-L287 PolarHBondContact O-N 3.04Å; L287-A291 VanDerWaalsContact O-CB 3.29Å; L287-A291 WeakPolarHBondContact O-CB 3.43Å; L287-A291 PolarHBondContact O-N 3.12Å; L287-Y345 HydrophobicContact CD2-CD1 3.45Å; L287-Y345 VanDerWaalsContact CD2-CD1 3.45Å; L287-Y345 HydrophobicContact CD2-CD2 4.28Å; L287-Y345 HydrophobicContact CD2-CE1 3.86Å; L287-Y345 HydrophobicContact CD2-CG 3.68Å; L287-Y349 HydrophobicContact CD2-CD1 4.08Å; L287-Y349 HydrophobicContact CD2-CE1 3.86Å; L287-Y349 HydrophobicContact CG-CE1 4.1Å; L287-M351 HydrophobicContact CD1-SD 4.37Å; L287-L361 HydrophobicContact CD1-CD1 3.4Å; L287-L361 VanDerWaalsContact CD1-CD1 3.4Å; L287-F454 HydrophobicContact CB-CZ 4.44Å
288	C	96.1	Very high	94.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-67	-43.2	174.9	-65.9	0	0	0	0	111.4	L284 T285 A291 D292 M465 F469	L284-C288 PolarHBondContact O-N 3.46Å; L284-C288 PolarHBondContact O-SG 2.95Å; T285-C288 PolarHBondContact O-N 3.3Å; C288-A291 PolarHBondContact O-N 3.37Å; C288-D292 PolarHBondContact O-N 3.35Å; C288-M465 HydrophobicContact CB-CG 4.32Å; C288-F469 HydrophobicContact CB-CD1 4.29Å; C288-F469 HydrophobicContact CB-CE1 4.08Å
289	D	95.3	Very high	94.6	Very high	37 Å²	37	20 Å²	20	20%	0.198	11%	0.11	C	C	.	.	H	α-helix	trans	-72.8	-30.3	179.7	-63.3	-29	0	0	0	112.1	T285 R293 H466	T285-D289 WeakPolarHBondContact CG2-OD2 3.38Å; T285-D289 PolarHBondContact O-N 3.06Å; D289-R293 WeakPolarHBondContact O-CG 3.15Å; D289-R293 PolarHBondContact O-N 3.26Å; D289-R293 PolarHBondContact O-NE 2.85Å; D289-H466 IonicContact OD1-CD2 2.71Å; D289-H466 IonicContact OD1-CE1 2.71Å; D289-H466 PolarHBondContact OD1-CE1 3.38Å; D289-H466 IonicContact OD1-CG 3.99Å; D289-H466 IonicContact OD1-ND1 2.74Å; D289-H466 PolarHBondContact OD1-ND1 3.23Å; D289-H466 IonicContact OD1-NE2 2.62Å
290	L	96.5	Very high	94.6	Very high	7 Å²	7	18.8 Å²	18.8	4%	0.037	10%	0.103	C	C	.	.	H	α-helix	trans	-65.1	-48.3	167.4	176.5	61	0	0	0	111.1	I268 A270 T286 D292 R293 E294 A346	I268-L290 HydrophobicContact CD1-CD1 3.83Å; I268-L290 HydrophobicContact CG1-CD1 3.81Å; I268-L290 HydrophobicContact CG2-CD1 3.98Å; A270-L290 HydrophobicContact CB-CD2 4.35Å; T286-L290 VanDerWaalsContact O-CB 3.22Å; T286-L290 WeakPolarHBondContact O-CB 3.5Å; T286-L290 PolarHBondContact O-N 3.05Å; L290-D292 PolarHBondContact O-N 3.47Å; L290-R293 PolarHBondContact O-N 3.23Å; L290-E294 PolarHBondContact O-N 2.74Å; L290-A346 HydrophobicContact CD1-CB 4.4Å; L290-A346 HydrophobicContact CD2-CB 4.09Å
291	A	96.3	Very high	94.7	Very high	13 Å²	13	15.4 Å²	15.4	11%	0.107	9%	0.085	C	C	.	.	H	α-helix	trans	-64.1	-39.9	-178.8	0	0	0	0	0	113	L287 C288 R293 E294 L295 L328 F469	L287-A291 VanDerWaalsContact O-CB 3.29Å; L287-A291 WeakPolarHBondContact O-CB 3.43Å; L287-A291 PolarHBondContact O-N 3.12Å; C288-A291 PolarHBondContact O-N 3.37Å; A291-R293 PolarHBondContact O-N 3.03Å; A291-E294 PolarHBondContact O-N 3.24Å; A291-L295 VanDerWaalsContact O-CB 3.31Å; A291-L295 WeakPolarHBondContact O-CB 3.24Å; A291-L295 VanDerWaalsContact O-CG 3.28Å; A291-L295 WeakPolarHBondContact O-CG 3.32Å; A291-L295 PolarHBondContact O-N 2.51Å; A291-L328 HydrophobicContact CB-CD1 4.21Å; A291-F469 HydrophobicContact CB-CD2 3.7Å; A291-F469 HydrophobicContact CB-CE2 3.52Å; A291-F469 HydrophobicContact CB-CZ 4.24Å
292	D	95.1	Very high	94.9	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-64.4	-38.4	175.8	-167.5	89.2	0	0	0	112.3	R44 C288 L290 V296 H466 L468 F469	R44-D292 IonicContact CZ-OD2 3.45Å; R44-D292 IonicContact NH1-OD2 3.19Å; R44-D292 PolarHBondContact NH1-OD2 3.17Å; R44-D292 IonicContact NH2-OD2 3.15Å; R44-D292 PolarHBondContact NH2-OD2 2.9Å; C288-D292 PolarHBondContact O-N 3.35Å; L290-D292 PolarHBondContact O-N 3.47Å; D292-V296 PolarHBondContact O-N 2.9Å; D292-H466 HydrophobicContact CB-CB 3.58Å; D292-H466 WeakPolarHBondContact OD1-CB 3.25Å; D292-H466 WeakPolarHBondContact OD2-CB 3.32Å; D292-H466 IonicContact OD2-CD2 3.4Å; D292-H466 PolarHBondContact OD2-CD2 3.44Å; D292-H466 IonicContact OD2-CG 3.83Å; D292-L468 WeakPolarHBondContact OD1-CA 3.24Å; D292-L468 WeakPolarHBondContact OD1-CB 3.18Å; D292-L468 PolarHBondContact OD1-N 3Å; D292-L468 VanDerWaalsContact OD1-N 3.15Å; D292-F469 HydrophobicContact CB-CB 3.96Å; D292-F469 PolarHBondContact OD1-N 3.46Å
293	R	94.5	Very high	94.8	Very high	33 Å²	33	13.7 Å²	13.7	13%	0.125	8%	0.075	C	C	.	.	H	α-helix	trans	-70.1	-44.4	174.5	-72	177.9	-73.1	152.2	-5.8	112.1	L41 I268 Y269 A270 D289 L290 A291 L295 V296 V297	L41-R293 HydrophobicContact CD2-CB 4.1Å; L41-R293 HydrophobicContact CD2-CG 3.74Å; I268-R293 HydrophobicContact CD1-CB 3.74Å; Y269-R293 PolarHBondContact O-NH1 3.31Å; A270-R293 PolarHBondContact O-NH2 3.33Å; D289-R293 WeakPolarHBondContact O-CG 3.15Å; D289-R293 PolarHBondContact O-N 3.26Å; D289-R293 PolarHBondContact O-NE 2.85Å; L290-R293 PolarHBondContact O-N 3.23Å; A291-R293 PolarHBondContact O-N 3.03Å; R293-L295 VanDerWaalsContact C-N 3.3Å; R293-L295 PolarHBondContact O-N 3.17Å; R293-V296 PolarHBondContact O-N 2.62Å; R293-V297 PolarHBondContact O-N 2.71Å
294	E	95.4	Very high	94.7	Very high	18 Å²	18	17.7 Å²	17.7	8%	0.084	9%	0.094	C	C	.	.	H	α-helix	trans	-67.3	-31.5	177.8	-165	171.8	157.2	0	0	111.5	I268 L290 A291 V297 I298 L328 S331 R335	I268-E294 HydrophobicContact CD1-CB 4.31Å; L290-E294 PolarHBondContact O-N 2.74Å; A291-E294 PolarHBondContact O-N 3.24Å; E294-V297 PolarHBondContact O-N 3.4Å; E294-I298 HydrophobicContact CG-CD1 4.02Å; E294-I298 HydrophobicContact CG-CG1 4.42Å; E294-I298 WeakPolarHBondContact O-CB 3.14Å; E294-I298 VanDerWaalsContact O-CG1 3.28Å; E294-I298 WeakPolarHBondContact O-CG1 3.36Å; E294-I298 PolarHBondContact O-N 2.83Å; E294-L328 HydrophobicContact CB-CD2 3.67Å; E294-L328 HydrophobicContact CG-CD2 3.59Å; E294-S331 WeakPolarHBondContact OE1-CB 3.47Å; E294-S331 PolarHBondContact OE1-OG 2.98Å; E294-R335 IonicContact OE2-NH2 2.69Å
295	L	95.3	Very high	94.8	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-57.6	-48.2	169.2	-86.1	170.2	0	0	0	112.8	A291 R293 V297 I298 I299 W324 L468 F469 M472	A291-L295 VanDerWaalsContact O-CB 3.31Å; A291-L295 WeakPolarHBondContact O-CB 3.24Å; A291-L295 VanDerWaalsContact O-CG 3.28Å; A291-L295 WeakPolarHBondContact O-CG 3.32Å; A291-L295 PolarHBondContact O-N 2.51Å; R293-L295 VanDerWaalsContact C-N 3.3Å; R293-L295 PolarHBondContact O-N 3.17Å; L295-V297 PolarHBondContact O-N 2.99Å; L295-I298 PolarHBondContact O-N 2.82Å; L295-I299 WeakPolarHBondContact O-CD1 3.46Å; L295-I299 VanDerWaalsContact O-CG1 3.28Å; L295-I299 WeakPolarHBondContact O-CG1 3.43Å; L295-I299 PolarHBondContact O-N 2.96Å; L295-W324 HydrophobicContact CD1-CE3 4.25Å; L295-W324 HydrophobicContact CD1-CZ3 4.34Å; L295-W324 HydrophobicContact CD2-CB 3.71Å; L295-W324 HydrophobicContact CD2-CD2 4.1Å; L295-W324 HydrophobicContact CD2-CE3 3.79Å; L295-W324 HydrophobicContact CD2-CG 4.13Å; L295-W324 HydrophobicContact CG-CE3 4.3Å; L295-L468 HydrophobicContact CB-CD2 3.93Å; L295-L468 HydrophobicContact CB-CG 4.46Å; L295-L468 HydrophobicContact CD1-CG 4.46Å; L295-F469 HydrophobicContact CD1-CB 4.14Å; L295-F469 HydrophobicContact CD1-CD2 3.94Å; L295-M472 HydrophobicContact CD1-CB 4.26Å; L295-M472 HydrophobicContact CD1-CG 4.13Å; L295-M472 HydrophobicContact CD2-CE 4.21Å; L295-M472 HydrophobicContact CD2-CG 4.32Å
296	V	93.3	Very high	94.7	Very high	7 Å²	7	18.7 Å²	18.7	4%	0.042	10%	0.101	C	C	.	.	H	α-helix	trans	-59	-39.3	176.4	174.2	0	0	0	0	111.1	F27 D292 R293 G300 L468	F27-V296 HydrophobicContact CD1-CG1 4.5Å; F27-V296 HydrophobicContact CE1-CG1 4.01Å; F27-V296 HydrophobicContact CE1-CG2 4.22Å; F27-V296 HydrophobicContact CZ-CG2 3.98Å; D292-V296 PolarHBondContact O-N 2.9Å; R293-V296 PolarHBondContact O-N 2.62Å; V296-G300 PolarHBondContact O-N 2.62Å; V296-L468 HydrophobicContact CG2-CD2 3.67Å
297	V	93.6	Very high	94.6	Very high	50 Å²	50	19.8 Å²	19.8	30%	0.303	11%	0.114	S	C	.	.	H	α-helix	trans	-68.1	-41.4	176.4	176.8	0	0	0	0	111.6	P265 R293 E294 L295 G300 W301	P265-V297 HydrophobicContact CB-CG1 3.42Å; P265-V297 VanDerWaalsContact CB-CG1 3.42Å; P265-V297 HydrophobicContact CG-CG1 3.52Å; R293-V297 PolarHBondContact O-N 2.71Å; E294-V297 PolarHBondContact O-N 3.4Å; L295-V297 PolarHBondContact O-N 2.99Å; V297-G300 PolarHBondContact O-N 2.71Å; V297-W301 WeakPolarHBondContact O-CB 3.41Å; V297-W301 PolarHBondContact O-N 3.45Å
298	I	93.7	Very high	94.6	Very high	3 Å²	3	19.4 Å²	19.4	2%	0.015	11%	0.112	C	C	.	.	H	α-helix	trans	-64.8	-41	177.9	-74.1	163.9	0	0	0	111.8	E294 L295 G300 W301 A302 L320 I327 L328	E294-I298 HydrophobicContact CG-CD1 4.02Å; E294-I298 HydrophobicContact CG-CG1 4.42Å; E294-I298 WeakPolarHBondContact O-CB 3.14Å; E294-I298 VanDerWaalsContact O-CG1 3.28Å; E294-I298 WeakPolarHBondContact O-CG1 3.36Å; E294-I298 PolarHBondContact O-N 2.83Å; L295-I298 PolarHBondContact O-N 2.82Å; I298-G300 VanDerWaalsContact C-N 3.3Å; I298-G300 PolarHBondContact O-N 3.42Å; I298-W301 HydrophobicContact CG2-CE3 4.29Å; I298-W301 PolarHBondContact O-N 2.96Å; I298-A302 WeakPolarHBondContact O-CB 3.28Å; I298-A302 PolarHBondContact O-N 3.21Å; I298-L320 HydrophobicContact CG2-CD2 4.21Å; I298-I327 HydrophobicContact CD1-CB 4.17Å; I298-I327 HydrophobicContact CD1-CG2 3.59Å; I298-I327 HydrophobicContact CG1-CG2 3.79Å; I298-I327 HydrophobicContact CG2-CB 4.45Å; I298-I327 HydrophobicContact CG2-CD1 3.95Å; I298-I327 HydrophobicContact CG2-CG2 3.95Å; I298-L328 HydrophobicContact CD1-CD2 3.54Å; I298-L328 HydrophobicContact CD1-CG 3.99Å
299	I	92.6	Very high	94.5	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.01	13%	0.134	C	C	.	.	H	α-helix	trans	-65.8	-36.3	176.9	-61	157.2	0	0	0	110.7	L24 F27 L28 L295 L320 L468	L24-I299 HydrophobicContact CD2-CD1 3.61Å; L24-I299 HydrophobicContact CD2-CG1 4.15Å; F27-I299 HydrophobicContact CB-CG2 3.62Å; F27-I299 HydrophobicContact CD2-CD1 4.28Å; L28-I299 HydrophobicContact CD2-CG2 3.88Å; L28-I299 HydrophobicContact CG-CG2 4.07Å; L295-I299 WeakPolarHBondContact O-CD1 3.46Å; L295-I299 VanDerWaalsContact O-CG1 3.28Å; L295-I299 WeakPolarHBondContact O-CG1 3.43Å; L295-I299 PolarHBondContact O-N 2.96Å; I299-L320 HydrophobicContact CG1-CD1 4.22Å; I299-L320 HydrophobicContact CG1-CD2 4.32Å; I299-L320 HydrophobicContact CG2-CD1 4.13Å; I299-L468 HydrophobicContact CD1-CD1 4.28Å; I299-L468 HydrophobicContact CD1-CD2 3.84Å
300	G	91.3	Very high	94.4	Very high	12 Å²	12	26.6 Å²	26.6	12%	0.124	16%	0.161	C	C	.	.	H	α-helix	trans	-64.5	-49.1	170.8	0	0	0	0	0	112.6	V296 V297 I298 A302 K303 H304	V296-G300 PolarHBondContact O-N 2.62Å; V297-G300 PolarHBondContact O-N 2.71Å; I298-G300 VanDerWaalsContact C-N 3.3Å; I298-G300 PolarHBondContact O-N 3.42Å; G300-A302 VanDerWaalsContact C-N 3.32Å; G300-A302 PolarHBondContact O-N 2.86Å; G300-K303 WeakPolarHBondContact O-CB 3.42Å; G300-K303 PolarHBondContact O-N 3.09Å; G300-H304 PolarHBondContact O-CD2 2.81Å
301	W	95.4	Very high	94.3	Very high	6 Å²	6	26.9 Å²	26.9	2%	0.023	16%	0.162	C	C	.	.	H	α-helix	trans	-56.8	-40.6	177.5	166.4	79.4	0	0	0	113	E264 P265 V297 I298 K303 H304 I305 I327 K389 L393	E264-W301 PolarHBondContact OE2-NE1 3.45Å; P265-W301 HydrophobicContact CG-CB 4.02Å; P265-W301 HydrophobicContact CG-CG 4.24Å; V297-W301 WeakPolarHBondContact O-CB 3.41Å; V297-W301 PolarHBondContact O-N 3.45Å; I298-W301 HydrophobicContact CG2-CE3 4.29Å; I298-W301 PolarHBondContact O-N 2.96Å; W301-K303 VanDerWaalsContact C-N 3.25Å; W301-K303 PolarHBondContact O-N 3.02Å; W301-H304 WeakPolarHBondContact O-CB 3.18Å; W301-H304 PolarHBondContact O-N 2.79Å; W301-I305 HydrophobicContact CD2-CD1 4.49Å; W301-I305 HydrophobicContact CE3-CD1 4.2Å; W301-I305 HydrophobicContact CH2-CD1 3.65Å; W301-I305 HydrophobicContact CH2-CG1 4.47Å; W301-I305 HydrophobicContact CZ2-CD1 3.98Å; W301-I305 HydrophobicContact CZ2-CG1 4.31Å; W301-I305 HydrophobicContact CZ3-CD1 3.78Å; W301-I327 HydrophobicContact CZ3-CD1 4.16Å; W301-I327 HydrophobicContact CZ3-CG2 4.21Å; W301-K389 HydrophobicContact CH2-CB 4.15Å; W301-K389 HydrophobicContact CH2-CD 3.97Å; W301-K389 HydrophobicContact CH2-CG 3.61Å; W301-K389 HydrophobicContact CZ2-CB 4.2Å; W301-K389 HydrophobicContact CZ2-CD 3.72Å; W301-K389 HydrophobicContact CZ2-CG 3.83Å; W301-K389 HydrophobicContact CZ3-CG 4.39Å; W301-L393 HydrophobicContact CZ3-CD2 4.32Å
302	A	96.2	Very high	94.2	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-56.7	-37.3	-178.7	0	0	0	0	0	112.8	I298 G300 H304 I305 F308 L320 L393	I298-A302 WeakPolarHBondContact O-CB 3.28Å; I298-A302 PolarHBondContact O-N 3.21Å; G300-A302 VanDerWaalsContact C-N 3.32Å; G300-A302 PolarHBondContact O-N 2.86Å; A302-H304 PolarHBondContact O-N 3.06Å; A302-H304 VanDerWaalsContact O-N 3.15Å; A302-I305 WeakPolarHBondContact O-CB 3.42Å; A302-I305 PolarHBondContact O-N 2.77Å; A302-F308 HydrophobicContact CB-CD1 4.07Å; A302-F308 HydrophobicContact CB-CE1 3.68Å; A302-F308 HydrophobicContact CB-CE2 4.43Å; A302-F308 HydrophobicContact CB-CZ 3.88Å; A302-F308 WeakPolarHBondContact O-CB 2.96Å; A302-F308 WeakPolarHBondContact O-CD1 3.24Å; A302-F308 WeakPolarHBondContact O-CG 3.19Å; A302-L320 HydrophobicContact CB-CD2 4.1Å; A302-L393 HydrophobicContact CB-CD2 3.86Å
303	K	92.7	Very high	94	Very high	46 Å²	46	31.5 Å²	31.5	20%	0.2	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-26.7	174.9	-60.9	-171.2	-176.5	-173	0	113.8	F27 L28 S29 A32 G300 W301 S309	F27-K303 WeakPolarHBondContact O-CE 3.43Å; F27-K303 PolarHBondContact O-NZ 2.83Å; L28-K303 VanDerWaalsContact CA-CE 3.49Å; L28-K303 HydrophobicContact CD2-CG 4.45Å; L28-K303 WeakPolarHBondContact O-CE 2.98Å; L28-K303 PolarHBondContact O-NZ 3.18Å; S29-K303 PolarHBondContact O-NZ 3.02Å; S29-K303 VanDerWaalsContact O-NZ 3.15Å; A32-K303 PolarHBondContact O-NZ 3.47Å; G300-K303 WeakPolarHBondContact O-CB 3.42Å; G300-K303 PolarHBondContact O-N 3.09Å; W301-K303 VanDerWaalsContact C-N 3.25Å; W301-K303 PolarHBondContact O-N 3.02Å; K303-S309 WeakPolarHBondContact CA-OG 3.33Å; K303-S309 PolarHBondContact O-OG 2.76Å
304	H	92.9	Very high	93.9	Very high	85 Å²	85	31 Å²	31	39%	0.394	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-2.1	-179.1	-62.3	-73	0	0	0	113.1	H259 A263 G300 W301 A302 P306	H259-H304 PolarHBondContact CD2-O 3.26Å; H259-H304 PolarHBondContact NE2-O 3.38Å; A263-H304 HydrophobicContact CB-CB 3.64Å; G300-H304 PolarHBondContact O-CD2 2.81Å; W301-H304 WeakPolarHBondContact O-CB 3.18Å; W301-H304 PolarHBondContact O-N 2.79Å; A302-H304 PolarHBondContact O-N 3.06Å; A302-H304 VanDerWaalsContact O-N 3.15Å; H304-P306 WeakPolarHBondContact O-CD 3.11Å
305	I	96.1	Very high	93.8	Very high	3 Å²	3	30.1 Å²	30.1	2%	0.015	19%	0.189	C	C	.	.	S	Bend	trans	-74.9	123.2	173.1	-62.2	167.5	0	0	0	108.6	L260 W301 A302 G307 F308 A390 L393 L410 L414	L260-I305 HydrophobicContact CD2-CB 4.46Å; L260-I305 HydrophobicContact CD2-CG1 3.98Å; L260-I305 HydrophobicContact CD2-CG2 4.41Å; W301-I305 HydrophobicContact CD2-CD1 4.49Å; W301-I305 HydrophobicContact CE3-CD1 4.2Å; W301-I305 HydrophobicContact CH2-CD1 3.65Å; W301-I305 HydrophobicContact CH2-CG1 4.47Å; W301-I305 HydrophobicContact CZ2-CD1 3.98Å; W301-I305 HydrophobicContact CZ2-CG1 4.31Å; W301-I305 HydrophobicContact CZ3-CD1 3.78Å; A302-I305 WeakPolarHBondContact O-CB 3.42Å; A302-I305 PolarHBondContact O-N 2.77Å; I305-G307 PolarHBondContact O-N 3.28Å; I305-G307 VanDerWaalsContact O-N 3.09Å; I305-F308 HydrophobicContact CB-CB 3.92Å; I305-F308 HydrophobicContact CG2-CB 4.31Å; I305-F308 WeakPolarHBondContact O-CB 3.29Å; I305-F308 PolarHBondContact O-N 2.85Å; I305-A390 HydrophobicContact CD1-CB 4.23Å; I305-A390 HydrophobicContact CG1-CB 4.48Å; I305-A390 HydrophobicContact CG2-CB 4.36Å; I305-L393 HydrophobicContact CD1-CD2 3.46Å; I305-L393 VanDerWaalsContact CD1-CD2 3.46Å; I305-L410 HydrophobicContact CG2-CD1 4.27Å; I305-L414 HydrophobicContact CG2-CD2 4.36Å
306	P	94.6	Very high	93.7	Very high	50 Å²	50	30.9 Å²	30.9	33%	0.325	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	117.3	-179.5	-26	35.7	0	0	0	111.8	I256 H259 H304 L410	I256-P306 HydrophobicContact CG1-CB 4.45Å; I256-P306 HydrophobicContact CG1-CG 4.42Å; H259-P306 HydrophobicContact CB-CG 4.28Å; H304-P306 WeakPolarHBondContact O-CD 3.11Å; P306-L410 VanDerWaalsContact O-CD1 3.25Å; P306-L410 WeakPolarHBondContact O-CD1 3.11Å
307	G	93.6	Very high	93.6	Very high	34 Å²	34	31.3 Å²	31.3	35%	0.351	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.6	-10.8	-178.5	0	0	0	0	0	115.7	I305 T310	I305-G307 PolarHBondContact O-N 3.28Å; I305-G307 VanDerWaalsContact O-N 3.09Å; G307-T310 WeakPolarHBondContact CA-OG1 3.3Å; G307-T310 PolarHBondContact O-OG1 3.28Å
308	F	96.1	Very high	93.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-70.5	-50	178.7	-179	-93.2	0	0	0	112.3	L28 A302 I305 T310 L311 Q316 L319 L320 L393 L410	L28-F308 HydrophobicContact CD2-CE1 4.21Å; A302-F308 HydrophobicContact CB-CD1 4.07Å; A302-F308 HydrophobicContact CB-CE1 3.68Å; A302-F308 HydrophobicContact CB-CE2 4.43Å; A302-F308 HydrophobicContact CB-CZ 3.88Å; A302-F308 WeakPolarHBondContact O-CB 2.96Å; A302-F308 WeakPolarHBondContact O-CD1 3.24Å; A302-F308 WeakPolarHBondContact O-CG 3.19Å; I305-F308 HydrophobicContact CB-CB 3.92Å; I305-F308 HydrophobicContact CG2-CB 4.31Å; I305-F308 WeakPolarHBondContact O-CB 3.29Å; I305-F308 PolarHBondContact O-N 2.85Å; F308-T310 PolarHBondContact O-N 3.26Å; F308-L311 HydrophobicContact CD2-CD1 4.33Å; F308-L311 WeakPolarHBondContact O-CB 3.29Å; F308-L311 WeakPolarHBondContact O-CG 3.3Å; F308-L311 PolarHBondContact O-N 3.42Å; F308-Q316 HydrophobicContact CD1-CG 4.04Å; F308-Q316 HydrophobicContact CE1-CB 3.78Å; F308-Q316 HydrophobicContact CE1-CG 3.6Å; F308-Q316 HydrophobicContact CE2-CB 4.31Å; F308-Q316 HydrophobicContact CE2-CG 4.26Å; F308-Q316 HydrophobicContact CZ-CB 3.56Å; F308-Q316 HydrophobicContact CZ-CG 3.73Å; F308-Q316 WeakPolarHBondContact CZ-O 3.37Å; F308-L319 HydrophobicContact CD2-CD1 4.14Å; F308-L319 HydrophobicContact CE2-CB 4.21Å; F308-L319 HydrophobicContact CE2-CD1 3.87Å; F308-L320 HydrophobicContact CZ-CD1 4.11Å; F308-L320 HydrophobicContact CZ-CG 4.23Å; F308-L393 HydrophobicContact CD2-CD2 3.81Å; F308-L393 HydrophobicContact CE2-CD1 4.46Å; F308-L393 HydrophobicContact CE2-CD2 3.63Å; F308-L393 HydrophobicContact CE2-CG 4.15Å; F308-L393 HydrophobicContact CZ-CD2 4.31Å; F308-L410 HydrophobicContact CB-CD2 4.35Å; F308-L410 HydrophobicContact CD2-CD2 4.28Å
309	S	94	Very high	93.6	Very high	64 Å²	64	29.2 Å²	29.2	45%	0.448	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-70.9	4.5	178.8	-65.4	0	0	0	0	115.3	K303	K303-S309 WeakPolarHBondContact CA-OG 3.33Å; K303-S309 PolarHBondContact O-OG 2.76Å
310	T	93.3	Very high	93.7	Very high	125 Å²	125	29.2 Å²	29.2	77%	0.767	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-98.4	-6.5	168.9	41.9	0	0	0	0	113.7	G307 F308	G307-T310 WeakPolarHBondContact CA-OG1 3.3Å; G307-T310 PolarHBondContact O-OG1 3.28Å; F308-T310 PolarHBondContact O-N 3.26Å
311	L	94.3	Very high	93.8	Very high	13 Å²	13	29.6 Å²	29.6	7%	0.068	18%	0.18	C	C	.	.	S	Bend	trans	-74.7	163.8	171.8	-59.1	177.8	0	0	0	111.5	F308 D315 Q316 L319 A406 V407 L410	F308-L311 HydrophobicContact CD2-CD1 4.33Å; F308-L311 WeakPolarHBondContact O-CB 3.29Å; F308-L311 WeakPolarHBondContact O-CG 3.3Å; F308-L311 PolarHBondContact O-N 3.42Å; L311-D315 HydrophobicContact CB-CB 4.08Å; L311-Q316 HydrophobicContact CB-CG 4.02Å; L311-Q316 PolarHBondContact O-NE2 3.43Å; L311-L319 HydrophobicContact CD1-CD1 3.49Å; L311-L319 VanDerWaalsContact CD1-CD1 3.49Å; L311-A406 HydrophobicContact CD2-CB 3.63Å; L311-V407 HydrophobicContact CD1-CG2 4.16Å; L311-V407 HydrophobicContact CD2-CG2 4.09Å; L311-L410 HydrophobicContact CD1-CD2 3.79Å
312	S	94	Very high	93.6	Very high	43 Å²	43	30 Å²	30	30%	0.301	18%	0.184	S	C	.	.			trans	-51.4	150.2	167	162.8	0	0	0	0	111.4	G314 D315 Q316 E402	S312-G314 VanDerWaalsContact C-N 3.26Å; S312-G314 PolarHBondContact O-N 3.03Å; S312-G314 PolarHBondContact OG-N 3.28Å; S312-D315 WeakPolarHBondContact CB-OD2 3.49Å; S312-D315 PolarHBondContact O-N 2.84Å; S312-Q316 WeakPolarHBondContact O-CG 3.44Å; S312-Q316 PolarHBondContact O-N 3.39Å; S312-E402 VanDerWaalsContact CB-OE2 3.28Å; S312-E402 WeakPolarHBondContact CB-OE2 3.33Å; S312-E402 PolarHBondContact OG-OE2 3.02Å
313	L	91.6	Very high	93.5	Very high	67 Å²	67	30 Å²	30	35%	0.351	18%	0.184	S	C	.	.	H	α-helix	trans	-64.2	-34.7	172.1	-175.6	53.8	0	0	0	111.2	E25 L28 M317	E25-L313 HydrophobicContact CB-CD2 4.44Å; E25-L313 HydrophobicContact CG-CD2 3.98Å; E25-L313 HydrophobicContact CG-CG 4.42Å; L28-L313 HydrophobicContact CB-CD1 3.61Å; L28-L313 HydrophobicContact CD1-CD1 3.8Å; L28-L313 HydrophobicContact CG-CD1 4.37Å; L313-M317 HydrophobicContact CD1-CG 4.45Å; L313-M317 HydrophobicContact CD1-SD 4.14Å; L313-M317 HydrophobicContact CG-SD 4.15Å; L313-M317 WeakPolarHBondContact O-CB 3.28Å; L313-M317 WeakPolarHBondContact O-CG 3.46Å; L313-M317 PolarHBondContact O-N 2.94Å; L313-M317 VanDerWaalsContact O-N 3.17Å
314	G	91.5	Very high	93.7	Very high	22 Å²	22	27.8 Å²	27.8	23%	0.227	18%	0.175	C	C	.	.	H	α-helix	trans	-60.9	-48.1	170.7	0	0	0	0	0	111.7	S312 M317 S318	S312-G314 VanDerWaalsContact C-N 3.26Å; S312-G314 PolarHBondContact O-N 3.03Å; S312-G314 PolarHBondContact OG-N 3.28Å; G314-M317 PolarHBondContact O-N 3.27Å; G314-S318 WeakPolarHBondContact O-CB 3.5Å; G314-S318 PolarHBondContact O-N 3.26Å
315	D	93.5	Very high	93.9	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.9	-48	177.8	-72.7	-28.4	0	0	0	112.6	L311 S312 M317 S318 L319 I401 E402 D403 V407	L311-D315 HydrophobicContact CB-CB 4.08Å; S312-D315 WeakPolarHBondContact CB-OD2 3.49Å; S312-D315 PolarHBondContact O-N 2.84Å; D315-M317 PolarHBondContact O-N 3.5Å; D315-S318 PolarHBondContact O-N 3.31Å; D315-L319 VanDerWaalsContact O-CG 3.31Å; D315-L319 WeakPolarHBondContact O-CG 3.38Å; D315-L319 PolarHBondContact O-N 3.39Å; D315-I401 VanDerWaalsContact OD1-CA 3.29Å; D315-I401 WeakPolarHBondContact OD1-CA 3.25Å; D315-I401 WeakPolarHBondContact OD1-CG2 3.34Å; D315-E402 PolarHBondContact OD1-N 3.46Å; D315-D403 PolarHBondContact OD2-N 2.85Å; D315-D403 VanDerWaalsContact OD2-N 3.12Å; D315-V407 HydrophobicContact CB-CG2 4.43Å
316	Q	94.3	Very high	93.9	Very high	17 Å²	17	24.1 Å²	24.1	8%	0.079	16%	0.158	C	C	.	.	H	α-helix	trans	-54.2	-38.3	176.1	-71.7	177	56.4	0	0	111.5	L28 F308 L311 S312 L320	L28-Q316 HydrophobicContact CD1-CB 4Å; F308-Q316 HydrophobicContact CD1-CG 4.04Å; F308-Q316 HydrophobicContact CE1-CB 3.78Å; F308-Q316 HydrophobicContact CE1-CG 3.6Å; F308-Q316 HydrophobicContact CE2-CB 4.31Å; F308-Q316 HydrophobicContact CE2-CG 4.26Å; F308-Q316 HydrophobicContact CZ-CB 3.56Å; F308-Q316 HydrophobicContact CZ-CG 3.73Å; F308-Q316 WeakPolarHBondContact CZ-O 3.37Å; L311-Q316 HydrophobicContact CB-CG 4.02Å; L311-Q316 PolarHBondContact O-NE2 3.43Å; S312-Q316 WeakPolarHBondContact O-CG 3.44Å; S312-Q316 PolarHBondContact O-N 3.39Å; Q316-L320 WeakPolarHBondContact O-CD1 3.45Å; Q316-L320 WeakPolarHBondContact O-CG 3.5Å; Q316-L320 PolarHBondContact O-N 3.48Å
317	M	91.4	Very high	94.1	Very high	15 Å²	15	21.8 Å²	21.8	7%	0.074	14%	0.142	C	C	.	.	H	α-helix	trans	-75.3	-44.6	178.3	-67.2	179.2	-7.8	0	0	112.3	S21 L24 E25 L28 L313 G314 D315 L319 L320 Q321	S21-M317 WeakPolarHBondContact OG-CE 3.28Å; L24-M317 HydrophobicContact CB-CG 3.65Å; L24-M317 HydrophobicContact CB-SD 3.65Å; L24-M317 HydrophobicContact CD1-CB 3.95Å; L24-M317 HydrophobicContact CD1-CG 4Å; L24-M317 HydrophobicContact CG-CG 4.49Å; E25-M317 HydrophobicContact CB-SD 4.48Å; E25-M317 HydrophobicContact CG-CE 4.27Å; E25-M317 HydrophobicContact CG-SD 3.78Å; L28-M317 HydrophobicContact CD1-CG 3.38Å; L28-M317 HydrophobicContact CD1-SD 4.24Å; L313-M317 HydrophobicContact CD1-CG 4.45Å; L313-M317 HydrophobicContact CD1-SD 4.14Å; L313-M317 HydrophobicContact CG-SD 4.15Å; L313-M317 WeakPolarHBondContact O-CB 3.28Å; L313-M317 WeakPolarHBondContact O-CG 3.46Å; L313-M317 PolarHBondContact O-N 2.94Å; L313-M317 VanDerWaalsContact O-N 3.17Å; G314-M317 PolarHBondContact O-N 3.27Å; D315-M317 PolarHBondContact O-N 3.5Å; M317-L319 VanDerWaalsContact C-N 3.34Å; M317-L319 PolarHBondContact O-N 3.37Å; M317-L320 PolarHBondContact O-N 3.12Å; M317-Q321 WeakPolarHBondContact O-CB 3.35Å; M317-Q321 WeakPolarHBondContact O-CG 3.45Å; M317-Q321 PolarHBondContact O-N 3.32Å
318	S	92.5	Very high	94.2	Very high	10 Å²	10	20.6 Å²	20.6	7%	0.07	13%	0.128	C	C	.	.	H	α-helix	trans	-56.7	-43.9	173.9	-87.1	0	0	0	0	112.5	G314 D315 S322 S398 H400	G314-S318 WeakPolarHBondContact O-CB 3.5Å; G314-S318 PolarHBondContact O-N 3.26Å; D315-S318 PolarHBondContact O-N 3.31Å; S318-S322 WeakPolarHBondContact O-CB 3.42Å; S318-S322 PolarHBondContact O-N 2.87Å; S318-S322 PolarHBondContact O-OG 3.49Å; S318-S398 PolarHBondContact OG-OG 3.43Å; S318-H400 PolarHBondContact OG-O 2.87Å
319	L	94.7	Very high	94.3	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.7	-51.9	175.3	-66.7	-176.6	0	0	0	110.8	F308 L311 D315 M317 Q321 S322 A323 L393 I401 V407 L410	F308-L319 HydrophobicContact CD2-CD1 4.14Å; F308-L319 HydrophobicContact CE2-CB 4.21Å; F308-L319 HydrophobicContact CE2-CD1 3.87Å; L311-L319 HydrophobicContact CD1-CD1 3.49Å; L311-L319 VanDerWaalsContact CD1-CD1 3.49Å; D315-L319 VanDerWaalsContact O-CG 3.31Å; D315-L319 WeakPolarHBondContact O-CG 3.38Å; D315-L319 PolarHBondContact O-N 3.39Å; M317-L319 VanDerWaalsContact C-N 3.34Å; M317-L319 PolarHBondContact O-N 3.37Å; L319-Q321 PolarHBondContact O-N 2.82Å; L319-S322 PolarHBondContact O-N 3.25Å; L319-S322 PolarHBondContact O-OG 2.87Å; L319-A323 WeakPolarHBondContact O-CB 3.36Å; L319-A323 PolarHBondContact O-N 3.1Å; L319-L393 HydrophobicContact CB-CD1 4.03Å; L319-L393 HydrophobicContact CB-CG 4.38Å; L319-I401 HydrophobicContact CD2-CD1 3.98Å; L319-I401 HydrophobicContact CG-CD1 4.42Å; L319-V407 HydrophobicContact CD2-CG1 4.12Å; L319-L410 HydrophobicContact CD1-CD2 4.47Å
320	L	94.5	Very high	94.5	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-60.1	-46.5	178.6	-78.6	164.5	0	0	0	112.9	L28 I298 I299 A302 F308 Q316 M317 S322 A323 W324 L393	L28-L320 HydrophobicContact CD1-CD1 4.15Å; L28-L320 HydrophobicContact CD2-CD1 4.02Å; L28-L320 HydrophobicContact CG-CD1 4.48Å; I298-L320 HydrophobicContact CG2-CD2 4.21Å; I299-L320 HydrophobicContact CG1-CD1 4.22Å; I299-L320 HydrophobicContact CG1-CD2 4.32Å; I299-L320 HydrophobicContact CG2-CD1 4.13Å; A302-L320 HydrophobicContact CB-CD2 4.1Å; F308-L320 HydrophobicContact CZ-CD1 4.11Å; F308-L320 HydrophobicContact CZ-CG 4.23Å; Q316-L320 WeakPolarHBondContact O-CD1 3.45Å; Q316-L320 WeakPolarHBondContact O-CG 3.5Å; Q316-L320 PolarHBondContact O-N 3.48Å; M317-L320 PolarHBondContact O-N 3.12Å; L320-S322 PolarHBondContact O-N 3.26Å; L320-A323 PolarHBondContact O-N 3.18Å; L320-W324 WeakPolarHBondContact O-CB 3.21Å; L320-W324 PolarHBondContact O-N 3.02Å; L320-L393 HydrophobicContact CD2-CD1 3.88Å; L320-L393 HydrophobicContact CG-CD1 4.05Å
321	Q	91.9	Very high	94.8	Very high	20 Å²	20	12.4 Å²	12.4	9%	0.093	8%	0.075	C	C	.	.	H	α-helix	trans	-59.2	-35.8	176.6	-72.9	173	12.9	0	0	112.2	L20 L24 M317 L319 W324 M472 A475 K476	L20-Q321 HydrophobicContact CD2-CG 3.74Å; L24-Q321 HydrophobicContact CD1-CG 3.87Å; M317-Q321 WeakPolarHBondContact O-CB 3.35Å; M317-Q321 WeakPolarHBondContact O-CG 3.45Å; M317-Q321 PolarHBondContact O-N 3.32Å; L319-Q321 PolarHBondContact O-N 2.82Å; Q321-W324 VanDerWaalsContact O-CD1 3.24Å; Q321-M472 HydrophobicContact CG-SD 4.42Å; Q321-A475 HydrophobicContact CB-CB 4.42Å; Q321-A475 HydrophobicContact CG-CB 4.18Å; Q321-K476 WeakPolarHBondContact O-CE 3.45Å
322	S	92	Very high	94.9	Very high	15 Å²	15	12.5 Å²	12.5	11%	0.105	8%	0.076	C	C	.	.	H	α-helix	trans	-76.2	-35.5	178.6	75.9	0	0	0	0	114.1	S318 L319 L320 S396 K476	S318-S322 WeakPolarHBondContact O-CB 3.42Å; S318-S322 PolarHBondContact O-N 2.87Å; S318-S322 PolarHBondContact O-OG 3.49Å; L319-S322 PolarHBondContact O-N 3.25Å; L319-S322 PolarHBondContact O-OG 2.87Å; L320-S322 PolarHBondContact O-N 3.26Å; S322-S396 WeakPolarHBondContact CB-OG 3.39Å; S322-S396 VanDerWaalsContact OG-CB 3.27Å; S322-S396 WeakPolarHBondContact OG-CB 3.28Å; S322-S396 PolarHBondContact OG-OG 3.25Å; S322-K476 WeakPolarHBondContact O-CE 3.35Å; S322-K476 PolarHBondContact O-NZ 2.83Å
323	A	95.1	Very high	95.2	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-111.8	-11.2	-164	0	0	0	0	0	115.4	L319 L320 M325 E326 I327 A392 L393	L319-A323 WeakPolarHBondContact O-CB 3.36Å; L319-A323 PolarHBondContact O-N 3.1Å; L320-A323 PolarHBondContact O-N 3.18Å; A323-M325 VanDerWaalsContact C-N 3.34Å; A323-M325 PolarHBondContact O-N 3.39Å; A323-M325 VanDerWaalsContact O-N 3.15Å; A323-E326 WeakPolarHBondContact O-CA 3.46Å; A323-E326 WeakPolarHBondContact O-CB 3.46Å; A323-E326 PolarHBondContact O-N 3.02Å; A323-I327 HydrophobicContact CB-CD1 4.19Å; A323-I327 WeakPolarHBondContact O-CG1 3.5Å; A323-I327 PolarHBondContact O-N 2.97Å; A323-I327 VanDerWaalsContact O-N 3.08Å; A323-A392 VanDerWaalsContact CB-O 3.29Å; A323-A392 WeakPolarHBondContact CB-O 3.12Å; A323-L393 HydrophobicContact CB-CD1 4.16Å
324	W	95.6	Very high	95.5	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-50.8	-45.4	-170.2	68.3	-88.5	0	0	0	115.2	L295 L320 Q321 E326 I327 L328 V451 F469 M472 L473	L295-W324 HydrophobicContact CD1-CE3 4.25Å; L295-W324 HydrophobicContact CD1-CZ3 4.34Å; L295-W324 HydrophobicContact CD2-CB 3.71Å; L295-W324 HydrophobicContact CD2-CD2 4.1Å; L295-W324 HydrophobicContact CD2-CE3 3.79Å; L295-W324 HydrophobicContact CD2-CG 4.13Å; L295-W324 HydrophobicContact CG-CE3 4.3Å; L320-W324 WeakPolarHBondContact O-CB 3.21Å; L320-W324 PolarHBondContact O-N 3.02Å; Q321-W324 VanDerWaalsContact O-CD1 3.24Å; W324-E326 VanDerWaalsContact C-N 3.32Å; W324-E326 PolarHBondContact O-N 2.67Å; W324-I327 PolarHBondContact O-N 2.81Å; W324-L328 HydrophobicContact CE3-CD1 3.63Å; W324-L328 HydrophobicContact CZ3-CD1 3.71Å; W324-L328 PolarHBondContact O-N 3.26Å; W324-V451 HydrophobicContact CZ2-CG2 4.24Å; W324-F469 AromaticContact CH2-CD2 3.97Å; W324-F469 HydrophobicContact CH2-CD2 3.97Å; W324-F469 AromaticContact CH2-CE2 3.7Å; W324-F469 HydrophobicContact CH2-CE2 3.7Å; W324-F469 AromaticContact CZ3-CD2 3.92Å; W324-F469 HydrophobicContact CZ3-CD2 3.92Å; W324-F469 AromaticContact CZ3-CE2 3.7Å; W324-F469 HydrophobicContact CZ3-CE2 3.7Å; W324-M472 HydrophobicContact CB-CE 3.64Å; W324-M472 VanDerWaalsContact CD1-CE 3.45Å; W324-M472 HydrophobicContact CD2-CB 4.21Å; W324-M472 HydrophobicContact CD2-CE 4.4Å; W324-M472 HydrophobicContact CG-CE 3.57Å; W324-M472 HydrophobicContact CZ2-CB 4.05Å; W324-M472 WeakPolarHBondContact CZ2-O 3.31Å; W324-M472 PolarHBondContact NE1-O 3.22Å; W324-L473 HydrophobicContact CH2-CD2 3.82Å; W324-L473 HydrophobicContact CH2-CG 4.01Å; W324-L473 HydrophobicContact CZ2-CD2 3.9Å; W324-L473 HydrophobicContact CZ2-CG 4.1Å
325	M	96.8	Very high	95.8	Very high	8 Å²	8	10.6 Å²	10.6	4%	0.039	5%	0.052	C	C	.	.	H	α-helix	trans	-69.3	-30.9	179.7	-175.4	65.2	82.2	0	0	111.7	A323 I327 L328 I329 A447 A450 V451 F454	A323-M325 VanDerWaalsContact C-N 3.34Å; A323-M325 PolarHBondContact O-N 3.39Å; A323-M325 VanDerWaalsContact O-N 3.15Å; M325-I327 VanDerWaalsContact C-N 3.32Å; M325-L328 HydrophobicContact SD-CD1 4.37Å; M325-I329 HydrophobicContact CG-CG1 4.15Å; M325-I329 VanDerWaalsContact O-CB 3.31Å; M325-I329 WeakPolarHBondContact O-CB 3.48Å; M325-I329 WeakPolarHBondContact O-CG1 3.29Å; M325-I329 PolarHBondContact O-N 3.43Å; M325-I329 HydrophobicContact SD-CG1 4.15Å; M325-A447 HydrophobicContact CB-CB 4.08Å; M325-A447 HydrophobicContact CG-CB 3.81Å; M325-A447 WeakPolarHBondContact CG-O 3.29Å; M325-A450 HydrophobicContact CE-CB 3.94Å; M325-A450 HydrophobicContact CG-CB 3.89Å; M325-A450 HydrophobicContact SD-CB 3.72Å; M325-V451 HydrophobicContact CB-CG2 3.91Å; M325-V451 HydrophobicContact CE-CG2 4.06Å; M325-V451 HydrophobicContact CG-CG2 4Å; M325-F454 HydrophobicContact CE-CD2 4.1Å
326	E	97.3	Very high	96	Very high	3 Å²	3	10.6 Å²	10.6	1%	0.014	5%	0.052	C	C	.	.	H	α-helix	trans	-67.1	-37.1	173	-65.4	-179.8	-95.4	0	0	111.4	A323 W324 I329 L330 L443 R444 A447	A323-E326 WeakPolarHBondContact O-CA 3.46Å; A323-E326 WeakPolarHBondContact O-CB 3.46Å; A323-E326 PolarHBondContact O-N 3.02Å; W324-E326 VanDerWaalsContact C-N 3.32Å; W324-E326 PolarHBondContact O-N 2.67Å; E326-I329 PolarHBondContact O-N 2.89Å; E326-L330 VanDerWaalsContact O-CB 3.31Å; E326-L330 WeakPolarHBondContact O-CB 3.5Å; E326-L330 VanDerWaalsContact O-CG 3.32Å; E326-L330 WeakPolarHBondContact O-CG 3.43Å; E326-L330 PolarHBondContact O-N 2.96Å; E326-L443 HydrophobicContact CB-CD1 4.24Å; E326-L443 HydrophobicContact CB-CD2 3.91Å; E326-L443 HydrophobicContact CB-CG 3.88Å; E326-L443 HydrophobicContact CG-CD2 4.4Å; E326-L443 HydrophobicContact CG-CG 4Å; E326-R444 IonicContact OE1-CZ 2.71Å; E326-R444 IonicContact OE1-NE 3.85Å; E326-R444 PolarHBondContact OE1-NE 3.36Å; E326-R444 IonicContact OE1-NH2 3.42Å; E326-R444 PolarHBondContact OE1-NH2 2.71Å; E326-R444 WeakPolarHBondContact OE2-CA 3.48Å; E326-R444 IonicContact OE2-CZ 2.87Å; E326-R444 PolarHBondContact OE2-N 2.91Å; E326-R444 IonicContact OE2-NE 2.73Å; E326-R444 PolarHBondContact OE2-NE 2.8Å; E326-R444 VanDerWaalsContact OE2-NE 3.15Å; E326-R444 IonicContact OE2-NH2 3.58Å; E326-R444 PolarHBondContact OE2-NH2 3.14Å; E326-A447 HydrophobicContact CB-CB 4.33Å; E326-A447 HydrophobicContact CG-CB 3.41Å; E326-A447 VanDerWaalsContact CG-CB 3.41Å
327	I	97.3	Very high	96.2	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-67.1	-44.5	177.4	-59.5	162.7	0	0	0	110.4	I298 W301 A323 W324 M325 L330 S331 K389 L393	I298-I327 HydrophobicContact CD1-CB 4.17Å; I298-I327 HydrophobicContact CD1-CG2 3.59Å; I298-I327 HydrophobicContact CG1-CG2 3.79Å; I298-I327 HydrophobicContact CG2-CB 4.45Å; I298-I327 HydrophobicContact CG2-CD1 3.95Å; I298-I327 HydrophobicContact CG2-CG2 3.95Å; W301-I327 HydrophobicContact CZ3-CD1 4.16Å; W301-I327 HydrophobicContact CZ3-CG2 4.21Å; A323-I327 HydrophobicContact CB-CD1 4.19Å; A323-I327 WeakPolarHBondContact O-CG1 3.5Å; A323-I327 PolarHBondContact O-N 2.97Å; A323-I327 VanDerWaalsContact O-N 3.08Å; W324-I327 PolarHBondContact O-N 2.81Å; M325-I327 VanDerWaalsContact C-N 3.32Å; I327-L330 PolarHBondContact O-N 2.78Å; I327-S331 PolarHBondContact O-N 2.86Å; I327-S331 PolarHBondContact O-OG 3.06Å; I327-K389 HydrophobicContact CG2-CD 4.31Å; I327-K389 VanDerWaalsContact CG2-CE 3.49Å; I327-K389 HydrophobicContact CG2-CG 3.89Å; I327-L393 HydrophobicContact CD1-CB 4.12Å; I327-L393 HydrophobicContact CD1-CD1 3.96Å
328	L	97.4	Very high	96.4	Very high	9 Å²	9	15.1 Å²	15.1	5%	0.047	8%	0.083	C	C	.	.	H	α-helix	trans	-61.1	-47.9	173.3	-68.5	175.7	0	0	0	112.2	A291 E294 I298 W324 M325 L330 S331 I332	A291-L328 HydrophobicContact CB-CD1 4.21Å; E294-L328 HydrophobicContact CB-CD2 3.67Å; E294-L328 HydrophobicContact CG-CD2 3.59Å; I298-L328 HydrophobicContact CD1-CD2 3.54Å; I298-L328 HydrophobicContact CD1-CG 3.99Å; W324-L328 HydrophobicContact CE3-CD1 3.63Å; W324-L328 HydrophobicContact CZ3-CD1 3.71Å; W324-L328 PolarHBondContact O-N 3.26Å; M325-L328 HydrophobicContact SD-CD1 4.37Å; L328-L330 VanDerWaalsContact C-N 3.3Å; L328-L330 PolarHBondContact O-N 3.24Å; L328-S331 WeakPolarHBondContact O-CB 3.5Å; L328-S331 PolarHBondContact O-N 2.84Å; L328-S331 VanDerWaalsContact O-N 3.14Å; L328-I332 WeakPolarHBondContact O-CG1 3.48Å; L328-I332 PolarHBondContact O-N 3.17Å
329	I	98.3	Very high	96.6	Very high	5 Å²	5	18.9 Å²	18.9	3%	0.026	10%	0.096	C	C	.	.	H	α-helix	trans	-64.8	-36.1	-179.8	-65.7	-75.7	0	0	0	110.6	M325 E326 I332 V333 I368 L371 L443 T446 A450	M325-I329 HydrophobicContact CG-CG1 4.15Å; M325-I329 VanDerWaalsContact O-CB 3.31Å; M325-I329 WeakPolarHBondContact O-CB 3.48Å; M325-I329 WeakPolarHBondContact O-CG1 3.29Å; M325-I329 PolarHBondContact O-N 3.43Å; M325-I329 HydrophobicContact SD-CG1 4.15Å; E326-I329 PolarHBondContact O-N 2.89Å; I329-I332 HydrophobicContact CD1-CD1 4.47Å; I329-I332 PolarHBondContact O-N 3.07Å; I329-V333 HydrophobicContact CG2-CG2 4.33Å; I329-V333 VanDerWaalsContact O-CB 3.3Å; I329-V333 WeakPolarHBondContact O-CB 3.08Å; I329-V333 WeakPolarHBondContact O-CG2 3.41Å; I329-V333 PolarHBondContact O-N 3.46Å; I329-I368 HydrophobicContact CD1-CD1 3.59Å; I329-I368 HydrophobicContact CD1-CG1 3.8Å; I329-I368 HydrophobicContact CG2-CG1 4.46Å; I329-L371 HydrophobicContact CG2-CD2 4.17Å; I329-L443 HydrophobicContact CB-CD1 4.06Å; I329-L443 HydrophobicContact CG2-CD1 3.74Å; I329-T446 HydrophobicContact CG2-CG2 4.01Å; I329-A450 HydrophobicContact CD1-CB 4.16Å
330	L	98.1	Very high	96.6	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-62.4	-45.6	170.3	-81.8	177.1	0	0	0	112.2	E326 I327 L328 I332 V333 F334 Y375 F385 K389 A392 L443	E326-L330 VanDerWaalsContact O-CB 3.31Å; E326-L330 WeakPolarHBondContact O-CB 3.5Å; E326-L330 VanDerWaalsContact O-CG 3.32Å; E326-L330 WeakPolarHBondContact O-CG 3.43Å; E326-L330 PolarHBondContact O-N 2.96Å; I327-L330 PolarHBondContact O-N 2.78Å; L328-L330 VanDerWaalsContact C-N 3.3Å; L328-L330 PolarHBondContact O-N 3.24Å; L330-I332 PolarHBondContact O-N 3.22Å; L330-V333 PolarHBondContact O-N 3.13Å; L330-F334 WeakPolarHBondContact O-CB 3.37Å; L330-F334 PolarHBondContact O-N 3.38Å; L330-Y375 HydrophobicContact CD2-CE1 4.47Å; L330-Y375 HydrophobicContact CD2-CE2 4.33Å; L330-Y375 WeakPolarHBondContact CD2-OH 3.34Å; L330-F385 HydrophobicContact CB-CE2 4.06Å; L330-F385 WeakPolarHBondContact O-CE2 3.24Å; L330-K389 HydrophobicContact CD1-CB 4.23Å; L330-K389 HydrophobicContact CD1-CG 4.48Å; L330-A392 HydrophobicContact CD1-CB 4.04Å; L330-L443 HydrophobicContact CD1-CD2 3.61Å; L330-L443 HydrophobicContact CD2-CD1 4.12Å; L330-L443 HydrophobicContact CD2-CD2 3.87Å; L330-L443 HydrophobicContact CG-CD1 3.81Å; L330-L443 HydrophobicContact CG-CD2 3.55Å; L330-L443 HydrophobicContact CG-CG 4.32Å
331	S	97.9	Very high	96.5	Very high	11 Å²	11	28.6 Å²	28.6	8%	0.077	14%	0.144	C	C	.	.	H	α-helix	trans	-54.8	-50	175.5	-67.4	0	0	0	0	111.3	E294 I327 L328 F334 R335	E294-S331 WeakPolarHBondContact OE1-CB 3.47Å; E294-S331 PolarHBondContact OE1-OG 2.98Å; I327-S331 PolarHBondContact O-N 2.86Å; I327-S331 PolarHBondContact O-OG 3.06Å; L328-S331 WeakPolarHBondContact O-CB 3.5Å; L328-S331 PolarHBondContact O-N 2.84Å; L328-S331 VanDerWaalsContact O-N 3.14Å; S331-F334 PolarHBondContact O-N 2.82Å; S331-R335 VanDerWaalsContact O-CB 3.28Å; S331-R335 WeakPolarHBondContact O-CB 3.28Å; S331-R335 PolarHBondContact O-N 3.18Å
332	I	98.3	Very high	96.8	Very high	16 Å²	16	30.9 Å²	30.9	8%	0.082	15%	0.154	C	C	.	.	H	α-helix	trans	-60.8	-48.1	177.7	-62.2	161.4	0	0	0	110.4	L328 I329 L330 F334 R335 S336 Y345 I368	L328-I332 WeakPolarHBondContact O-CG1 3.48Å; L328-I332 PolarHBondContact O-N 3.17Å; I329-I332 HydrophobicContact CD1-CD1 4.47Å; I329-I332 PolarHBondContact O-N 3.07Å; L330-I332 PolarHBondContact O-N 3.22Å; I332-F334 PolarHBondContact O-N 2.84Å; I332-R335 PolarHBondContact O-N 3.2Å; I332-S336 WeakPolarHBondContact O-CB 3.44Å; I332-S336 PolarHBondContact O-N 2.73Å; I332-S336 PolarHBondContact O-OG 3.05Å; I332-Y345 HydrophobicContact CD1-CD1 3.64Å; I332-Y345 HydrophobicContact CD1-CE1 3.85Å; I332-Y345 HydrophobicContact CG1-CD1 4.08Å; I332-Y345 HydrophobicContact CG2-CD1 4.49Å; I332-I368 HydrophobicContact CG2-CG2 4.17Å
333	V	98.5	Very high	97.1	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-58.9	-46.4	-178.8	161.9	0	0	0	0	111.8	I329 L330 S336 L337 I368 L371 V372 Y375	I329-V333 HydrophobicContact CG2-CG2 4.33Å; I329-V333 VanDerWaalsContact O-CB 3.3Å; I329-V333 WeakPolarHBondContact O-CB 3.08Å; I329-V333 WeakPolarHBondContact O-CG2 3.41Å; I329-V333 PolarHBondContact O-N 3.46Å; L330-V333 PolarHBondContact O-N 3.13Å; V333-S336 PolarHBondContact O-N 3.24Å; V333-L337 WeakPolarHBondContact O-CG 3.22Å; V333-L337 PolarHBondContact O-N 3.16Å; V333-I368 HydrophobicContact CG2-CG2 3.88Å; V333-L371 HydrophobicContact CG1-CG 4.42Å; V333-L371 HydrophobicContact CG2-CB 4.04Å; V333-L371 HydrophobicContact CG2-CD2 4.01Å; V333-L371 HydrophobicContact CG2-CG 3.99Å; V333-V372 HydrophobicContact CB-CG2 4.29Å; V333-V372 HydrophobicContact CG1-CG2 4.33Å; V333-V372 HydrophobicContact CG2-CG2 4Å; V333-Y375 HydrophobicContact CG1-CD1 3.86Å; V333-Y375 HydrophobicContact CG1-CD2 4.35Å; V333-Y375 HydrophobicContact CG1-CE1 4.42Å; V333-Y375 HydrophobicContact CG1-CG 3.85Å
334	F	98.1	Very high	97.2	Very high	52 Å²	52	30.3 Å²	30.3	23%	0.228	15%	0.15	C	C	.	.	H	α-helix	trans	-69.7	-41	-179.3	-173.1	-101.6	0	0	0	112.2	L330 S331 I332 S336 L337 K382 F385	L330-F334 WeakPolarHBondContact O-CB 3.37Å; L330-F334 PolarHBondContact O-N 3.38Å; S331-F334 PolarHBondContact O-N 2.82Å; I332-F334 PolarHBondContact O-N 2.84Å; F334-S336 PolarHBondContact O-N 3.46Å; F334-L337 HydrophobicContact CD2-CD1 3.62Å; F334-L337 HydrophobicContact CE2-CD1 4.03Å; F334-L337 HydrophobicContact CG-CD1 4.39Å; F334-L337 WeakPolarHBondContact O-CG 3.26Å; F334-L337 PolarHBondContact O-N 2.97Å; F334-K382 HydrophobicContact CE1-CG 4.16Å; F334-K382 HydrophobicContact CZ-CB 3.87Å; F334-K382 HydrophobicContact CZ-CG 3.99Å; F334-F385 HydrophobicContact CB-CD1 4.25Å; F334-F385 HydrophobicContact CB-CD2 3.47Å; F334-F385 VanDerWaalsContact CB-CD2 3.47Å; F334-F385 HydrophobicContact CB-CE1 4.26Å; F334-F385 HydrophobicContact CB-CE2 3.47Å; F334-F385 VanDerWaalsContact CB-CE2 3.47Å; F334-F385 HydrophobicContact CB-CG 3.87Å; F334-F385 HydrophobicContact CB-CZ 3.89Å; F334-F385 AromaticContact CD1-CD1 3.63Å; F334-F385 HydrophobicContact CD1-CD1 3.63Å; F334-F385 HydrophobicContact CD1-CD2 4.4Å; F334-F385 AromaticContact CD1-CE1 3.76Å; F334-F385 HydrophobicContact CD1-CE1 3.76Å; F334-F385 HydrophobicContact CD1-CE2 4.49Å; F334-F385 AromaticContact CD1-CG 3.96Å; F334-F385 HydrophobicContact CD1-CG 3.96Å; F334-F385 HydrophobicContact CD1-CZ 4.19Å; F334-F385 HydrophobicContact CD2-CB 3.44Å; F334-F385 VanDerWaalsContact CD2-CB 3.44Å; F334-F385 AromaticContact CD2-CD1 3.96Å; F334-F385 HydrophobicContact CD2-CD1 3.96Å; F334-F385 AromaticContact CD2-CD2 3.88Å; F334-F385 HydrophobicContact CD2-CD2 3.88Å; F334-F385 AromaticContact CD2-CG 3.47Å; F334-F385 HydrophobicContact CD2-CG 3.47Å; F334-F385 VanDerWaalsContact CD2-CG 3.47Å; F334-F385 AromaticContact CE1-CD1 3.92Å; F334-F385 HydrophobicContact CE1-CD1 3.92Å; F334-F385 HydrophobicContact CE1-CE1 4.32Å; F334-F385 HydrophobicContact CE1-CG 4.41Å; F334-F385 HydrophobicContact CE2-CB 3.62Å; F334-F385 HydrophobicContact CE2-CD1 4.23Å; F334-F385 AromaticContact CE2-CG 3.98Å; F334-F385 HydrophobicContact CE2-CG 3.98Å; F334-F385 HydrophobicContact CG-CB 4.01Å; F334-F385 AromaticContact CG-CD1 3.66Å; F334-F385 HydrophobicContact CG-CD1 3.66Å; F334-F385 AromaticContact CG-CD2 3.66Å; F334-F385 HydrophobicContact CG-CD2 3.66Å; F334-F385 AromaticContact CG-CE1 4Å; F334-F385 HydrophobicContact CG-CE1 4Å; F334-F385 AromaticContact CG-CE2 3.98Å; F334-F385 HydrophobicContact CG-CE2 3.98Å; F334-F385 AromaticContact CG-CG 3.47Å; F334-F385 HydrophobicContact CG-CG 3.47Å; F334-F385 VanDerWaalsContact CG-CG 3.47Å; F334-F385 HydrophobicContact CG-CZ 4.14Å; F334-F385 HydrophobicContact CZ-CB 4.31Å; F334-F385 HydrophobicContact CZ-CD1 4.21Å; F334-F385 HydrophobicContact CZ-CG 4.43Å
335	R	97.4	Very high	97.3	Very high	39 Å²	39	31 Å²	31	15%	0.147	15%	0.153	C	C	.	.	H	α-helix	trans	-62.4	-29.9	176.2	-155.4	-169.1	-58.1	-134.8	21.9	112.3	I268 E294 S331 I332 P338 V344 Y345 E347	I268-R335 PolarHBondContact O-NH1 3.09Å; E294-R335 IonicContact OE2-NH2 2.69Å; S331-R335 VanDerWaalsContact O-CB 3.28Å; S331-R335 WeakPolarHBondContact O-CB 3.28Å; S331-R335 PolarHBondContact O-N 3.18Å; I332-R335 PolarHBondContact O-N 3.2Å; R335-P338 WeakPolarHBondContact O-CD 3.48Å; R335-V344 HydrophobicContact CB-CB 4.36Å; R335-V344 VanDerWaalsContact CD-CG1 3.43Å; R335-V344 WeakPolarHBondContact CD-O 3.35Å; R335-V344 HydrophobicContact CG-CB 4.15Å; R335-V344 HydrophobicContact CG-CG1 3.77Å; R335-Y345 VanDerWaalsContact CZ-O 3.29Å; R335-Y345 PolarHBondContact NE-O 3.18Å; R335-Y345 PolarHBondContact NH2-O 3.12Å; R335-E347 IonicContact NH1-OE1 2.74Å; R335-E347 PolarHBondContact NH1-OE1 3.49Å
336	S	98.4	Very high	97.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-84.3	-12.9	-178.9	-51.4	0	0	0	0	114.9	I332 V333 F334 P338 Y339 V344	I332-S336 WeakPolarHBondContact O-CB 3.44Å; I332-S336 PolarHBondContact O-N 2.73Å; I332-S336 PolarHBondContact O-OG 3.05Å; V333-S336 PolarHBondContact O-N 3.24Å; F334-S336 PolarHBondContact O-N 3.46Å; S336-P338 VanDerWaalsContact C-N 3.34Å; S336-Y339 PolarHBondContact O-N 3.18Å; S336-V344 PolarHBondContact OG-N 2.59Å
337	L	97.9	Very high	96.9	Very high	24 Å²	24	33.7 Å²	33.7	13%	0.126	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-32.7	-177	-60.7	178.3	0	0	0	116.2	V333 F334 Y339 V372 K376	V333-L337 WeakPolarHBondContact O-CG 3.22Å; V333-L337 PolarHBondContact O-N 3.16Å; F334-L337 HydrophobicContact CD2-CD1 3.62Å; F334-L337 HydrophobicContact CE2-CD1 4.03Å; F334-L337 HydrophobicContact CG-CD1 4.39Å; F334-L337 WeakPolarHBondContact O-CG 3.26Å; F334-L337 PolarHBondContact O-N 2.97Å; L337-Y339 VanDerWaalsContact C-N 3.29Å; L337-Y339 PolarHBondContact O-N 3.32Å; L337-V372 HydrophobicContact CD2-CG1 4.29Å; L337-K376 HydrophobicContact CD2-CB 4.1Å; L337-K376 VanDerWaalsContact O-CE 3.26Å; L337-K376 WeakPolarHBondContact O-CE 3.41Å
338	P	96.8	Very high	96.7	Very high	102 Å²	102	36.6 Å²	36.6	66%	0.662	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-18.3	176.5	-20.9	34.4	0	0	0	115.1	R335 S336	R335-P338 WeakPolarHBondContact O-CD 3.48Å; S336-P338 VanDerWaalsContact C-N 3.34Å
339	Y	96.4	Very high	96.7	Very high	89 Å²	89	37.4 Å²	37.4	35%	0.349	18%	0.183	S	C	.	.	S	Bend	trans	-99.7	162.8	-170	-60.9	-98	0	0	0	111.3	S336 L337 E342 V344 I350 K376	S336-Y339 PolarHBondContact O-N 3.18Å; L337-Y339 VanDerWaalsContact C-N 3.29Å; L337-Y339 PolarHBondContact O-N 3.32Å; Y339-E342 WeakPolarHBondContact CD1-OE2 3.31Å; Y339-V344 HydrophobicContact CD1-CG2 4.43Å; Y339-V344 HydrophobicContact CD2-CG2 3.47Å; Y339-V344 VanDerWaalsContact CD2-CG2 3.47Å; Y339-V344 HydrophobicContact CE1-CG2 4.48Å; Y339-V344 HydrophobicContact CE2-CG2 3.55Å; Y339-V344 HydrophobicContact CG-CG2 3.95Å; Y339-I350 HydrophobicContact CE1-CD1 3.94Å; Y339-K376 PolarHBondContact O-NZ 3.43Å
340	E	93.8	Very high	96.6	Very high	137 Å²	137	40.2 Å²	40.2	64%	0.64	20%	0.198	S	C	*	.	S	Bend	trans	-111.4	111.6	177.5	-62.2	-59	161.8	0	0	109.9	E342 K376	E340-E342 VanDerWaalsContact C-N 3.27Å; E340-E342 PolarHBondContact O-N 3.42Å; E340-K376 IonicContact OE1-NZ 3.45Å; E340-K376 PolarHBondContact OE1-NZ 3.31Å; E340-K376 IonicContact OE2-NZ 4Å; E340-K376 PolarHBondContact OE2-NZ 3.41Å
341	D	93.8	Very high	96.6	Very high	69 Å²	69	40.4 Å²	40.4	37%	0.369	20%	0.199	S	C	.	.	S	Bend	trans	52.6	42.4	177.9	-62.8	-21.3	0	0	0	114.4	Y365 L369 R373	D341-Y365 PolarHBondContact O-OH 3Å; D341-L369 HydrophobicContact CB-CD2 4.16Å; D341-R373 IonicContact OD1-CZ 2.63Å; D341-R373 IonicContact OD1-NE 3.9Å; D341-R373 PolarHBondContact OD1-NE 3.45Å; D341-R373 IonicContact OD1-NH2 2.84Å; D341-R373 PolarHBondContact OD1-NH2 2.95Å; D341-R373 IonicContact OD2-CZ 2.88Å; D341-R373 IonicContact OD2-NE 3.21Å; D341-R373 IonicContact OD2-NH2 3.99Å; D341-R373 PolarHBondContact OD2-NH2 3.12Å
342	E	97	Very high	96.5	Very high	67 Å²	67	42.5 Å²	42.5	31%	0.313	21%	0.209	S	C	.	.			trans	-130.3	150.1	170.5	-65.1	170.3	109.9	0	0	109.2	Y339 E340 I350	Y339-E342 WeakPolarHBondContact CD1-OE2 3.31Å; E340-E342 VanDerWaalsContact C-N 3.27Å; E340-E342 PolarHBondContact O-N 3.42Å; E342-I350 HydrophobicContact CB-CG2 3.9Å; E342-I350 HydrophobicContact CG-CG2 4.4Å
343	L	98.3	Very high	96.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	122.2	172.5	-64.4	-174.1	0	0	0	111.2	Y345 I350 M351 Y365 I368 L369 V372	L343-Y345 HydrophobicContact CB-CD2 4.4Å; L343-Y345 HydrophobicContact CB-CE2 3.85Å; L343-I350 CarbonylContact O-C 3.59Å; L343-I350 WeakPolarHBondContact O-CA 3.49Å; L343-M351 PolarHBondContact N-O 2.85Å; L343-M351 PolarHBondContact O-N 3.49Å; L343-Y365 HydrophobicContact CD1-CD2 3.63Å; L343-Y365 HydrophobicContact CD1-CE2 4.41Å; L343-Y365 HydrophobicContact CD1-CG 4.25Å; L343-Y365 HydrophobicContact CG-CD2 3.76Å; L343-Y365 HydrophobicContact CG-CE2 4.06Å; L343-I368 HydrophobicContact CD1-CB 3.8Å; L343-I368 HydrophobicContact CD1-CD1 4.2Å; L343-I368 HydrophobicContact CD1-CG2 3.83Å; L343-I368 HydrophobicContact CD2-CB 4.35Å; L343-I368 HydrophobicContact CD2-CG2 3.72Å; L343-I368 HydrophobicContact CG-CG2 4.45Å; L343-L369 HydrophobicContact CD2-CB 4.43Å; L343-L369 HydrophobicContact CD2-CD1 4.49Å; L343-V372 HydrophobicContact CD2-CG2 3.84Å
344	V	97.9	Very high	96.3	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.018	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	97.8	-178.2	-169.8	0	0	0	0	108.5	R335 S336 Y339 A346 I350	R335-V344 HydrophobicContact CB-CB 4.36Å; R335-V344 VanDerWaalsContact CD-CG1 3.43Å; R335-V344 WeakPolarHBondContact CD-O 3.35Å; R335-V344 HydrophobicContact CG-CB 4.15Å; R335-V344 HydrophobicContact CG-CG1 3.77Å; S336-V344 PolarHBondContact OG-N 2.59Å; Y339-V344 HydrophobicContact CD1-CG2 4.43Å; Y339-V344 HydrophobicContact CD2-CG2 3.47Å; Y339-V344 VanDerWaalsContact CD2-CG2 3.47Å; Y339-V344 HydrophobicContact CE1-CG2 4.48Å; Y339-V344 HydrophobicContact CE2-CG2 3.55Å; Y339-V344 HydrophobicContact CG-CG2 3.95Å; V344-A346 VanDerWaalsContact CG1-O 3.28Å; V344-A346 WeakPolarHBondContact CG1-O 3.44Å; V344-I350 HydrophobicContact CB-CG1 4.47Å; V344-I350 HydrophobicContact CG1-CD1 4.45Å; V344-I350 HydrophobicContact CG1-CG1 4.06Å; V344-I350 HydrophobicContact CG2-CD1 4.27Å; V344-I350 HydrophobicContact CG2-CG1 4.18Å; V344-I350 HydrophobicContact CG2-CG2 4.29Å
345	Y	97.3	Very high	96.2	Very high	16 Å²	16	53.4 Å²	53.4	6%	0.063	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-42.9	177.3	-66.4	-95.5	0	0	0	110.6	L287 I332 R335 L343 Y349 M351	L287-Y345 HydrophobicContact CD2-CD1 3.45Å; L287-Y345 VanDerWaalsContact CD2-CD1 3.45Å; L287-Y345 HydrophobicContact CD2-CD2 4.28Å; L287-Y345 HydrophobicContact CD2-CE1 3.86Å; L287-Y345 HydrophobicContact CD2-CG 3.68Å; I332-Y345 HydrophobicContact CD1-CD1 3.64Å; I332-Y345 HydrophobicContact CD1-CE1 3.85Å; I332-Y345 HydrophobicContact CG1-CD1 4.08Å; I332-Y345 HydrophobicContact CG2-CD1 4.49Å; R335-Y345 VanDerWaalsContact CZ-O 3.29Å; R335-Y345 PolarHBondContact NE-O 3.18Å; R335-Y345 PolarHBondContact NH2-O 3.12Å; L343-Y345 HydrophobicContact CB-CD2 4.4Å; L343-Y345 HydrophobicContact CB-CE2 3.85Å; Y345-Y349 HydrophobicContact CD2-CD1 4.34Å; Y345-Y349 HydrophobicContact CG-CD1 4.48Å; Y345-Y349 PolarHBondContact N-O 3.01Å; Y345-M351 HydrophobicContact CD2-CG 4.13Å; Y345-M351 HydrophobicContact CD2-SD 4.24Å; Y345-M351 HydrophobicContact CE2-CB 4.11Å; Y345-M351 HydrophobicContact CE2-CG 3.93Å; Y345-M351 HydrophobicContact CE2-SD 3.75Å
346	A	96.7	Very high	96.2	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	170.4	174.8	0	0	0	0	0	110.8	A270 L290 V344 D348 Y349	A270-A346 HydrophobicContact CB-CB 3.78Å; L290-A346 HydrophobicContact CD1-CB 4.4Å; L290-A346 HydrophobicContact CD2-CB 4.09Å; V344-A346 VanDerWaalsContact CG1-O 3.28Å; V344-A346 WeakPolarHBondContact CG1-O 3.44Å; A346-D348 VanDerWaalsContact CB-OD1 3.24Å; A346-D348 WeakPolarHBondContact CB-OD1 3.28Å; A346-D348 PolarHBondContact O-N 2.73Å; A346-Y349 PolarHBondContact N-O 3.42Å; A346-Y349 VanDerWaalsContact N-O 3.16Å; A346-Y349 PolarHBondContact O-N 3.36Å
347	E	90	Very high	96.1	Very high	67 Å²	67	56.6 Å²	56.6	31%	0.313	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-24.5	179	-59	-66.6	125.3	0	0	113.6	K267 Y269 R335	K267-E347 HydrophobicContact CB-CG 3.82Å; K267-E347 HydrophobicContact CD-CG 4.15Å; K267-E347 HydrophobicContact CG-CG 4.18Å; K267-E347 WeakPolarHBondContact CG-OE1 3.39Å; K267-E347 IonicContact NZ-OE1 2.71Å; K267-E347 PolarHBondContact NZ-OE1 2.74Å; K267-E347 IonicContact NZ-OE2 2.69Å; K267-E347 PolarHBondContact NZ-OE2 3.12Å; Y269-E347 HydrophobicContact CD1-CB 3.88Å; Y269-E347 HydrophobicContact CE1-CB 3.59Å; Y269-E347 HydrophobicContact CE1-CG 4.11Å; R335-E347 IonicContact NH1-OE1 2.74Å; R335-E347 PolarHBondContact NH1-OE1 3.49Å
348	D	93.6	Very high	95.9	Very high	61 Å²	61	61.5 Å²	61.5	33%	0.326	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	4.5	-178.3	61.3	-39.2	0	0	0	112.9	Y269 A270 M271 A346	Y269-D348 WeakPolarHBondContact CA-OD1 3.48Å; Y269-D348 HydrophobicContact CD1-CB 4.15Å; A270-D348 PolarHBondContact N-OD1 2.75Å; A270-D348 PolarHBondContact N-OD2 3.38Å; M271-D348 PolarHBondContact N-OD2 2.77Å; A346-D348 VanDerWaalsContact CB-OD1 3.24Å; A346-D348 WeakPolarHBondContact CB-OD1 3.28Å; A346-D348 PolarHBondContact O-N 2.73Å
349	Y	96.4	Very high	95.7	Very high	25 Å²	25	57.3 Å²	57.3	10%	0.098	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	98.8	-177.3	-154.5	-102.2	0	0	0	111.6	A270 P272 A283 T286 L287 Y345 A346 M351	A270-Y349 HydrophobicContact CB-CD2 4.32Å; A270-Y349 HydrophobicContact CB-CG 4Å; P272-Y349 HydrophobicContact CB-CE2 4.45Å; P272-Y349 HydrophobicContact CG-CD2 4.27Å; A283-Y349 WeakPolarHBondContact CA-OH 3.48Å; A283-Y349 VanDerWaalsContact CB-OH 3.28Å; A283-Y349 WeakPolarHBondContact CB-OH 3.33Å; T286-Y349 HydrophobicContact CG2-CD2 4.18Å; T286-Y349 HydrophobicContact CG2-CE2 4.03Å; L287-Y349 HydrophobicContact CD2-CD1 4.08Å; L287-Y349 HydrophobicContact CD2-CE1 3.86Å; L287-Y349 HydrophobicContact CG-CE1 4.1Å; Y345-Y349 HydrophobicContact CD2-CD1 4.34Å; Y345-Y349 HydrophobicContact CG-CD1 4.48Å; Y345-Y349 PolarHBondContact N-O 3.01Å; A346-Y349 PolarHBondContact N-O 3.42Å; A346-Y349 VanDerWaalsContact N-O 3.16Å; A346-Y349 PolarHBondContact O-N 3.36Å; Y349-M351 HydrophobicContact CD1-CG 4.38Å; Y349-M351 HydrophobicContact CE1-CG 3.96Å; Y349-M351 HydrophobicContact CE1-SD 3.68Å
350	I	96.8	Very high	95.5	Very high	65 Å²	65	55.5 Å²	55.5	33%	0.333	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	138.8	179.7	-53.8	-176.3	0	0	0	107.8	Y339 E342 L343 V344	Y339-I350 HydrophobicContact CE1-CD1 3.94Å; E342-I350 HydrophobicContact CB-CG2 3.9Å; E342-I350 HydrophobicContact CG-CG2 4.4Å; L343-I350 CarbonylContact O-C 3.59Å; L343-I350 WeakPolarHBondContact O-CA 3.49Å; V344-I350 HydrophobicContact CB-CG1 4.47Å; V344-I350 HydrophobicContact CG1-CD1 4.45Å; V344-I350 HydrophobicContact CG1-CG1 4.06Å; V344-I350 HydrophobicContact CG2-CD1 4.27Å; V344-I350 HydrophobicContact CG2-CG1 4.18Å; V344-I350 HydrophobicContact CG2-CG2 4.29Å
351	M	96.7	Very high	95.6	Very high	5 Å²	5	49 Å²	49	3%	0.025	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	127.6	175.8	-55.4	-174.9	72.3	0	0	110.7	L287 L343 Y345 Y349 H355 T359 L361	L287-M351 HydrophobicContact CD1-SD 4.37Å; L343-M351 PolarHBondContact N-O 2.85Å; L343-M351 PolarHBondContact O-N 3.49Å; Y345-M351 HydrophobicContact CD2-CG 4.13Å; Y345-M351 HydrophobicContact CD2-SD 4.24Å; Y345-M351 HydrophobicContact CE2-CB 4.11Å; Y345-M351 HydrophobicContact CE2-CG 3.93Å; Y345-M351 HydrophobicContact CE2-SD 3.75Å; Y349-M351 HydrophobicContact CD1-CG 4.38Å; Y349-M351 HydrophobicContact CE1-CG 3.96Å; Y349-M351 HydrophobicContact CE1-SD 3.68Å; M351-H355 HydrophobicContact CB-CB 4.37Å; M351-H355 HydrophobicContact CE-CB 4.07Å; M351-T359 HydrophobicContact CE-CG2 3.86Å; M351-T359 WeakPolarHBondContact CE-OG1 3.31Å; M351-L361 HydrophobicContact CE-CD1 4.03Å; M351-L361 HydrophobicContact SD-CD1 4.08Å
352	D	96.5	Very high	95.8	Very high	54 Å²	54	48.3 Å²	48.3	29%	0.289	24%	0.244	S	C	.	.			trans	-84.2	-175.4	166.5	61.7	35.7	0	0	0	111.2	E354 H355 S356	D352-E354 VanDerWaalsContact C-N 3.31Å; D352-E354 PolarHBondContact O-N 2.91Å; D352-E354 WeakPolarHBondContact OD1-CA 3.34Å; D352-E354 WeakPolarHBondContact OD1-CB 3.4Å; D352-E354 PolarHBondContact OD1-N 3.46Å; D352-H355 IonicContact OD1-CE1 3.8Å; D352-H355 IonicContact OD1-CG 3.75Å; D352-H355 PolarHBondContact OD1-N 3.5Å; D352-H355 IonicContact OD1-ND1 3.24Å; D352-H355 PolarHBondContact OD1-ND1 2.96Å; D352-H355 IonicContact OD2-CE1 3.45Å; D352-H355 PolarHBondContact OD2-CE1 2.92Å; D352-H355 IonicContact OD2-ND1 3.56Å; D352-H355 PolarHBondContact OD2-ND1 3.47Å; D352-S356 VanDerWaalsContact O-CB 3.24Å; D352-S356 WeakPolarHBondContact O-CB 3.42Å; D352-S356 PolarHBondContact O-N 3.27Å; D352-S356 PolarHBondContact O-OG 2.9Å
353	E	97.2	Very high	95.8	Very high	95 Å²	95	51.2 Å²	51.2	44%	0.444	26%	0.262	S	S	.	.	H	α-helix	trans	-62.4	-33.7	175.8	-166.3	-169.9	105.3	0	0	113.4	R357 L362 Y365	E353-R357 WeakPolarHBondContact O-CB 3.22Å; E353-R357 PolarHBondContact O-N 3.01Å; E353-R357 IonicContact OE1-NH1 3.19Å; E353-R357 PolarHBondContact OE1-NH1 2.75Å; E353-L362 HydrophobicContact CG-CD1 3.63Å; E353-Y365 HydrophobicContact CB-CD1 4.41Å; E353-Y365 HydrophobicContact CB-CE1 3.59Å; E353-Y365 HydrophobicContact CG-CD1 4.21Å; E353-Y365 HydrophobicContact CG-CE1 3.64Å; E353-Y365 PolarHBondContact N-OH 3.21Å
354	E	96.5	Very high	95.7	Very high	106 Å²	106	51.7 Å²	51.7	50%	0.495	27%	0.265	S	S	.	.	H	α-helix	trans	-74.3	-48.8	-176	177.4	128.4	-104.2	0	0	111.2	D352 S356 R357 L358	D352-E354 VanDerWaalsContact C-N 3.31Å; D352-E354 PolarHBondContact O-N 2.91Å; D352-E354 WeakPolarHBondContact OD1-CA 3.34Å; D352-E354 WeakPolarHBondContact OD1-CB 3.4Å; D352-E354 PolarHBondContact OD1-N 3.46Å; E354-S356 VanDerWaalsContact C-N 3.31Å; E354-S356 PolarHBondContact O-N 2.91Å; E354-R357 WeakPolarHBondContact O-CB 3.38Å; E354-R357 PolarHBondContact O-N 3.48Å; E354-R357 VanDerWaalsContact O-N 3.13Å; E354-R357 IonicContact OE1-CZ 2.89Å; E354-R357 IonicContact OE1-NH2 2.83Å; E354-R357 PolarHBondContact OE1-NH2 3.27Å; E354-L358 HydrophobicContact CG-CD1 4.1Å; E354-L358 VanDerWaalsContact O-CG 3.31Å; E354-L358 WeakPolarHBondContact O-CG 3.36Å; E354-L358 PolarHBondContact O-N 3.27Å
355	H	94.9	Very high	95.7	Very high	98 Å²	98	51.8 Å²	51.8	45%	0.454	27%	0.265	S	S	.	.	H	α-helix	trans	-59.2	-44.9	172.5	-67.3	82.6	0	0	0	110.2	M351 D352 R357 L358 T359	M351-H355 HydrophobicContact CB-CB 4.37Å; M351-H355 HydrophobicContact CE-CB 4.07Å; D352-H355 IonicContact OD1-CE1 3.8Å; D352-H355 IonicContact OD1-CG 3.75Å; D352-H355 PolarHBondContact OD1-N 3.5Å; D352-H355 IonicContact OD1-ND1 3.24Å; D352-H355 PolarHBondContact OD1-ND1 2.96Å; D352-H355 IonicContact OD2-CE1 3.45Å; D352-H355 PolarHBondContact OD2-CE1 2.92Å; D352-H355 IonicContact OD2-ND1 3.56Å; D352-H355 PolarHBondContact OD2-ND1 3.47Å; H355-R357 VanDerWaalsContact C-N 3.27Å; H355-R357 PolarHBondContact O-N 3.03Å; H355-L358 PolarHBondContact O-N 2.95Å; H355-T359 WeakPolarHBondContact O-CG2 3.32Å; H355-T359 PolarHBondContact O-N 3.49Å; H355-T359 PolarHBondContact O-OG1 3.29Å
356	S	96.7	Very high	95.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.8	-31.6	176.3	-58.2	0	0	0	0	113.3	D352 E354 G360 L361 L362 Y365	D352-S356 VanDerWaalsContact O-CB 3.24Å; D352-S356 WeakPolarHBondContact O-CB 3.42Å; D352-S356 PolarHBondContact O-N 3.27Å; D352-S356 PolarHBondContact O-OG 2.9Å; E354-S356 VanDerWaalsContact C-N 3.31Å; E354-S356 PolarHBondContact O-N 2.91Å; S356-G360 PolarHBondContact O-N 3.14Å; S356-L361 CarbonylContact O-C 3.48Å; S356-L361 WeakPolarHBondContact O-CA 3.36Å; S356-L361 PolarHBondContact O-N 3.21Å; S356-L362 PolarHBondContact O-N 3.41Å; S356-Y365 VanDerWaalsContact OG-CD2 3.25Å; S356-Y365 WeakPolarHBondContact OG-CD2 3.17Å
357	R	96.2	Very high	95.8	Very high	106 Å²	106	54.6 Å²	54.6	40%	0.4	28%	0.283	S	S	.	.	H	α-helix	trans	-72.4	-42.7	173.8	170.3	171.8	56.6	-117.9	2.8	111.8	E353 E354 H355 T359 G360 L362	E353-R357 WeakPolarHBondContact O-CB 3.22Å; E353-R357 PolarHBondContact O-N 3.01Å; E353-R357 IonicContact OE1-NH1 3.19Å; E353-R357 PolarHBondContact OE1-NH1 2.75Å; E354-R357 WeakPolarHBondContact O-CB 3.38Å; E354-R357 PolarHBondContact O-N 3.48Å; E354-R357 VanDerWaalsContact O-N 3.13Å; E354-R357 IonicContact OE1-CZ 2.89Å; E354-R357 IonicContact OE1-NH2 2.83Å; E354-R357 PolarHBondContact OE1-NH2 3.27Å; H355-R357 VanDerWaalsContact C-N 3.27Å; H355-R357 PolarHBondContact O-N 3.03Å; R357-T359 VanDerWaalsContact C-N 3.34Å; R357-G360 PolarHBondContact O-N 3.41Å; R357-L362 HydrophobicContact CB-CD1 4.42Å; R357-L362 HydrophobicContact CB-CD2 4.36Å
358	L	93.8	Very high	96.2	Very high	126 Å²	126	51.5 Å²	51.5	66%	0.66	27%	0.269	S	S	*	.	H	α-helix	trans	-68.2	-30.9	179.6	-69.4	169.6	0	0	0	112.9	E354 H355	E354-L358 HydrophobicContact CG-CD1 4.1Å; E354-L358 VanDerWaalsContact O-CG 3.31Å; E354-L358 WeakPolarHBondContact O-CG 3.36Å; E354-L358 PolarHBondContact O-N 3.27Å; H355-L358 PolarHBondContact O-N 2.95Å
359	T	93.3	Very high	96.5	Very high	15 Å²	15	48.8 Å²	48.8	9%	0.092	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	3	177.8	65.3	0	0	0	0	114.3	A283 M351 H355 R357 L361	A283-T359 HydrophobicContact CB-CG2 3.37Å; M351-T359 HydrophobicContact CE-CG2 3.86Å; M351-T359 WeakPolarHBondContact CE-OG1 3.31Å; H355-T359 WeakPolarHBondContact O-CG2 3.32Å; H355-T359 PolarHBondContact O-N 3.49Å; H355-T359 PolarHBondContact O-OG1 3.29Å; R357-T359 VanDerWaalsContact C-N 3.34Å; T359-L361 VanDerWaalsContact C-N 3.31Å; T359-L361 PolarHBondContact O-N 2.87Å; T359-L361 WeakPolarHBondContact OG1-CD1 3.28Å; T359-L361 WeakPolarHBondContact OG1-CG 3.37Å
360	G	92.9	Very high	96.5	Very high	50 Å²	50	52.4 Å²	52.4	52%	0.515	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.4	9.2	-179.4	0	0	0	0	0	115.6	S356 R357 H453	S356-G360 PolarHBondContact O-N 3.14Å; R357-G360 PolarHBondContact O-N 3.41Å; G360-H453 PolarHBondContact O-CE1 3.34Å
361	L	95.8	Very high	96.6	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.005	26%	0.256	C	S	.	.			trans	-88.3	-0.4	-177.7	-67.7	171.8	0	0	0	114.7	L284 L287 M351 S356 T359 D363 L364 Y365	L284-L361 HydrophobicContact CD2-CD1 4.27Å; L284-L361 HydrophobicContact CD2-CD2 3.75Å; L284-L361 HydrophobicContact CD2-CG 4.08Å; L287-L361 HydrophobicContact CD1-CD1 3.4Å; L287-L361 VanDerWaalsContact CD1-CD1 3.4Å; M351-L361 HydrophobicContact CE-CD1 4.03Å; M351-L361 HydrophobicContact SD-CD1 4.08Å; S356-L361 CarbonylContact O-C 3.48Å; S356-L361 WeakPolarHBondContact O-CA 3.36Å; S356-L361 PolarHBondContact O-N 3.21Å; T359-L361 VanDerWaalsContact C-N 3.31Å; T359-L361 PolarHBondContact O-N 2.87Å; T359-L361 WeakPolarHBondContact OG1-CD1 3.28Å; T359-L361 WeakPolarHBondContact OG1-CG 3.37Å; L361-D363 VanDerWaalsContact C-N 3.32Å; L361-D363 PolarHBondContact O-N 2.92Å; L361-D363 VanDerWaalsContact O-N 3.13Å; L361-L364 HydrophobicContact CD2-CD1 4.12Å; L361-L364 WeakPolarHBondContact O-CA 3.46Å; L361-L364 WeakPolarHBondContact O-CB 3.39Å; L361-L364 PolarHBondContact O-N 2.98Å; L361-Y365 PolarHBondContact O-N 3.34Å
362	L	96.8	Very high	96.7	Very high	55 Å²	55	49.3 Å²	49.3	29%	0.288	26%	0.256	S	S	.	.	H	α-helix	trans	-49.7	-43.3	-169.4	-173.7	60.4	0	0	0	114.6	E353 S356 R357 L364 Y365 V366	E353-L362 HydrophobicContact CG-CD1 3.63Å; S356-L362 PolarHBondContact O-N 3.41Å; R357-L362 HydrophobicContact CB-CD1 4.42Å; R357-L362 HydrophobicContact CB-CD2 4.36Å; L362-L364 VanDerWaalsContact C-N 3.34Å; L362-L364 PolarHBondContact O-N 2.86Å; L362-Y365 HydrophobicContact CD1-CD1 4.08Å; L362-Y365 WeakPolarHBondContact O-CB 3.48Å; L362-Y365 PolarHBondContact O-N 2.66Å; L362-V366 HydrophobicContact CD1-CG2 4.32Å; L362-V366 WeakPolarHBondContact O-CG2 3.28Å; L362-V366 PolarHBondContact O-N 3.46Å
363	D	96.8	Very high	96.7	Very high	128 Å²	128	52.6 Å²	52.6	68%	0.684	27%	0.265	S	S	*	.	H	α-helix	trans	-66.7	-33.4	179	-73.2	-35.4	0	0	0	113	L361 S367	L361-D363 VanDerWaalsContact C-N 3.32Å; L361-D363 PolarHBondContact O-N 2.92Å; L361-D363 VanDerWaalsContact O-N 3.13Å; D363-S367 WeakPolarHBondContact O-CB 3.31Å; D363-S367 PolarHBondContact O-N 3.41Å; D363-S367 PolarHBondContact O-OG 3.48Å
364	L	97	Very high	96.8	Very high	10 Å²	10	51.5 Å²	51.5	5%	0.052	26%	0.259	C	S	.	.	H	α-helix	trans	-72.2	-45.8	171.8	-62.8	-169.7	0	0	0	110.4	L361 L362 V366 S367 I368 K449 A450 H453 F454	L361-L364 HydrophobicContact CD2-CD1 4.12Å; L361-L364 WeakPolarHBondContact O-CA 3.46Å; L361-L364 WeakPolarHBondContact O-CB 3.39Å; L361-L364 PolarHBondContact O-N 2.98Å; L362-L364 VanDerWaalsContact C-N 3.34Å; L362-L364 PolarHBondContact O-N 2.86Å; L364-V366 PolarHBondContact O-N 2.88Å; L364-S367 PolarHBondContact O-N 2.93Å; L364-S367 VanDerWaalsContact O-N 3.08Å; L364-I368 HydrophobicContact CB-CD1 4.49Å; L364-I368 VanDerWaalsContact O-CG1 3.29Å; L364-I368 WeakPolarHBondContact O-CG1 3.49Å; L364-I368 PolarHBondContact O-N 3.48Å; L364-K449 HydrophobicContact CD2-CB 4.06Å; L364-A450 HydrophobicContact CD1-CB 4.44Å; L364-A450 HydrophobicContact CD2-CB 4.3Å; L364-H453 HydrophobicContact CD1-CB 3.87Å; L364-H453 HydrophobicContact CD2-CB 4Å; L364-H453 HydrophobicContact CG-CB 4.15Å; L364-F454 HydrophobicContact CD1-CE2 4.36Å
365	Y	98.2	Very high	96.8	Very high	5 Å²	5	46.5 Å²	46.5	2%	0.02	24%	0.235	C	C	.	.	H	α-helix	trans	-53.3	-51.6	177.3	164.9	-89.9	0	0	0	111.4	D341 L343 E353 S356 L361 L362 S367 I368 L369	D341-Y365 PolarHBondContact O-OH 3Å; L343-Y365 HydrophobicContact CD1-CD2 3.63Å; L343-Y365 HydrophobicContact CD1-CE2 4.41Å; L343-Y365 HydrophobicContact CD1-CG 4.25Å; L343-Y365 HydrophobicContact CG-CD2 3.76Å; L343-Y365 HydrophobicContact CG-CE2 4.06Å; E353-Y365 HydrophobicContact CB-CD1 4.41Å; E353-Y365 HydrophobicContact CB-CE1 3.59Å; E353-Y365 HydrophobicContact CG-CD1 4.21Å; E353-Y365 HydrophobicContact CG-CE1 3.64Å; E353-Y365 PolarHBondContact N-OH 3.21Å; S356-Y365 VanDerWaalsContact OG-CD2 3.25Å; S356-Y365 WeakPolarHBondContact OG-CD2 3.17Å; L361-Y365 PolarHBondContact O-N 3.34Å; L362-Y365 HydrophobicContact CD1-CD1 4.08Å; L362-Y365 WeakPolarHBondContact O-CB 3.48Å; L362-Y365 PolarHBondContact O-N 2.66Å; Y365-S367 VanDerWaalsContact C-N 3.31Å; Y365-S367 PolarHBondContact O-N 2.93Å; Y365-I368 PolarHBondContact O-N 3.38Å; Y365-L369 HydrophobicContact CE1-CD2 3.89Å; Y365-L369 HydrophobicContact CE2-CD2 4.41Å; Y365-L369 WeakPolarHBondContact O-CB 3.44Å; Y365-L369 PolarHBondContact O-N 3.48Å; Y365-L369 WeakPolarHBondContact OH-CD2 3.5Å
366	V	98.1	Very high	97	Very high	70 Å²	70	44.7 Å²	44.7	42%	0.424	23%	0.226	S	C	.	.	H	α-helix	trans	-60.8	-40.1	177.2	172.8	0	0	0	0	111.6	L362 L364 Q370	L362-V366 HydrophobicContact CD1-CG2 4.32Å; L362-V366 WeakPolarHBondContact O-CG2 3.28Å; L362-V366 PolarHBondContact O-N 3.46Å; L364-V366 PolarHBondContact O-N 2.88Å; V366-Q370 WeakPolarHBondContact O-CB 3.11Å; V366-Q370 PolarHBondContact O-N 3.04Å
367	S	98.2	Very high	97	Very high	4 Å²	4	53.5 Å²	53.5	3%	0.028	26%	0.264	C	S	.	.	H	α-helix	trans	-68.9	-41.6	-179.2	-57.6	0	0	0	0	112.7	D363 L364 Y365 K449	D363-S367 WeakPolarHBondContact O-CB 3.31Å; D363-S367 PolarHBondContact O-N 3.41Å; D363-S367 PolarHBondContact O-OG 3.48Å; L364-S367 PolarHBondContact O-N 2.93Å; L364-S367 VanDerWaalsContact O-N 3.08Å; Y365-S367 VanDerWaalsContact C-N 3.31Å; Y365-S367 PolarHBondContact O-N 2.93Å; S367-K449 WeakPolarHBondContact OG-CD 3.36Å; S367-K449 PolarHBondContact OG-NZ 3.49Å
368	I	98.6	Very high	97	Very high	3 Å²	3	50.3 Å²	50.3	2%	0.015	26%	0.255	C	S	.	.	H	α-helix	trans	-70.9	-43.2	176.2	-62.3	166.3	0	0	0	110	I329 I332 V333 L343 L364 Y365 Q370 L371 V372 T446	I329-I368 HydrophobicContact CD1-CD1 3.59Å; I329-I368 HydrophobicContact CD1-CG1 3.8Å; I329-I368 HydrophobicContact CG2-CG1 4.46Å; I332-I368 HydrophobicContact CG2-CG2 4.17Å; V333-I368 HydrophobicContact CG2-CG2 3.88Å; L343-I368 HydrophobicContact CD1-CB 3.8Å; L343-I368 HydrophobicContact CD1-CD1 4.2Å; L343-I368 HydrophobicContact CD1-CG2 3.83Å; L343-I368 HydrophobicContact CD2-CB 4.35Å; L343-I368 HydrophobicContact CD2-CG2 3.72Å; L343-I368 HydrophobicContact CG-CG2 4.45Å; L364-I368 HydrophobicContact CB-CD1 4.49Å; L364-I368 VanDerWaalsContact O-CG1 3.29Å; L364-I368 WeakPolarHBondContact O-CG1 3.49Å; L364-I368 PolarHBondContact O-N 3.48Å; Y365-I368 PolarHBondContact O-N 3.38Å; I368-Q370 VanDerWaalsContact C-N 3.3Å; I368-Q370 PolarHBondContact O-N 3.4Å; I368-L371 CarbonylContact O-C 3.55Å; I368-L371 WeakPolarHBondContact O-CA 3.29Å; I368-L371 VanDerWaalsContact O-CB 3.27Å; I368-L371 WeakPolarHBondContact O-CB 3.45Å; I368-L371 PolarHBondContact O-N 2.93Å; I368-V372 HydrophobicContact CG2-CG2 4.42Å; I368-V372 PolarHBondContact O-N 3.2Å; I368-T446 HydrophobicContact CB-CG2 4.48Å; I368-T446 HydrophobicContact CG1-CG2 3.68Å
369	L	98.2	Very high	97.1	Very high	3 Å²	3	52.3 Å²	52.3	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-64.8	-32.3	179.6	-175.8	63.2	0	0	0	112.4	D341 L343 Y365 L371 V372 R373	D341-L369 HydrophobicContact CB-CD2 4.16Å; L343-L369 HydrophobicContact CD2-CB 4.43Å; L343-L369 HydrophobicContact CD2-CD1 4.49Å; Y365-L369 HydrophobicContact CE1-CD2 3.89Å; Y365-L369 HydrophobicContact CE2-CD2 4.41Å; Y365-L369 WeakPolarHBondContact O-CB 3.44Å; Y365-L369 PolarHBondContact O-N 3.48Å; Y365-L369 WeakPolarHBondContact OH-CD2 3.5Å; L369-L371 PolarHBondContact O-N 2.94Å; L369-V372 HydrophobicContact CD1-CB 4.22Å; L369-V372 HydrophobicContact CD1-CG1 4.37Å; L369-V372 PolarHBondContact O-N 3.29Å; L369-R373 HydrophobicContact CD1-CG 4.35Å; L369-R373 HydrophobicContact CG-CG 4.38Å; L369-R373 WeakPolarHBondContact O-CB 3.44Å; L369-R373 WeakPolarHBondContact O-CD 3.41Å; L369-R373 VanDerWaalsContact O-CG 3.24Å; L369-R373 WeakPolarHBondContact O-CG 3.18Å; L369-R373 PolarHBondContact O-N 3.37Å
370	Q	98	Very high	97.3	Very high	102 Å²	102	52.1 Å²	52.1	48%	0.477	26%	0.257	S	S	.	.	H	α-helix	trans	-58.6	-37	168.7	-175	-175.8	-26.9	0	0	111.9	V366 I368 K374 L442	V366-Q370 WeakPolarHBondContact O-CB 3.11Å; V366-Q370 PolarHBondContact O-N 3.04Å; I368-Q370 VanDerWaalsContact C-N 3.3Å; I368-Q370 PolarHBondContact O-N 3.4Å; Q370-K374 PolarHBondContact O-N 3.42Å; Q370-L442 HydrophobicContact CG-CD2 4.26Å
371	L	97.9	Very high	97.5	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-74.8	-43.9	176.7	-164.8	55.9	0	0	0	111.5	I329 V333 I368 L369 R373 K374 Y375 L442 L443	I329-L371 HydrophobicContact CG2-CD2 4.17Å; V333-L371 HydrophobicContact CG1-CG 4.42Å; V333-L371 HydrophobicContact CG2-CB 4.04Å; V333-L371 HydrophobicContact CG2-CD2 4.01Å; V333-L371 HydrophobicContact CG2-CG 3.99Å; I368-L371 CarbonylContact O-C 3.55Å; I368-L371 WeakPolarHBondContact O-CA 3.29Å; I368-L371 VanDerWaalsContact O-CB 3.27Å; I368-L371 WeakPolarHBondContact O-CB 3.45Å; I368-L371 PolarHBondContact O-N 2.93Å; L369-L371 PolarHBondContact O-N 2.94Å; L371-R373 PolarHBondContact O-N 3.01Å; L371-K374 WeakPolarHBondContact O-CB 3.22Å; L371-K374 PolarHBondContact O-N 3.15Å; L371-K374 VanDerWaalsContact O-N 3.08Å; L371-Y375 HydrophobicContact CD1-CD1 3.93Å; L371-Y375 HydrophobicContact CD1-CE1 3.69Å; L371-Y375 HydrophobicContact CG-CD1 4.06Å; L371-Y375 HydrophobicContact CG-CE1 4Å; L371-Y375 WeakPolarHBondContact O-CD1 3.13Å; L371-Y375 PolarHBondContact O-N 2.82Å; L371-L442 HydrophobicContact CD1-CB 4.21Å; L371-L442 HydrophobicContact CD1-CD2 3.87Å; L371-L442 HydrophobicContact CD1-CG 3.98Å; L371-L443 HydrophobicContact CD2-CB 4.01Å; L371-L443 HydrophobicContact CD2-CD1 3.73Å
372	V	98.5	Very high	97.5	Very high	4 Å²	4	56.4 Å²	56.4	2%	0.024	26%	0.263	C	S	.	.	H	α-helix	trans	-52.1	-53.2	170.6	175.8	0	0	0	0	110.8	V333 L337 L343 I368 L369 K374 Y375 K376	V333-V372 HydrophobicContact CB-CG2 4.29Å; V333-V372 HydrophobicContact CG1-CG2 4.33Å; V333-V372 HydrophobicContact CG2-CG2 4Å; L337-V372 HydrophobicContact CD2-CG1 4.29Å; L343-V372 HydrophobicContact CD2-CG2 3.84Å; I368-V372 HydrophobicContact CG2-CG2 4.42Å; I368-V372 PolarHBondContact O-N 3.2Å; L369-V372 HydrophobicContact CD1-CB 4.22Å; L369-V372 HydrophobicContact CD1-CG1 4.37Å; L369-V372 PolarHBondContact O-N 3.29Å; V372-K374 VanDerWaalsContact C-N 3.25Å; V372-K374 PolarHBondContact O-N 3.08Å; V372-Y375 PolarHBondContact O-N 3.46Å; V372-K376 VanDerWaalsContact O-CB 3.24Å; V372-K376 WeakPolarHBondContact O-CB 3.21Å; V372-K376 PolarHBondContact O-N 3.04Å
373	R	97.9	Very high	97.4	Very high	124 Å²	124	56 Å²	56	47%	0.468	26%	0.259	S	S	.	.	H	α-helix	trans	-60.2	-32.7	179.1	-70.4	165.6	172.2	172.3	-10.6	112.2	D341 L369 L371 K377	D341-R373 IonicContact OD1-CZ 2.63Å; D341-R373 IonicContact OD1-NE 3.9Å; D341-R373 PolarHBondContact OD1-NE 3.45Å; D341-R373 IonicContact OD1-NH2 2.84Å; D341-R373 PolarHBondContact OD1-NH2 2.95Å; D341-R373 IonicContact OD2-CZ 2.88Å; D341-R373 IonicContact OD2-NE 3.21Å; D341-R373 IonicContact OD2-NH2 3.99Å; D341-R373 PolarHBondContact OD2-NH2 3.12Å; L369-R373 HydrophobicContact CD1-CG 4.35Å; L369-R373 HydrophobicContact CG-CG 4.38Å; L369-R373 WeakPolarHBondContact O-CB 3.44Å; L369-R373 WeakPolarHBondContact O-CD 3.41Å; L369-R373 VanDerWaalsContact O-CG 3.24Å; L369-R373 WeakPolarHBondContact O-CG 3.18Å; L369-R373 PolarHBondContact O-N 3.37Å; L371-R373 PolarHBondContact O-N 3.01Å; R373-K377 VanDerWaalsContact O-CB 3.29Å; R373-K377 WeakPolarHBondContact O-CB 3.27Å; R373-K377 PolarHBondContact O-N 2.96Å; R373-K377 VanDerWaalsContact O-N 3.11Å
374	K	97.8	Very high	97.5	Very high	72 Å²	72	49.9 Å²	49.9	31%	0.313	23%	0.226	S	C	.	.	H	α-helix	trans	-70.4	-47.2	173.9	-171.9	176.1	179.7	178.5	0	112.2	Q370 L371 V372 K377 L378 M438 T439 L442	Q370-K374 PolarHBondContact O-N 3.42Å; L371-K374 WeakPolarHBondContact O-CB 3.22Å; L371-K374 PolarHBondContact O-N 3.15Å; L371-K374 VanDerWaalsContact O-N 3.08Å; V372-K374 VanDerWaalsContact C-N 3.25Å; V372-K374 PolarHBondContact O-N 3.08Å; K374-K377 PolarHBondContact O-N 2.88Å; K374-L378 WeakPolarHBondContact O-CG 3.35Å; K374-L378 PolarHBondContact O-N 2.8Å; K374-L378 VanDerWaalsContact O-N 3.09Å; K374-M438 PolarHBondContact NZ-O 3.07Å; K374-T439 HydrophobicContact CD-CG2 4.34Å; K374-L442 HydrophobicContact CD-CD2 3.9Å
375	Y	98.2	Very high	97.5	Very high	1 Å²	1	49.7 Å²	49.7	0%	0.004	23%	0.225	C	C	.	.	H	α-helix	trans	-64.9	-42.9	176.7	-87.9	73.6	0	0	0	111.8	L330 V333 L371 V372 K377 L378 K379 V380 L388 T439	L330-Y375 HydrophobicContact CD2-CE1 4.47Å; L330-Y375 HydrophobicContact CD2-CE2 4.33Å; L330-Y375 WeakPolarHBondContact CD2-OH 3.34Å; V333-Y375 HydrophobicContact CG1-CD1 3.86Å; V333-Y375 HydrophobicContact CG1-CD2 4.35Å; V333-Y375 HydrophobicContact CG1-CE1 4.42Å; V333-Y375 HydrophobicContact CG1-CG 3.85Å; L371-Y375 HydrophobicContact CD1-CD1 3.93Å; L371-Y375 HydrophobicContact CD1-CE1 3.69Å; L371-Y375 HydrophobicContact CG-CD1 4.06Å; L371-Y375 HydrophobicContact CG-CE1 4Å; L371-Y375 WeakPolarHBondContact O-CD1 3.13Å; L371-Y375 PolarHBondContact O-N 2.82Å; V372-Y375 PolarHBondContact O-N 3.46Å; Y375-K377 VanDerWaalsContact C-N 3.34Å; Y375-K377 PolarHBondContact O-N 3.15Å; Y375-L378 CarbonylContact O-C 3.57Å; Y375-L378 PolarHBondContact O-N 3.03Å; Y375-L378 VanDerWaalsContact O-N 3.12Å; Y375-K379 PolarHBondContact O-N 2.99Å; Y375-V380 HydrophobicContact CD2-CB 3.81Å; Y375-V380 HydrophobicContact CD2-CG1 3.9Å; Y375-V380 HydrophobicContact CD2-CG2 3.5Å; Y375-V380 VanDerWaalsContact CD2-CG2 3.5Å; Y375-V380 HydrophobicContact CE2-CB 4.47Å; Y375-V380 HydrophobicContact CE2-CG1 4.1Å; Y375-V380 HydrophobicContact CE2-CG2 4.13Å; Y375-V380 HydrophobicContact CG-CG2 4.14Å; Y375-V380 PolarHBondContact O-N 2.9Å; Y375-L388 HydrophobicContact CE2-CD1 3.94Å; Y375-T439 HydrophobicContact CD1-CG2 4.38Å; Y375-T439 HydrophobicContact CE1-CG2 3.84Å; Y375-T439 PolarHBondContact OH-OG1 3.3Å
376	K	97.5	Very high	97.5	Very high	59 Å²	59	49.4 Å²	49.4	26%	0.257	22%	0.224	S	C	.	.	H	α-helix	trans	-61.8	-39.2	176.5	-164.4	170.5	-173.8	178.6	0	112	L337 Y339 E340 V372 K379	L337-K376 HydrophobicContact CD2-CB 4.1Å; L337-K376 VanDerWaalsContact O-CE 3.26Å; L337-K376 WeakPolarHBondContact O-CE 3.41Å; Y339-K376 PolarHBondContact O-NZ 3.43Å; E340-K376 IonicContact OE1-NZ 3.45Å; E340-K376 PolarHBondContact OE1-NZ 3.31Å; E340-K376 IonicContact OE2-NZ 4Å; E340-K376 PolarHBondContact OE2-NZ 3.41Å; V372-K376 VanDerWaalsContact O-CB 3.24Å; V372-K376 WeakPolarHBondContact O-CB 3.21Å; V372-K376 PolarHBondContact O-N 3.04Å; K376-K379 PolarHBondContact O-N 3.32Å
377	K	96.9	Very high	97.5	Very high	186 Å²	186	46.1 Å²	46.1	81%	0.809	20%	0.204	S	C	*	.	H	α-helix	trans	-66.6	-34.9	172.5	-178.3	173.4	179.5	175	0	113.5	R373 K374 Y375 K379	R373-K377 VanDerWaalsContact O-CB 3.29Å; R373-K377 WeakPolarHBondContact O-CB 3.27Å; R373-K377 PolarHBondContact O-N 2.96Å; R373-K377 VanDerWaalsContact O-N 3.11Å; K374-K377 PolarHBondContact O-N 2.88Å; Y375-K377 VanDerWaalsContact C-N 3.34Å; Y375-K377 PolarHBondContact O-N 3.15Å; K377-K379 VanDerWaalsContact C-N 3.29Å
378	L	96.4	Very high	97.5	Very high	39 Å²	39	45.9 Å²	45.9	20%	0.204	20%	0.203	C	C	.	.	H	α-helix	trans	-75.6	-17.6	174.1	-72.2	171.1	0	0	0	112.9	K374 Y375 V380 R432 K435 L436 T439	K374-L378 WeakPolarHBondContact O-CG 3.35Å; K374-L378 PolarHBondContact O-N 2.8Å; K374-L378 VanDerWaalsContact O-N 3.09Å; Y375-L378 CarbonylContact O-C 3.57Å; Y375-L378 PolarHBondContact O-N 3.03Å; Y375-L378 VanDerWaalsContact O-N 3.12Å; L378-V380 HydrophobicContact CB-CG2 3.82Å; L378-R432 PolarHBondContact O-NH1 2.88Å; L378-K435 HydrophobicContact CD2-CB 4.15Å; L378-L436 HydrophobicContact CD1-CD2 4.44Å; L378-T439 HydrophobicContact CD1-CG2 3.7Å
379	K	96.6	Very high	97.5	Very high	167 Å²	167	45.9 Å²	45.9	73%	0.726	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	63	-172.4	-58.1	-177.4	179.9	-176.5	0	110.9	Y375 K376 K377 R432	Y375-K379 PolarHBondContact O-N 2.99Å; K376-K379 PolarHBondContact O-N 3.32Å; K377-K379 VanDerWaalsContact C-N 3.29Å; K379-R432 PolarHBondContact O-NH2 2.84Å
380	V	97.4	Very high	97.4	Very high	12 Å²	12	45.8 Å²	45.8	7%	0.073	20%	0.202	C	C	.	.			trans	-72	128.1	-174.3	178.7	0	0	0	0	111.2	Y375 L378 E384 F385 L436	Y375-V380 HydrophobicContact CD2-CB 3.81Å; Y375-V380 HydrophobicContact CD2-CG1 3.9Å; Y375-V380 HydrophobicContact CD2-CG2 3.5Å; Y375-V380 VanDerWaalsContact CD2-CG2 3.5Å; Y375-V380 HydrophobicContact CE2-CB 4.47Å; Y375-V380 HydrophobicContact CE2-CG1 4.1Å; Y375-V380 HydrophobicContact CE2-CG2 4.13Å; Y375-V380 HydrophobicContact CG-CG2 4.14Å; Y375-V380 PolarHBondContact O-N 2.9Å; L378-V380 HydrophobicContact CB-CG2 3.82Å; V380-E384 VanDerWaalsContact CA-OE2 3.22Å; V380-E384 WeakPolarHBondContact CA-OE2 2.82Å; V380-E384 HydrophobicContact CG1-CB 3.71Å; V380-F385 HydrophobicContact CG1-CB 4.37Å; V380-L436 HydrophobicContact CG1-CD2 4.4Å; V380-L436 HydrophobicContact CG2-CD2 3.7Å
381	E	95.9	Very high	97.4	Very high	57 Å²	57	41 Å²	41	27%	0.266	18%	0.18	S	C	.	.			trans	-81.5	164.3	177.8	-61.7	-172.3	-173.5	0	0	111.2	K250 E383 E384 F385 H426	K250-E381 IonicContact NZ-OE1 2.74Å; K250-E381 PolarHBondContact NZ-OE1 3.01Å; K250-E381 IonicContact NZ-OE2 3.56Å; K250-E381 PolarHBondContact NZ-OE2 2.58Å; E381-E383 VanDerWaalsContact C-N 3.28Å; E381-E383 PolarHBondContact O-N 3.48Å; E381-E384 HydrophobicContact CB-CG 4.16Å; E381-E384 PolarHBondContact N-OE2 3.43Å; E381-E384 PolarHBondContact O-N 2.65Å; E381-F385 PolarHBondContact O-N 3.04Å; E381-H426 IonicContact OE1-CE1 2.67Å; E381-H426 PolarHBondContact OE1-CE1 3.23Å; E381-H426 IonicContact OE1-NE2 3.97Å; E381-H426 PolarHBondContact OE1-NE2 3.22Å; E381-H426 IonicContact OE2-CE1 3.38Å; E381-H426 IonicContact OE2-NE2 3.41Å
382	K	96.4	Very high	97.4	Very high	84 Å²	84	41 Å²	41	37%	0.365	18%	0.18	S	C	.	.	H	α-helix	trans	-64.2	-39	-176.6	-170.6	-171.3	175.9	-163.3	0	110.9	L261 F334 E384 F385 V386	L261-K382 HydrophobicContact CD2-CB 4.29Å; L261-K382 HydrophobicContact CD2-CD 3.85Å; L261-K382 HydrophobicContact CD2-CG 3.98Å; F334-K382 HydrophobicContact CE1-CG 4.16Å; F334-K382 HydrophobicContact CZ-CB 3.87Å; F334-K382 HydrophobicContact CZ-CG 3.99Å; K382-E384 VanDerWaalsContact C-N 3.32Å; K382-E384 PolarHBondContact O-N 3.31Å; K382-F385 WeakPolarHBondContact O-CB 3.39Å; K382-F385 PolarHBondContact O-N 3.2Å; K382-V386 HydrophobicContact CG-CG1 4.39Å; K382-V386 PolarHBondContact O-N 3.03Å
383	E	96.1	Very high	97.3	Very high	46 Å²	46	41 Å²	41	22%	0.215	18%	0.179	C	C	.	.	H	α-helix	trans	-54.7	-46.2	175.6	-71.6	79.7	176.8	0	0	111.9	L253 V257 L261 E381 V386 T387 F421	L253-E383 HydrophobicContact CD1-CG 4.36Å; L253-E383 HydrophobicContact CD2-CG 4.23Å; V257-E383 HydrophobicContact CG1-CB 3.76Å; V257-E383 HydrophobicContact CG1-CG 3.83Å; L261-E383 HydrophobicContact CD1-CG 3.91Å; L261-E383 HydrophobicContact CD2-CG 4.12Å; L261-E383 HydrophobicContact CG-CG 4.24Å; E381-E383 VanDerWaalsContact C-N 3.28Å; E381-E383 PolarHBondContact O-N 3.48Å; E383-V386 WeakPolarHBondContact O-CG2 3.48Å; E383-T387 WeakPolarHBondContact O-CB 3.33Å; E383-T387 PolarHBondContact O-N 2.72Å; E383-T387 PolarHBondContact O-OG1 3.34Å; E383-F421 HydrophobicContact CB-CD2 4.15Å; E383-F421 HydrophobicContact CB-CE1 4.16Å; E383-F421 HydrophobicContact CB-CE2 3.39Å; E383-F421 HydrophobicContact CB-CZ 3.41Å; E383-F421 VanDerWaalsContact CB-CZ 3.41Å; E383-F421 HydrophobicContact CG-CE2 3.63Å; E383-F421 HydrophobicContact CG-CZ 3.99Å
384	E	97.4	Very high	97.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-68.2	-43.3	178.1	-59.1	171.4	-171.6	0	0	110.7	V380 E381 K382 T387 L388 F421 E422 H426 R432 L436	V380-E384 VanDerWaalsContact CA-OE2 3.22Å; V380-E384 WeakPolarHBondContact CA-OE2 2.82Å; V380-E384 HydrophobicContact CG1-CB 3.71Å; E381-E384 HydrophobicContact CB-CG 4.16Å; E381-E384 PolarHBondContact N-OE2 3.43Å; E381-E384 PolarHBondContact O-N 2.65Å; K382-E384 VanDerWaalsContact C-N 3.32Å; K382-E384 PolarHBondContact O-N 3.31Å; E384-T387 PolarHBondContact O-N 2.74Å; E384-L388 WeakPolarHBondContact O-CB 3.49Å; E384-L388 VanDerWaalsContact O-CG 3.29Å; E384-L388 WeakPolarHBondContact O-CG 3.42Å; E384-L388 PolarHBondContact O-N 3.15Å; E384-F421 HydrophobicContact CG-CD1 4.15Å; E384-F421 HydrophobicContact CG-CE1 3.49Å; E384-F421 VanDerWaalsContact CG-CE1 3.49Å; E384-F421 HydrophobicContact CG-CZ 4.28Å; E384-E422 WeakPolarHBondContact CG-OE1 3.37Å; E384-H426 IonicContact OE1-CE1 3.79Å; E384-H426 PolarHBondContact OE1-CE1 3.23Å; E384-H426 IonicContact OE1-ND1 2.87Å; E384-H426 IonicContact OE1-NE2 2.74Å; E384-R432 IonicContact OE1-CZ 3.64Å; E384-R432 VanDerWaalsContact OE1-CZ 3.24Å; E384-R432 IonicContact OE1-NE 2.78Å; E384-R432 PolarHBondContact OE1-NE 2.88Å; E384-R432 IonicContact OE1-NH2 3.94Å; E384-R432 PolarHBondContact OE1-NH2 3.06Å; E384-R432 IonicContact OE2-CZ 3.76Å; E384-R432 IonicContact OE2-NE 3.89Å; E384-R432 IonicContact OE2-NH2 3.42Å; E384-R432 PolarHBondContact OE2-NH2 3.44Å; E384-L436 HydrophobicContact CB-CD1 4.13Å; E384-L436 HydrophobicContact CG-CD1 4.07Å
385	F	98.2	Very high	96.5	Very high	5 Å²	5	34.4 Å²	34.4	2%	0.022	16%	0.158	C	C	.	.	H	α-helix	trans	-59.7	-52.4	175.8	158.5	-106.7	0	0	0	112.7	E264 L330 F334 V380 E381 K382 T387 L388 K389	E264-F385 WeakPolarHBondContact OE1-CE1 3.35Å; L330-F385 HydrophobicContact CB-CE2 4.06Å; L330-F385 WeakPolarHBondContact O-CE2 3.24Å; F334-F385 HydrophobicContact CB-CD1 4.25Å; F334-F385 HydrophobicContact CB-CD2 3.47Å; F334-F385 VanDerWaalsContact CB-CD2 3.47Å; F334-F385 HydrophobicContact CB-CE1 4.26Å; F334-F385 HydrophobicContact CB-CE2 3.47Å; F334-F385 VanDerWaalsContact CB-CE2 3.47Å; F334-F385 HydrophobicContact CB-CG 3.87Å; F334-F385 HydrophobicContact CB-CZ 3.89Å; F334-F385 AromaticContact CD1-CD1 3.63Å; F334-F385 HydrophobicContact CD1-CD1 3.63Å; F334-F385 HydrophobicContact CD1-CD2 4.4Å; F334-F385 AromaticContact CD1-CE1 3.76Å; F334-F385 HydrophobicContact CD1-CE1 3.76Å; F334-F385 HydrophobicContact CD1-CE2 4.49Å; F334-F385 AromaticContact CD1-CG 3.96Å; F334-F385 HydrophobicContact CD1-CG 3.96Å; F334-F385 HydrophobicContact CD1-CZ 4.19Å; F334-F385 HydrophobicContact CD2-CB 3.44Å; F334-F385 VanDerWaalsContact CD2-CB 3.44Å; F334-F385 AromaticContact CD2-CD1 3.96Å; F334-F385 HydrophobicContact CD2-CD1 3.96Å; F334-F385 AromaticContact CD2-CD2 3.88Å; F334-F385 HydrophobicContact CD2-CD2 3.88Å; F334-F385 AromaticContact CD2-CG 3.47Å; F334-F385 HydrophobicContact CD2-CG 3.47Å; F334-F385 VanDerWaalsContact CD2-CG 3.47Å; F334-F385 AromaticContact CE1-CD1 3.92Å; F334-F385 HydrophobicContact CE1-CD1 3.92Å; F334-F385 HydrophobicContact CE1-CE1 4.32Å; F334-F385 HydrophobicContact CE1-CG 4.41Å; F334-F385 HydrophobicContact CE2-CB 3.62Å; F334-F385 HydrophobicContact CE2-CD1 4.23Å; F334-F385 AromaticContact CE2-CG 3.98Å; F334-F385 HydrophobicContact CE2-CG 3.98Å; F334-F385 HydrophobicContact CG-CB 4.01Å; F334-F385 AromaticContact CG-CD1 3.66Å; F334-F385 HydrophobicContact CG-CD1 3.66Å; F334-F385 AromaticContact CG-CD2 3.66Å; F334-F385 HydrophobicContact CG-CD2 3.66Å; F334-F385 AromaticContact CG-CE1 4Å; F334-F385 HydrophobicContact CG-CE1 4Å; F334-F385 AromaticContact CG-CE2 3.98Å; F334-F385 HydrophobicContact CG-CE2 3.98Å; F334-F385 AromaticContact CG-CG 3.47Å; F334-F385 HydrophobicContact CG-CG 3.47Å; F334-F385 VanDerWaalsContact CG-CG 3.47Å; F334-F385 HydrophobicContact CG-CZ 4.14Å; F334-F385 HydrophobicContact CZ-CB 4.31Å; F334-F385 HydrophobicContact CZ-CD1 4.21Å; F334-F385 HydrophobicContact CZ-CG 4.43Å; V380-F385 HydrophobicContact CG1-CB 4.37Å; E381-F385 PolarHBondContact O-N 3.04Å; K382-F385 WeakPolarHBondContact O-CB 3.39Å; K382-F385 PolarHBondContact O-N 3.2Å; F385-T387 PolarHBondContact O-N 2.86Å; F385-L388 PolarHBondContact O-N 3.18Å; F385-K389 HydrophobicContact CE1-CD 4.47Å; F385-K389 HydrophobicContact CE2-CD 4.37Å; F385-K389 HydrophobicContact CZ-CD 3.96Å; F385-K389 VanDerWaalsContact O-CB 3.3Å; F385-K389 WeakPolarHBondContact O-CB 3.46Å; F385-K389 PolarHBondContact O-N 3.45Å
386	V	97.9	Very high	95.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65	-29.8	-179.1	-60.7	0	0	0	0	111.9	L260 L261 E264 K382 E383 A390	L260-V386 HydrophobicContact CB-CB 4.11Å; L260-V386 HydrophobicContact CB-CG2 3.73Å; L261-V386 HydrophobicContact CD2-CG2 4.19Å; L261-V386 HydrophobicContact CG-CG2 4.44Å; E264-V386 HydrophobicContact CB-CG1 3.88Å; E264-V386 HydrophobicContact CG-CG1 3.78Å; K382-V386 HydrophobicContact CG-CG1 4.39Å; K382-V386 PolarHBondContact O-N 3.03Å; E383-V386 WeakPolarHBondContact O-CG2 3.48Å; V386-A390 PolarHBondContact O-N 3.39Å; V386-A390 VanDerWaalsContact O-N 3.13Å
387	T	97.8	Very high	94.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-73.7	-44.6	175.9	-50.4	0	0	0	0	111.2	E383 E384 F385 K389 A390 I391 L418	E383-T387 WeakPolarHBondContact O-CB 3.33Å; E383-T387 PolarHBondContact O-N 2.72Å; E383-T387 PolarHBondContact O-OG1 3.34Å; E384-T387 PolarHBondContact O-N 2.74Å; F385-T387 PolarHBondContact O-N 2.86Å; T387-K389 VanDerWaalsContact C-N 3.3Å; T387-K389 PolarHBondContact O-N 3Å; T387-A390 PolarHBondContact O-N 3.02Å; T387-I391 HydrophobicContact CG2-CD1 3.97Å; T387-I391 WeakPolarHBondContact O-CD1 3.48Å; T387-I391 VanDerWaalsContact O-CG1 3.25Å; T387-I391 WeakPolarHBondContact O-CG1 3.44Å; T387-I391 PolarHBondContact O-N 2.7Å; T387-L418 HydrophobicContact CG2-CB 3.88Å; T387-L418 HydrophobicContact CG2-CD1 4.19Å
388	L	98.1	Very high	93.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.3	-35.6	172.9	-75.3	166.9	0	0	0	112.6	Y375 E384 F385 I391 A392 L436 L437 L440	Y375-L388 HydrophobicContact CE2-CD1 3.94Å; E384-L388 WeakPolarHBondContact O-CB 3.49Å; E384-L388 VanDerWaalsContact O-CG 3.29Å; E384-L388 WeakPolarHBondContact O-CG 3.42Å; E384-L388 PolarHBondContact O-N 3.15Å; F385-L388 PolarHBondContact O-N 3.18Å; L388-I391 PolarHBondContact O-N 3.24Å; L388-A392 WeakPolarHBondContact O-CB 3.29Å; L388-A392 PolarHBondContact O-N 3.27Å; L388-L436 HydrophobicContact CD1-CB 4.12Å; L388-L436 HydrophobicContact CD1-CD2 4.11Å; L388-L436 HydrophobicContact CD2-CB 4.19Å; L388-L437 HydrophobicContact CD2-CD2 4.45Å; L388-L440 HydrophobicContact CD2-CD2 4.3Å
389	K	97.5	Very high	92	Very high	3 Å²	3	37.4 Å²	37.4	1%	0.013	19%	0.187	C	C	.	.	H	α-helix	trans	-63.2	-43.4	174.8	-164.4	-173.7	179.6	-174.8	0	111.4	E264 W301 I327 L330 F385 T387 A392 L393	E264-K389 IonicContact OE1-NZ 3.4Å; E264-K389 PolarHBondContact OE1-NZ 3.2Å; E264-K389 IonicContact OE2-NZ 3.67Å; E264-K389 PolarHBondContact OE2-NZ 2.98Å; W301-K389 HydrophobicContact CH2-CB 4.15Å; W301-K389 HydrophobicContact CH2-CD 3.97Å; W301-K389 HydrophobicContact CH2-CG 3.61Å; W301-K389 HydrophobicContact CZ2-CB 4.2Å; W301-K389 HydrophobicContact CZ2-CD 3.72Å; W301-K389 HydrophobicContact CZ2-CG 3.83Å; W301-K389 HydrophobicContact CZ3-CG 4.39Å; I327-K389 HydrophobicContact CG2-CD 4.31Å; I327-K389 VanDerWaalsContact CG2-CE 3.49Å; I327-K389 HydrophobicContact CG2-CG 3.89Å; L330-K389 HydrophobicContact CD1-CB 4.23Å; L330-K389 HydrophobicContact CD1-CG 4.48Å; F385-K389 HydrophobicContact CE1-CD 4.47Å; F385-K389 HydrophobicContact CE2-CD 4.37Å; F385-K389 HydrophobicContact CZ-CD 3.96Å; F385-K389 VanDerWaalsContact O-CB 3.3Å; F385-K389 WeakPolarHBondContact O-CB 3.46Å; F385-K389 PolarHBondContact O-N 3.45Å; T387-K389 VanDerWaalsContact C-N 3.3Å; T387-K389 PolarHBondContact O-N 3Å; K389-A392 PolarHBondContact O-N 3.47Å; K389-L393 PolarHBondContact O-N 3.2Å
390	A	98	Very high	91.3	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.008	18%	0.176	C	C	.	.	H	α-helix	trans	-69.1	-39.9	173.8	0	0	0	0	0	112.6	L260 I305 V386 T387 A392 L393 A394 L414	L260-A390 HydrophobicContact CD1-CB 3.93Å; L260-A390 HydrophobicContact CD2-CB 4.07Å; I305-A390 HydrophobicContact CD1-CB 4.23Å; I305-A390 HydrophobicContact CG1-CB 4.48Å; I305-A390 HydrophobicContact CG2-CB 4.36Å; V386-A390 PolarHBondContact O-N 3.39Å; V386-A390 VanDerWaalsContact O-N 3.13Å; T387-A390 PolarHBondContact O-N 3.02Å; A390-A392 VanDerWaalsContact C-N 3.33Å; A390-A392 PolarHBondContact O-N 2.86Å; A390-L393 PolarHBondContact O-N 2.69Å; A390-A394 PolarHBondContact O-N 2.71Å; A390-A394 VanDerWaalsContact O-N 3.12Å; A390-L414 HydrophobicContact CB-CD1 4.17Å; A390-L414 HydrophobicContact CB-CD2 3.82Å
391	I	97.9	Very high	90.9	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-62.7	-40	174.3	-68.2	161.8	0	0	0	110.7	T387 L388 L393 A394 N395 L414 L418 L437 L440	T387-I391 HydrophobicContact CG2-CD1 3.97Å; T387-I391 WeakPolarHBondContact O-CD1 3.48Å; T387-I391 VanDerWaalsContact O-CG1 3.25Å; T387-I391 WeakPolarHBondContact O-CG1 3.44Å; T387-I391 PolarHBondContact O-N 2.7Å; L388-I391 PolarHBondContact O-N 3.24Å; I391-L393 VanDerWaalsContact C-N 3.29Å; I391-L393 PolarHBondContact O-N 2.74Å; I391-A394 PolarHBondContact O-N 2.89Å; I391-N395 HydrophobicContact CG2-CB 4.46Å; I391-N395 WeakPolarHBondContact O-CB 3.45Å; I391-N395 PolarHBondContact O-N 2.85Å; I391-L414 HydrophobicContact CG1-CB 3.78Å; I391-L418 HydrophobicContact CD1-CB 4.28Å; I391-L418 HydrophobicContact CD1-CD2 3.9Å; I391-L437 HydrophobicContact CD1-CD2 4.16Å; I391-L437 HydrophobicContact CG2-CD2 4.06Å; I391-L440 HydrophobicContact CG2-CD1 3.84Å
392	A	96.9	Very high	90.6	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.008	20%	0.203	C	C	.	.	H	α-helix	trans	-62.6	-34.5	176.9	0	0	0	0	0	112.6	A323 L330 L388 K389 A390 L440 L443	A323-A392 VanDerWaalsContact CB-O 3.29Å; A323-A392 WeakPolarHBondContact CB-O 3.12Å; L330-A392 HydrophobicContact CD1-CB 4.04Å; L388-A392 WeakPolarHBondContact O-CB 3.29Å; L388-A392 PolarHBondContact O-N 3.27Å; K389-A392 PolarHBondContact O-N 3.47Å; A390-A392 VanDerWaalsContact C-N 3.33Å; A390-A392 PolarHBondContact O-N 2.86Å; A392-L440 HydrophobicContact CB-CD2 4.45Å; A392-L443 HydrophobicContact CB-CD2 4.23Å
393	L	96.1	Very high	90.4	Very high	2 Å²	2	40 Å²	40	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-67.9	-43.9	172.3	-179	65.5	0	0	0	112.5	W301 A302 I305 F308 L319 L320 A323 I327 K389 A390 I391	W301-L393 HydrophobicContact CZ3-CD2 4.32Å; A302-L393 HydrophobicContact CB-CD2 3.86Å; I305-L393 HydrophobicContact CD1-CD2 3.46Å; I305-L393 VanDerWaalsContact CD1-CD2 3.46Å; F308-L393 HydrophobicContact CD2-CD2 3.81Å; F308-L393 HydrophobicContact CE2-CD1 4.46Å; F308-L393 HydrophobicContact CE2-CD2 3.63Å; F308-L393 HydrophobicContact CE2-CG 4.15Å; F308-L393 HydrophobicContact CZ-CD2 4.31Å; L319-L393 HydrophobicContact CB-CD1 4.03Å; L319-L393 HydrophobicContact CB-CG 4.38Å; L320-L393 HydrophobicContact CD2-CD1 3.88Å; L320-L393 HydrophobicContact CG-CD1 4.05Å; A323-L393 HydrophobicContact CB-CD1 4.16Å; I327-L393 HydrophobicContact CD1-CB 4.12Å; I327-L393 HydrophobicContact CD1-CD1 3.96Å; K389-L393 PolarHBondContact O-N 3.2Å; A390-L393 PolarHBondContact O-N 2.69Å; I391-L393 VanDerWaalsContact C-N 3.29Å; I391-L393 PolarHBondContact O-N 2.74Å
394	A	94.4	Very high	90.2	Very high	4 Å²	4	44.8 Å²	44.8	3%	0.033	23%	0.229	C	C	.	.	H	α-helix	trans	-76.8	-28.7	-177.9	0	0	0	0	0	113.4	A390 I391 S396 L410 Q411 L414	A390-A394 PolarHBondContact O-N 2.71Å; A390-A394 VanDerWaalsContact O-N 3.12Å; I391-A394 PolarHBondContact O-N 2.89Å; A394-S396 PolarHBondContact O-N 2.92Å; A394-L410 HydrophobicContact CB-CD2 4.31Å; A394-L410 HydrophobicContact CB-CG 4.23Å; A394-Q411 HydrophobicContact CB-CB 4.45Å; A394-L414 HydrophobicContact CB-CD1 3.83Å
395	N	85.5	Confident	90.1	Very high	55 Å²	55	50.9 Å²	50.9	29%	0.294	26%	0.258	S	S	.	.	S	Bend	trans	-85.7	62.3	-178.2	-166.6	39.2	0	0	0	111.6	I391 Q411 R444	I391-N395 HydrophobicContact CG2-CB 4.46Å; I391-N395 WeakPolarHBondContact O-CB 3.45Å; I391-N395 PolarHBondContact O-N 2.85Å; N395-Q411 PolarHBondContact OD1-NE2 2.8Å; N395-R444 PolarHBondContact O-NH2 2.67Å
396	S	77.3	Confident	89.9	Confident	27 Å²	27	51.7 Å²	51.7	19%	0.189	27%	0.265	C	S	.	.			trans	-84.9	137.9	-175.2	-177.2	0	0	0	0	113	S322 A394 S398	S322-S396 WeakPolarHBondContact CB-OG 3.39Å; S322-S396 VanDerWaalsContact OG-CB 3.27Å; S322-S396 WeakPolarHBondContact OG-CB 3.28Å; S322-S396 PolarHBondContact OG-OG 3.25Å; A394-S396 PolarHBondContact O-N 2.92Å; S396-S398 WeakPolarHBondContact OG-CB 3.18Å; S396-S398 PolarHBondContact OG-N 3.19Å
397	D	72	Confident	89.8	Confident	112 Å²	112	52.4 Å²	52.4	60%	0.599	27%	0.27	S	S	*	.			trans	-87.6	13.6	167.9	-58.8	-11.5	0	0	0	112	M399 R444	D397-M399 PolarHBondContact O-N 3.09Å; D397-R444 IonicContact OD1-CZ 2.82Å; D397-R444 IonicContact OD1-NH1 3.09Å; D397-R444 PolarHBondContact OD1-NH1 3Å; D397-R444 IonicContact OD2-CZ 2.96Å; D397-R444 IonicContact OD2-NE 3.7Å; D397-R444 IonicContact OD2-NH1 2.86Å; D397-R444 PolarHBondContact OD2-NH1 3.44Å
398	S	77.3	Confident	89.6	Confident	31 Å²	31	56.2 Å²	56.2	22%	0.217	29%	0.287	C	S	.	.			trans	-65.6	127.2	-175.3	-176.5	0	0	0	0	111.8	S318 S396 H400	S318-S398 PolarHBondContact OG-OG 3.43Å; S396-S398 WeakPolarHBondContact OG-CB 3.18Å; S396-S398 PolarHBondContact OG-N 3.19Å; S398-H400 PolarHBondContact O-N 3.11Å; S398-H400 PolarHBondContact OG-N 2.91Å; S398-H400 VanDerWaalsContact OG-N 3.15Å
399	M	68.3	Low	89.5	Confident	178 Å²	178	61.6 Å²	61.6	88%	0.877	31%	0.311	S	S	*	.	S	Bend	trans	-80.3	10.3	171.5	-55.7	-156.5	76.6	0	0	113	D397	D397-M399 PolarHBondContact O-N 3.09Å
400	H	79.9	Confident	89.4	Confident	108 Å²	108	61.9 Å²	61.9	50%	0.5	31%	0.312	S	S	.	.			trans	-125	40	-174.5	-52.1	-38.4	0	0	0	111.6	S318 S398	S318-H400 PolarHBondContact OG-O 2.87Å; S398-H400 PolarHBondContact O-N 3.11Å; S398-H400 PolarHBondContact OG-N 2.91Å; S398-H400 VanDerWaalsContact OG-N 3.15Å
401	I	89.3	Confident	89.3	Confident	44 Å²	44	63.3 Å²	63.3	23%	0.226	32%	0.319	C	S	.	.			trans	-90.9	127.7	170.3	-60.5	-59.5	0	0	0	109	D315 L319 M404 V407	D315-I401 VanDerWaalsContact OD1-CA 3.29Å; D315-I401 WeakPolarHBondContact OD1-CA 3.25Å; D315-I401 WeakPolarHBondContact OD1-CG2 3.34Å; L319-I401 HydrophobicContact CD2-CD1 3.98Å; L319-I401 HydrophobicContact CG-CD1 4.42Å; I401-M404 HydrophobicContact CG2-CB 4.37Å; I401-V407 HydrophobicContact CD1-CG2 4.44Å; I401-V407 HydrophobicContact CG2-CB 4.27Å; I401-V407 HydrophobicContact CG2-CG2 3.75Å
402	E	89.8	Confident	89.2	Confident	144 Å²	144	67.2 Å²	67.2	67%	0.673	34%	0.34	S	S	*	.	S	Bend	trans	-85.2	-53.7	179.9	-60.6	-179.2	148.2	0	0	111	S312 D315	S312-E402 VanDerWaalsContact CB-OE2 3.28Å; S312-E402 WeakPolarHBondContact CB-OE2 3.33Å; S312-E402 PolarHBondContact OG-OE2 3.02Å; D315-E402 PolarHBondContact OD1-N 3.46Å
403	D	92.3	Very high	89.1	Confident	77 Å²	77	68.7 Å²	68.7	41%	0.412	35%	0.352	S	S	.	.			trans	-109.1	83.9	176.3	-169.1	-15.7	0	0	0	111.6	D315 E405 A406 V407	D315-D403 PolarHBondContact OD2-N 2.85Å; D315-D403 VanDerWaalsContact OD2-N 3.12Å; D403-E405 PolarHBondContact O-N 3.3Å; D403-E405 WeakPolarHBondContact OD1-CA 3.3Å; D403-E405 WeakPolarHBondContact OD1-CB 3.4Å; D403-E405 PolarHBondContact OD1-N 2.77Å; D403-A406 HydrophobicContact CB-CB 3.94Å; D403-A406 VanDerWaalsContact CG-CB 3.4Å; D403-A406 PolarHBondContact O-N 2.89Å; D403-A406 PolarHBondContact OD1-N 3.47Å; D403-A406 WeakPolarHBondContact OD2-CB 3.42Å; D403-V407 PolarHBondContact O-N 2.97Å
404	M	92.6	Very high	89.2	Confident	147 Å²	147	68.7 Å²	68.7	72%	0.724	35%	0.352	S	S	*	.	H	α-helix	trans	-60.1	-26.5	175.1	-170.5	177.6	68.6	0	0	112.7	I401 Q408	I401-M404 HydrophobicContact CG2-CB 4.37Å; M404-Q408 VanDerWaalsContact O-CB 3.29Å; M404-Q408 WeakPolarHBondContact O-CB 3.27Å; M404-Q408 PolarHBondContact O-N 3.2Å
405	E	94.3	Very high	89.3	Confident	129 Å²	129	70.4 Å²	70.4	60%	0.603	36%	0.359	S	S	*	.	H	α-helix	trans	-76.2	-37.9	178.6	-157.4	-167.3	129	0	0	111.1	D403 K409	D403-E405 PolarHBondContact O-N 3.3Å; D403-E405 WeakPolarHBondContact OD1-CA 3.3Å; D403-E405 WeakPolarHBondContact OD1-CB 3.4Å; D403-E405 PolarHBondContact OD1-N 2.77Å; E405-K409 WeakPolarHBondContact O-CD 3.31Å; E405-K409 VanDerWaalsContact O-CG 3.24Å; E405-K409 WeakPolarHBondContact O-CG 3.33Å; E405-K409 PolarHBondContact O-N 3.42Å; E405-K409 WeakPolarHBondContact OE1-CE 3.42Å; E405-K409 IonicContact OE1-NZ 2.69Å; E405-K409 PolarHBondContact OE1-NZ 3.34Å
406	A	94.8	Very high	89.7	Confident	21 Å²	21	73.8 Å²	73.8	17%	0.174	37%	0.373	C	S	.	.	H	α-helix	trans	-68.1	-41.6	173.3	0	0	0	0	0	112.3	L311 D403 K409 L410	L311-A406 HydrophobicContact CD2-CB 3.63Å; D403-A406 HydrophobicContact CB-CB 3.94Å; D403-A406 VanDerWaalsContact CG-CB 3.4Å; D403-A406 PolarHBondContact O-N 2.89Å; D403-A406 PolarHBondContact OD1-N 3.47Å; D403-A406 WeakPolarHBondContact OD2-CB 3.42Å; A406-K409 PolarHBondContact O-N 2.91Å; A406-L410 PolarHBondContact O-N 3.48Å; A406-L410 VanDerWaalsContact O-N 3.12Å
407	V	94.8	Very high	90.6	Very high	16 Å²	16	72.7 Å²	72.7	10%	0.097	37%	0.366	C	S	.	.	H	α-helix	trans	-64.8	-41.3	174.2	175.1	0	0	0	0	111.3	L311 D315 L319 I401 D403 K409 L410 Q411	L311-V407 HydrophobicContact CD1-CG2 4.16Å; L311-V407 HydrophobicContact CD2-CG2 4.09Å; D315-V407 HydrophobicContact CB-CG2 4.43Å; L319-V407 HydrophobicContact CD2-CG1 4.12Å; I401-V407 HydrophobicContact CD1-CG2 4.44Å; I401-V407 HydrophobicContact CG2-CB 4.27Å; I401-V407 HydrophobicContact CG2-CG2 3.75Å; D403-V407 PolarHBondContact O-N 2.97Å; V407-K409 PolarHBondContact O-N 2.98Å; V407-L410 PolarHBondContact O-N 3.03Å; V407-Q411 PolarHBondContact O-N 3.11Å
408	Q	94.5	Very high	91.8	Very high	80 Å²	80	67.4 Å²	67.4	37%	0.374	34%	0.338	S	S	.	.	H	α-helix	trans	-61.5	-43.4	175	-170.2	63.2	60.2	0	0	111.8	M404 L410 Q411 D412	M404-Q408 VanDerWaalsContact O-CB 3.29Å; M404-Q408 WeakPolarHBondContact O-CB 3.27Å; M404-Q408 PolarHBondContact O-N 3.2Å; Q408-L410 VanDerWaalsContact C-N 3.3Å; Q408-L410 PolarHBondContact O-N 2.92Å; Q408-Q411 PolarHBondContact O-N 2.98Å; Q408-Q411 VanDerWaalsContact O-N 3.14Å; Q408-D412 PolarHBondContact NE2-OD1 3.11Å; Q408-D412 WeakPolarHBondContact O-CB 3.29Å; Q408-D412 VanDerWaalsContact O-CG 3.22Å; Q408-D412 PolarHBondContact O-N 2.94Å
409	K	95.1	Very high	92.6	Very high	113 Å²	113	71.3 Å²	71.3	49%	0.491	35%	0.353	S	S	.	.	H	α-helix	trans	-60	-37.4	175.7	-72.2	160.2	-170.8	155.6	0	112.9	E405 A406 V407 A413	E405-K409 WeakPolarHBondContact O-CD 3.31Å; E405-K409 VanDerWaalsContact O-CG 3.24Å; E405-K409 WeakPolarHBondContact O-CG 3.33Å; E405-K409 PolarHBondContact O-N 3.42Å; E405-K409 WeakPolarHBondContact OE1-CE 3.42Å; E405-K409 IonicContact OE1-NZ 2.69Å; E405-K409 PolarHBondContact OE1-NZ 3.34Å; A406-K409 PolarHBondContact O-N 2.91Å; V407-K409 PolarHBondContact O-N 2.98Å; K409-A413 WeakPolarHBondContact O-CB 3.08Å; K409-A413 PolarHBondContact O-N 3.23Å; K409-A413 VanDerWaalsContact O-N 3.09Å
410	L	96	Very high	93.8	Very high	8 Å²	8	67.1 Å²	67.1	4%	0.042	33%	0.333	C	S	.	.	H	α-helix	trans	-66.1	-45.9	173.7	175.9	60.9	0	0	0	111.1	I305 P306 F308 L311 L319 A394 A406 V407 Q408 L414	I305-L410 HydrophobicContact CG2-CD1 4.27Å; P306-L410 VanDerWaalsContact O-CD1 3.25Å; P306-L410 WeakPolarHBondContact O-CD1 3.11Å; F308-L410 HydrophobicContact CB-CD2 4.35Å; F308-L410 HydrophobicContact CD2-CD2 4.28Å; L311-L410 HydrophobicContact CD1-CD2 3.79Å; L319-L410 HydrophobicContact CD1-CD2 4.47Å; A394-L410 HydrophobicContact CB-CD2 4.31Å; A394-L410 HydrophobicContact CB-CG 4.23Å; A406-L410 PolarHBondContact O-N 3.48Å; A406-L410 VanDerWaalsContact O-N 3.12Å; V407-L410 PolarHBondContact O-N 3.03Å; Q408-L410 VanDerWaalsContact C-N 3.3Å; Q408-L410 PolarHBondContact O-N 2.92Å; L410-L414 HydrophobicContact CD1-CD1 3.97Å; L410-L414 HydrophobicContact CD1-CG 4.33Å; L410-L414 HydrophobicContact CG-CD1 4.08Å; L410-L414 VanDerWaalsContact O-CG 3.28Å; L410-L414 WeakPolarHBondContact O-CG 3.31Å; L410-L414 PolarHBondContact O-N 3.04Å; L410-L414 VanDerWaalsContact O-N 3.15Å
411	Q	95.8	Very high	94.4	Very high	31 Å²	31	62 Å²	62	15%	0.145	31%	0.31	C	S	.	.	H	α-helix	trans	-60.5	-46.7	176.7	180	-179.8	86	0	0	111.6	A394 N395 V407 Q408 A413 L414 H415	A394-Q411 HydrophobicContact CB-CB 4.45Å; N395-Q411 PolarHBondContact OD1-NE2 2.8Å; V407-Q411 PolarHBondContact O-N 3.11Å; Q408-Q411 PolarHBondContact O-N 2.98Å; Q408-Q411 VanDerWaalsContact O-N 3.14Å; Q411-A413 PolarHBondContact O-N 2.99Å; Q411-L414 PolarHBondContact O-N 3.03Å; Q411-H415 WeakPolarHBondContact CG-CE1 3.35Å; Q411-H415 WeakPolarHBondContact O-CB 3.35Å; Q411-H415 PolarHBondContact O-N 2.94Å
412	D	95.5	Very high	94.6	Very high	84 Å²	84	60.3 Å²	60.3	45%	0.449	30%	0.301	S	S	.	.	H	α-helix	trans	-61.8	-45.2	-179.2	-69.8	-12.7	0	0	0	111.3	Q408 L414 H415 E416	Q408-D412 PolarHBondContact NE2-OD1 3.11Å; Q408-D412 WeakPolarHBondContact O-CB 3.29Å; Q408-D412 VanDerWaalsContact O-CG 3.22Å; Q408-D412 PolarHBondContact O-N 2.94Å; D412-L414 VanDerWaalsContact C-N 3.29Å; D412-L414 PolarHBondContact O-N 2.74Å; D412-H415 PolarHBondContact O-N 2.91Å; D412-E416 WeakPolarHBondContact O-CB 3.18Å; D412-E416 PolarHBondContact O-N 3.4Å
413	A	96.1	Very high	94.6	Very high	32 Å²	32	56.5 Å²	56.5	26%	0.264	29%	0.29	S	S	.	.	H	α-helix	trans	-63.2	-33.2	176.8	0	0	0	0	0	113	I256 K409 Q411 A417	I256-A413 HydrophobicContact CD1-CB 4.3Å; K409-A413 WeakPolarHBondContact O-CB 3.08Å; K409-A413 PolarHBondContact O-N 3.23Å; K409-A413 VanDerWaalsContact O-N 3.09Å; Q411-A413 PolarHBondContact O-N 2.99Å; A413-A417 VanDerWaalsContact O-CB 3.23Å; A413-A417 WeakPolarHBondContact O-CB 3.35Å; A413-A417 PolarHBondContact O-N 3.03Å
414	L	97	Very high	94.4	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-76.1	-37.9	175.2	-68.3	168.2	0	0	0	112.1	I256 L260 I305 A390 I391 A394 L410 Q411 D412 A417 L418	I256-L414 HydrophobicContact CG2-CD2 4.01Å; L260-L414 HydrophobicContact CD1-CD2 4.3Å; I305-L414 HydrophobicContact CG2-CD2 4.36Å; A390-L414 HydrophobicContact CB-CD1 4.17Å; A390-L414 HydrophobicContact CB-CD2 3.82Å; I391-L414 HydrophobicContact CG1-CB 3.78Å; A394-L414 HydrophobicContact CB-CD1 3.83Å; L410-L414 HydrophobicContact CD1-CD1 3.97Å; L410-L414 HydrophobicContact CD1-CG 4.33Å; L410-L414 HydrophobicContact CG-CD1 4.08Å; L410-L414 VanDerWaalsContact O-CG 3.28Å; L410-L414 WeakPolarHBondContact O-CG 3.31Å; L410-L414 PolarHBondContact O-N 3.04Å; L410-L414 VanDerWaalsContact O-N 3.15Å; Q411-L414 PolarHBondContact O-N 3.03Å; D412-L414 VanDerWaalsContact C-N 3.29Å; D412-L414 PolarHBondContact O-N 2.74Å; L414-A417 PolarHBondContact O-N 3.32Å; L414-L418 PolarHBondContact O-N 3.45Å
415	H	96.4	Very high	94.2	Very high	40 Å²	40	47 Å²	47	19%	0.185	24%	0.242	C	C	.	.	H	α-helix	trans	-67.4	-38.6	173	-74.7	159.5	0	0	0	112.6	Q411 D412 Q419	Q411-H415 WeakPolarHBondContact CG-CE1 3.35Å; Q411-H415 WeakPolarHBondContact O-CB 3.35Å; Q411-H415 PolarHBondContact O-N 2.94Å; D412-H415 PolarHBondContact O-N 2.91Å; H415-Q419 VanDerWaalsContact O-CG 3.3Å; H415-Q419 WeakPolarHBondContact O-CG 3.38Å; H415-Q419 PolarHBondContact O-N 3.38Å; H415-Q419 PolarHBondContact O-NE2 2.99Å; H415-Q419 VanDerWaalsContact O-NE2 3.1Å
416	E	95.8	Very high	93.8	Very high	126 Å²	126	41.4 Å²	41.4	59%	0.589	22%	0.217	S	C	*	.	H	α-helix	trans	-64.7	-47.7	172.5	-175.1	177.7	-144.7	0	0	110.1	D412 L418 Q419 D420	D412-E416 WeakPolarHBondContact O-CB 3.18Å; D412-E416 PolarHBondContact O-N 3.4Å; E416-L418 VanDerWaalsContact C-N 3.26Å; E416-L418 PolarHBondContact O-N 3.15Å; E416-Q419 PolarHBondContact O-N 2.88Å; E416-D420 WeakPolarHBondContact O-CB 3.41Å; E416-D420 PolarHBondContact O-N 3.5Å
417	A	95.6	Very high	93.4	Very high	5 Å²	5	45.1 Å²	45.1	4%	0.041	23%	0.23	C	C	.	.	H	α-helix	trans	-57.6	-36	177.2	0	0	0	0	0	113.5	I256 A413 L414 F421	I256-A417 HydrophobicContact CB-CB 3.76Å; I256-A417 HydrophobicContact CD1-CB 4.02Å; I256-A417 HydrophobicContact CG1-CB 4.47Å; I256-A417 HydrophobicContact CG2-CB 3.72Å; A413-A417 VanDerWaalsContact O-CB 3.23Å; A413-A417 WeakPolarHBondContact O-CB 3.35Å; A413-A417 PolarHBondContact O-N 3.03Å; L414-A417 PolarHBondContact O-N 3.32Å; A417-F421 WeakPolarHBondContact O-CB 3.5Å; A417-F421 PolarHBondContact O-N 2.81Å; A417-F421 VanDerWaalsContact O-N 3.15Å
418	L	96	Very high	93.2	Very high	1 Å²	1	51 Å²	51	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-68.9	-50.2	171.7	-176	62.4	0	0	0	111.2	T387 I391 L414 E416 D420 F421 E422 A433 L436 L437	T387-L418 HydrophobicContact CG2-CB 3.88Å; T387-L418 HydrophobicContact CG2-CD1 4.19Å; I391-L418 HydrophobicContact CD1-CB 4.28Å; I391-L418 HydrophobicContact CD1-CD2 3.9Å; L414-L418 PolarHBondContact O-N 3.45Å; E416-L418 VanDerWaalsContact C-N 3.26Å; E416-L418 PolarHBondContact O-N 3.15Å; L418-D420 VanDerWaalsContact C-N 3.34Å; L418-D420 PolarHBondContact O-N 3.48Å; L418-F421 WeakPolarHBondContact O-CB 3.44Å; L418-F421 PolarHBondContact O-N 3.43Å; L418-F421 VanDerWaalsContact O-N 3.11Å; L418-E422 HydrophobicContact CD1-CG 4.11Å; L418-E422 HydrophobicContact CG-CG 4.28Å; L418-E422 VanDerWaalsContact O-CG 3.29Å; L418-E422 WeakPolarHBondContact O-CG 3.45Å; L418-E422 PolarHBondContact O-N 2.72Å; L418-A433 HydrophobicContact CD2-CB 4.37Å; L418-A433 HydrophobicContact CG-CB 4.28Å; L418-L436 HydrophobicContact CD1-CD1 4.17Å; L418-L437 HydrophobicContact CD2-CD2 4.18Å; L418-L437 HydrophobicContact CD2-CG 4.16Å
419	Q	95.1	Very high	93	Very high	113 Å²	113	48.8 Å²	48.8	53%	0.528	25%	0.247	S	C	.	.	H	α-helix	trans	-61.2	-39.1	-178.8	-74.2	171.3	75.2	0	0	113.1	H415 E416 S423 A433	H415-Q419 VanDerWaalsContact O-CG 3.3Å; H415-Q419 WeakPolarHBondContact O-CG 3.38Å; H415-Q419 PolarHBondContact O-N 3.38Å; H415-Q419 PolarHBondContact O-NE2 2.99Å; H415-Q419 VanDerWaalsContact O-NE2 3.1Å; E416-Q419 PolarHBondContact O-N 2.88Å; Q419-S423 VanDerWaalsContact O-CB 3.22Å; Q419-S423 WeakPolarHBondContact O-CB 3.36Å; Q419-S423 PolarHBondContact O-N 2.78Å; Q419-S423 PolarHBondContact O-OG 2.71Å; Q419-A433 HydrophobicContact CG-CB 4.2Å
420	D	92.4	Very high	92.7	Very high	89 Å²	89	49 Å²	49	48%	0.476	26%	0.26	S	S	.	.	H	α-helix	trans	-66.1	-39.9	172.6	-100.6	7.8	0	0	0	112	T254 E416 L418 S423 S424	T254-D420 HydrophobicContact CG2-CB 3.52Å; E416-D420 WeakPolarHBondContact O-CB 3.41Å; E416-D420 PolarHBondContact O-N 3.5Å; L418-D420 VanDerWaalsContact C-N 3.34Å; L418-D420 PolarHBondContact O-N 3.48Å; D420-S423 PolarHBondContact O-OG 3Å; D420-S424 WeakPolarHBondContact O-CB 3.34Å; D420-S424 PolarHBondContact O-N 2.73Å; D420-S424 VanDerWaalsContact O-N 3.09Å; D420-S424 PolarHBondContact O-OG 3.22Å
421	F	93.3	Very high	92.6	Very high	1 Å²	1	57.4 Å²	57.4	0%	0.004	29%	0.291	C	S	.	.	H	α-helix	trans	-61.3	-56.1	173.7	175.8	-92.2	0	0	0	110.6	L253 V257 E383 E384 A417 L418 S423 S424 Q425 H426	L253-F421 HydrophobicContact CD2-CD2 3.81Å; L253-F421 HydrophobicContact CD2-CE2 3.58Å; V257-F421 HydrophobicContact CG1-CD2 4.15Å; V257-F421 HydrophobicContact CG2-CB 4.25Å; E383-F421 HydrophobicContact CB-CD2 4.15Å; E383-F421 HydrophobicContact CB-CE1 4.16Å; E383-F421 HydrophobicContact CB-CE2 3.39Å; E383-F421 HydrophobicContact CB-CZ 3.41Å; E383-F421 VanDerWaalsContact CB-CZ 3.41Å; E383-F421 HydrophobicContact CG-CE2 3.63Å; E383-F421 HydrophobicContact CG-CZ 3.99Å; E384-F421 HydrophobicContact CG-CD1 4.15Å; E384-F421 HydrophobicContact CG-CE1 3.49Å; E384-F421 VanDerWaalsContact CG-CE1 3.49Å; E384-F421 HydrophobicContact CG-CZ 4.28Å; A417-F421 WeakPolarHBondContact O-CB 3.5Å; A417-F421 PolarHBondContact O-N 2.81Å; A417-F421 VanDerWaalsContact O-N 3.15Å; L418-F421 WeakPolarHBondContact O-CB 3.44Å; L418-F421 PolarHBondContact O-N 3.43Å; L418-F421 VanDerWaalsContact O-N 3.11Å; F421-S423 PolarHBondContact O-N 2.74Å; F421-S424 PolarHBondContact O-N 3.17Å; F421-S424 PolarHBondContact O-OG 3.07Å; F421-Q425 HydrophobicContact CD1-CG 4.39Å; F421-Q425 HydrophobicContact CD2-CG 3.68Å; F421-Q425 HydrophobicContact CE1-CB 4.4Å; F421-Q425 HydrophobicContact CE1-CG 4.14Å; F421-Q425 HydrophobicContact CE2-CB 4.43Å; F421-Q425 HydrophobicContact CE2-CG 3.41Å; F421-Q425 VanDerWaalsContact CE2-CG 3.41Å; F421-Q425 HydrophobicContact CG-CG 4.17Å; F421-Q425 HydrophobicContact CZ-CB 4.22Å; F421-Q425 HydrophobicContact CZ-CG 3.66Å; F421-Q425 WeakPolarHBondContact O-CB 3.48Å; F421-Q425 WeakPolarHBondContact O-CG 3.38Å; F421-Q425 PolarHBondContact O-N 3.41Å; F421-H426 AromaticContact CE1-CE1 3.88Å
422	E	93.6	Very high	92.6	Very high	8 Å²	8	57.1 Å²	57.1	4%	0.037	29%	0.289	C	S	.	.	H	α-helix	trans	-58.9	-48	-178.3	-63.4	-59.3	150.1	0	0	112.4	E384 L418 S424 Q425 H426 R432 A433 L436	E384-E422 WeakPolarHBondContact CG-OE1 3.37Å; L418-E422 HydrophobicContact CD1-CG 4.11Å; L418-E422 HydrophobicContact CG-CG 4.28Å; L418-E422 VanDerWaalsContact O-CG 3.29Å; L418-E422 WeakPolarHBondContact O-CG 3.45Å; L418-E422 PolarHBondContact O-N 2.72Å; E422-S424 PolarHBondContact O-N 2.99Å; E422-Q425 PolarHBondContact O-N 3.23Å; E422-H426 CarbonylContact O-C 3.47Å; E422-H426 PolarHBondContact O-N 2.93Å; E422-H426 IonicContact OE2-ND1 2.75Å; E422-R432 WeakPolarHBondContact OE2-CB 3.4Å; E422-R432 WeakPolarHBondContact OE2-CD 3.42Å; E422-R432 WeakPolarHBondContact OE2-CG 3.33Å; E422-R432 IonicContact OE2-NE 3.27Å; E422-R432 PolarHBondContact OE2-NE 2.73Å; E422-A433 HydrophobicContact CB-CB 4.31Å; E422-A433 HydrophobicContact CG-CB 3.84Å; E422-L436 WeakPolarHBondContact OE1-CD1 3.48Å
423	S	90.6	Very high	92.6	Very high	64 Å²	64	53.9 Å²	53.9	45%	0.448	27%	0.274	S	S	.	.	H	α-helix	trans	-69.5	-11.6	178	69.3	0	0	0	0	114.1	Q419 D420 F421 Q427	Q419-S423 VanDerWaalsContact O-CB 3.22Å; Q419-S423 WeakPolarHBondContact O-CB 3.36Å; Q419-S423 PolarHBondContact O-N 2.78Å; Q419-S423 PolarHBondContact O-OG 2.71Å; D420-S423 PolarHBondContact O-OG 3Å; F421-S423 PolarHBondContact O-N 2.74Å; S423-Q427 VanDerWaalsContact O-CG 3.29Å; S423-Q427 WeakPolarHBondContact O-CG 3.11Å
424	S	87.7	Confident	92.7	Very high	9 Å²	9	54.1 Å²	54.1	6%	0.063	28%	0.28	C	S	.	.	H	α-helix	trans	-97.8	-36.3	174.9	67.9	0	0	0	0	113.7	D420 F421 E422 Q427	D420-S424 WeakPolarHBondContact O-CB 3.34Å; D420-S424 PolarHBondContact O-N 2.73Å; D420-S424 VanDerWaalsContact O-N 3.09Å; D420-S424 PolarHBondContact O-OG 3.22Å; F421-S424 PolarHBondContact O-N 3.17Å; F421-S424 PolarHBondContact O-OG 3.07Å; E422-S424 PolarHBondContact O-N 2.99Å; S424-Q427 PolarHBondContact O-NE2 3.47Å
425	Q	87.1	Confident	92.7	Very high	15 Å²	15	58.1 Å²	58.1	7%	0.07	30%	0.297	C	S	.	.	H	α-helix	trans	-98.7	-37	-173.6	-54.9	-46.5	-67.4	0	0	114.1	K251 F421 E422	K251-Q425 PolarHBondContact O-NE2 3.36Å; F421-Q425 HydrophobicContact CD1-CG 4.39Å; F421-Q425 HydrophobicContact CD2-CG 3.68Å; F421-Q425 HydrophobicContact CE1-CB 4.4Å; F421-Q425 HydrophobicContact CE1-CG 4.14Å; F421-Q425 HydrophobicContact CE2-CB 4.43Å; F421-Q425 HydrophobicContact CE2-CG 3.41Å; F421-Q425 VanDerWaalsContact CE2-CG 3.41Å; F421-Q425 HydrophobicContact CG-CG 4.17Å; F421-Q425 HydrophobicContact CZ-CB 4.22Å; F421-Q425 HydrophobicContact CZ-CG 3.66Å; F421-Q425 WeakPolarHBondContact O-CB 3.48Å; F421-Q425 WeakPolarHBondContact O-CG 3.38Å; F421-Q425 PolarHBondContact O-N 3.41Å; E422-Q425 PolarHBondContact O-N 3.23Å
426	H	87.2	Confident	92.7	Very high	13 Å²	13	56.2 Å²	56.2	6%	0.06	29%	0.288	C	S	.	.			trans	-125.6	53.8	-170.1	-55.5	95.1	0	0	0	111.5	E381 E384 F421 E422 E428 D429	E381-H426 IonicContact OE1-CE1 2.67Å; E381-H426 PolarHBondContact OE1-CE1 3.23Å; E381-H426 IonicContact OE1-NE2 3.97Å; E381-H426 PolarHBondContact OE1-NE2 3.22Å; E381-H426 IonicContact OE2-CE1 3.38Å; E381-H426 IonicContact OE2-NE2 3.41Å; E384-H426 IonicContact OE1-CE1 3.79Å; E384-H426 PolarHBondContact OE1-CE1 3.23Å; E384-H426 IonicContact OE1-ND1 2.87Å; E384-H426 IonicContact OE1-NE2 2.74Å; F421-H426 AromaticContact CE1-CE1 3.88Å; E422-H426 CarbonylContact O-C 3.47Å; E422-H426 PolarHBondContact O-N 2.93Å; E422-H426 IonicContact OE2-ND1 2.75Å; H426-E428 VanDerWaalsContact C-OE2 3.23Å; H426-E428 WeakPolarHBondContact CA-OE2 3.33Å; H426-E428 IonicContact CD2-OE1 3.66Å; H426-E428 PolarHBondContact O-N 3.42Å; H426-D429 PolarHBondContact O-N 2.95Å
427	Q	86	Confident	92.8	Very high	98 Å²	98	52 Å²	52	46%	0.458	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-18.6	-176.1	-69.3	164.2	50.1	0	0	113.6	S423 S424	S423-Q427 VanDerWaalsContact O-CG 3.29Å; S423-Q427 WeakPolarHBondContact O-CG 3.11Å; S424-Q427 PolarHBondContact O-NE2 3.47Å
428	E	89.9	Confident	92.9	Very high	141 Å²	141	57.8 Å²	57.8	66%	0.659	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-18.6	173.7	70.2	-74.2	173.6	0	0	114.9	H426	H426-E428 VanDerWaalsContact C-OE2 3.23Å; H426-E428 WeakPolarHBondContact CA-OE2 3.33Å; H426-E428 IonicContact CD2-OE1 3.66Å; H426-E428 PolarHBondContact O-N 3.42Å
429	D	90.5	Very high	92.9	Very high	32 Å²	32	57.7 Å²	57.7	17%	0.171	30%	0.297	C	S	.	.			trans	-130	77	176.8	-171.8	14.2	0	0	0	112.5	H426 R431 R432 K435	H426-D429 PolarHBondContact O-N 2.95Å; D429-R431 PolarHBondContact O-N 3.34Å; D429-R431 PolarHBondContact OD1-N 3.38Å; D429-R432 HydrophobicContact CB-CB 4.22Å; D429-R432 WeakPolarHBondContact O-CB 3.5Å; D429-R432 PolarHBondContact O-N 2.79Å; D429-K435 IonicContact OD1-NZ 2.78Å; D429-K435 PolarHBondContact OD1-NZ 3.45Å; D429-K435 IonicContact OD2-NZ 3.59Å; D429-K435 PolarHBondContact OD2-NZ 2.94Å
430	P	89.2	Confident	93	Very high	117 Å²	117	53 Å²	53	76%	0.76	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	2.8	178.4	-25.1	35.1	0	0	0	116.1
431	R	94.1	Very high	93.2	Very high	186 Å²	186	52.7 Å²	52.7	70%	0.702	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	6.4	176.6	-67.8	171	-69.2	-161.6	-3.4	112.5	D429 G434 K435	D429-R431 PolarHBondContact O-N 3.34Å; D429-R431 PolarHBondContact OD1-N 3.38Å; R431-G434 PolarHBondContact O-N 2.87Å; R431-K435 WeakPolarHBondContact O-CG 3.39Å; R431-K435 PolarHBondContact O-N 2.7Å
432	R	95.4	Very high	93.4	Very high	25 Å²	25	53.6 Å²	53.6	9%	0.094	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-46	-176.8	-169.1	169.9	165.4	91.3	-1.6	112.3	L378 K379 E384 E422 D429 G434 K435 L436	L378-R432 PolarHBondContact O-NH1 2.88Å; K379-R432 PolarHBondContact O-NH2 2.84Å; E384-R432 IonicContact OE1-CZ 3.64Å; E384-R432 VanDerWaalsContact OE1-CZ 3.24Å; E384-R432 IonicContact OE1-NE 2.78Å; E384-R432 PolarHBondContact OE1-NE 2.88Å; E384-R432 IonicContact OE1-NH2 3.94Å; E384-R432 PolarHBondContact OE1-NH2 3.06Å; E384-R432 IonicContact OE2-CZ 3.76Å; E384-R432 IonicContact OE2-NE 3.89Å; E384-R432 IonicContact OE2-NH2 3.42Å; E384-R432 PolarHBondContact OE2-NH2 3.44Å; E422-R432 WeakPolarHBondContact OE2-CB 3.4Å; E422-R432 WeakPolarHBondContact OE2-CD 3.42Å; E422-R432 WeakPolarHBondContact OE2-CG 3.33Å; E422-R432 IonicContact OE2-NE 3.27Å; E422-R432 PolarHBondContact OE2-NE 2.73Å; D429-R432 HydrophobicContact CB-CB 4.22Å; D429-R432 WeakPolarHBondContact O-CB 3.5Å; D429-R432 PolarHBondContact O-N 2.79Å; R432-G434 VanDerWaalsContact C-N 3.32Å; R432-G434 PolarHBondContact O-N 2.84Å; R432-K435 WeakPolarHBondContact O-CB 3.46Å; R432-K435 PolarHBondContact O-N 3.29Å; R432-L436 HydrophobicContact CG-CD1 4.25Å; R432-L436 HydrophobicContact CG-CG 4.48Å; R432-L436 WeakPolarHBondContact O-CG 3.49Å; R432-L436 PolarHBondContact O-N 3.18Å
433	A	96.2	Very high	93.6	Very high	15 Å²	15	53.2 Å²	53.2	12%	0.124	28%	0.281	C	S	.	.	H	α-helix	trans	-49.5	-49.9	170.5	0	0	0	0	0	112.5	L418 Q419 E422 K435 L436 L437	L418-A433 HydrophobicContact CD2-CB 4.37Å; L418-A433 HydrophobicContact CG-CB 4.28Å; Q419-A433 HydrophobicContact CG-CB 4.2Å; E422-A433 HydrophobicContact CB-CB 4.31Å; E422-A433 HydrophobicContact CG-CB 3.84Å; A433-K435 PolarHBondContact O-N 3.42Å; A433-L436 WeakPolarHBondContact O-CB 3.38Å; A433-L436 PolarHBondContact O-N 3.08Å; A433-L437 WeakPolarHBondContact O-CG 3.49Å; A433-L437 PolarHBondContact O-N 2.92Å
434	G	96.8	Very high	93.9	Very high	38 Å²	38	52.1 Å²	52.1	39%	0.392	27%	0.267	S	S	.	.	H	α-helix	trans	-63.6	-39.7	177.6	0	0	0	0	0	113.3	R431 R432 L436 L437 M438	R431-G434 PolarHBondContact O-N 2.87Å; R432-G434 VanDerWaalsContact C-N 3.32Å; R432-G434 PolarHBondContact O-N 2.84Å; G434-L436 VanDerWaalsContact C-N 3.33Å; G434-L436 PolarHBondContact O-N 2.87Å; G434-L437 PolarHBondContact O-N 3.28Å; G434-M438 WeakPolarHBondContact O-CB 3.24Å; G434-M438 WeakPolarHBondContact O-CG 3.35Å; G434-M438 PolarHBondContact O-N 3.27Å
435	K	97.1	Very high	94.3	Very high	84 Å²	84	57 Å²	57	37%	0.365	29%	0.289	S	S	.	.	H	α-helix	trans	-63.7	-37.9	175.4	-70.8	161.4	173.3	167.7	0	112.3	L378 D429 R431 R432 A433	L378-K435 HydrophobicContact CD2-CB 4.15Å; D429-K435 IonicContact OD1-NZ 2.78Å; D429-K435 PolarHBondContact OD1-NZ 3.45Å; D429-K435 IonicContact OD2-NZ 3.59Å; D429-K435 PolarHBondContact OD2-NZ 2.94Å; R431-K435 WeakPolarHBondContact O-CG 3.39Å; R431-K435 PolarHBondContact O-N 2.7Å; R432-K435 WeakPolarHBondContact O-CB 3.46Å; R432-K435 PolarHBondContact O-N 3.29Å; A433-K435 PolarHBondContact O-N 3.42Å
436	L	97.8	Very high	94.8	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-68.4	-48.6	176.5	-69.2	172.4	0	0	0	111.1	L378 V380 E384 L388 L418 E422 R432 A433 G434 M438 T439	L378-L436 HydrophobicContact CD1-CD2 4.44Å; V380-L436 HydrophobicContact CG1-CD2 4.4Å; V380-L436 HydrophobicContact CG2-CD2 3.7Å; E384-L436 HydrophobicContact CB-CD1 4.13Å; E384-L436 HydrophobicContact CG-CD1 4.07Å; L388-L436 HydrophobicContact CD1-CB 4.12Å; L388-L436 HydrophobicContact CD1-CD2 4.11Å; L388-L436 HydrophobicContact CD2-CB 4.19Å; L418-L436 HydrophobicContact CD1-CD1 4.17Å; E422-L436 WeakPolarHBondContact OE1-CD1 3.48Å; R432-L436 HydrophobicContact CG-CD1 4.25Å; R432-L436 HydrophobicContact CG-CG 4.48Å; R432-L436 WeakPolarHBondContact O-CG 3.49Å; R432-L436 PolarHBondContact O-N 3.18Å; A433-L436 WeakPolarHBondContact O-CB 3.38Å; A433-L436 PolarHBondContact O-N 3.08Å; G434-L436 VanDerWaalsContact C-N 3.33Å; G434-L436 PolarHBondContact O-N 2.87Å; L436-M438 VanDerWaalsContact C-N 3.28Å; L436-M438 PolarHBondContact O-N 3.43Å; L436-T439 VanDerWaalsContact O-CB 3.28Å; L436-T439 WeakPolarHBondContact O-CB 3.24Å; L436-T439 WeakPolarHBondContact O-CG2 3.26Å; L436-T439 PolarHBondContact O-N 3.37Å; L436-T439 PolarHBondContact O-OG1 3.37Å
437	L	97.3	Very high	95.2	Very high	38 Å²	38	56 Å²	56	20%	0.199	29%	0.285	C	S	.	.	H	α-helix	trans	-60.4	-36.5	174.7	-67.8	172.9	0	0	0	112.2	L388 I391 L418 A433 G434 T439 L440	L388-L437 HydrophobicContact CD2-CD2 4.45Å; I391-L437 HydrophobicContact CD1-CD2 4.16Å; I391-L437 HydrophobicContact CG2-CD2 4.06Å; L418-L437 HydrophobicContact CD2-CD2 4.18Å; L418-L437 HydrophobicContact CD2-CG 4.16Å; A433-L437 WeakPolarHBondContact O-CG 3.49Å; A433-L437 PolarHBondContact O-N 2.92Å; G434-L437 PolarHBondContact O-N 3.28Å; L437-T439 PolarHBondContact O-N 3.32Å; L437-L440 HydrophobicContact CD2-CD1 3.94Å; L437-L440 WeakPolarHBondContact O-CB 3.25Å; L437-L440 WeakPolarHBondContact O-CG 3.14Å; L437-L440 PolarHBondContact O-N 3.45Å
438	M	97	Very high	95.7	Very high	126 Å²	126	54.1 Å²	54.1	62%	0.621	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	9.6	172.2	-67.1	-64.8	101.9	0	0	114.3	K374 G434 L436	K374-M438 PolarHBondContact NZ-O 3.07Å; G434-M438 WeakPolarHBondContact O-CB 3.24Å; G434-M438 WeakPolarHBondContact O-CG 3.35Å; G434-M438 PolarHBondContact O-N 3.27Å; L436-M438 VanDerWaalsContact C-N 3.28Å; L436-M438 PolarHBondContact O-N 3.43Å
439	T	97.3	Very high	96	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-31.3	160.8	70.8	0	0	0	0	112.9	K374 Y375 L378 L436 L437 L442 L443	K374-T439 HydrophobicContact CD-CG2 4.34Å; Y375-T439 HydrophobicContact CD1-CG2 4.38Å; Y375-T439 HydrophobicContact CE1-CG2 3.84Å; Y375-T439 PolarHBondContact OH-OG1 3.3Å; L378-T439 HydrophobicContact CD1-CG2 3.7Å; L436-T439 VanDerWaalsContact O-CB 3.28Å; L436-T439 WeakPolarHBondContact O-CB 3.24Å; L436-T439 WeakPolarHBondContact O-CG2 3.26Å; L436-T439 PolarHBondContact O-N 3.37Å; L436-T439 PolarHBondContact O-OG1 3.37Å; L437-T439 PolarHBondContact O-N 3.32Å; T439-L442 PolarHBondContact O-N 3.31Å; T439-L443 PolarHBondContact O-N 2.9Å
440	L	96.7	Very high	96.3	Very high	13 Å²	13	50 Å²	50	7%	0.068	26%	0.26	C	S	.	.	H	α-helix	trans	-58.5	-37.7	-170.1	-59.9	175	0	0	0	114.3	L388 I391 A392 L437 L442 L443 R444	L388-L440 HydrophobicContact CD2-CD2 4.3Å; I391-L440 HydrophobicContact CG2-CD1 3.84Å; A392-L440 HydrophobicContact CB-CD2 4.45Å; L437-L440 HydrophobicContact CD2-CD1 3.94Å; L437-L440 WeakPolarHBondContact O-CB 3.25Å; L437-L440 WeakPolarHBondContact O-CG 3.14Å; L437-L440 PolarHBondContact O-N 3.45Å; L440-L442 VanDerWaalsContact C-N 3.27Å; L440-L442 PolarHBondContact O-N 3.17Å; L440-L443 HydrophobicContact CD2-CD2 3.93Å; L440-L443 WeakPolarHBondContact O-CB 3.35Å; L440-L443 PolarHBondContact O-N 3.41Å; L440-L443 VanDerWaalsContact O-N 3.11Å; L440-R444 WeakPolarHBondContact O-CB 3.46Å; L440-R444 PolarHBondContact O-N 3.35Å
441	P	96.4	Very high	96.7	Very high	84 Å²	84	44.8 Å²	44.8	55%	0.545	23%	0.225	S	C	.	.	H	α-helix	trans	-62.2	-30.8	176	-25.7	36.1	0	0	0	114.2	Q445	P441-Q445 WeakPolarHBondContact O-CB 3.37Å; P441-Q445 PolarHBondContact O-N 2.89Å; P441-Q445 VanDerWaalsContact O-N 3.15Å
442	L	97.3	Very high	96.7	Very high	20 Å²	20	41.7 Å²	41.7	11%	0.105	22%	0.219	C	C	.	.	H	α-helix	trans	-78.9	-31.4	175.6	-178	61.7	0	0	0	111.6	Q370 L371 K374 T439 L440 T446	Q370-L442 HydrophobicContact CG-CD2 4.26Å; L371-L442 HydrophobicContact CD1-CB 4.21Å; L371-L442 HydrophobicContact CD1-CD2 3.87Å; L371-L442 HydrophobicContact CD1-CG 3.98Å; K374-L442 HydrophobicContact CD-CD2 3.9Å; T439-L442 PolarHBondContact O-N 3.31Å; L440-L442 VanDerWaalsContact C-N 3.27Å; L440-L442 PolarHBondContact O-N 3.17Å; L442-T446 WeakPolarHBondContact O-CB 3.5Å; L442-T446 PolarHBondContact O-N 3.28Å; L442-T446 PolarHBondContact O-OG1 3Å
443	L	97.8	Very high	96.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.1	-54.1	171.1	175.1	66.2	0	0	0	110.8	E326 I329 L330 L371 A392 T439 L440 Q445 T446 A447	E326-L443 HydrophobicContact CB-CD1 4.24Å; E326-L443 HydrophobicContact CB-CD2 3.91Å; E326-L443 HydrophobicContact CB-CG 3.88Å; E326-L443 HydrophobicContact CG-CD2 4.4Å; E326-L443 HydrophobicContact CG-CG 4Å; I329-L443 HydrophobicContact CB-CD1 4.06Å; I329-L443 HydrophobicContact CG2-CD1 3.74Å; L330-L443 HydrophobicContact CD1-CD2 3.61Å; L330-L443 HydrophobicContact CD2-CD1 4.12Å; L330-L443 HydrophobicContact CD2-CD2 3.87Å; L330-L443 HydrophobicContact CG-CD1 3.81Å; L330-L443 HydrophobicContact CG-CD2 3.55Å; L330-L443 HydrophobicContact CG-CG 4.32Å; L371-L443 HydrophobicContact CD2-CB 4.01Å; L371-L443 HydrophobicContact CD2-CD1 3.73Å; A392-L443 HydrophobicContact CB-CD2 4.23Å; T439-L443 PolarHBondContact O-N 2.9Å; L440-L443 HydrophobicContact CD2-CD2 3.93Å; L440-L443 WeakPolarHBondContact O-CB 3.35Å; L440-L443 PolarHBondContact O-N 3.41Å; L440-L443 VanDerWaalsContact O-N 3.11Å; L443-Q445 VanDerWaalsContact C-N 3.31Å; L443-Q445 PolarHBondContact O-N 3.08Å; L443-T446 PolarHBondContact O-N 2.83Å; L443-A447 WeakPolarHBondContact O-CB 3.35Å; L443-A447 PolarHBondContact O-N 2.83Å
444	R	96.3	Very high	96.7	Very high	40 Å²	40	43.1 Å²	43.1	15%	0.151	22%	0.224	C	C	.	.	H	α-helix	trans	-51.3	-47.2	174.3	-178.6	61.7	51.7	75.3	-3.7	111.6	E326 N395 D397 L440 T446 A447 T448	E326-R444 IonicContact OE1-CZ 2.71Å; E326-R444 IonicContact OE1-NE 3.85Å; E326-R444 PolarHBondContact OE1-NE 3.36Å; E326-R444 IonicContact OE1-NH2 3.42Å; E326-R444 PolarHBondContact OE1-NH2 2.71Å; E326-R444 WeakPolarHBondContact OE2-CA 3.48Å; E326-R444 IonicContact OE2-CZ 2.87Å; E326-R444 PolarHBondContact OE2-N 2.91Å; E326-R444 IonicContact OE2-NE 2.73Å; E326-R444 PolarHBondContact OE2-NE 2.8Å; E326-R444 VanDerWaalsContact OE2-NE 3.15Å; E326-R444 IonicContact OE2-NH2 3.58Å; E326-R444 PolarHBondContact OE2-NH2 3.14Å; N395-R444 PolarHBondContact O-NH2 2.67Å; D397-R444 IonicContact OD1-CZ 2.82Å; D397-R444 IonicContact OD1-NH1 3.09Å; D397-R444 PolarHBondContact OD1-NH1 3Å; D397-R444 IonicContact OD2-CZ 2.96Å; D397-R444 IonicContact OD2-NE 3.7Å; D397-R444 IonicContact OD2-NH1 2.86Å; D397-R444 PolarHBondContact OD2-NH1 3.44Å; L440-R444 WeakPolarHBondContact O-CB 3.46Å; L440-R444 PolarHBondContact O-N 3.35Å; R444-T446 PolarHBondContact O-N 2.79Å; R444-A447 PolarHBondContact O-N 3.25Å; R444-T448 PolarHBondContact O-N 3.37Å; R444-T448 PolarHBondContact O-OG1 3.38Å; R444-T448 VanDerWaalsContact O-OG1 3.11Å
445	Q	96.4	Very high	96.6	Very high	111 Å²	111	44.9 Å²	44.9	52%	0.519	22%	0.219	S	C	.	.	H	α-helix	trans	-61.4	-43.1	175.7	-171.7	-177.9	32.5	0	0	113.1	P441 L443 K449	P441-Q445 WeakPolarHBondContact O-CB 3.37Å; P441-Q445 PolarHBondContact O-N 2.89Å; P441-Q445 VanDerWaalsContact O-N 3.15Å; L443-Q445 VanDerWaalsContact C-N 3.31Å; L443-Q445 PolarHBondContact O-N 3.08Å; Q445-K449 PolarHBondContact O-N 2.98Å
446	T	97.9	Very high	96.5	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.018	22%	0.222	C	C	.	.	H	α-helix	trans	-70.5	-38.7	-179.6	-57.8	0	0	0	0	111.6	I329 I368 L442 L443 R444 K449 A450	I329-T446 HydrophobicContact CG2-CG2 4.01Å; I368-T446 HydrophobicContact CB-CG2 4.48Å; I368-T446 HydrophobicContact CG1-CG2 3.68Å; L442-T446 WeakPolarHBondContact O-CB 3.5Å; L442-T446 PolarHBondContact O-N 3.28Å; L442-T446 PolarHBondContact O-OG1 3Å; L443-T446 PolarHBondContact O-N 2.83Å; R444-T446 PolarHBondContact O-N 2.79Å; T446-K449 WeakPolarHBondContact O-CB 3.29Å; T446-K449 PolarHBondContact O-N 3.44Å; T446-A450 PolarHBondContact O-N 3.49Å
447	A	96.9	Very high	96.3	Very high	4 Å²	4	44.3 Å²	44.3	3%	0.033	23%	0.225	C	C	.	.	H	α-helix	trans	-65.7	-41.8	175.1	0	0	0	0	0	112.2	M325 E326 L443 R444 K449 A450 V451	M325-A447 HydrophobicContact CB-CB 4.08Å; M325-A447 HydrophobicContact CG-CB 3.81Å; M325-A447 WeakPolarHBondContact CG-O 3.29Å; E326-A447 HydrophobicContact CB-CB 4.33Å; E326-A447 HydrophobicContact CG-CB 3.41Å; E326-A447 VanDerWaalsContact CG-CB 3.41Å; L443-A447 WeakPolarHBondContact O-CB 3.35Å; L443-A447 PolarHBondContact O-N 2.83Å; R444-A447 PolarHBondContact O-N 3.25Å; A447-K449 VanDerWaalsContact C-N 3.35Å; A447-K449 PolarHBondContact O-N 2.91Å; A447-A450 PolarHBondContact O-N 3.18Å; A447-V451 WeakPolarHBondContact O-CG2 3.46Å; A447-V451 PolarHBondContact O-N 3.17Å
448	T	95.3	Very high	96.1	Very high	60 Å²	60	44.8 Å²	44.8	37%	0.368	23%	0.225	S	C	.	.	H	α-helix	trans	-60.8	-42.5	174	-63	0	0	0	0	111.8	R444 A450 V451 Q452	R444-T448 PolarHBondContact O-N 3.37Å; R444-T448 PolarHBondContact O-OG1 3.38Å; R444-T448 VanDerWaalsContact O-OG1 3.11Å; T448-A450 PolarHBondContact O-N 2.99Å; T448-V451 PolarHBondContact O-N 2.99Å; T448-Q452 WeakPolarHBondContact O-CB 3.24Å; T448-Q452 VanDerWaalsContact O-CG 3.28Å; T448-Q452 WeakPolarHBondContact O-CG 3.38Å; T448-Q452 PolarHBondContact O-N 3.46Å
449	K	96.4	Very high	95.9	Very high	85 Å²	85	43.8 Å²	43.8	37%	0.37	23%	0.226	S	C	.	.	H	α-helix	trans	-58.9	-45.2	172.1	-76.7	175.8	163.2	-176.4	0	112.3	L364 S367 Q445 T446 A447 Q452 H453	L364-K449 HydrophobicContact CD2-CB 4.06Å; S367-K449 WeakPolarHBondContact OG-CD 3.36Å; S367-K449 PolarHBondContact OG-NZ 3.49Å; Q445-K449 PolarHBondContact O-N 2.98Å; T446-K449 WeakPolarHBondContact O-CB 3.29Å; T446-K449 PolarHBondContact O-N 3.44Å; A447-K449 VanDerWaalsContact C-N 3.35Å; A447-K449 PolarHBondContact O-N 2.91Å; K449-Q452 PolarHBondContact O-N 3.31Å; K449-H453 WeakPolarHBondContact O-CB 3.38Å; K449-H453 PolarHBondContact O-N 3.49Å
450	A	97.2	Very high	95.7	Very high	2 Å²	2	48.7 Å²	48.7	2%	0.017	25%	0.248	C	C	.	.	H	α-helix	trans	-62.9	-45.5	179.6	0	0	0	0	0	111.8	M325 I329 L364 T446 A447 T448 Q452 H453 F454	M325-A450 HydrophobicContact CE-CB 3.94Å; M325-A450 HydrophobicContact CG-CB 3.89Å; M325-A450 HydrophobicContact SD-CB 3.72Å; I329-A450 HydrophobicContact CD1-CB 4.16Å; L364-A450 HydrophobicContact CD1-CB 4.44Å; L364-A450 HydrophobicContact CD2-CB 4.3Å; T446-A450 PolarHBondContact O-N 3.49Å; A447-A450 PolarHBondContact O-N 3.18Å; T448-A450 PolarHBondContact O-N 2.99Å; A450-Q452 PolarHBondContact O-N 3.46Å; A450-H453 PolarHBondContact O-N 3.38Å; A450-F454 VanDerWaalsContact O-CD2 3.31Å; A450-F454 WeakPolarHBondContact O-CD2 3.47Å; A450-F454 PolarHBondContact O-N 2.9Å
451	V	96.5	Very high	95.4	Very high	6 Å²	6	51 Å²	51	4%	0.036	28%	0.276	C	S	.	.	H	α-helix	trans	-56.1	-50.7	172.8	166.9	0	0	0	0	111.1	W324 M325 A447 T448 H453 F454 Y455 L473 K476 V477	W324-V451 HydrophobicContact CZ2-CG2 4.24Å; M325-V451 HydrophobicContact CB-CG2 3.91Å; M325-V451 HydrophobicContact CE-CG2 4.06Å; M325-V451 HydrophobicContact CG-CG2 4Å; A447-V451 WeakPolarHBondContact O-CG2 3.46Å; A447-V451 PolarHBondContact O-N 3.17Å; T448-V451 PolarHBondContact O-N 2.99Å; V451-H453 VanDerWaalsContact C-N 3.3Å; V451-H453 PolarHBondContact O-N 3.15Å; V451-F454 PolarHBondContact O-N 2.84Å; V451-Y455 VanDerWaalsContact O-CB 3.28Å; V451-Y455 WeakPolarHBondContact O-CB 3.48Å; V451-Y455 PolarHBondContact O-N 3Å; V451-L473 HydrophobicContact CG1-CD2 4.35Å; V451-K476 HydrophobicContact CG1-CB 3.87Å; V451-K476 HydrophobicContact CG1-CG 4.45Å; V451-K476 HydrophobicContact CG2-CD 4.48Å; V451-K476 HydrophobicContact CG2-CG 4.41Å; V451-V477 HydrophobicContact CG1-CG2 4.07Å
452	Q	95.5	Very high	95.1	Very high	122 Å²	122	53 Å²	53	57%	0.57	28%	0.276	S	S	*	.	H	α-helix	trans	-60.1	-39.4	-179.6	-73.5	170.9	-19.6	0	0	112.5	T448 K449 A450 S456	T448-Q452 WeakPolarHBondContact O-CB 3.24Å; T448-Q452 VanDerWaalsContact O-CG 3.28Å; T448-Q452 WeakPolarHBondContact O-CG 3.38Å; T448-Q452 PolarHBondContact O-N 3.46Å; K449-Q452 PolarHBondContact O-N 3.31Å; A450-Q452 PolarHBondContact O-N 3.46Å; Q452-S456 PolarHBondContact O-N 2.63Å
453	H	95.1	Very high	94.9	Very high	49 Å²	49	52.6 Å²	52.6	23%	0.227	27%	0.274	C	S	.	.	H	α-helix	trans	-68.1	-49.1	177.8	-175.1	94.9	0	0	0	112.1	G360 L364 K449 A450 V451 Y455 S456 I457	G360-H453 PolarHBondContact O-CE1 3.34Å; L364-H453 HydrophobicContact CD1-CB 3.87Å; L364-H453 HydrophobicContact CD2-CB 4Å; L364-H453 HydrophobicContact CG-CB 4.15Å; K449-H453 WeakPolarHBondContact O-CB 3.38Å; K449-H453 PolarHBondContact O-N 3.49Å; A450-H453 PolarHBondContact O-N 3.38Å; V451-H453 VanDerWaalsContact C-N 3.3Å; V451-H453 PolarHBondContact O-N 3.15Å; H453-Y455 VanDerWaalsContact C-N 3.32Å; H453-Y455 PolarHBondContact O-N 3.11Å; H453-S456 WeakPolarHBondContact O-CB 3.31Å; H453-S456 PolarHBondContact O-N 3.29Å; H453-S456 VanDerWaalsContact O-N 3.12Å; H453-I457 PolarHBondContact O-N 2.99Å
454	F	95.8	Very high	94.5	Very high	21 Å²	21	56.4 Å²	56.4	9%	0.092	30%	0.299	C	S	.	.	H	α-helix	trans	-66.1	-32.7	176.4	-78.4	-71.8	0	0	0	112.6	L287 M325 L364 A450 V451 S456 I457 K458 F469 L473	L287-F454 HydrophobicContact CB-CZ 4.44Å; M325-F454 HydrophobicContact CE-CD2 4.1Å; L364-F454 HydrophobicContact CD1-CE2 4.36Å; A450-F454 VanDerWaalsContact O-CD2 3.31Å; A450-F454 WeakPolarHBondContact O-CD2 3.47Å; A450-F454 PolarHBondContact O-N 2.9Å; V451-F454 PolarHBondContact O-N 2.84Å; F454-S456 VanDerWaalsContact C-N 3.34Å; F454-S456 PolarHBondContact O-N 3.5Å; F454-I457 HydrophobicContact CD1-CD1 3.9Å; F454-I457 HydrophobicContact CE1-CD1 4.19Å; F454-I457 PolarHBondContact O-N 3.26Å; F454-K458 PolarHBondContact O-N 2.83Å; F454-F469 HydrophobicContact CB-CE1 4.49Å; F454-F469 HydrophobicContact CB-CZ 4.1Å; F454-F469 HydrophobicContact CD1-CE1 4.17Å; F454-F469 AromaticContact CD1-CZ 3.87Å; F454-F469 HydrophobicContact CD1-CZ 3.87Å; F454-F469 HydrophobicContact CD2-CZ 4.3Å; F454-F469 HydrophobicContact CE1-CZ 4.38Å; F454-F469 HydrophobicContact CG-CE1 4.43Å; F454-F469 AromaticContact CG-CZ 3.83Å; F454-F469 HydrophobicContact CG-CZ 3.83Å; F454-L473 HydrophobicContact CB-CD1 4.14Å; F454-L473 HydrophobicContact CB-CD2 3.97Å
455	Y	95.2	Very high	94.4	Very high	75 Å²	75	55.7 Å²	55.7	29%	0.294	30%	0.298	S	S	.	.	H	α-helix	trans	-63.8	-38.1	170.7	-167.4	-90	0	0	0	112.1	V451 H453 K458 V459 V477	V451-Y455 VanDerWaalsContact O-CB 3.28Å; V451-Y455 WeakPolarHBondContact O-CB 3.48Å; V451-Y455 PolarHBondContact O-N 3Å; H453-Y455 VanDerWaalsContact C-N 3.32Å; H453-Y455 PolarHBondContact O-N 3.11Å; Y455-K458 HydrophobicContact CD2-CD 4.31Å; Y455-K458 HydrophobicContact CE2-CD 4.35Å; Y455-K458 WeakPolarHBondContact O-CB 3.42Å; Y455-K458 PolarHBondContact O-N 3.03Å; Y455-V459 HydrophobicContact CD1-CG2 3.99Å; Y455-V459 HydrophobicContact CE1-CG2 3.69Å; Y455-V459 WeakPolarHBondContact O-CG2 3.45Å; Y455-V459 PolarHBondContact O-N 2.89Å; Y455-V477 HydrophobicContact CD1-CG1 4.35Å; Y455-V477 HydrophobicContact CD2-CB 4.06Å; Y455-V477 HydrophobicContact CD2-CG1 4.28Å; Y455-V477 HydrophobicContact CD2-CG2 3.72Å; Y455-V477 HydrophobicContact CE1-CG1 4.05Å; Y455-V477 HydrophobicContact CE2-CB 3.91Å; Y455-V477 HydrophobicContact CE2-CG1 3.97Å; Y455-V477 HydrophobicContact CE2-CG2 4.11Å; Y455-V477 HydrophobicContact CG-CG1 4.47Å; Y455-V477 HydrophobicContact CG-CG2 4.03Å
456	S	94.1	Very high	94.2	Very high	62 Å²	62	52.7 Å²	52.7	43%	0.434	28%	0.284	S	S	.	.	H	α-helix	trans	-63.5	-40.6	172.1	-176.3	0	0	0	0	112.5	Q452 H453 F454 V459 Q460	Q452-S456 PolarHBondContact O-N 2.63Å; H453-S456 WeakPolarHBondContact O-CB 3.31Å; H453-S456 PolarHBondContact O-N 3.29Å; H453-S456 VanDerWaalsContact O-N 3.12Å; F454-S456 VanDerWaalsContact C-N 3.34Å; F454-S456 PolarHBondContact O-N 3.5Å; S456-V459 PolarHBondContact O-N 3.38Å; S456-Q460 WeakPolarHBondContact O-CG 3.49Å; S456-Q460 PolarHBondContact O-N 3.01Å; S456-Q460 VanDerWaalsContact O-N 3.14Å
457	I	93.4	Very high	93.8	Very high	10 Å²	10	58.1 Å²	58.1	5%	0.051	31%	0.307	C	S	.	.	H	α-helix	trans	-63.5	-43.8	174.5	-62.8	163.6	0	0	0	110.7	L284 H453 F454 V459 Q460 G461 V463 M465	L284-I457 HydrophobicContact CD1-CD1 3.87Å; L284-I457 HydrophobicContact CD1-CG1 4.26Å; L284-I457 HydrophobicContact CD1-CG2 4.4Å; L284-I457 HydrophobicContact CD2-CD1 3.69Å; L284-I457 HydrophobicContact CG-CD1 4.31Å; H453-I457 PolarHBondContact O-N 2.99Å; F454-I457 HydrophobicContact CD1-CD1 3.9Å; F454-I457 HydrophobicContact CE1-CD1 4.19Å; F454-I457 PolarHBondContact O-N 3.26Å; I457-V459 PolarHBondContact O-N 3.44Å; I457-Q460 WeakPolarHBondContact O-CB 3.28Å; I457-Q460 PolarHBondContact O-N 3.21Å; I457-Q460 VanDerWaalsContact O-N 3.15Å; I457-G461 PolarHBondContact O-N 3.32Å; I457-V463 HydrophobicContact CG2-CB 3.72Å; I457-V463 HydrophobicContact CG2-CG1 4.4Å; I457-V463 HydrophobicContact CG2-CG2 3.65Å; I457-M465 HydrophobicContact CB-CE 3.88Å; I457-M465 HydrophobicContact CG2-CE 3.63Å
458	K	93.3	Very high	93.5	Very high	48 Å²	48	58.4 Å²	58.4	21%	0.209	31%	0.308	C	S	.	.	H	α-helix	trans	-55.4	-49.2	174.3	178.3	-160.4	172.8	-164.9	0	111.3	F454 Y455 Q460 G461 M465 L470 E474	F454-K458 PolarHBondContact O-N 2.83Å; Y455-K458 HydrophobicContact CD2-CD 4.31Å; Y455-K458 HydrophobicContact CE2-CD 4.35Å; Y455-K458 WeakPolarHBondContact O-CB 3.42Å; Y455-K458 PolarHBondContact O-N 3.03Å; K458-Q460 PolarHBondContact O-N 2.89Å; K458-G461 PolarHBondContact O-N 3.13Å; K458-M465 HydrophobicContact CB-CE 4.08Å; K458-M465 HydrophobicContact CB-SD 3.88Å; K458-M465 HydrophobicContact CG-SD 4.39Å; K458-L470 HydrophobicContact CD-CD2 3.9Å; K458-L470 HydrophobicContact CG-CD2 3.77Å; K458-E474 WeakPolarHBondContact CE-OE1 3.28Å; K458-E474 VanDerWaalsContact NZ-CD 3.33Å; K458-E474 IonicContact NZ-OE1 3.87Å; K458-E474 PolarHBondContact NZ-OE1 3.44Å
459	V	93.7	Very high	93.5	Very high	104 Å²	104	55.6 Å²	55.6	63%	0.63	29%	0.29	S	S	*	.	H	α-helix	trans	-63	-27.7	179.7	170.3	0	0	0	0	112.4	Y455 S456 I457 G461	Y455-V459 HydrophobicContact CD1-CG2 3.99Å; Y455-V459 HydrophobicContact CE1-CG2 3.69Å; Y455-V459 WeakPolarHBondContact O-CG2 3.45Å; Y455-V459 PolarHBondContact O-N 2.89Å; S456-V459 PolarHBondContact O-N 3.38Å; I457-V459 PolarHBondContact O-N 3.44Å; V459-G461 VanDerWaalsContact C-N 3.34Å
460	Q	92.8	Very high	93.3	Very high	103 Å²	103	53.8 Å²	53.8	48%	0.481	29%	0.285	S	S	.	.	H	α-helix	trans	-74.4	-20	172.6	-71	176.5	65	0	0	114.1	S456 I457 K458 K462	S456-Q460 WeakPolarHBondContact O-CG 3.49Å; S456-Q460 PolarHBondContact O-N 3.01Å; S456-Q460 VanDerWaalsContact O-N 3.14Å; I457-Q460 WeakPolarHBondContact O-CB 3.28Å; I457-Q460 PolarHBondContact O-N 3.21Å; I457-Q460 VanDerWaalsContact O-N 3.15Å; K458-Q460 PolarHBondContact O-N 2.89Å; Q460-K462 HydrophobicContact CB-CD 4.5Å; Q460-K462 HydrophobicContact CB-CG 4.41Å; Q460-K462 PolarHBondContact O-N 3.03Å; Q460-K462 VanDerWaalsContact O-N 3.08Å
461	G	91	Very high	93	Very high	63 Å²	63	54.1 Å²	54.1	65%	0.649	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	8.9	175.8	0	0	0	0	0	116.6	I457 K458 V459	I457-G461 PolarHBondContact O-N 3.32Å; K458-G461 PolarHBondContact O-N 3.13Å; V459-G461 VanDerWaalsContact C-N 3.34Å
462	K	89	Confident	92.8	Very high	126 Å²	126	53.9 Å²	53.9	55%	0.548	28%	0.284	S	S	.	.			trans	-83.1	-27.8	-175.9	-64.7	173.5	-173.8	159.2	0	114.5	Q460	Q460-K462 HydrophobicContact CB-CD 4.5Å; Q460-K462 HydrophobicContact CB-CG 4.41Å; Q460-K462 PolarHBondContact O-N 3.03Å; Q460-K462 VanDerWaalsContact O-N 3.08Å
463	V	92.6	Very high	92.7	Very high	11 Å²	11	48 Å²	48	7%	0.067	26%	0.257	C	S	.	.	S	Bend	trans	-107.8	123.9	-174.5	175.9	0	0	0	0	107.3	L284 I457 M465	L284-V463 HydrophobicContact CB-CG1 4.09Å; L284-V463 HydrophobicContact CB-CG2 3.79Å; L284-V463 HydrophobicContact CD1-CG2 4.11Å; I457-V463 HydrophobicContact CG2-CB 3.72Å; I457-V463 HydrophobicContact CG2-CG1 4.4Å; I457-V463 HydrophobicContact CG2-CG2 3.65Å; V463-M465 PolarHBondContact O-N 2.82Å
464	P	91	Very high	92.3	Very high	79 Å²	79	48.2 Å²	48.2	51%	0.513	26%	0.258	S	S	.	.			trans	-63.7	137.1	173.5	28.9	-33.8	0	0	0	108.9	T285	T285-P464 HydrophobicContact CG2-CG 3.86Å
465	M	93.4	Very high	91.7	Very high	26 Å²	26	48.7 Å²	48.7	13%	0.128	27%	0.266	C	S	.	.			trans	-125.6	136.4	175.5	-67.6	-174.6	-177.9	0	0	109.5	C288 I457 K458 V463 F469 L470 L473	C288-M465 HydrophobicContact CB-CG 4.32Å; I457-M465 HydrophobicContact CB-CE 3.88Å; I457-M465 HydrophobicContact CG2-CE 3.63Å; K458-M465 HydrophobicContact CB-CE 4.08Å; K458-M465 HydrophobicContact CB-SD 3.88Å; K458-M465 HydrophobicContact CG-SD 4.39Å; V463-M465 PolarHBondContact O-N 2.82Å; M465-F469 HydrophobicContact CB-CD1 4.37Å; M465-F469 HydrophobicContact CE-CE1 4.41Å; M465-F469 HydrophobicContact CG-CD1 4.33Å; M465-F469 HydrophobicContact CG-CE1 4.44Å; M465-F469 HydrophobicContact SD-CD1 4.13Å; M465-F469 HydrophobicContact SD-CE1 3.96Å; M465-L470 HydrophobicContact CB-CD1 4.02Å; M465-L470 HydrophobicContact CB-CD2 3.69Å; M465-L470 HydrophobicContact CB-CG 3.6Å; M465-L470 HydrophobicContact CG-CD2 4.37Å; M465-L470 WeakPolarHBondContact O-CD1 3.41Å; M465-L470 HydrophobicContact SD-CD2 3.85Å; M465-L473 HydrophobicContact SD-CD1 4.07Å
466	H	91.8	Very high	90.7	Very high	48 Å²	48	48.3 Å²	48.3	22%	0.222	27%	0.266	C	S	.	.			trans	-70.6	153.1	176.9	-83.3	3	0	0	0	112.5	R44 D289 D292 L468 F469 L470	R44-H466 PolarHBondContact NE-CD2 2.91Å; R44-H466 PolarHBondContact NE-NE2 2.64Å; R44-H466 VanDerWaalsContact NH2-CB 3.26Å; R44-H466 PolarHBondContact NH2-CD2 3.26Å; R44-H466 PolarHBondContact NH2-NE2 2.81Å; D289-H466 IonicContact OD1-CD2 2.71Å; D289-H466 IonicContact OD1-CE1 2.71Å; D289-H466 PolarHBondContact OD1-CE1 3.38Å; D289-H466 IonicContact OD1-CG 3.99Å; D289-H466 IonicContact OD1-ND1 2.74Å; D289-H466 PolarHBondContact OD1-ND1 3.23Å; D289-H466 IonicContact OD1-NE2 2.62Å; D292-H466 HydrophobicContact CB-CB 3.58Å; D292-H466 WeakPolarHBondContact OD1-CB 3.25Å; D292-H466 WeakPolarHBondContact OD2-CB 3.32Å; D292-H466 IonicContact OD2-CD2 3.4Å; D292-H466 PolarHBondContact OD2-CD2 3.44Å; D292-H466 IonicContact OD2-CG 3.83Å; H466-L468 PolarHBondContact O-N 2.91Å; H466-F469 PolarHBondContact O-N 3.13Å; H466-L470 WeakPolarHBondContact O-CG 3.31Å; H466-L470 PolarHBondContact O-N 3.45Å
467	K	89.7	Confident	89.3	Confident	117 Å²	117	50.8 Å²	50.8	51%	0.509	28%	0.278	S	S	.	.	H	α-helix	trans	-59.1	-44.8	-168.5	-178.8	179.2	178.7	-150.2	0	113.9	L470 E471	K467-L470 PolarHBondContact O-N 3.35Å; K467-E471 WeakPolarHBondContact CE-OE1 3.42Å; K467-E471 WeakPolarHBondContact CE-OE2 3.38Å; K467-E471 HydrophobicContact CG-CG 4.43Å; K467-E471 IonicContact NZ-OE1 2.62Å; K467-E471 PolarHBondContact NZ-OE1 3.42Å; K467-E471 IonicContact NZ-OE2 2.73Å; K467-E471 WeakPolarHBondContact O-CG 3.44Å; K467-E471 PolarHBondContact O-N 3.12Å
468	L	91.4	Very high	89.1	Confident	9 Å²	9	52.9 Å²	52.9	5%	0.047	29%	0.29	C	S	.	.	H	α-helix	trans	-70.2	-43.2	-175.1	174	67	0	0	0	110.4	L20 L24 F27 D292 L295 V296 I299 H466 L470 E471 M472	L20-L468 HydrophobicContact CD1-CD1 4.34Å; L24-L468 HydrophobicContact CD2-CD1 4.36Å; F27-L468 HydrophobicContact CE2-CD1 4.38Å; F27-L468 HydrophobicContact CE2-CD2 4.01Å; F27-L468 HydrophobicContact CZ-CD2 4.5Å; D292-L468 WeakPolarHBondContact OD1-CA 3.24Å; D292-L468 WeakPolarHBondContact OD1-CB 3.18Å; D292-L468 PolarHBondContact OD1-N 3Å; D292-L468 VanDerWaalsContact OD1-N 3.15Å; L295-L468 HydrophobicContact CB-CD2 3.93Å; L295-L468 HydrophobicContact CB-CG 4.46Å; L295-L468 HydrophobicContact CD1-CG 4.46Å; V296-L468 HydrophobicContact CG2-CD2 3.67Å; I299-L468 HydrophobicContact CD1-CD1 4.28Å; I299-L468 HydrophobicContact CD1-CD2 3.84Å; H466-L468 PolarHBondContact O-N 2.91Å; L468-L470 VanDerWaalsContact C-N 3.32Å; L468-L470 PolarHBondContact O-N 3.34Å; L468-E471 PolarHBondContact O-N 3.08Å; L468-M472 HydrophobicContact CD1-CG 4.02Å; L468-M472 HydrophobicContact CG-CG 4.33Å; L468-M472 WeakPolarHBondContact O-CB 3.42Å; L468-M472 WeakPolarHBondContact O-CG 3.39Å; L468-M472 PolarHBondContact O-N 3.14Å
469	F	94	Very high	88.9	Confident	1 Å²	1	53.1 Å²	53.1	0%	0.004	29%	0.294	C	S	.	.	H	α-helix	trans	-59.8	-39.8	173.6	-176.4	-111.7	0	0	0	112.3	C288 A291 D292 L295 W324 F454 M465 H466 M472 L473	C288-F469 HydrophobicContact CB-CD1 4.29Å; C288-F469 HydrophobicContact CB-CE1 4.08Å; A291-F469 HydrophobicContact CB-CD2 3.7Å; A291-F469 HydrophobicContact CB-CE2 3.52Å; A291-F469 HydrophobicContact CB-CZ 4.24Å; D292-F469 HydrophobicContact CB-CB 3.96Å; D292-F469 PolarHBondContact OD1-N 3.46Å; L295-F469 HydrophobicContact CD1-CB 4.14Å; L295-F469 HydrophobicContact CD1-CD2 3.94Å; W324-F469 AromaticContact CH2-CD2 3.97Å; W324-F469 HydrophobicContact CH2-CD2 3.97Å; W324-F469 AromaticContact CH2-CE2 3.7Å; W324-F469 HydrophobicContact CH2-CE2 3.7Å; W324-F469 AromaticContact CZ3-CD2 3.92Å; W324-F469 HydrophobicContact CZ3-CD2 3.92Å; W324-F469 AromaticContact CZ3-CE2 3.7Å; W324-F469 HydrophobicContact CZ3-CE2 3.7Å; F454-F469 HydrophobicContact CB-CE1 4.49Å; F454-F469 HydrophobicContact CB-CZ 4.1Å; F454-F469 HydrophobicContact CD1-CE1 4.17Å; F454-F469 AromaticContact CD1-CZ 3.87Å; F454-F469 HydrophobicContact CD1-CZ 3.87Å; F454-F469 HydrophobicContact CD2-CZ 4.3Å; F454-F469 HydrophobicContact CE1-CZ 4.38Å; F454-F469 HydrophobicContact CG-CE1 4.43Å; F454-F469 AromaticContact CG-CZ 3.83Å; F454-F469 HydrophobicContact CG-CZ 3.83Å; M465-F469 HydrophobicContact CB-CD1 4.37Å; M465-F469 HydrophobicContact CE-CE1 4.41Å; M465-F469 HydrophobicContact CG-CD1 4.33Å; M465-F469 HydrophobicContact CG-CE1 4.44Å; M465-F469 HydrophobicContact SD-CD1 4.13Å; M465-F469 HydrophobicContact SD-CE1 3.96Å; H466-F469 PolarHBondContact O-N 3.13Å; F469-M472 PolarHBondContact O-N 3.04Å; F469-L473 HydrophobicContact CD1-CD1 3.89Å; F469-L473 HydrophobicContact CE1-CD1 3.62Å; F469-L473 HydrophobicContact CG-CD1 4.48Å; F469-L473 HydrophobicContact CZ-CD1 3.98Å; F469-L473 WeakPolarHBondContact O-CB 3.35Å; F469-L473 WeakPolarHBondContact O-CG 3.42Å; F469-L473 PolarHBondContact O-N 2.96Å
470	L	92.5	Very high	88.6	Confident	47 Å²	47	50.3 Å²	50.3	25%	0.246	28%	0.275	C	S	.	.	H	α-helix	trans	-61.6	-50.8	172.9	-78.8	172	0	0	0	112.6	K458 M465 H466 K467 L468 M472 L473 E474	K458-L470 HydrophobicContact CD-CD2 3.9Å; K458-L470 HydrophobicContact CG-CD2 3.77Å; M465-L470 HydrophobicContact CB-CD1 4.02Å; M465-L470 HydrophobicContact CB-CD2 3.69Å; M465-L470 HydrophobicContact CB-CG 3.6Å; M465-L470 HydrophobicContact CG-CD2 4.37Å; M465-L470 WeakPolarHBondContact O-CD1 3.41Å; M465-L470 HydrophobicContact SD-CD2 3.85Å; H466-L470 WeakPolarHBondContact O-CG 3.31Å; H466-L470 PolarHBondContact O-N 3.45Å; K467-L470 PolarHBondContact O-N 3.35Å; L468-L470 VanDerWaalsContact C-N 3.32Å; L468-L470 PolarHBondContact O-N 3.34Å; L470-M472 VanDerWaalsContact C-N 3.32Å; L470-M472 PolarHBondContact O-N 3.46Å; L470-L473 PolarHBondContact O-N 3.37Å; L470-E474 WeakPolarHBondContact O-CG 3.44Å; L470-E474 PolarHBondContact O-N 3.02Å
471	E	91.3	Very high	88.3	Confident	10 Å²	10	47.2 Å²	47.2	5%	0.047	26%	0.263	C	S	.	.	H	α-helix	trans	-61	-41	178.9	-73.8	179.6	147.2	0	0	111.2	L20 S23 K467 L468 L473 E474 A475	L20-E471 HydrophobicContact CB-CB 3.95Å; L20-E471 HydrophobicContact CB-CG 4.47Å; L20-E471 HydrophobicContact CD1-CB 3.57Å; L20-E471 WeakPolarHBondContact CD2-O 3.45Å; L20-E471 HydrophobicContact CG-CB 4.19Å; S23-E471 WeakPolarHBondContact CB-OE2 3.35Å; S23-E471 PolarHBondContact OG-OE2 3.15Å; K467-E471 WeakPolarHBondContact CE-OE1 3.42Å; K467-E471 WeakPolarHBondContact CE-OE2 3.38Å; K467-E471 HydrophobicContact CG-CG 4.43Å; K467-E471 IonicContact NZ-OE1 2.62Å; K467-E471 PolarHBondContact NZ-OE1 3.42Å; K467-E471 IonicContact NZ-OE2 2.73Å; K467-E471 WeakPolarHBondContact O-CG 3.44Å; K467-E471 PolarHBondContact O-N 3.12Å; L468-E471 PolarHBondContact O-N 3.08Å; E471-L473 PolarHBondContact O-N 2.97Å; E471-E474 PolarHBondContact O-N 2.92Å; E471-A475 PolarHBondContact O-N 3.32Å; E471-A475 VanDerWaalsContact O-N 3.07Å
472	M	92.9	Very high	88.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-70.2	-26.4	177.7	-64.9	-66.5	-71	0	0	113.7	L20 L24 L295 Q321 W324 L468 F469 L470	L20-M472 HydrophobicContact CD1-CG 4.1Å; L20-M472 HydrophobicContact CD1-SD 3.55Å; L20-M472 VanDerWaalsContact CD1-SD 3.55Å; L20-M472 HydrophobicContact CD2-SD 4.03Å; L20-M472 HydrophobicContact CG-SD 4.37Å; L24-M472 HydrophobicContact CD1-SD 4.19Å; L24-M472 HydrophobicContact CD2-SD 4.06Å; L295-M472 HydrophobicContact CD1-CB 4.26Å; L295-M472 HydrophobicContact CD1-CG 4.13Å; L295-M472 HydrophobicContact CD2-CE 4.21Å; L295-M472 HydrophobicContact CD2-CG 4.32Å; Q321-M472 HydrophobicContact CG-SD 4.42Å; W324-M472 HydrophobicContact CB-CE 3.64Å; W324-M472 VanDerWaalsContact CD1-CE 3.45Å; W324-M472 HydrophobicContact CD2-CB 4.21Å; W324-M472 HydrophobicContact CD2-CE 4.4Å; W324-M472 HydrophobicContact CG-CE 3.57Å; W324-M472 HydrophobicContact CZ2-CB 4.05Å; W324-M472 WeakPolarHBondContact CZ2-O 3.31Å; W324-M472 PolarHBondContact NE1-O 3.22Å; L468-M472 HydrophobicContact CD1-CG 4.02Å; L468-M472 HydrophobicContact CG-CG 4.33Å; L468-M472 WeakPolarHBondContact O-CB 3.42Å; L468-M472 WeakPolarHBondContact O-CG 3.39Å; L468-M472 PolarHBondContact O-N 3.14Å; F469-M472 PolarHBondContact O-N 3.04Å; L470-M472 VanDerWaalsContact C-N 3.32Å; L470-M472 PolarHBondContact O-N 3.46Å
473	L	91.8	Very high	88.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-73.6	-35.1	168.2	-77.3	169.2	0	0	0	112.1	W324 V451 F454 M465 F469 L470 E471 K476	W324-L473 HydrophobicContact CH2-CD2 3.82Å; W324-L473 HydrophobicContact CH2-CG 4.01Å; W324-L473 HydrophobicContact CZ2-CD2 3.9Å; W324-L473 HydrophobicContact CZ2-CG 4.1Å; V451-L473 HydrophobicContact CG1-CD2 4.35Å; F454-L473 HydrophobicContact CB-CD1 4.14Å; F454-L473 HydrophobicContact CB-CD2 3.97Å; M465-L473 HydrophobicContact SD-CD1 4.07Å; F469-L473 HydrophobicContact CD1-CD1 3.89Å; F469-L473 HydrophobicContact CE1-CD1 3.62Å; F469-L473 HydrophobicContact CG-CD1 4.48Å; F469-L473 HydrophobicContact CZ-CD1 3.98Å; F469-L473 WeakPolarHBondContact O-CB 3.35Å; F469-L473 WeakPolarHBondContact O-CG 3.42Å; F469-L473 PolarHBondContact O-N 2.96Å; L470-L473 PolarHBondContact O-N 3.37Å; E471-L473 PolarHBondContact O-N 2.97Å; L473-K476 PolarHBondContact O-N 3.44Å
474	E	88.1	Confident	87.8	Confident	52 Å²	52	43 Å²	43	24%	0.243	23%	0.229	C	C	.	.	H	α-helix	trans	-74.3	-28.3	179.9	-75	178.3	170.1	0	0	113.9	N16 K458 L470 E471 K476	N16-E474 PolarHBondContact ND2-OE2 3.15Å; K458-E474 WeakPolarHBondContact CE-OE1 3.28Å; K458-E474 VanDerWaalsContact NZ-CD 3.33Å; K458-E474 IonicContact NZ-OE1 3.87Å; K458-E474 PolarHBondContact NZ-OE1 3.44Å; L470-E474 WeakPolarHBondContact O-CG 3.44Å; L470-E474 PolarHBondContact O-N 3.02Å; E471-E474 PolarHBondContact O-N 2.92Å; E474-K476 PolarHBondContact O-N 2.89Å
475	A	83.2	Confident	87.6	Confident	32 Å²	32	40.2 Å²	40.2	26%	0.264	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	4.2	173.2	0	0	0	0	0	114.3	L20 Q321 E471	L20-A475 HydrophobicContact CD2-CB 3.36Å; Q321-A475 HydrophobicContact CB-CB 4.42Å; Q321-A475 HydrophobicContact CG-CB 4.18Å; E471-A475 PolarHBondContact O-N 3.32Å; E471-A475 VanDerWaalsContact O-N 3.07Å
476	K	73.1	Confident	87.1	Confident	66 Å²	66	41.4 Å²	41.4	29%	0.287	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119	-4.5	-170.4	-101.2	-72.3	-176.7	-179.2	0	114.4	Q321 S322 V451 L473 E474	Q321-K476 WeakPolarHBondContact O-CE 3.45Å; S322-K476 WeakPolarHBondContact O-CE 3.35Å; S322-K476 PolarHBondContact O-NZ 2.83Å; V451-K476 HydrophobicContact CG1-CB 3.87Å; V451-K476 HydrophobicContact CG1-CG 4.45Å; V451-K476 HydrophobicContact CG2-CD 4.48Å; V451-K476 HydrophobicContact CG2-CG 4.41Å; L473-K476 PolarHBondContact O-N 3.44Å; E474-K476 PolarHBondContact O-N 2.89Å
477	V	65.1	Low	86.6	Confident	115 Å²	115	40.8 Å²	40.8	70%	0.697	21%	0.213	S	C	*	.			trans	-138.7	0	-171.9	-177.5	0	0	0	0	110	V451 Y455	V451-V477 HydrophobicContact CG1-CG2 4.07Å; Y455-V477 HydrophobicContact CD1-CG1 4.35Å; Y455-V477 HydrophobicContact CD2-CB 4.06Å; Y455-V477 HydrophobicContact CD2-CG1 4.28Å; Y455-V477 HydrophobicContact CD2-CG2 3.72Å; Y455-V477 HydrophobicContact CE1-CG1 4.05Å; Y455-V477 HydrophobicContact CE2-CB 3.91Å; Y455-V477 HydrophobicContact CE2-CG1 3.97Å; Y455-V477 HydrophobicContact CE2-CG2 4.11Å; Y455-V477 HydrophobicContact CG-CG1 4.47Å; Y455-V477 HydrophobicContact CG-CG2 4.03Å

Retrieved 477 of 477 residues in 154.9 ms (Link to these results)

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