A0A087Y5C2_POEFO Loading...

SANT and BTB domain regulator of CSR

AlphaFold DB , UniProt , Accession A0A087Y5C2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 708 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	27.8	Very low	26.6	Very low	234 Å²	234	145.7 Å²	145.7	100%	1.153	75%	0.753	S	S	*	*				0	113.3	0	-73.8	170.4	174.7	0	0	106.6
2	S	24.2	Very low	27.3	Very low	98 Å²	98	142.3 Å²	142.3	69%	0.685	75%	0.747	S	S	*	*				71.1	133	63	73.5	0	0	0	0	112.3
3	R	25.5	Very low	28.1	Very low	206 Å²	206	147.1 Å²	147.1	78%	0.777	75%	0.751	S	S	*	*			cis	-169.8	155.7	4.5	-129.8	171.6	177.6	-170.1	1.2	109.6
4	F	27	Very low	29.8	Very low	174 Å²	174	143.9 Å²	143.9	76%	0.763	74%	0.737	S	S	*	*			trans	63.8	166.3	158	-63.1	-46.9	0	0	0	118.4
5	C	25.5	Very low	31.8	Very low	102 Å²	102	141.7 Å²	141.7	69%	0.689	73%	0.727	S	S	*	*			cis	-176.4	177.7	-36.6	-159	0	0	0	0	108.2
6	S	27.8	Very low	34.1	Very low	91 Å²	91	137.6 Å²	137.6	64%	0.636	71%	0.707	S	S	*	*			trans	75.8	138.8	155.1	-67.5	0	0	0	0	118.7
7	D	27.6	Very low	36.6	Very low	135 Å²	135	132.8 Å²	132.8	72%	0.722	69%	0.685	S	S	*	*			cis	-154.2	139.2	-10.1	-109.9	-41.3	0	0	0	114.8
8	N	26.2	Very low	38.9	Very low	124 Å²	124	131.9 Å²	131.9	66%	0.663	68%	0.681	S	S	*	*			trans	25.6	130.5	134.5	-149.3	6.9	0	0	0	122
9	N	26.2	Very low	41.1	Very low	130 Å²	130	128.4 Å²	128.4	70%	0.695	67%	0.666	S	S	*	*				172.2	129.2	112.1	-89.9	-55.6	0	0	0	116.3
10	N	25.2	Very low	43.2	Very low	145 Å²	145	122.2 Å²	122.2	78%	0.775	63%	0.634	S	S	*	*			trans	62.8	142.7	145.3	-73.8	-19.7	0	0	0	126.1
11	F	30.1	Very low	45.2	Very low	164 Å²	164	117.7 Å²	117.7	72%	0.719	61%	0.611	S	S	*	*			trans	-48.6	165.9	155.4	-84.2	-98.7	0	0	0	113.8
12	P	34.3	Very low	47.8	Very low	105 Å²	105	112.9 Å²	112.9	68%	0.682	59%	0.587	S	S	*	*			cis	-144	139.3	27.9	37.4	-16.6	0	0	0	118.4
13	Y	38.4	Very low	50.6	Low	204 Å²	204	109.9 Å²	109.9	80%	0.8	56%	0.564	S	S	*	*	S	Bend	trans	-143	-30.6	164.6	-100.4	-86.7	0	0	0	116.3	N15	Y13-N15 PolarHBondContact O-N 2.92Å
14	D	52	Low	53.4	Low	103 Å²	103	100 Å²	100	55%	0.551	53%	0.527	S	S	*	.	H	α-helix	trans	-65.6	-32.2	-168.6	-58	-66.4	0	0	0	115.9	N16 V17 L18	D14-N16 PolarHBondContact O-N 3.21Å; D14-N16 VanDerWaalsContact O-N 3.14Å; D14-V17 PolarHBondContact O-N 2.57Å; D14-V17 VanDerWaalsContact O-N 3.13Å; D14-L18 PolarHBondContact O-N 3.11Å
15	N	59	Low	56	Low	110 Å²	110	92.8 Å²	92.8	59%	0.588	50%	0.502	S	S	*	.	H	α-helix	trans	-57.1	-34	-175.1	-76.2	-11.4	0	0	0	113.2	Y13 V17 L18 V19	Y13-N15 PolarHBondContact O-N 2.92Å; N15-V17 VanDerWaalsContact C-N 3.34Å; N15-V17 PolarHBondContact O-N 3.27Å; N15-L18 PolarHBondContact O-N 2.78Å; N15-V19 WeakPolarHBondContact O-CG2 3.37Å; N15-V19 PolarHBondContact O-N 3.35Å
16	N	68.2	Low	58.6	Low	76 Å²	76	92.5 Å²	92.5	41%	0.406	50%	0.501	S	S	.	.	H	α-helix	trans	-69.3	-34.2	-176.8	-68.9	4.2	0	0	0	111.6	D14 L20 F46	D14-N16 PolarHBondContact O-N 3.21Å; D14-N16 VanDerWaalsContact O-N 3.14Å; N16-L20 WeakPolarHBondContact O-CB 3.5Å; N16-L20 PolarHBondContact O-N 3.08Å; N16-F46 HydrophobicContact CB-CE2 3.93Å; N16-F46 HydrophobicContact CB-CZ 4.16Å; N16-F46 WeakPolarHBondContact O-CE2 3.47Å
17	V	77	Confident	61	Low	56 Å²	56	89.9 Å²	89.9	34%	0.339	48%	0.479	S	S	.	.	H	α-helix	trans	-70.5	-41.5	176.9	-175.9	0	0	0	0	110.6	D14 N15 V19 L20 D21 F46	D14-V17 PolarHBondContact O-N 2.57Å; D14-V17 VanDerWaalsContact O-N 3.13Å; N15-V17 VanDerWaalsContact C-N 3.34Å; N15-V17 PolarHBondContact O-N 3.27Å; V17-V19 PolarHBondContact O-N 3.17Å; V17-L20 WeakPolarHBondContact O-CB 3.46Å; V17-L20 PolarHBondContact O-N 3.01Å; V17-D21 PolarHBondContact O-N 3.09Å; V17-F46 HydrophobicContact CG2-CZ 4.16Å
18	L	78.8	Confident	63.3	Low	118 Å²	118	89.4 Å²	89.4	62%	0.618	47%	0.468	S	S	*	.	H	α-helix	trans	-63.4	-39.4	176.2	-66.6	173	0	0	0	112.4	D14 N15 M22	D14-L18 PolarHBondContact O-N 3.11Å; N15-L18 PolarHBondContact O-N 2.78Å; L18-M22 WeakPolarHBondContact O-CB 3.48Å; L18-M22 PolarHBondContact O-N 3.14Å; L18-M22 VanDerWaalsContact O-N 3.07Å
19	V	79.5	Confident	65.4	Low	65 Å²	65	87.1 Å²	87.1	39%	0.394	47%	0.473	S	S	.	.	H	α-helix	trans	-66.3	-41.4	173.7	171.9	0	0	0	0	111.2	N15 V17 M22 V23 V43	N15-V19 WeakPolarHBondContact O-CG2 3.37Å; N15-V19 PolarHBondContact O-N 3.35Å; V17-V19 PolarHBondContact O-N 3.17Å; V19-M22 PolarHBondContact O-N 3.27Å; V19-V23 WeakPolarHBondContact O-CG2 3.15Å; V19-V23 PolarHBondContact O-N 3.16Å; V19-V43 HydrophobicContact CG1-CG1 4.14Å; V19-V43 HydrophobicContact CG1-CG2 4.37Å
20	L	84	Confident	67.8	Low	4 Å²	4	84.2 Å²	84.2	2%	0.021	46%	0.46	C	S	.	.	H	α-helix	trans	-59.9	-52.4	175.3	180	62.7	0	0	0	111.3	N16 V17 M22 V23 L24 V43 F46 C51 R54	N16-L20 WeakPolarHBondContact O-CB 3.5Å; N16-L20 PolarHBondContact O-N 3.08Å; V17-L20 WeakPolarHBondContact O-CB 3.46Å; V17-L20 PolarHBondContact O-N 3.01Å; L20-M22 VanDerWaalsContact C-N 3.28Å; L20-M22 PolarHBondContact O-N 3.25Å; L20-V23 PolarHBondContact O-N 3.38Å; L20-L24 HydrophobicContact CD1-CD1 3.92Å; L20-L24 HydrophobicContact CD1-CG 3.99Å; L20-L24 HydrophobicContact CD2-CD1 4.45Å; L20-L24 HydrophobicContact CG-CD1 3.81Å; L20-L24 HydrophobicContact CG-CG 4.25Å; L20-L24 WeakPolarHBondContact O-CB 3.41Å; L20-L24 VanDerWaalsContact O-CG 3.26Å; L20-L24 WeakPolarHBondContact O-CG 3.17Å; L20-L24 PolarHBondContact O-N 3.28Å; L20-V43 HydrophobicContact CB-CG1 4.28Å; L20-V43 HydrophobicContact CD1-CG2 4.31Å; L20-F46 HydrophobicContact CB-CD2 4.33Å; L20-F46 HydrophobicContact CB-CE2 3.92Å; L20-F46 HydrophobicContact CB-CZ 4.3Å; L20-F46 HydrophobicContact CD1-CD2 4.47Å; L20-F46 HydrophobicContact CD2-CD1 3.87Å; L20-F46 HydrophobicContact CD2-CD2 4Å; L20-F46 HydrophobicContact CD2-CE1 3.86Å; L20-F46 HydrophobicContact CD2-CE2 3.98Å; L20-F46 HydrophobicContact CD2-CG 3.93Å; L20-F46 HydrophobicContact CD2-CZ 3.91Å; L20-F46 HydrophobicContact CG-CE2 4.46Å; L20-C51 HydrophobicContact CD1-CB 4.32Å; L20-R54 HydrophobicContact CD2-CB 4.23Å; L20-R54 HydrophobicContact CD2-CG 4.01Å; L20-R54 HydrophobicContact CG-CG 4.47Å
21	D	85.1	Confident	69.6	Low	27 Å²	27	82.8 Å²	82.8	14%	0.144	46%	0.458	C	S	.	.	H	α-helix	trans	-62.9	-35	-177.7	-69	-8.8	0	0	0	111.8	V17 G25 R54 L58 F64	V17-D21 PolarHBondContact O-N 3.09Å; D21-G25 PolarHBondContact O-N 2.95Å; D21-R54 WeakPolarHBondContact OD1-CG 3.37Å; D21-R54 IonicContact OD1-CZ 3.69Å; D21-R54 IonicContact OD1-NE 2.66Å; D21-R54 PolarHBondContact OD1-NE 3.49Å; D21-R54 IonicContact OD1-NH2 3.84Å; D21-R54 IonicContact OD2-CZ 3.27Å; D21-R54 IonicContact OD2-NE 2.98Å; D21-R54 IonicContact OD2-NH2 2.77Å; D21-R54 PolarHBondContact OD2-NH2 3.04Å; D21-L58 HydrophobicContact CB-CD1 4.38Å; D21-F64 WeakPolarHBondContact O-CE1 3.37Å
22	M	81.5	Confident	71.7	Confident	133 Å²	133	81.8 Å²	81.8	66%	0.655	46%	0.456	S	S	*	.	H	α-helix	trans	-65.2	-47.4	173.1	-174	179.9	70.5	0	0	112.5	L18 V19 L20 L24 G25 S26	L18-M22 WeakPolarHBondContact O-CB 3.48Å; L18-M22 PolarHBondContact O-N 3.14Å; L18-M22 VanDerWaalsContact O-N 3.07Å; V19-M22 PolarHBondContact O-N 3.27Å; L20-M22 VanDerWaalsContact C-N 3.28Å; L20-M22 PolarHBondContact O-N 3.25Å; M22-L24 VanDerWaalsContact C-N 3.32Å; M22-L24 PolarHBondContact O-N 2.81Å; M22-G25 PolarHBondContact O-N 3.25Å; M22-S26 PolarHBondContact O-N 3.22Å; M22-S26 PolarHBondContact O-OG 2.81Å
23	V	82.9	Confident	73.6	Confident	35 Å²	35	82.8 Å²	82.8	21%	0.212	46%	0.462	C	S	.	.	H	α-helix	trans	-63.5	-39.2	177	169.6	0	0	0	0	111.1	V19 L20 S26 V39 V43	V19-V23 WeakPolarHBondContact O-CG2 3.15Å; V19-V23 PolarHBondContact O-N 3.16Å; L20-V23 PolarHBondContact O-N 3.38Å; V23-S26 PolarHBondContact O-N 2.95Å; V23-V39 HydrophobicContact CG1-CG1 4.33Å; V23-V43 HydrophobicContact CB-CG2 4.4Å; V23-V43 HydrophobicContact CG2-CG2 4.2Å
24	L	84.9	Confident	75.6	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	43%	0.43	C	S	.	.	H	α-helix	trans	-67.5	-34.8	176.6	-70.7	-178.2	0	0	0	112.5	L20 M22 S26 L27 W36 V39 R54 F55 L58	L20-L24 HydrophobicContact CD1-CD1 3.92Å; L20-L24 HydrophobicContact CD1-CG 3.99Å; L20-L24 HydrophobicContact CD2-CD1 4.45Å; L20-L24 HydrophobicContact CG-CD1 3.81Å; L20-L24 HydrophobicContact CG-CG 4.25Å; L20-L24 WeakPolarHBondContact O-CB 3.41Å; L20-L24 VanDerWaalsContact O-CG 3.26Å; L20-L24 WeakPolarHBondContact O-CG 3.17Å; L20-L24 PolarHBondContact O-N 3.28Å; M22-L24 VanDerWaalsContact C-N 3.32Å; M22-L24 PolarHBondContact O-N 2.81Å; L24-S26 PolarHBondContact O-N 3.49Å; L24-L27 HydrophobicContact CD2-CD1 4.29Å; L24-L27 PolarHBondContact O-N 3.27Å; L24-L27 VanDerWaalsContact O-N 3.13Å; L24-W36 HydrophobicContact CD2-CZ3 3.85Å; L24-V39 HydrophobicContact CD2-CG1 4.14Å; L24-R54 HydrophobicContact CD1-CB 3.76Å; L24-R54 HydrophobicContact CD1-CG 3.67Å; L24-F55 HydrophobicContact CB-CD2 4.17Å; L24-F55 HydrophobicContact CD1-CB 4.29Å; L24-F55 HydrophobicContact CD2-CB 4.08Å; L24-F55 HydrophobicContact CD2-CD2 4.15Å; L24-F55 HydrophobicContact CD2-CG 4.49Å; L24-F55 WeakPolarHBondContact O-CE2 3.25Å; L24-L58 HydrophobicContact CB-CD1 3.98Å; L24-L58 HydrophobicContact CD1-CD1 3.88Å
25	G	80.9	Confident	77.2	Confident	22 Å²	22	72.3 Å²	72.3	23%	0.227	43%	0.425	C	S	.	.	H	α-helix	trans	-60.4	-41.7	173.3	0	0	0	0	0	113.2	D21 M22 L27 W28 F64	D21-G25 PolarHBondContact O-N 2.95Å; M22-G25 PolarHBondContact O-N 3.25Å; G25-L27 PolarHBondContact O-N 3.42Å; G25-W28 WeakPolarHBondContact O-CB 3.43Å; G25-W28 PolarHBondContact O-N 3.37Å; G25-F64 VanDerWaalsContact CA-CZ 3.46Å
26	S	80.8	Confident	78.6	Confident	95 Å²	95	70 Å²	70	66%	0.664	41%	0.408	S	S	*	.	H	α-helix	trans	-62.4	-21	175.3	-53.2	0	0	0	0	113.9	M22 V23 L24	M22-S26 PolarHBondContact O-N 3.22Å; M22-S26 PolarHBondContact O-OG 2.81Å; V23-S26 PolarHBondContact O-N 2.95Å; L24-S26 PolarHBondContact O-N 3.49Å
27	L	78.1	Confident	79.3	Confident	36 Å²	36	72.6 Å²	72.6	19%	0.188	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-6.9	-178.7	-64.1	172.9	0	0	0	114	L24 G25 G29 V30 I34 V39 F55	L24-L27 HydrophobicContact CD2-CD1 4.29Å; L24-L27 PolarHBondContact O-N 3.27Å; L24-L27 VanDerWaalsContact O-N 3.13Å; G25-L27 PolarHBondContact O-N 3.42Å; L27-G29 VanDerWaalsContact C-N 3.3Å; L27-G29 PolarHBondContact O-N 3.41Å; L27-V30 HydrophobicContact CD2-CG2 4.19Å; L27-V30 PolarHBondContact O-N 3Å; L27-V30 VanDerWaalsContact O-N 3.17Å; L27-I34 HydrophobicContact CB-CD1 4.24Å; L27-I34 HydrophobicContact CD1-CG2 4.14Å; L27-V39 HydrophobicContact CD1-CG2 3.72Å; L27-F55 HydrophobicContact CB-CE2 4.09Å
28	W	75.5	Confident	79.5	Confident	126 Å²	126	73.9 Å²	73.9	48%	0.477	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-34.4	-175.5	-172.3	-88.7	0	0	0	114.1	G25 K59 F64	G25-W28 WeakPolarHBondContact O-CB 3.43Å; G25-W28 PolarHBondContact O-N 3.37Å; W28-K59 HydrophobicContact CE3-CG 3.84Å; W28-K59 HydrophobicContact CH2-CB 4.23Å; W28-K59 HydrophobicContact CH2-CG 3.85Å; W28-K59 VanDerWaalsContact CZ3-CA 3.46Å; W28-K59 HydrophobicContact CZ3-CB 3.98Å; W28-K59 HydrophobicContact CZ3-CG 3.32Å; W28-F64 HydrophobicContact CD2-CE2 4.08Å; W28-F64 AromaticContact CE3-CE2 3.45Å; W28-F64 HydrophobicContact CE3-CE2 3.45Å; W28-F64 VanDerWaalsContact CE3-CE2 3.45Å; W28-F64 HydrophobicContact CE3-CZ 4.03Å; W28-F64 HydrophobicContact CH2-CE2 4.4Å; W28-F64 AromaticContact CZ3-CE2 3.6Å; W28-F64 HydrophobicContact CZ3-CE2 3.6Å; W28-F64 HydrophobicContact CZ3-CZ 4.24Å
29	G	69.8	Low	79.7	Confident	75 Å²	75	68.7 Å²	68.7	77%	0.773	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	1.6	179.1	0	0	0	0	0	115.3	L27	L27-G29 VanDerWaalsContact C-N 3.3Å; L27-G29 PolarHBondContact O-N 3.41Å
30	V	77	Confident	79.9	Confident	70 Å²	70	66.4 Å²	66.4	42%	0.424	38%	0.384	S	S	.	.	S	Bend	trans	-87.6	131.2	-171.5	-178.5	0	0	0	0	110.8	L27	L27-V30 HydrophobicContact CD2-CG2 4.19Å; L27-V30 PolarHBondContact O-N 3Å; L27-V30 VanDerWaalsContact O-N 3.17Å
31	P	64.6	Low	79.8	Confident	114 Å²	114	72.9 Å²	72.9	74%	0.74	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-63.4	138.6	175.7	26	-34.2	0	0	0	111.6
32	Q	73.4	Confident	79.5	Confident	144 Å²	144	77.6 Å²	77.6	67%	0.673	44%	0.437	S	S	*	.	S	Bend	trans	-73.9	153.9	-176.8	-71.6	-164.9	-1.1	0	0	113
33	P	73.2	Confident	79.4	Confident	125 Å²	125	71.4 Å²	71.4	81%	0.812	41%	0.406	S	S	*	.	P	Polyproline II helix	cis	-91.5	144.4	7.5	34.8	-34.6	0	0	0	115
34	I	81.4	Confident	78.9	Confident	24 Å²	24	74.6 Å²	74.6	12%	0.123	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-81.6	132.2	173.8	-62.5	168.7	0	0	0	109.9	L27 W36 V39 F55	L27-I34 HydrophobicContact CB-CD1 4.24Å; L27-I34 HydrophobicContact CD1-CG2 4.14Å; I34-W36 HydrophobicContact CB-CH2 4.08Å; I34-W36 HydrophobicContact CB-CZ2 3.85Å; I34-W36 HydrophobicContact CD1-CH2 3.83Å; I34-W36 HydrophobicContact CD1-CZ2 4.06Å; I34-W36 HydrophobicContact CG2-CD2 4.08Å; I34-W36 HydrophobicContact CG2-CE3 3.92Å; I34-W36 HydrophobicContact CG2-CH2 3.73Å; I34-W36 HydrophobicContact CG2-CZ2 3.94Å; I34-W36 HydrophobicContact CG2-CZ3 3.74Å; I34-W36 PolarHBondContact O-N 2.66Å; I34-V39 HydrophobicContact CG2-CG2 4.1Å; I34-F55 HydrophobicContact CD1-CD1 4.33Å; I34-F55 HydrophobicContact CD1-CE1 3.54Å; I34-F55 HydrophobicContact CD1-CE2 4.39Å; I34-F55 HydrophobicContact CD1-CZ 3.59Å
35	S	86.3	Confident	78.5	Confident	63 Å²	63	78.1 Å²	78.1	44%	0.441	46%	0.464	S	S	.	.			trans	-83.9	89.6	176.4	-177	0	0	0	0	111.7	E37 N38 V39	S35-E37 PolarHBondContact O-N 2.77Å; S35-N38 PolarHBondContact O-N 3.02Å; S35-V39 PolarHBondContact O-N 2.98Å
36	W	87	Confident	78.7	Confident	61 Å²	61	79.4 Å²	79.4	23%	0.231	46%	0.463	C	S	.	.	H	α-helix	trans	-59.8	-27.2	-179.9	-58.3	117.5	0	0	0	114.3	L24 I34 N38 V39 A40 P48 C51 A52 F55	L24-W36 HydrophobicContact CD2-CZ3 3.85Å; I34-W36 HydrophobicContact CB-CH2 4.08Å; I34-W36 HydrophobicContact CB-CZ2 3.85Å; I34-W36 HydrophobicContact CD1-CH2 3.83Å; I34-W36 HydrophobicContact CD1-CZ2 4.06Å; I34-W36 HydrophobicContact CG2-CD2 4.08Å; I34-W36 HydrophobicContact CG2-CE3 3.92Å; I34-W36 HydrophobicContact CG2-CH2 3.73Å; I34-W36 HydrophobicContact CG2-CZ2 3.94Å; I34-W36 HydrophobicContact CG2-CZ3 3.74Å; I34-W36 PolarHBondContact O-N 2.66Å; W36-N38 PolarHBondContact O-N 3.03Å; W36-V39 HydrophobicContact CE3-CB 4.3Å; W36-V39 HydrophobicContact CE3-CG2 4.03Å; W36-V39 HydrophobicContact CZ3-CG2 4.31Å; W36-V39 PolarHBondContact O-N 3.03Å; W36-A40 WeakPolarHBondContact O-CB 3.36Å; W36-A40 PolarHBondContact O-N 3.03Å; W36-P48 HydrophobicContact CB-CB 3.82Å; W36-P48 WeakPolarHBondContact CB-O 3.48Å; W36-C51 HydrophobicContact CE3-CB 4.05Å; W36-A52 HydrophobicContact CD2-CB 3.71Å; W36-A52 HydrophobicContact CE3-CB 4.26Å; W36-A52 HydrophobicContact CG-CB 3.91Å; W36-A52 HydrophobicContact CZ2-CB 4.25Å; W36-F55 HydrophobicContact CH2-CB 3.64Å; W36-F55 AromaticContact CH2-CD1 3.48Å; W36-F55 HydrophobicContact CH2-CD1 3.48Å; W36-F55 VanDerWaalsContact CH2-CD1 3.48Å; W36-F55 HydrophobicContact CH2-CD2 4.31Å; W36-F55 HydrophobicContact CH2-CE1 4.09Å; W36-F55 AromaticContact CH2-CG 3.58Å; W36-F55 HydrophobicContact CH2-CG 3.58Å; W36-F55 HydrophobicContact CZ2-CB 4.48Å; W36-F55 AromaticContact CZ2-CD1 3.92Å; W36-F55 HydrophobicContact CZ2-CD1 3.92Å; W36-F55 HydrophobicContact CZ2-CE1 4.46Å; W36-F55 HydrophobicContact CZ2-CG 4.42Å; W36-F55 HydrophobicContact CZ3-CB 4.13Å; W36-F55 HydrophobicContact CZ3-CG 4.36Å
37	E	83.8	Confident	79	Confident	131 Å²	131	78 Å²	78	61%	0.612	45%	0.451	S	S	*	.	H	α-helix	trans	-65.2	-27.5	172.7	-68.1	-169.2	174.1	0	0	113.2	S35 K41 P48	S35-E37 PolarHBondContact O-N 2.77Å; E37-K41 VanDerWaalsContact O-CD 3.31Å; E37-K41 WeakPolarHBondContact O-CD 3.39Å; E37-K41 WeakPolarHBondContact O-CE 3.4Å; E37-K41 VanDerWaalsContact O-CG 3.27Å; E37-K41 WeakPolarHBondContact O-CG 3.47Å; E37-P48 HydrophobicContact CG-CG 4.25Å
38	N	81.4	Confident	79.4	Confident	84 Å²	84	78.6 Å²	78.6	45%	0.449	46%	0.457	S	S	.	.	H	α-helix	trans	-85.9	-35.8	175.8	-67.9	-14.6	0	0	0	111.2	S35 W36 A40 K41 L42	S35-N38 PolarHBondContact O-N 3.02Å; W36-N38 PolarHBondContact O-N 3.03Å; N38-A40 VanDerWaalsContact C-N 3.34Å; N38-A40 PolarHBondContact O-N 3.39Å; N38-K41 PolarHBondContact O-N 3.15Å; N38-K41 VanDerWaalsContact O-N 3.16Å; N38-K41 PolarHBondContact OD1-NZ 3.49Å; N38-L42 WeakPolarHBondContact O-CG 3.38Å; N38-L42 PolarHBondContact O-N 3.43Å
39	V	83.1	Confident	79.9	Confident	9 Å²	9	80.9 Å²	80.9	6%	0.055	47%	0.47	C	S	.	.	H	α-helix	trans	-59.3	-44.6	172.3	-176.1	0	0	0	0	111.1	V23 L24 L27 I34 S35 W36 K41 L42 V43 C51	V23-V39 HydrophobicContact CG1-CG1 4.33Å; L24-V39 HydrophobicContact CD2-CG1 4.14Å; L27-V39 HydrophobicContact CD1-CG2 3.72Å; I34-V39 HydrophobicContact CG2-CG2 4.1Å; S35-V39 PolarHBondContact O-N 2.98Å; W36-V39 HydrophobicContact CE3-CB 4.3Å; W36-V39 HydrophobicContact CE3-CG2 4.03Å; W36-V39 HydrophobicContact CZ3-CG2 4.31Å; W36-V39 PolarHBondContact O-N 3.03Å; V39-K41 VanDerWaalsContact C-N 3.27Å; V39-K41 PolarHBondContact O-N 3.27Å; V39-L42 PolarHBondContact O-N 3.43Å; V39-L42 VanDerWaalsContact O-N 3.1Å; V39-V43 PolarHBondContact O-N 3Å; V39-C51 HydrophobicContact CB-CB 4.48Å; V39-C51 HydrophobicContact CG1-CB 3.97Å
40	A	83.5	Confident	80.7	Confident	17 Å²	17	81.9 Å²	81.9	14%	0.14	46%	0.455	C	S	.	.	H	α-helix	trans	-66.5	-21.6	177.4	0	0	0	0	0	114.5	W36 N38 P48	W36-A40 WeakPolarHBondContact O-CB 3.36Å; W36-A40 PolarHBondContact O-N 3.03Å; N38-A40 VanDerWaalsContact C-N 3.34Å; N38-A40 PolarHBondContact O-N 3.39Å; A40-P48 HydrophobicContact CB-CB 4.44Å; A40-P48 HydrophobicContact CB-CG 3.74Å
41	K	81.6	Confident	81.2	Confident	139 Å²	139	78.6 Å²	78.6	60%	0.604	44%	0.435	S	S	*	.	H	α-helix	trans	-78.1	-26.9	172.4	-68.8	163.1	-161.1	157.6	0	112.2	E37 N38 V39	E37-K41 VanDerWaalsContact O-CD 3.31Å; E37-K41 WeakPolarHBondContact O-CD 3.39Å; E37-K41 WeakPolarHBondContact O-CE 3.4Å; E37-K41 VanDerWaalsContact O-CG 3.27Å; E37-K41 WeakPolarHBondContact O-CG 3.47Å; N38-K41 PolarHBondContact O-N 3.15Å; N38-K41 VanDerWaalsContact O-N 3.16Å; N38-K41 PolarHBondContact OD1-NZ 3.49Å; V39-K41 VanDerWaalsContact C-N 3.27Å; V39-K41 PolarHBondContact O-N 3.27Å
42	L	78.1	Confident	82.3	Confident	127 Å²	127	74.3 Å²	74.3	67%	0.665	41%	0.409	S	S	*	.	H	α-helix	trans	-82.2	-22.6	-179.4	-67.6	169.1	0	0	0	113.2	N38 V39	N38-L42 WeakPolarHBondContact O-CG 3.38Å; N38-L42 PolarHBondContact O-N 3.43Å; V39-L42 PolarHBondContact O-N 3.43Å; V39-L42 VanDerWaalsContact O-N 3.1Å
43	V	79.5	Confident	82.8	Confident	3 Å²	3	71.5 Å²	71.5	2%	0.018	41%	0.405	C	S	.	.	S	Bend	trans	-123.9	90.4	179.1	-164.3	0	0	0	0	110.5	V19 L20 V23 V39 G45 F46	V19-V43 HydrophobicContact CG1-CG1 4.14Å; V19-V43 HydrophobicContact CG1-CG2 4.37Å; L20-V43 HydrophobicContact CB-CG1 4.28Å; L20-V43 HydrophobicContact CD1-CG2 4.31Å; V23-V43 HydrophobicContact CB-CG2 4.4Å; V23-V43 HydrophobicContact CG2-CG2 4.2Å; V39-V43 PolarHBondContact O-N 3Å; V43-G45 PolarHBondContact O-N 3.24Å; V43-F46 HydrophobicContact CB-CD2 4.2Å; V43-F46 HydrophobicContact CG1-CD2 3.63Å; V43-F46 HydrophobicContact CG1-CE2 3.74Å
44	P	72.3	Confident	83.5	Confident	102 Å²	102	68.6 Å²	68.6	66%	0.662	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	121.5	-178.2	-25.6	35.1	0	0	0	112.6
45	G	78.3	Confident	83.7	Confident	74 Å²	74	67.7 Å²	67.7	76%	0.763	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	121.8	-12.3	177.4	0	0	0	0	0	115.2	V43	V43-G45 PolarHBondContact O-N 3.24Å
46	F	84.1	Confident	83.6	Confident	48 Å²	48	69.3 Å²	69.3	21%	0.211	37%	0.374	C	S	.	.			trans	-111.9	146.7	176.6	-58.5	-80.5	0	0	0	112.4	N16 V17 L20 V43 E50	N16-F46 HydrophobicContact CB-CE2 3.93Å; N16-F46 HydrophobicContact CB-CZ 4.16Å; N16-F46 WeakPolarHBondContact O-CE2 3.47Å; V17-F46 HydrophobicContact CG2-CZ 4.16Å; L20-F46 HydrophobicContact CB-CD2 4.33Å; L20-F46 HydrophobicContact CB-CE2 3.92Å; L20-F46 HydrophobicContact CB-CZ 4.3Å; L20-F46 HydrophobicContact CD1-CD2 4.47Å; L20-F46 HydrophobicContact CD2-CD1 3.87Å; L20-F46 HydrophobicContact CD2-CD2 4Å; L20-F46 HydrophobicContact CD2-CE1 3.86Å; L20-F46 HydrophobicContact CD2-CE2 3.98Å; L20-F46 HydrophobicContact CD2-CG 3.93Å; L20-F46 HydrophobicContact CD2-CZ 3.91Å; L20-F46 HydrophobicContact CG-CE2 4.46Å; V43-F46 HydrophobicContact CB-CD2 4.2Å; V43-F46 HydrophobicContact CG1-CD2 3.63Å; V43-F46 HydrophobicContact CG1-CE2 3.74Å; F46-E50 HydrophobicContact CD1-CB 4.49Å
47	T	88.1	Confident	83.4	Confident	66 Å²	66	70.9 Å²	70.9	41%	0.405	38%	0.384	S	S	.	.			trans	-85.7	158.8	170.7	69.7	0	0	0	0	111.5	K49 E50 C51	T47-K49 PolarHBondContact O-N 2.92Å; T47-E50 WeakPolarHBondContact CA-OE2 3.21Å; T47-E50 WeakPolarHBondContact CB-OE2 3.18Å; T47-E50 VanDerWaalsContact CG2-OE2 3.3Å; T47-E50 WeakPolarHBondContact CG2-OE2 3.3Å; T47-E50 PolarHBondContact N-OE2 3.31Å; T47-E50 PolarHBondContact O-N 3.26Å; T47-E50 VanDerWaalsContact OG1-CD 3.28Å; T47-E50 PolarHBondContact OG1-N 2.9Å; T47-E50 PolarHBondContact OG1-OE2 3.16Å; T47-C51 PolarHBondContact O-N 2.9Å; T47-C51 VanDerWaalsContact O-N 3.13Å; T47-C51 PolarHBondContact O-SG 3.05Å; T47-C51 VanDerWaalsContact O-SG 3.42Å
48	P	86.6	Confident	83.2	Confident	48 Å²	48	65.4 Å²	65.4	31%	0.312	36%	0.359	S	S	.	.	H	α-helix	trans	-53.6	-28.6	175.1	-28.8	36.4	0	0	0	114.3	W36 E37 A40 A52	W36-P48 HydrophobicContact CB-CB 3.82Å; W36-P48 WeakPolarHBondContact CB-O 3.48Å; E37-P48 HydrophobicContact CG-CG 4.25Å; A40-P48 HydrophobicContact CB-CB 4.44Å; A40-P48 HydrophobicContact CB-CG 3.74Å; P48-A52 WeakPolarHBondContact O-CB 3.46Å; P48-A52 PolarHBondContact O-N 2.82Å
49	K	85.9	Confident	83.1	Confident	174 Å²	174	64.5 Å²	64.5	76%	0.757	35%	0.351	S	S	*	.	H	α-helix	trans	-74.9	-37.8	178.8	-67.2	-176.7	177.9	-179.8	0	112.4	T47 S53	T47-K49 PolarHBondContact O-N 2.92Å; K49-S53 WeakPolarHBondContact O-CB 3.48Å; K49-S53 PolarHBondContact O-N 3.01Å
50	E	86.3	Confident	82.8	Confident	97 Å²	97	68.3 Å²	68.3	45%	0.453	38%	0.383	S	S	.	.	H	α-helix	trans	-70.3	-42.8	177.3	-71.6	148.7	152.4	0	0	110.5	F46 T47 A52 S53 R54	F46-E50 HydrophobicContact CD1-CB 4.49Å; T47-E50 WeakPolarHBondContact CA-OE2 3.21Å; T47-E50 WeakPolarHBondContact CB-OE2 3.18Å; T47-E50 VanDerWaalsContact CG2-OE2 3.3Å; T47-E50 WeakPolarHBondContact CG2-OE2 3.3Å; T47-E50 PolarHBondContact N-OE2 3.31Å; T47-E50 PolarHBondContact O-N 3.26Å; T47-E50 VanDerWaalsContact OG1-CD 3.28Å; T47-E50 PolarHBondContact OG1-N 2.9Å; T47-E50 PolarHBondContact OG1-OE2 3.16Å; E50-A52 VanDerWaalsContact C-N 3.34Å; E50-A52 PolarHBondContact O-N 3.38Å; E50-S53 PolarHBondContact O-N 3.05Å; E50-R54 VanDerWaalsContact O-CB 3.31Å; E50-R54 WeakPolarHBondContact O-CB 3.48Å; E50-R54 PolarHBondContact O-N 3.41Å
51	C	87.9	Confident	82.1	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-57.6	-44.7	173.2	-57.9	0	0	0	0	112.3	L20 W36 V39 T47 F55	L20-C51 HydrophobicContact CD1-CB 4.32Å; W36-C51 HydrophobicContact CE3-CB 4.05Å; V39-C51 HydrophobicContact CB-CB 4.48Å; V39-C51 HydrophobicContact CG1-CB 3.97Å; T47-C51 PolarHBondContact O-N 2.9Å; T47-C51 VanDerWaalsContact O-N 3.13Å; T47-C51 PolarHBondContact O-SG 3.05Å; T47-C51 VanDerWaalsContact O-SG 3.42Å; C51-F55 WeakPolarHBondContact O-CB 3.38Å; C51-F55 PolarHBondContact O-N 3.47Å; C51-F55 VanDerWaalsContact O-N 3.07Å
52	A	86.2	Confident	81	Confident	25 Å²	25	69.8 Å²	69.8	21%	0.207	41%	0.411	C	S	.	.	H	α-helix	trans	-65.5	-43.1	177	0	0	0	0	0	112.4	W36 P48 E50 F55 E56	W36-A52 HydrophobicContact CD2-CB 3.71Å; W36-A52 HydrophobicContact CE3-CB 4.26Å; W36-A52 HydrophobicContact CG-CB 3.91Å; W36-A52 HydrophobicContact CZ2-CB 4.25Å; P48-A52 WeakPolarHBondContact O-CB 3.46Å; P48-A52 PolarHBondContact O-N 2.82Å; E50-A52 VanDerWaalsContact C-N 3.34Å; E50-A52 PolarHBondContact O-N 3.38Å; A52-F55 PolarHBondContact O-N 2.93Å; A52-E56 PolarHBondContact O-N 2.76Å
53	S	85.5	Confident	79.9	Confident	85 Å²	85	65.8 Å²	65.8	59%	0.594	40%	0.401	S	S	*	.	H	α-helix	trans	-64	-42	177.9	-166.7	0	0	0	0	111.8	K49 E50 E56 E57	K49-S53 WeakPolarHBondContact O-CB 3.48Å; K49-S53 PolarHBondContact O-N 3.01Å; E50-S53 PolarHBondContact O-N 3.05Å; S53-E56 PolarHBondContact O-N 3.21Å; S53-E57 PolarHBondContact O-N 3.4Å
54	R	85.9	Confident	78.8	Confident	64 Å²	64	68.7 Å²	68.7	24%	0.242	41%	0.413	C	S	.	.	H	α-helix	trans	-67.2	-35.5	179	-172.4	59.1	172.7	177.5	3.4	112.1	L20 D21 L24 E50 E57 L58	L20-R54 HydrophobicContact CD2-CB 4.23Å; L20-R54 HydrophobicContact CD2-CG 4.01Å; L20-R54 HydrophobicContact CG-CG 4.47Å; D21-R54 WeakPolarHBondContact OD1-CG 3.37Å; D21-R54 IonicContact OD1-CZ 3.69Å; D21-R54 IonicContact OD1-NE 2.66Å; D21-R54 PolarHBondContact OD1-NE 3.49Å; D21-R54 IonicContact OD1-NH2 3.84Å; D21-R54 IonicContact OD2-CZ 3.27Å; D21-R54 IonicContact OD2-NE 2.98Å; D21-R54 IonicContact OD2-NH2 2.77Å; D21-R54 PolarHBondContact OD2-NH2 3.04Å; L24-R54 HydrophobicContact CD1-CB 3.76Å; L24-R54 HydrophobicContact CD1-CG 3.67Å; E50-R54 VanDerWaalsContact O-CB 3.31Å; E50-R54 WeakPolarHBondContact O-CB 3.48Å; E50-R54 PolarHBondContact O-N 3.41Å; R54-E57 WeakPolarHBondContact CD-OE2 3.41Å; R54-E57 IonicContact CZ-OE2 2.69Å; R54-E57 IonicContact NE-OE2 2.72Å; R54-E57 IonicContact NH1-OE1 3.18Å; R54-E57 PolarHBondContact NH1-OE1 2.86Å; R54-E57 IonicContact NH1-OE2 2.76Å; R54-E57 PolarHBondContact NH1-OE2 3.07Å; R54-E57 WeakPolarHBondContact O-CB 3.44Å; R54-E57 PolarHBondContact O-N 3.13Å; R54-L58 HydrophobicContact CG-CD1 4.05Å; R54-L58 WeakPolarHBondContact O-CB 3.49Å; R54-L58 WeakPolarHBondContact O-CD1 3.49Å; R54-L58 VanDerWaalsContact O-CG 3.25Å; R54-L58 WeakPolarHBondContact O-CG 3.31Å; R54-L58 PolarHBondContact O-N 2.89Å
55	F	86.3	Confident	77.3	Confident	4 Å²	4	69.4 Å²	69.4	2%	0.018	42%	0.418	C	S	.	.	H	α-helix	trans	-64.8	-41.6	175.5	-174.3	-114.8	0	0	0	112.8	L24 L27 I34 W36 C51 A52 K59	L24-F55 HydrophobicContact CB-CD2 4.17Å; L24-F55 HydrophobicContact CD1-CB 4.29Å; L24-F55 HydrophobicContact CD2-CB 4.08Å; L24-F55 HydrophobicContact CD2-CD2 4.15Å; L24-F55 HydrophobicContact CD2-CG 4.49Å; L24-F55 WeakPolarHBondContact O-CE2 3.25Å; L27-F55 HydrophobicContact CB-CE2 4.09Å; I34-F55 HydrophobicContact CD1-CD1 4.33Å; I34-F55 HydrophobicContact CD1-CE1 3.54Å; I34-F55 HydrophobicContact CD1-CE2 4.39Å; I34-F55 HydrophobicContact CD1-CZ 3.59Å; W36-F55 HydrophobicContact CH2-CB 3.64Å; W36-F55 AromaticContact CH2-CD1 3.48Å; W36-F55 HydrophobicContact CH2-CD1 3.48Å; W36-F55 VanDerWaalsContact CH2-CD1 3.48Å; W36-F55 HydrophobicContact CH2-CD2 4.31Å; W36-F55 HydrophobicContact CH2-CE1 4.09Å; W36-F55 AromaticContact CH2-CG 3.58Å; W36-F55 HydrophobicContact CH2-CG 3.58Å; W36-F55 HydrophobicContact CZ2-CB 4.48Å; W36-F55 AromaticContact CZ2-CD1 3.92Å; W36-F55 HydrophobicContact CZ2-CD1 3.92Å; W36-F55 HydrophobicContact CZ2-CE1 4.46Å; W36-F55 HydrophobicContact CZ2-CG 4.42Å; W36-F55 HydrophobicContact CZ3-CB 4.13Å; W36-F55 HydrophobicContact CZ3-CG 4.36Å; C51-F55 WeakPolarHBondContact O-CB 3.38Å; C51-F55 PolarHBondContact O-N 3.47Å; C51-F55 VanDerWaalsContact O-N 3.07Å; A52-F55 PolarHBondContact O-N 2.93Å; F55-K59 HydrophobicContact CD1-CD 4.25Å; F55-K59 HydrophobicContact CE1-CD 4.2Å; F55-K59 WeakPolarHBondContact O-CG 3.19Å; F55-K59 PolarHBondContact O-N 2.6Å
56	E	83.4	Confident	75.3	Confident	97 Å²	97	73.5 Å²	73.5	45%	0.453	42%	0.417	S	S	.	.	H	α-helix	trans	-74.7	-28.2	176	-60.3	-58.2	138.6	0	0	112.5	A52 S53 K59 A60	A52-E56 PolarHBondContact O-N 2.76Å; S53-E56 PolarHBondContact O-N 3.21Å; E56-K59 VanDerWaalsContact CD-NZ 3.35Å; E56-K59 WeakPolarHBondContact O-CB 3.34Å; E56-K59 PolarHBondContact O-N 2.93Å; E56-K59 IonicContact OE1-NZ 2.57Å; E56-K59 PolarHBondContact OE1-NZ 2.77Å; E56-K59 WeakPolarHBondContact OE2-CD 3.46Å; E56-K59 IonicContact OE2-NZ 3.15Å; E56-K59 PolarHBondContact OE2-NZ 3.19Å; E56-A60 PolarHBondContact O-N 3.28Å
57	E	83.4	Confident	73	Confident	95 Å²	95	76.3 Å²	76.3	44%	0.444	44%	0.438	S	S	.	.	H	α-helix	trans	-62.4	-51.6	168.3	-171.8	-170.8	175.6	0	0	111.1	S53 R54 K59 A60 T61	S53-E57 PolarHBondContact O-N 3.4Å; R54-E57 WeakPolarHBondContact CD-OE2 3.41Å; R54-E57 IonicContact CZ-OE2 2.69Å; R54-E57 IonicContact NE-OE2 2.72Å; R54-E57 IonicContact NH1-OE1 3.18Å; R54-E57 PolarHBondContact NH1-OE1 2.86Å; R54-E57 IonicContact NH1-OE2 2.76Å; R54-E57 PolarHBondContact NH1-OE2 3.07Å; R54-E57 WeakPolarHBondContact O-CB 3.44Å; R54-E57 PolarHBondContact O-N 3.13Å; E57-K59 PolarHBondContact O-N 2.73Å; E57-A60 WeakPolarHBondContact O-CB 3.39Å; E57-A60 PolarHBondContact O-N 3.17Å; E57-T61 PolarHBondContact O-N 3.04Å; E57-T61 PolarHBondContact O-OG1 3.42Å
58	L	80.5	Confident	70.1	Confident	15 Å²	15	78.8 Å²	78.8	8%	0.079	45%	0.449	C	S	.	.	H	α-helix	trans	-59.6	-33.8	176.2	-70.1	160.3	0	0	0	112.1	D21 L24 R54 T61 A62 F64	D21-L58 HydrophobicContact CB-CD1 4.38Å; L24-L58 HydrophobicContact CB-CD1 3.98Å; L24-L58 HydrophobicContact CD1-CD1 3.88Å; R54-L58 HydrophobicContact CG-CD1 4.05Å; R54-L58 WeakPolarHBondContact O-CB 3.49Å; R54-L58 WeakPolarHBondContact O-CD1 3.49Å; R54-L58 VanDerWaalsContact O-CG 3.25Å; R54-L58 WeakPolarHBondContact O-CG 3.31Å; R54-L58 PolarHBondContact O-N 2.89Å; L58-T61 PolarHBondContact O-N 3.24Å; L58-A62 PolarHBondContact O-N 3.34Å; L58-A62 VanDerWaalsContact O-N 3.15Å; L58-F64 HydrophobicContact CB-CE1 4.28Å; L58-F64 HydrophobicContact CB-CZ 3.85Å; L58-F64 HydrophobicContact CD1-CE1 3.85Å; L58-F64 HydrophobicContact CD1-CZ 4.11Å; L58-F64 HydrophobicContact CD2-CE1 4.13Å; L58-F64 HydrophobicContact CD2-CZ 4.5Å; L58-F64 HydrophobicContact CG-CE1 4.31Å; L58-F64 HydrophobicContact CG-CZ 4.38Å
59	K	78	Confident	67.4	Low	66 Å²	66	87 Å²	87	29%	0.287	48%	0.475	S	S	.	.	H	α-helix	trans	-63.8	-43.5	170.6	-82	169.6	166.8	-179.6	0	113.9	W28 F55 E56 E57 T61	W28-K59 HydrophobicContact CE3-CG 3.84Å; W28-K59 HydrophobicContact CH2-CB 4.23Å; W28-K59 HydrophobicContact CH2-CG 3.85Å; W28-K59 VanDerWaalsContact CZ3-CA 3.46Å; W28-K59 HydrophobicContact CZ3-CB 3.98Å; W28-K59 HydrophobicContact CZ3-CG 3.32Å; F55-K59 HydrophobicContact CD1-CD 4.25Å; F55-K59 HydrophobicContact CE1-CD 4.2Å; F55-K59 WeakPolarHBondContact O-CG 3.19Å; F55-K59 PolarHBondContact O-N 2.6Å; E56-K59 VanDerWaalsContact CD-NZ 3.35Å; E56-K59 WeakPolarHBondContact O-CB 3.34Å; E56-K59 PolarHBondContact O-N 2.93Å; E56-K59 IonicContact OE1-NZ 2.57Å; E56-K59 PolarHBondContact OE1-NZ 2.77Å; E56-K59 WeakPolarHBondContact OE2-CD 3.46Å; E56-K59 IonicContact OE2-NZ 3.15Å; E56-K59 PolarHBondContact OE2-NZ 3.19Å; E57-K59 PolarHBondContact O-N 2.73Å; K59-T61 VanDerWaalsContact C-N 3.28Å; K59-T61 PolarHBondContact O-N 3.49Å
60	A	76.6	Confident	64.8	Low	89 Å²	89	87.3 Å²	87.3	74%	0.736	48%	0.479	S	S	*	.	H	α-helix	trans	-67.4	-31.1	177	0	0	0	0	0	112.2	E56 E57	E56-A60 PolarHBondContact O-N 3.28Å; E57-A60 WeakPolarHBondContact O-CB 3.39Å; E57-A60 PolarHBondContact O-N 3.17Å
61	T	69.8	Low	61.8	Low	100 Å²	100	87.9 Å²	87.9	61%	0.613	49%	0.493	S	S	*	.	H	α-helix	trans	-87.6	-13.9	-175.4	-51.1	0	0	0	0	114.3	E57 L58 K59 G63	E57-T61 PolarHBondContact O-N 3.04Å; E57-T61 PolarHBondContact O-OG1 3.42Å; L58-T61 PolarHBondContact O-N 3.24Å; K59-T61 VanDerWaalsContact C-N 3.28Å; K59-T61 PolarHBondContact O-N 3.49Å; T61-G63 VanDerWaalsContact C-N 3.32Å; T61-G63 PolarHBondContact O-N 3.19Å
62	A	59.1	Low	58.9	Low	87 Å²	87	95 Å²	95	72%	0.719	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	36	171.3	0	0	0	0	0	115.6	L58	L58-A62 PolarHBondContact O-N 3.34Å; L58-A62 VanDerWaalsContact O-N 3.15Å
63	G	54.4	Low	56.1	Low	43 Å²	43	101 Å²	101	44%	0.443	56%	0.56	S	S	.	*			trans	-152.9	117.2	179.1	0	0	0	0	0	113.8	T61	T61-G63 VanDerWaalsContact C-N 3.32Å; T61-G63 PolarHBondContact O-N 3.19Å
64	F	55.3	Low	53.3	Low	64 Å²	64	104.2 Å²	104.2	28%	0.281	57%	0.569	S	S	.	*			trans	-105.7	153	156.1	-69.3	-83.9	0	0	0	109.1	D21 G25 W28 L58 Q66	D21-F64 WeakPolarHBondContact O-CE1 3.37Å; G25-F64 VanDerWaalsContact CA-CZ 3.46Å; W28-F64 HydrophobicContact CD2-CE2 4.08Å; W28-F64 AromaticContact CE3-CE2 3.45Å; W28-F64 HydrophobicContact CE3-CE2 3.45Å; W28-F64 VanDerWaalsContact CE3-CE2 3.45Å; W28-F64 HydrophobicContact CE3-CZ 4.03Å; W28-F64 HydrophobicContact CH2-CE2 4.4Å; W28-F64 AromaticContact CZ3-CE2 3.6Å; W28-F64 HydrophobicContact CZ3-CE2 3.6Å; W28-F64 HydrophobicContact CZ3-CZ 4.24Å; L58-F64 HydrophobicContact CB-CE1 4.28Å; L58-F64 HydrophobicContact CB-CZ 3.85Å; L58-F64 HydrophobicContact CD1-CE1 3.85Å; L58-F64 HydrophobicContact CD1-CZ 4.11Å; L58-F64 HydrophobicContact CD2-CE1 4.13Å; L58-F64 HydrophobicContact CD2-CZ 4.5Å; L58-F64 HydrophobicContact CG-CE1 4.31Å; L58-F64 HydrophobicContact CG-CZ 4.38Å; F64-Q66 PolarHBondContact O-N 3.33Å; F64-Q66 VanDerWaalsContact O-N 3.12Å
65	P	42.4	Very low	50.5	Low	117 Å²	117	108.2 Å²	108.2	76%	0.76	60%	0.601	S	S	*	*			trans	-59.7	114.8	164.4	-19	32.2	0	0	0	109.5	V67	P65-V67 PolarHBondContact O-N 2.63Å
66	Q	36.5	Very low	47.6	Very low	159 Å²	159	111.8 Å²	111.8	74%	0.743	64%	0.639	S	S	*	*			trans	-70	120.5	179	-179	175.3	-19.6	0	0	110	F64 D68	F64-Q66 PolarHBondContact O-N 3.33Å; F64-Q66 VanDerWaalsContact O-N 3.12Å; Q66-D68 PolarHBondContact NE2-OD1 3.37Å
67	V	34.1	Very low	44.7	Very low	107 Å²	107	110.4 Å²	110.4	65%	0.648	65%	0.65	S	S	*	*			trans	-117.5	103.1	173.5	-175.7	0	0	0	0	107.8	P65 Y69	P65-V67 PolarHBondContact O-N 2.63Å; V67-Y69 HydrophobicContact CG1-CD2 3.99Å; V67-Y69 HydrophobicContact CG1-CE2 3.8Å; V67-Y69 PolarHBondContact O-N 3.01Å
68	D	27.2	Very low	41.9	Very low	119 Å²	119	112.1 Å²	112.1	64%	0.636	67%	0.668	S	S	*	*			trans	-71.6	97.1	-175	-78.2	-24.7	0	0	0	112.3	Q66	Q66-D68 PolarHBondContact NE2-OD1 3.37Å
69	Y	31.2	Very low	39.2	Very low	219 Å²	219	116.7 Å²	116.7	86%	0.859	70%	0.701	S	S	*	*			trans	-92.9	87.3	163	-84.6	-90.5	0	0	0	110.2	V67	V67-Y69 HydrophobicContact CG1-CD2 3.99Å; V67-Y69 HydrophobicContact CG1-CE2 3.8Å; V67-Y69 PolarHBondContact O-N 3.01Å
70	Q	30.4	Very low	36.6	Very low	182 Å²	182	119 Å²	119	85%	0.85	73%	0.725	S	S	*	*			trans	-105.6	100.5	166.7	-72.6	-167	4.7	0	0	111.2
71	C	24.3	Very low	34.6	Very low	109 Å²	109	120 Å²	120	74%	0.736	72%	0.724	S	S	*	*			trans	-151.6	132.7	163.6	-163.7	0	0	0	0	110.5
72	N	27.2	Very low	32.4	Very low	150 Å²	150	119.7 Å²	119.7	80%	0.802	73%	0.726	S	S	*	*			trans	65.3	89.5	171	-61.2	-22.3	0	0	0	118.8
73	D	26.8	Very low	30.7	Very low	151 Å²	151	122.9 Å²	122.9	81%	0.807	73%	0.731	S	S	*	*			trans	-154	137.5	132.1	-121	-9.2	0	0	0	106.4
74	L	26.6	Very low	29.2	Very low	152 Å²	152	125.7 Å²	125.7	80%	0.796	74%	0.744	S	S	*	*			cis	-137.3	165.4	9.4	-77.8	153.7	0	0	0	110.9
75	T	26.8	Very low	27.8	Very low	148 Å²	148	130 Å²	130	91%	0.908	77%	0.769	S	S	*	*			trans	-89.4	133.7	163.3	31.3	0	0	0	0	112
76	G	24.7	Very low	27	Very low	79 Å²	79	130 Å²	130	81%	0.814	77%	0.772	S	S	*	*			trans	178.3	112.2	172.5	0	0	0	0	0	118
77	G	23.7	Very low	26.4	Very low	67 Å²	67	126.2 Å²	126.2	69%	0.691	77%	0.768	S	S	*	*			trans	68.2	87.9	135.5	0	0	0	0	0	121.8
78	T	24.1	Very low	26	Very low	132 Å²	132	128.8 Å²	128.8	81%	0.81	78%	0.777	S	S	*	*				52.8	136.9	128.1	52.1	0	0	0	0	123.9
79	S	24	Very low	26	Very low	111 Å²	111	130.1 Å²	130.1	78%	0.776	78%	0.783	S	S	*	*			trans	67.8	113.4	144.2	57.1	0	0	0	0	121.9
80	S	22.8	Very low	25.7	Very low	113 Å²	113	128 Å²	128	79%	0.79	78%	0.781	S	S	*	*			trans	-66.9	172.2	143.7	-27.5	0	0	0	0	111.1
81	P	34.2	Very low	25.5	Very low	112 Å²	112	124.1 Å²	124.1	73%	0.727	78%	0.781	S	S	*	*			cis	-142.6	-167.5	14.6	42.4	-21.5	0	0	0	116.8
82	S	23.9	Very low	25.6	Very low	93 Å²	93	122.2 Å²	122.2	65%	0.65	78%	0.779	S	S	*	*			trans	70.7	116.3	149.3	59.6	0	0	0	0	122.3
83	D	23.3	Very low	25.5	Very low	154 Å²	154	122.8 Å²	122.8	82%	0.824	78%	0.782	S	S	*	*				78.1	139.3	125.6	-61.8	-9.4	0	0	0	125
84	S	24.1	Very low	25.6	Very low	101 Å²	101	121 Å²	121	71%	0.706	78%	0.777	S	S	*	*			trans	94.4	97.7	145.2	-65.6	0	0	0	0	122.2
85	L	25.4	Very low	25.6	Very low	156 Å²	156	119.2 Å²	119.2	82%	0.817	77%	0.772	S	S	*	*				65.5	115.1	119.9	-74.5	158.3	0	0	0	121.2
86	S	26	Very low	25.5	Very low	116 Å²	116	121.2 Å²	121.2	81%	0.811	77%	0.768	S	S	*	*				166.2	157.5	104.8	-72.4	0	0	0	0	111.8
87	A	24.5	Very low	25.5	Very low	80 Å²	80	127.4 Å²	127.4	66%	0.661	77%	0.767	S	S	*	*			cis	-174.8	148.8	-29.3	0	0	0	0	0	108.6
88	L	24.1	Very low	25.5	Very low	160 Å²	160	132.4 Å²	132.4	84%	0.838	77%	0.772	S	S	*	*			trans	150.1	101	162.7	-84.7	153	0	0	0	107.8
89	L	27.8	Very low	25.4	Very low	148 Å²	148	130 Å²	130	78%	0.775	77%	0.773	S	S	*	*				70.1	124.9	76.3	-68.2	-177.6	0	0	0	112.8
90	E	25.6	Very low	25.4	Very low	173 Å²	173	128.3 Å²	128.3	81%	0.808	77%	0.773	S	S	*	*			cis	-139.5	150.2	3.6	-88.8	169.8	163.3	0	0	109
91	A	26.3	Very low	25.5	Very low	102 Å²	102	128 Å²	128	84%	0.843	77%	0.771	S	S	*	*				67.7	132.6	60.6	0	0	0	0	0	114.5
92	G	26.3	Very low	25.2	Very low	69 Å²	69	130.5 Å²	130.5	71%	0.711	77%	0.773	S	S	*	*			cis	-142.1	169.6	-1.4	0	0	0	0	0	112
93	D	25.6	Very low	25.1	Very low	161 Å²	161	132.6 Å²	132.6	86%	0.861	78%	0.777	S	S	*	*				66	145.3	70.9	-115	15.5	0	0	0	113.4
94	V	27.1	Very low	25.1	Very low	114 Å²	114	130.8 Å²	130.8	69%	0.691	78%	0.775	S	S	*	*			cis	-169.2	158.1	11.6	87.6	0	0	0	0	107
95	V	27.9	Very low	25	Very low	114 Å²	114	130.7 Å²	130.7	69%	0.691	78%	0.775	S	S	*	*			cis	-172.8	171.7	-23.2	65.6	0	0	0	0	109.5
96	K	24.8	Very low	25	Very low	190 Å²	190	132.7 Å²	132.7	83%	0.826	78%	0.777	S	S	*	*			trans	74.7	166.9	168.5	-70.6	171.7	-179	175.2	0	119
97	R	24.5	Very low	25	Very low	210 Å²	210	134 Å²	134	79%	0.792	78%	0.78	S	S	*	*			cis	-178	162.2	-43.1	-149.1	-174	-158.1	-177.9	6.8	108.2
98	E	22.6	Very low	25	Very low	172 Å²	172	136.3 Å²	136.3	80%	0.804	79%	0.786	S	S	*	*			trans	67	153.4	168.8	-64.2	149.3	-144.8	0	0	115.3
99	G	23.6	Very low	25	Very low	80 Å²	80	132.5 Å²	132.5	83%	0.825	79%	0.785	S	S	*	*			cis	158.1	137.4	-11.6	0	0	0	0	0	112.8
100	G	24	Very low	25	Very low	76 Å²	76	131.2 Å²	131.2	78%	0.784	79%	0.788	S	S	*	*			trans	116.6	109.8	159.1	0	0	0	0	0	119.7
101	S	24.1	Very low	25.1	Very low	108 Å²	108	132.6 Å²	132.6	76%	0.755	79%	0.792	S	S	*	*			trans	50.8	124.5	131.3	-73.8	0	0	0	0	125.3
102	Q	26.9	Very low	25.1	Very low	163 Å²	163	133 Å²	133	76%	0.762	79%	0.788	S	S	*	*				84.4	128.8	123.7	-71	-177.2	2.2	0	0	123.7
103	N	23.6	Very low	25.3	Very low	138 Å²	138	137.7 Å²	137.7	74%	0.738	80%	0.796	S	S	*	*			trans	70.7	100.8	133.9	-66.5	-8.7	0	0	0	123.1
104	C	22.2	Very low	25.8	Very low	116 Å²	116	135.9 Å²	135.9	78%	0.784	79%	0.793	S	S	*	*				77.1	148.6	107	-158.1	0	0	0	0	121.3
105	S	22.5	Very low	25.8	Very low	99 Å²	99	135 Å²	135	69%	0.692	80%	0.798	S	S	*	*			trans	80.9	94.6	161.7	-63.5	0	0	0	0	121.1
106	K	25.4	Very low	25.7	Very low	197 Å²	197	132.8 Å²	132.8	86%	0.857	80%	0.798	S	S	*	*				54.9	116.8	105.8	-171.9	-172.2	-171	-179.5	0	119
107	V	25.1	Very low	26	Very low	144 Å²	144	136.2 Å²	136.2	87%	0.873	81%	0.806	S	S	*	*			trans	-153.4	156.2	142.1	129	0	0	0	0	111.2
108	T	24.4	Very low	25.9	Very low	129 Å²	129	130 Å²	130	79%	0.791	81%	0.808	S	S	*	*			trans	-94.1	157.8	-175.3	49.3	0	0	0	0	114
109	G	24.5	Very low	26	Very low	80 Å²	80	126 Å²	126	83%	0.825	81%	0.811	S	S	*	*			trans	-164.1	94	168.9	0	0	0	0	0	114.9
110	S	27.9	Very low	26.2	Very low	120 Å²	120	128.5 Å²	128.5	84%	0.839	81%	0.811	S	S	*	*			trans	-103.8	133.8	-176.2	-49.3	0	0	0	0	113.5
111	K	27	Very low	26.4	Very low	203 Å²	203	131.5 Å²	131.5	88%	0.883	81%	0.814	S	S	*	*			trans	-157.3	150.5	161	-68.5	-168.4	-177.3	179.1	0	109.4
112	S	26.5	Very low	26.5	Very low	110 Å²	110	135.2 Å²	135.2	77%	0.769	82%	0.819	S	S	*	*			cis	-173.8	143	-32.7	45.2	0	0	0	0	108.5
113	L	30.4	Very low	26.8	Very low	167 Å²	167	137.2 Å²	137.2	87%	0.874	83%	0.826	S	S	*	*			trans	-67	179.5	172.1	-75.9	171.5	0	0	0	112.7
114	P	37.2	Very low	27	Very low	123 Å²	123	140.5 Å²	140.5	80%	0.799	83%	0.833	S	S	*	*			cis	-124.3	-158.1	11.7	42	-22.4	0	0	0	112.9
115	A	27.4	Very low	27.2	Very low	97 Å²	97	143.4 Å²	143.4	80%	0.802	84%	0.835	S	S	*	*			cis	-155.6	177.6	8.5	0	0	0	0	0	109.8
116	G	26	Very low	27.3	Very low	66 Å²	66	143.7 Å²	143.7	68%	0.68	83%	0.833	S	S	*	*			cis	151.8	131.6	-11.1	0	0	0	0	0	113.6
117	R	29.5	Very low	27.3	Very low	262 Å²	262	145 Å²	145	99%	0.989	83%	0.832	S	S	*	*			trans	65.2	148.8	-176	-63.5	176.1	164.9	178	-6.1	115.4
118	G	23.8	Very low	27.4	Very low	81 Å²	81	144.4 Å²	144.4	84%	0.835	83%	0.829	S	S	*	*			cis	146.4	127.8	-8.2	0	0	0	0	0	112.5
119	G	24.8	Very low	27.4	Very low	86 Å²	86	142.8 Å²	142.8	89%	0.887	82%	0.823	S	S	*	*			trans	179.1	99.3	-178.3	0	0	0	0	0	115.4
120	T	26.2	Very low	27.8	Very low	134 Å²	134	145.5 Å²	145.5	82%	0.822	82%	0.823	S	S	*	*			trans	-78.8	147.2	-172.6	19.4	0	0	0	0	117.5
121	V	28.7	Very low	27.8	Very low	138 Å²	138	148.8 Å²	148.8	84%	0.836	83%	0.825	S	S	*	*			trans	57.4	157.8	158.9	-103.8	0	0	0	0	118.6
122	E	27.1	Very low	28.4	Very low	186 Å²	186	148.5 Å²	148.5	87%	0.869	83%	0.827	S	S	*	*			cis	-140.6	179.6	24.6	-83.2	-156	115.5	0	0	115.4
123	K	33.4	Very low	28.5	Very low	206 Å²	206	149 Å²	149	90%	0.896	82%	0.821	S	S	*	*			trans	-75.7	154.8	172	-69.4	178	173	-178.8	0	113.5
124	K	26.8	Very low	29	Very low	207 Å²	207	150.5 Å²	150.5	90%	0.9	82%	0.824	S	S	*	*			trans	-153.8	144.4	143.2	-151	170.4	-176.4	175.1	0	113
125	E	27.7	Very low	28.6	Very low	177 Å²	177	151.7 Å²	151.7	83%	0.827	82%	0.816	S	S	*	*			trans	-90.2	168	173.8	-55.7	164.6	121.3	0	0	111.3
126	T	23.4	Very low	28.7	Very low	105 Å²	105	153 Å²	153	64%	0.644	82%	0.817	S	S	*	*			trans	151.2	117.3	132	-67.2	0	0	0	0	114.7
127	R	25.1	Very low	28.9	Very low	223 Å²	223	156.6 Å²	156.6	84%	0.842	82%	0.816	S	S	*	*			trans	60.1	127.8	153.5	-62.7	165.6	-164.8	161.3	3.5	118.8
128	V	27.6	Very low	29.2	Very low	133 Å²	133	153 Å²	153	81%	0.806	81%	0.807	S	S	*	*				53.6	121.6	73.7	-176	0	0	0	0	110.9
129	S	24.9	Very low	29.8	Very low	94 Å²	94	154.7 Å²	154.7	66%	0.657	80%	0.803	S	S	*	*			cis	-166.7	157.8	25.2	33.7	0	0	0	0	112.8
130	V	32.4	Very low	30.7	Very low	137 Å²	137	159.5 Å²	159.5	83%	0.83	80%	0.795	S	S	*	*			trans	67.6	137.1	152.9	168.4	0	0	0	0	114
131	E	27.3	Very low	32.1	Very low	189 Å²	189	159.2 Å²	159.2	88%	0.883	79%	0.788	S	S	*	*			cis	-126.1	-172.8	39.7	-69.2	178.3	151.2	0	0	115.6
132	E	39.4	Very low	34.2	Very low	197 Å²	197	156.5 Å²	156.5	92%	0.921	77%	0.769	S	S	*	*			trans	-86.9	148.5	-171.8	-59.9	165.8	122.6	0	0	113.5
133	D	28.8	Very low	36.9	Very low	121 Å²	121	152.1 Å²	152.1	65%	0.647	75%	0.751	S	S	*	*			trans	-150.6	101.3	163.2	177.7	18	0	0	0	108.2	K135	D133-K135 VanDerWaalsContact CG-NZ 3.27Å; D133-K135 PolarHBondContact O-N 3.02Å; D133-K135 IonicContact OD1-NZ 3.95Å; D133-K135 PolarHBondContact OD1-NZ 3.28Å; D133-K135 IonicContact OD2-NZ 3.21Å; D133-K135 PolarHBondContact OD2-NZ 2.84Å
134	E	40.5	Very low	39.4	Very low	198 Å²	198	143 Å²	143	93%	0.925	71%	0.712	S	S	*	*			trans	-68.3	93.4	178.3	-80.2	-149.6	114.7	0	0	110.9
135	K	30.6	Very low	42.4	Very low	149 Å²	149	136 Å²	136	65%	0.648	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-95.5	135.7	159	-75.4	179.5	172.7	55	0	109.8	D133 Q137	D133-K135 VanDerWaalsContact CG-NZ 3.27Å; D133-K135 PolarHBondContact O-N 3.02Å; D133-K135 IonicContact OD1-NZ 3.95Å; D133-K135 PolarHBondContact OD1-NZ 3.28Å; D133-K135 IonicContact OD2-NZ 3.21Å; D133-K135 PolarHBondContact OD2-NZ 2.84Å; K135-Q137 PolarHBondContact O-N 2.88Å
136	P	28.8	Very low	45.4	Very low	125 Å²	125	127.6 Å²	127.6	81%	0.812	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-58.6	130.6	-175.5	24.2	-34.1	0	0	0	109.6	K138	P136-K138 PolarHBondContact O-N 3.47Å
137	Q	30	Very low	48.7	Very low	141 Å²	141	125.8 Å²	125.8	66%	0.659	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-57	125.5	172.6	-64.4	-173.8	40.3	0	0	107.6	K135 R140	K135-Q137 PolarHBondContact O-N 2.88Å; Q137-R140 VanDerWaalsContact OE1-NE 3.12Å; Q137-R140 VanDerWaalsContact OE1-NH2 3.1Å
138	K	34.8	Very low	51.9	Low	186 Å²	186	115.1 Å²	115.1	81%	0.809	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-50.6	141.5	156.2	-77.8	-174.7	173	-174.6	0	107.1	P136 R140	P136-K138 PolarHBondContact O-N 3.47Å; K138-R140 PolarHBondContact O-N 3.37Å
139	P	37.2	Very low	55	Low	116 Å²	116	109.4 Å²	109.4	75%	0.753	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-52.6	121.7	170.5	24.5	-33.2	0	0	0	107.1	D141	P139-D141 PolarHBondContact O-N 3.34Å
140	R	44.4	Very low	58.2	Low	187 Å²	187	105.2 Å²	105.2	71%	0.706	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-63.2	131	177.7	-62.2	179.9	-174.2	-167.3	-1.2	106.6	Q137 K138 L142	Q137-R140 VanDerWaalsContact OE1-NE 3.12Å; Q137-R140 VanDerWaalsContact OE1-NH2 3.1Å; K138-R140 PolarHBondContact O-N 3.37Å; R140-L142 VanDerWaalsContact C-N 3.32Å; R140-L142 PolarHBondContact O-N 3.3Å
141	D	55.7	Low	60.9	Low	128 Å²	128	105 Å²	105	68%	0.684	52%	0.517	S	S	*	.			trans	-59.2	97.2	175.8	-61	-73.6	0	0	0	108.8	P139 N143	P139-D141 PolarHBondContact O-N 3.34Å; D141-N143 PolarHBondContact O-N 2.79Å; D141-N143 PolarHBondContact O-ND2 2.91Å
142	L	73.1	Confident	63.8	Low	82 Å²	82	101.9 Å²	101.9	43%	0.429	51%	0.511	S	S	.	.			trans	-73.6	98.1	-171.9	-96.6	155.1	0	0	0	108.4	R140 M144 R163 W184	R140-L142 VanDerWaalsContact C-N 3.32Å; R140-L142 PolarHBondContact O-N 3.3Å; L142-M144 PolarHBondContact O-N 3.04Å; L142-R163 WeakPolarHBondContact O-CB 3.49Å; L142-R163 PolarHBondContact O-N 2.88Å; L142-W184 HydrophobicContact CD1-CE3 3.88Å; L142-W184 HydrophobicContact CD1-CZ3 3.8Å
143	N	83	Confident	66.2	Low	94 Å²	94	96.3 Å²	96.3	50%	0.503	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	107.8	-177.4	-84.6	-46.5	0	0	0	109.9	D141 T160 C161 P162	D141-N143 PolarHBondContact O-N 2.79Å; D141-N143 PolarHBondContact O-ND2 2.91Å; N143-T160 HydrophobicContact CB-CG2 3.59Å; N143-C161 CarbonylContact C-O 3.58Å; N143-C161 WeakPolarHBondContact CA-O 3.36Å; N143-P162 WeakPolarHBondContact OD1-CD 3.41Å
144	M	85.8	Confident	69	Low	15 Å²	15	97.3 Å²	97.3	7%	0.074	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	149.2	170.3	-56.8	-146.6	72.8	0	0	110.2	L142 T160 C161 R163 L177 V187 I189	L142-M144 PolarHBondContact O-N 3.04Å; M144-T160 CarbonylContact O-C 3.57Å; M144-T160 WeakPolarHBondContact O-CA 3.38Å; M144-C161 PolarHBondContact N-O 3.22Å; M144-C161 PolarHBondContact O-N 3.33Å; M144-R163 HydrophobicContact CG-CB 3.92Å; M144-R163 HydrophobicContact CG-CG 4.26Å; M144-R163 HydrophobicContact SD-CB 4.26Å; M144-R163 HydrophobicContact SD-CG 3.93Å; M144-L177 HydrophobicContact CE-CD2 3.81Å; M144-L177 HydrophobicContact SD-CD1 3.55Å; M144-L177 VanDerWaalsContact SD-CD1 3.55Å; M144-L177 HydrophobicContact SD-CD2 3.65Å; M144-L177 HydrophobicContact SD-CG 4.24Å; M144-V187 HydrophobicContact CE-CB 4.43Å; M144-V187 HydrophobicContact CE-CG1 4.44Å; M144-I189 HydrophobicContact CE-CD1 3.91Å; M144-I189 HydrophobicContact SD-CD1 4.1Å
145	V	89.6	Confident	71.5	Confident	60 Å²	60	91.9 Å²	91.9	36%	0.364	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	136.4	172.4	-176.1	0	0	0	0	108.5	D158	V145-D158 HydrophobicContact CG1-CB 4.08Å
146	I	91.4	Very high	74.5	Confident	0 Å²	0	92.9 Å²	92.9	0%	0	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	115.4	178.3	-53.8	175.4	0	0	0	108.1	V148 D158 F159 L166 I189 V191 F198	I146-V148 HydrophobicContact CG2-CG2 4.23Å; I146-V148 PolarHBondContact O-N 2.92Å; I146-D158 WeakPolarHBondContact O-CA 3.38Å; I146-F159 HydrophobicContact CB-CB 4.48Å; I146-F159 PolarHBondContact N-O 3.33Å; I146-F159 PolarHBondContact O-N 2.81Å; I146-L166 HydrophobicContact CD1-CD1 3.83Å; I146-L166 HydrophobicContact CD1-CD2 3.99Å; I146-I189 CarbonylContact C-O 3.54Å; I146-I189 WeakPolarHBondContact CA-O 3.35Å; I146-I189 HydrophobicContact CG1-CB 4.39Å; I146-I189 HydrophobicContact CG1-CD1 4.47Å; I146-I189 HydrophobicContact CG1-CG2 4.28Å; I146-I189 HydrophobicContact CG2-CG2 4.01Å; I146-V191 HydrophobicContact CG2-CB 4.45Å; I146-V191 HydrophobicContact CG2-CG2 3.66Å; I146-F198 HydrophobicContact CB-CE1 4.46Å; I146-F198 HydrophobicContact CB-CZ 4.49Å; I146-F198 HydrophobicContact CD1-CE1 4.35Å; I146-F198 HydrophobicContact CD1-CZ 4.03Å; I146-F198 HydrophobicContact CG2-CE1 4.08Å; I146-F198 HydrophobicContact CG2-CZ 3.78Å
147	H	92.3	Very high	77.5	Confident	66 Å²	66	90.9 Å²	90.9	31%	0.306	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	100.3	-177.1	-64.2	-70.6	0	0	0	110.4	D158 D188 I189 S190 V191	H147-D158 IonicContact CE1-OD1 3.6Å; H147-D158 IonicContact CE1-OD2 3.54Å; H147-D158 PolarHBondContact CE1-OD2 2.91Å; H147-D158 IonicContact CG-OD1 2.69Å; H147-D158 IonicContact ND1-OD1 3.68Å; H147-D158 PolarHBondContact ND1-OD1 3.18Å; H147-D158 IonicContact ND1-OD2 3.9Å; H147-D158 PolarHBondContact ND1-OD2 2.86Å; H147-D188 IonicContact CD2-OD1 2.75Å; H147-D188 PolarHBondContact CD2-OD1 2.86Å; H147-I189 PolarHBondContact N-O 3.26Å; H147-S190 WeakPolarHBondContact O-CA 3.37Å; H147-V191 PolarHBondContact O-N 3.37Å
148	V	93.2	Very high	80.5	Confident	0 Å²	0	88.8 Å²	88.8	0%	0	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	125.5	-176.9	-175	0	0	0	0	110.6	I146 K156 Q157 F159 V191 V195 F198	I146-V148 HydrophobicContact CG2-CG2 4.23Å; I146-V148 PolarHBondContact O-N 2.92Å; V148-K156 VanDerWaalsContact O-CA 3.29Å; V148-K156 WeakPolarHBondContact O-CA 3.39Å; V148-Q157 WeakPolarHBondContact CB-O 3.32Å; V148-Q157 PolarHBondContact N-O 3Å; V148-Q157 PolarHBondContact O-N 3.4Å; V148-F159 HydrophobicContact CB-CD2 4.1Å; V148-F159 HydrophobicContact CB-CE2 3.92Å; V148-F159 HydrophobicContact CG2-CD2 3.47Å; V148-F159 VanDerWaalsContact CG2-CD2 3.47Å; V148-F159 HydrophobicContact CG2-CE2 3.68Å; V148-V191 CarbonylContact C-O 3.56Å; V148-V191 WeakPolarHBondContact CA-O 3.38Å; V148-V191 HydrophobicContact CG2-CB 4.47Å; V148-V195 HydrophobicContact CB-CG2 4.22Å; V148-V195 HydrophobicContact CG1-CG2 3.73Å; V148-F198 HydrophobicContact CG1-CB 4.04Å; V148-F198 HydrophobicContact CG1-CG 4.31Å; V148-F198 HydrophobicContact CG2-CB 4.11Å; V148-F198 HydrophobicContact CG2-CD1 3.44Å; V148-F198 VanDerWaalsContact CG2-CD1 3.44Å; V148-F198 HydrophobicContact CG2-CD2 4.09Å; V148-F198 HydrophobicContact CG2-CE1 3.8Å; V148-F198 HydrophobicContact CG2-CE2 4.42Å; V148-F198 HydrophobicContact CG2-CG 3.59Å; V148-F198 HydrophobicContact CG2-CZ 4.29Å
149	C	91.8	Very high	83.2	Confident	13 Å²	13	80.7 Å²	80.7	9%	0.088	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	111.1	179.9	-65	0	0	0	0	110.8	K156 V191 H192 C193	C149-K156 WeakPolarHBondContact SG-CE 3.49Å; C149-V191 PolarHBondContact N-O 3.27Å; C149-H192 WeakPolarHBondContact O-CA 3.37Å; C149-C193 CarbonylContact C-O 3.58Å; C149-C193 PolarHBondContact O-N 3Å; C149-C193 VanDerWaalsContact O-N 3.16Å
150	D	92.6	Very high	85.7	Confident	6 Å²	6	78.1 Å²	78.1	3%	0.032	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	97.8	169.1	-174.5	-24.4	0	0	0	109.1	T152 K153 N154 L155 C193 V195	D150-T152 PolarHBondContact O-N 3.4Å; D150-T152 WeakPolarHBondContact OD1-CA 3.44Å; D150-T152 WeakPolarHBondContact OD1-CB 3.34Å; D150-T152 PolarHBondContact OD1-N 3Å; D150-T152 PolarHBondContact OD1-OG1 3.45Å; D150-K153 HydrophobicContact CB-CB 4.43Å; D150-K153 PolarHBondContact OD1-N 3.21Å; D150-K153 WeakPolarHBondContact OD2-CD 3.32Å; D150-K153 WeakPolarHBondContact OD2-CE 3.46Å; D150-K153 VanDerWaalsContact OD2-CG 3.29Å; D150-K153 WeakPolarHBondContact OD2-CG 3.26Å; D150-K153 IonicContact OD2-NZ 3.55Å; D150-N154 CarbonylContact O-C 3.46Å; D150-N154 WeakPolarHBondContact O-CA 3.26Å; D150-N154 PolarHBondContact O-N 3.23Å; D150-L155 HydrophobicContact CB-CB 4.31Å; D150-L155 PolarHBondContact N-O 2.95Å; D150-L155 PolarHBondContact O-N 3.3Å; D150-C193 VanDerWaalsContact CA-O 3.3Å; D150-C193 WeakPolarHBondContact CA-O 3.46Å; D150-C193 WeakPolarHBondContact CB-O 3.48Å; D150-V195 HydrophobicContact CB-CB 4.49Å; D150-V195 HydrophobicContact CB-CG2 3.93Å
151	E	89.4	Confident	87.8	Confident	133 Å²	133	69.2 Å²	69.2	62%	0.621	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-24.2	177.3	-63.4	-178.8	-176.4	0	0	113.2	N154 H192	E151-N154 PolarHBondContact O-ND2 3.1Å; E151-H192 IonicContact OE1-CE1 3.47Å; E151-H192 PolarHBondContact OE1-CE1 3.31Å; E151-H192 IonicContact OE1-CG 2.74Å; E151-H192 IonicContact OE1-ND1 3.62Å; E151-H192 PolarHBondContact OE1-ND1 3.42Å
152	T	88	Confident	89.4	Confident	122 Å²	122	65 Å²	65	75%	0.748	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-38.8	-177	73.1	0	0	0	0	111.7	D150	D150-T152 PolarHBondContact O-N 3.4Å; D150-T152 WeakPolarHBondContact OD1-CA 3.44Å; D150-T152 WeakPolarHBondContact OD1-CB 3.34Å; D150-T152 PolarHBondContact OD1-N 3Å; D150-T152 PolarHBondContact OD1-OG1 3.45Å
153	K	88.6	Confident	90	Very high	80 Å²	80	62.9 Å²	62.9	35%	0.348	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-7.7	176	-57.3	176.8	-155.8	166.5	0	112.7	D150 L155 D194	D150-K153 HydrophobicContact CB-CB 4.43Å; D150-K153 PolarHBondContact OD1-N 3.21Å; D150-K153 WeakPolarHBondContact OD2-CD 3.32Å; D150-K153 WeakPolarHBondContact OD2-CE 3.46Å; D150-K153 VanDerWaalsContact OD2-CG 3.29Å; D150-K153 WeakPolarHBondContact OD2-CG 3.26Å; D150-K153 IonicContact OD2-NZ 3.55Å; K153-L155 VanDerWaalsContact C-N 3.27Å; K153-L155 HydrophobicContact CB-CD1 3.81Å; K153-L155 HydrophobicContact CB-CG 3.8Å; K153-L155 HydrophobicContact CD-CD1 4.2Å; K153-L155 PolarHBondContact O-N 3.32Å; K153-D194 IonicContact NZ-OD1 3.62Å; K153-D194 PolarHBondContact NZ-OD1 3.13Å; K153-D194 IonicContact NZ-OD2 2.7Å; K153-D194 PolarHBondContact NZ-OD2 2.87Å
154	N	89	Confident	90.1	Very high	142 Å²	142	63.8 Å²	63.8	76%	0.759	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	41.3	-171.9	-72.9	-101.9	0	0	0	112.5	D150 E151	D150-N154 CarbonylContact O-C 3.46Å; D150-N154 WeakPolarHBondContact O-CA 3.26Å; D150-N154 PolarHBondContact O-N 3.23Å; E151-N154 PolarHBondContact O-ND2 3.1Å
155	L	92.4	Very high	90.3	Very high	85 Å²	85	64.6 Å²	64.6	45%	0.445	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	147	178.5	-61.8	175.7	0	0	0	110.8	D150 K153 V195	D150-L155 HydrophobicContact CB-CB 4.31Å; D150-L155 PolarHBondContact N-O 2.95Å; D150-L155 PolarHBondContact O-N 3.3Å; K153-L155 VanDerWaalsContact C-N 3.27Å; K153-L155 HydrophobicContact CB-CD1 3.81Å; K153-L155 HydrophobicContact CB-CG 3.8Å; K153-L155 HydrophobicContact CD-CD1 4.2Å; K153-L155 PolarHBondContact O-N 3.32Å; L155-V195 HydrophobicContact CB-CG2 4.39Å
156	K	92.6	Very high	90.2	Very high	169 Å²	169	61.7 Å²	61.7	74%	0.735	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.4	135.1	167.6	-63.1	-163.6	175	-154.6	0	109.6	V148 C149	V148-K156 VanDerWaalsContact O-CA 3.29Å; V148-K156 WeakPolarHBondContact O-CA 3.39Å; C149-K156 WeakPolarHBondContact SG-CE 3.49Å
157	Q	93.3	Very high	90	Very high	84 Å²	84	63.5 Å²	63.5	39%	0.393	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	134.9	178.1	-177.7	171.8	-30.7	0	0	110.5	V148 F159 V195	V148-Q157 WeakPolarHBondContact CB-O 3.32Å; V148-Q157 PolarHBondContact N-O 3Å; V148-Q157 PolarHBondContact O-N 3.4Å; Q157-F159 HydrophobicContact CB-CE2 3.87Å; Q157-F159 HydrophobicContact CB-CZ 4.35Å; Q157-F159 HydrophobicContact CG-CD2 4.28Å; Q157-F159 HydrophobicContact CG-CE2 3.67Å; Q157-F159 HydrophobicContact CG-CZ 3.83Å; Q157-F159 WeakPolarHBondContact O-CD2 3.45Å; Q157-V195 HydrophobicContact CB-CG1 3.73Å; Q157-V195 HydrophobicContact CB-CG2 4.3Å; Q157-V195 HydrophobicContact CG-CG1 4.35Å; Q157-V195 VanDerWaalsContact OE1-CG1 3.25Å
158	D	93	Very high	89.8	Confident	97 Å²	97	66.9 Å²	66.9	52%	0.519	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	130.6	-178.1	-62.1	-10.8	0	0	0	109.9	V145 I146 H147	V145-D158 HydrophobicContact CG1-CB 4.08Å; I146-D158 WeakPolarHBondContact O-CA 3.38Å; H147-D158 IonicContact CE1-OD1 3.6Å; H147-D158 IonicContact CE1-OD2 3.54Å; H147-D158 PolarHBondContact CE1-OD2 2.91Å; H147-D158 IonicContact CG-OD1 2.69Å; H147-D158 IonicContact ND1-OD1 3.68Å; H147-D158 PolarHBondContact ND1-OD1 3.18Å; H147-D158 IonicContact ND1-OD2 3.9Å; H147-D158 PolarHBondContact ND1-OD2 2.86Å
159	F	91.5	Very high	89.6	Confident	15 Å²	15	68.2 Å²	68.2	7%	0.066	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	124.5	-178.6	-67.8	-93.4	0	0	0	110.9	I146 V148 Q157 V195 F198 D199 M202	I146-F159 HydrophobicContact CB-CB 4.48Å; I146-F159 PolarHBondContact N-O 3.33Å; I146-F159 PolarHBondContact O-N 2.81Å; V148-F159 HydrophobicContact CB-CD2 4.1Å; V148-F159 HydrophobicContact CB-CE2 3.92Å; V148-F159 HydrophobicContact CG2-CD2 3.47Å; V148-F159 VanDerWaalsContact CG2-CD2 3.47Å; V148-F159 HydrophobicContact CG2-CE2 3.68Å; Q157-F159 HydrophobicContact CB-CE2 3.87Å; Q157-F159 HydrophobicContact CB-CZ 4.35Å; Q157-F159 HydrophobicContact CG-CD2 4.28Å; Q157-F159 HydrophobicContact CG-CE2 3.67Å; Q157-F159 HydrophobicContact CG-CZ 3.83Å; Q157-F159 WeakPolarHBondContact O-CD2 3.45Å; F159-V195 HydrophobicContact CE2-CG1 4.38Å; F159-V195 HydrophobicContact CZ-CG1 4.23Å; F159-F198 HydrophobicContact CB-CD1 4.41Å; F159-F198 HydrophobicContact CB-CE1 4.11Å; F159-F198 HydrophobicContact CD1-CD1 4.31Å; F159-F198 AromaticContact CD2-CD1 3.72Å; F159-F198 HydrophobicContact CD2-CD1 3.72Å; F159-F198 HydrophobicContact CD2-CE1 4.16Å; F159-F198 AromaticContact CE2-CD1 3.95Å; F159-F198 HydrophobicContact CE2-CD1 3.95Å; F159-F198 AromaticContact CG-CD1 3.89Å; F159-F198 HydrophobicContact CG-CD1 3.89Å; F159-F198 HydrophobicContact CG-CE1 4.1Å; F159-F198 HydrophobicContact CZ-CD1 4.34Å; F159-D199 HydrophobicContact CE1-CB 3.78Å; F159-D199 HydrophobicContact CZ-CB 3.9Å; F159-M202 HydrophobicContact CB-CG 4.18Å; F159-M202 HydrophobicContact CD1-CB 4.19Å; F159-M202 HydrophobicContact CD1-CG 3.77Å; F159-M202 HydrophobicContact CE1-CG 4.45Å; F159-M202 HydrophobicContact CG-CG 4.13Å
160	T	89.6	Confident	89.6	Confident	63 Å²	63	67.6 Å²	67.6	39%	0.387	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	135.9	178.4	-42.9	0	0	0	0	111.4	N143 M144 R206	N143-T160 HydrophobicContact CB-CG2 3.59Å; M144-T160 CarbonylContact O-C 3.57Å; M144-T160 WeakPolarHBondContact O-CA 3.38Å; T160-R206 PolarHBondContact O-NH2 3.48Å
161	C	87.8	Confident	89.5	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	136	175.9	-161.8	0	0	0	0	112.8	N143 M144 R163 L166 M202	N143-C161 CarbonylContact C-O 3.58Å; N143-C161 WeakPolarHBondContact CA-O 3.36Å; M144-C161 PolarHBondContact N-O 3.22Å; M144-C161 PolarHBondContact O-N 3.33Å; C161-R163 PolarHBondContact O-N 3.17Å; C161-L166 HydrophobicContact CB-CB 4.41Å; C161-M202 HydrophobicContact CB-CE 3.63Å
162	P	89	Confident	89.5	Confident	40 Å²	40	68.6 Å²	68.6	26%	0.26	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	126.8	167.9	-23.2	33.7	0	0	0	110.9	N143 D164 L165 L166	N143-P162 WeakPolarHBondContact OD1-CD 3.41Å; P162-D164 VanDerWaalsContact C-N 3.27Å; P162-D164 PolarHBondContact O-N 3.47Å; P162-D164 VanDerWaalsContact O-N 3.16Å; P162-L165 HydrophobicContact CB-CB 4.37Å; P162-L165 WeakPolarHBondContact O-CB 3.37Å; P162-L165 PolarHBondContact O-N 3.41Å; P162-L166 PolarHBondContact O-N 3.46Å
163	R	85.6	Confident	89.5	Confident	36 Å²	36	63.3 Å²	63.3	14%	0.136	31%	0.306	C	S	.	.	H	α-helix	trans	-50.2	-44.4	-174.8	-176.4	-83.6	-166.2	131.8	6.6	113	L142 M144 C161 L165 L166 V167 L177 S178 W184	L142-R163 WeakPolarHBondContact O-CB 3.49Å; L142-R163 PolarHBondContact O-N 2.88Å; M144-R163 HydrophobicContact CG-CB 3.92Å; M144-R163 HydrophobicContact CG-CG 4.26Å; M144-R163 HydrophobicContact SD-CB 4.26Å; M144-R163 HydrophobicContact SD-CG 3.93Å; C161-R163 PolarHBondContact O-N 3.17Å; R163-L165 VanDerWaalsContact C-N 3.31Å; R163-L165 PolarHBondContact O-N 3.13Å; R163-L166 PolarHBondContact O-N 3.27Å; R163-V167 HydrophobicContact CG-CG2 4.44Å; R163-V167 WeakPolarHBondContact O-CB 3.46Å; R163-V167 WeakPolarHBondContact O-CG2 3.43Å; R163-V167 PolarHBondContact O-N 2.95Å; R163-L177 HydrophobicContact CG-CD1 4.43Å; R163-L177 PolarHBondContact NH2-O 3.49Å; R163-S178 PolarHBondContact NH2-O 2.86Å; R163-W184 VanDerWaalsContact CZ-CZ2 3.45Å; R163-W184 VanDerWaalsContact NH1-CH2 3.28Å; R163-W184 VanDerWaalsContact NH2-CZ2 3.29Å
164	D	86.6	Confident	89.3	Confident	114 Å²	114	61.7 Å²	61.7	61%	0.61	31%	0.308	S	S	*	.	H	α-helix	trans	-70.3	-27.5	-176.1	-62.2	-15.7	0	0	0	112.8	P162 K168	P162-D164 VanDerWaalsContact C-N 3.27Å; P162-D164 PolarHBondContact O-N 3.47Å; P162-D164 VanDerWaalsContact O-N 3.16Å; D164-K168 WeakPolarHBondContact O-CB 3.37Å; D164-K168 PolarHBondContact O-N 3.41Å
165	L	88.6	Confident	88.9	Confident	31 Å²	31	60.6 Å²	60.6	16%	0.162	30%	0.298	C	S	.	.	H	α-helix	trans	-75.8	-41.3	172.1	-178.9	63.3	0	0	0	111.1	P162 R163 K168 E169 V205	P162-L165 HydrophobicContact CB-CB 4.37Å; P162-L165 WeakPolarHBondContact O-CB 3.37Å; P162-L165 PolarHBondContact O-N 3.41Å; R163-L165 VanDerWaalsContact C-N 3.31Å; R163-L165 PolarHBondContact O-N 3.13Å; L165-K168 PolarHBondContact O-N 3.31Å; L165-E169 HydrophobicContact CD1-CG 4.02Å; L165-E169 PolarHBondContact O-N 2.74Å; L165-V205 HydrophobicContact CD1-CG1 4.26Å; L165-V205 HydrophobicContact CD2-CG1 3.92Å; L165-V205 HydrophobicContact CG-CG1 3.68Å
166	L	88.3	Confident	88.3	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-60.8	-52.6	177.2	-175.7	66.5	0	0	0	111.4	I146 C161 P162 R163 K168 M170 F173 L177 I189	I146-L166 HydrophobicContact CD1-CD1 3.83Å; I146-L166 HydrophobicContact CD1-CD2 3.99Å; C161-L166 HydrophobicContact CB-CB 4.41Å; P162-L166 PolarHBondContact O-N 3.46Å; R163-L166 PolarHBondContact O-N 3.27Å; L166-K168 PolarHBondContact O-N 3.07Å; L166-M170 HydrophobicContact CD1-CB 4.27Å; L166-M170 HydrophobicContact CD1-CG 4.44Å; L166-M170 HydrophobicContact CD1-SD 3.67Å; L166-M170 CarbonylContact O-C 3.5Å; L166-M170 WeakPolarHBondContact O-CA 3.46Å; L166-M170 WeakPolarHBondContact O-CB 3.42Å; L166-M170 PolarHBondContact O-N 3.12Å; L166-F173 HydrophobicContact CD1-CD2 3.76Å; L166-F173 HydrophobicContact CD1-CE2 3.95Å; L166-F173 HydrophobicContact CD2-CD2 4.19Å; L166-F173 HydrophobicContact CD2-CG 4.33Å; L166-F173 HydrophobicContact CG-CB 4.45Å; L166-F173 HydrophobicContact CG-CD2 3.86Å; L166-F173 HydrophobicContact CG-CE2 4.48Å; L166-F173 HydrophobicContact CG-CG 4.34Å; L166-L177 HydrophobicContact CD2-CD1 4.1Å; L166-I189 HydrophobicContact CD2-CD1 4.46Å
167	V	88.1	Confident	87.6	Confident	37 Å²	37	55.6 Å²	55.6	22%	0.224	27%	0.27	C	S	.	.	H	α-helix	trans	-61	-33.4	178.7	168.1	0	0	0	0	112	R163 A174 L177	R163-V167 HydrophobicContact CG-CG2 4.44Å; R163-V167 WeakPolarHBondContact O-CB 3.46Å; R163-V167 WeakPolarHBondContact O-CG2 3.43Å; R163-V167 PolarHBondContact O-N 2.95Å; V167-A174 HydrophobicContact CG1-CB 3.84Å; V167-L177 HydrophobicContact CG2-CB 4.08Å; V167-L177 HydrophobicContact CG2-CD1 3.89Å
168	K	87.5	Confident	86.3	Confident	138 Å²	138	54.8 Å²	54.8	60%	0.6	27%	0.274	S	S	*	.	H	α-helix	trans	-73	-52.8	180	177	-174	169.3	-169.9	0	113.4	D164 L165 L166	D164-K168 WeakPolarHBondContact O-CB 3.37Å; D164-K168 PolarHBondContact O-N 3.41Å; L165-K168 PolarHBondContact O-N 3.31Å; L166-K168 PolarHBondContact O-N 3.07Å
169	E	89.4	Confident	84.7	Confident	27 Å²	27	56.3 Å²	56.3	13%	0.126	29%	0.286	C	S	.	.	H	α-helix	trans	-88.4	-28	-174.4	-57.6	-80	131.8	0	0	112.3	L165 V205 R207 M237	L165-E169 HydrophobicContact CD1-CG 4.02Å; L165-E169 PolarHBondContact O-N 2.74Å; E169-V205 HydrophobicContact CB-CB 4.49Å; E169-V205 HydrophobicContact CB-CG1 4.18Å; E169-V205 HydrophobicContact CB-CG2 3.92Å; E169-V205 HydrophobicContact CG-CG1 4.25Å; E169-R207 IonicContact OE2-CZ 2.77Å; E169-R207 IonicContact OE2-NE 2.81Å; E169-R207 IonicContact OE2-NH2 3.34Å; E169-R207 PolarHBondContact OE2-NH2 3.01Å; E169-M237 WeakPolarHBondContact O-CG 3.21Å
170	M	91.4	Very high	83.4	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.308	C	S	.	.			trans	-116.7	70.7	178.9	-66.6	-179.1	167.4	0	0	111.3	L166 Y172 F173 L201 M202 V205 L235 M237	L166-M170 HydrophobicContact CD1-CB 4.27Å; L166-M170 HydrophobicContact CD1-CG 4.44Å; L166-M170 HydrophobicContact CD1-SD 3.67Å; L166-M170 CarbonylContact O-C 3.5Å; L166-M170 WeakPolarHBondContact O-CA 3.46Å; L166-M170 WeakPolarHBondContact O-CB 3.42Å; L166-M170 PolarHBondContact O-N 3.12Å; M170-Y172 PolarHBondContact O-N 2.81Å; M170-F173 HydrophobicContact CB-CD2 3.81Å; M170-F173 HydrophobicContact CB-CE2 4.18Å; M170-F173 PolarHBondContact O-N 2.93Å; M170-F173 HydrophobicContact SD-CD2 4.38Å; M170-F173 HydrophobicContact SD-CE2 3.91Å; M170-L201 HydrophobicContact CE-CB 3.85Å; M170-M202 HydrophobicContact CE-SD 4.18Å; M170-V205 HydrophobicContact CE-CG2 3.79Å; M170-V205 HydrophobicContact CG-CG2 4.03Å; M170-V205 HydrophobicContact SD-CG2 4.32Å; M170-L235 CarbonylContact C-O 3.38Å; M170-L235 HydrophobicContact CE-CD1 3.82Å; M170-L235 HydrophobicContact CG-CB 4.43Å; M170-L235 HydrophobicContact SD-CD1 4.03Å; M170-M237 HydrophobicContact CE-CE 4.07Å; M170-M237 HydrophobicContact CE-SD 3.92Å; M170-M237 HydrophobicContact CG-CE 3.93Å; M170-M237 HydrophobicContact CG-CG 3.98Å; M170-M237 HydrophobicContact CG-SD 3.79Å
171	R	89.4	Confident	82.1	Confident	101 Å²	101	63.8 Å²	63.8	38%	0.381	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-61	-13.1	-172	-63.5	170.7	-55.5	163.2	21.7	115.1	F173 A174 L235 K236 D238	R171-F173 PolarHBondContact O-N 2.86Å; R171-A174 WeakPolarHBondContact O-CB 2.99Å; R171-A174 PolarHBondContact O-N 3.4Å; R171-L235 PolarHBondContact N-O 2.85Å; R171-K236 HydrophobicContact CB-CB 4.26Å; R171-K236 PolarHBondContact NE-O 3.32Å; R171-K236 VanDerWaalsContact NE-O 3.08Å; R171-K236 PolarHBondContact NH2-O 2.97Å; R171-D238 IonicContact CZ-OD1 3.84Å; R171-D238 IonicContact CZ-OD2 2.73Å; R171-D238 IonicContact NH1-OD2 3.51Å; R171-D238 PolarHBondContact NH1-OD2 3.15Å; R171-D238 IonicContact NH2-OD1 3.92Å; R171-D238 PolarHBondContact NH2-OD1 2.83Å; R171-D238 IonicContact NH2-OD2 3.56Å; R171-D238 PolarHBondContact NH2-OD2 2.94Å
172	Y	89.8	Confident	80.8	Confident	59 Å²	59	72.5 Å²	72.5	23%	0.231	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-50.6	-42	166.7	174.3	-89.4	0	0	0	111.9	M170 A174 Y176 F234 L235	M170-Y172 PolarHBondContact O-N 2.81Å; Y172-A174 VanDerWaalsContact C-N 3.28Å; Y172-A174 PolarHBondContact O-N 2.75Å; Y172-Y176 HydrophobicContact CD1-CE2 4.36Å; Y172-Y176 HydrophobicContact CE1-CD2 4.25Å; Y172-Y176 AromaticContact CE1-CE2 3.85Å; Y172-Y176 HydrophobicContact CE1-CE2 3.85Å; Y172-Y176 HydrophobicContact CE2-CE2 4.15Å; Y172-Y176 AromaticContact CZ-CE2 3.72Å; Y172-Y176 WeakPolarHBondContact O-CD2 3.24Å; Y172-F234 HydrophobicContact CD2-CE1 4.28Å; Y172-F234 HydrophobicContact CD2-CZ 4.48Å; Y172-F234 WeakPolarHBondContact CD2-O 3.01Å; Y172-F234 HydrophobicContact CE1-CE1 4.37Å; Y172-F234 AromaticContact CE2-CE1 3.9Å; Y172-F234 HydrophobicContact CE2-CE1 3.9Å; Y172-F234 HydrophobicContact CE2-CE2 4.41Å; Y172-F234 AromaticContact CE2-CZ 3.76Å; Y172-F234 HydrophobicContact CE2-CZ 3.76Å; Y172-F234 AromaticContact CZ-CE1 3.96Å; Y172-F234 AromaticContact CZ-CZ 3.92Å; Y172-L235 WeakPolarHBondContact CB-O 3.47Å; Y172-L235 HydrophobicContact CD1-CD2 4.21Å; Y172-L235 HydrophobicContact CG-CD2 4.37Å; Y172-L235 PolarHBondContact N-O 3.47Å; Y172-L235 VanDerWaalsContact N-O 3.15Å
173	F	87.4	Confident	79.5	Confident	12 Å²	12	78.3 Å²	78.3	5%	0.053	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-73.9	-15.8	179.3	-62.2	-67.7	0	0	0	113.7	L166 M170 R171 E175 Y176 L177 I189 L235	L166-F173 HydrophobicContact CD1-CD2 3.76Å; L166-F173 HydrophobicContact CD1-CE2 3.95Å; L166-F173 HydrophobicContact CD2-CD2 4.19Å; L166-F173 HydrophobicContact CD2-CG 4.33Å; L166-F173 HydrophobicContact CG-CB 4.45Å; L166-F173 HydrophobicContact CG-CD2 3.86Å; L166-F173 HydrophobicContact CG-CE2 4.48Å; L166-F173 HydrophobicContact CG-CG 4.34Å; M170-F173 HydrophobicContact CB-CD2 3.81Å; M170-F173 HydrophobicContact CB-CE2 4.18Å; M170-F173 PolarHBondContact O-N 2.93Å; M170-F173 HydrophobicContact SD-CD2 4.38Å; M170-F173 HydrophobicContact SD-CE2 3.91Å; R171-F173 PolarHBondContact O-N 2.86Å; F173-E175 PolarHBondContact O-N 2.77Å; F173-Y176 PolarHBondContact O-N 2.79Å; F173-L177 HydrophobicContact CB-CD1 3.85Å; F173-L177 HydrophobicContact CB-CG 4.33Å; F173-L177 WeakPolarHBondContact O-CB 3.13Å; F173-L177 WeakPolarHBondContact O-CG 3.31Å; F173-L177 PolarHBondContact O-N 3.08Å; F173-I189 HydrophobicContact CD1-CG2 4.4Å; F173-I189 HydrophobicContact CE1-CG2 3.63Å; F173-I189 HydrophobicContact CZ-CG2 4.22Å; F173-L235 HydrophobicContact CE2-CD2 3.76Å; F173-L235 HydrophobicContact CZ-CD2 3.95Å
174	A	85	Confident	78.5	Confident	46 Å²	46	78.4 Å²	78.4	38%	0.38	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-64.6	-28.9	178.2	0	0	0	0	0	112.8	V167 R171 Y172 Y176	V167-A174 HydrophobicContact CG1-CB 3.84Å; R171-A174 WeakPolarHBondContact O-CB 2.99Å; R171-A174 PolarHBondContact O-N 3.4Å; Y172-A174 VanDerWaalsContact C-N 3.28Å; Y172-A174 PolarHBondContact O-N 2.75Å; A174-Y176 VanDerWaalsContact C-N 3.3Å; A174-Y176 PolarHBondContact O-N 2.8Å
175	E	80.3	Confident	77.5	Confident	119 Å²	119	81.7 Å²	81.7	56%	0.556	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-74.1	-19.2	178.1	-78	155.3	-147.7	0	0	113.1	F173 K236	F173-E175 PolarHBondContact O-N 2.77Å; E175-K236 IonicContact OE1-NZ 3.5Å; E175-K236 PolarHBondContact OE1-NZ 2.7Å; E175-K236 IonicContact OE2-NZ 3.79Å; E175-K236 PolarHBondContact OE2-NZ 2.8Å
176	Y	80.1	Confident	76.5	Confident	141 Å²	141	87.8 Å²	87.8	55%	0.553	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.6	-34.8	-177.4	-58.2	-81.9	0	0	0	112.9	Y172 F173 A174 S178	Y172-Y176 HydrophobicContact CD1-CE2 4.36Å; Y172-Y176 HydrophobicContact CE1-CD2 4.25Å; Y172-Y176 AromaticContact CE1-CE2 3.85Å; Y172-Y176 HydrophobicContact CE1-CE2 3.85Å; Y172-Y176 HydrophobicContact CE2-CE2 4.15Å; Y172-Y176 AromaticContact CZ-CE2 3.72Å; Y172-Y176 WeakPolarHBondContact O-CD2 3.24Å; F173-Y176 PolarHBondContact O-N 2.79Å; A174-Y176 VanDerWaalsContact C-N 3.3Å; A174-Y176 PolarHBondContact O-N 2.8Å; Y176-S178 VanDerWaalsContact C-N 3.32Å; Y176-S178 PolarHBondContact O-N 3.49Å
177	L	77.3	Confident	75.9	Confident	7 Å²	7	90.5 Å²	90.5	4%	0.037	43%	0.434	C	S	.	.	S	Bend	trans	-87.1	65.4	-176.6	-61.3	178	0	0	0	112	M144 R163 L166 V167 F173 V187 I189	M144-L177 HydrophobicContact CE-CD2 3.81Å; M144-L177 HydrophobicContact SD-CD1 3.55Å; M144-L177 VanDerWaalsContact SD-CD1 3.55Å; M144-L177 HydrophobicContact SD-CD2 3.65Å; M144-L177 HydrophobicContact SD-CG 4.24Å; R163-L177 HydrophobicContact CG-CD1 4.43Å; R163-L177 PolarHBondContact NH2-O 3.49Å; L166-L177 HydrophobicContact CD2-CD1 4.1Å; V167-L177 HydrophobicContact CG2-CB 4.08Å; V167-L177 HydrophobicContact CG2-CD1 3.89Å; F173-L177 HydrophobicContact CB-CD1 3.85Å; F173-L177 HydrophobicContact CB-CG 4.33Å; F173-L177 WeakPolarHBondContact O-CB 3.13Å; F173-L177 WeakPolarHBondContact O-CG 3.31Å; F173-L177 PolarHBondContact O-N 3.08Å; L177-V187 HydrophobicContact CD2-CG1 3.95Å; L177-I189 HydrophobicContact CD2-CD1 4.39Å
178	S	66.3	Low	75.5	Confident	68 Å²	68	94.3 Å²	94.3	48%	0.476	45%	0.453	S	S	.	.			trans	-56.8	169.2	-179	-55.1	0	0	0	0	114.8	R163 Y176 D180 W184	R163-S178 PolarHBondContact NH2-O 2.86Å; Y176-S178 VanDerWaalsContact C-N 3.32Å; Y176-S178 PolarHBondContact O-N 3.49Å; S178-D180 VanDerWaalsContact C-N 3.29Å; S178-D180 PolarHBondContact O-N 3.41Å; S178-W184 PolarHBondContact O-NE1 2.82Å
179	V	59.2	Low	75.5	Confident	128 Å²	128	88.4 Å²	88.4	78%	0.776	43%	0.428	S	S	*	.	S	Bend	trans	-67.8	-20.8	-170.8	-173.3	0	0	0	0	114.2	Q181 W184	V179-Q181 PolarHBondContact O-N 2.86Å; V179-Q181 VanDerWaalsContact O-N 3.11Å; V179-W184 WeakPolarHBondContact O-CZ2 3.27Å
180	D	64.3	Low	75.4	Confident	97 Å²	97	90.5 Å²	90.5	52%	0.519	45%	0.445	S	S	.	.			trans	-72.7	100.9	-174.5	-63.7	-34.8	0	0	0	113.6	S178 Q182 R183 W184	S178-D180 VanDerWaalsContact C-N 3.29Å; S178-D180 PolarHBondContact O-N 3.41Å; D180-Q182 PolarHBondContact O-N 3.21Å; D180-Q182 VanDerWaalsContact O-N 3.09Å; D180-R183 PolarHBondContact O-N 3.35Å; D180-R183 VanDerWaalsContact O-N 3.08Å; D180-W184 PolarHBondContact O-NE1 3.2Å; D180-W184 VanDerWaalsContact O-NE1 3.16Å
181	Q	62.5	Low	75.3	Confident	138 Å²	138	91.9 Å²	91.9	65%	0.645	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-47.9	-38.6	-179.6	-80.7	176.9	-19.7	0	0	114.7	V179 R183 W184	V179-Q181 PolarHBondContact O-N 2.86Å; V179-Q181 VanDerWaalsContact O-N 3.11Å; Q181-R183 PolarHBondContact O-N 2.87Å; Q181-W184 HydrophobicContact CB-CH2 4.4Å; Q181-W184 HydrophobicContact CB-CZ2 4.46Å; Q181-W184 HydrophobicContact CG-CE3 4.29Å; Q181-W184 HydrophobicContact CG-CH2 3.41Å; Q181-W184 VanDerWaalsContact CG-CH2 3.41Å; Q181-W184 HydrophobicContact CG-CZ2 3.81Å; Q181-W184 HydrophobicContact CG-CZ3 3.7Å; Q181-W184 PolarHBondContact O-N 3.47Å
182	Q	60.6	Low	75.3	Confident	184 Å²	184	92.6 Å²	92.6	86%	0.86	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-67.9	-16.8	-176	-68.9	-171.3	-53.6	0	0	114.4	D180	D180-Q182 PolarHBondContact O-N 3.21Å; D180-Q182 VanDerWaalsContact O-N 3.09Å
183	R	62.9	Low	75.3	Confident	162 Å²	162	91.3 Å²	91.3	61%	0.611	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-89	-13.1	177.9	-68.3	-172.3	-178.7	-178.1	3.7	113.7	D180 Q181 E185 E186 V187	D180-R183 PolarHBondContact O-N 3.35Å; D180-R183 VanDerWaalsContact O-N 3.08Å; Q181-R183 PolarHBondContact O-N 2.87Å; R183-E185 VanDerWaalsContact C-N 3.3Å; R183-E185 PolarHBondContact O-N 3.47Å; R183-E186 PolarHBondContact O-N 3.4Å; R183-E186 VanDerWaalsContact O-N 3.14Å; R183-V187 WeakPolarHBondContact O-CG2 3.47Å
184	W	64.3	Low	75.5	Confident	37 Å²	37	93.1 Å²	93.1	14%	0.14	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-72.7	-24.6	-171.1	-54.5	-13.6	0	0	0	113.2	L142 R163 S178 V179 D180 Q181 E186	L142-W184 HydrophobicContact CD1-CE3 3.88Å; L142-W184 HydrophobicContact CD1-CZ3 3.8Å; R163-W184 VanDerWaalsContact CZ-CZ2 3.45Å; R163-W184 VanDerWaalsContact NH1-CH2 3.28Å; R163-W184 VanDerWaalsContact NH2-CZ2 3.29Å; S178-W184 PolarHBondContact O-NE1 2.82Å; V179-W184 WeakPolarHBondContact O-CZ2 3.27Å; D180-W184 PolarHBondContact O-NE1 3.2Å; D180-W184 VanDerWaalsContact O-NE1 3.16Å; Q181-W184 HydrophobicContact CB-CH2 4.4Å; Q181-W184 HydrophobicContact CB-CZ2 4.46Å; Q181-W184 HydrophobicContact CG-CE3 4.29Å; Q181-W184 HydrophobicContact CG-CH2 3.41Å; Q181-W184 VanDerWaalsContact CG-CH2 3.41Å; Q181-W184 HydrophobicContact CG-CZ2 3.81Å; Q181-W184 HydrophobicContact CG-CZ3 3.7Å; Q181-W184 PolarHBondContact O-N 3.47Å; W184-E186 VanDerWaalsContact C-N 3.27Å
185	E	65.8	Low	75.9	Confident	184 Å²	184	91.2 Å²	91.2	86%	0.86	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-77.3	-12.7	173.9	-61.2	-175.8	167	0	0	112.7	R183	R183-E185 VanDerWaalsContact C-N 3.3Å; R183-E185 PolarHBondContact O-N 3.47Å
186	E	66.2	Low	76.4	Confident	159 Å²	159	91.9 Å²	91.9	74%	0.743	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-96.6	-8.7	176.9	-58.4	-175.2	145.4	0	0	113.3	R183 W184 D188	R183-E186 PolarHBondContact O-N 3.4Å; R183-E186 VanDerWaalsContact O-N 3.14Å; W184-E186 VanDerWaalsContact C-N 3.27Å; E186-D188 PolarHBondContact O-N 3.44Å
187	V	75.5	Confident	77.1	Confident	57 Å²	57	85.9 Å²	85.9	35%	0.345	44%	0.435	S	S	.	.			trans	-92.5	95.9	-175.4	175.9	0	0	0	0	111.3	M144 L177 R183 I189	M144-V187 HydrophobicContact CE-CB 4.43Å; M144-V187 HydrophobicContact CE-CG1 4.44Å; L177-V187 HydrophobicContact CD2-CG1 3.95Å; R183-V187 WeakPolarHBondContact O-CG2 3.47Å; V187-I189 HydrophobicContact CG1-CD1 4.47Å; V187-I189 HydrophobicContact CG1-CG1 3.89Å
188	D	80.5	Confident	77.9	Confident	117 Å²	117	85.7 Å²	85.7	63%	0.626	43%	0.434	S	S	*	.			trans	-73.4	125.3	163.7	179.8	5.7	0	0	0	110.2	H147 E186	H147-D188 IonicContact CD2-OD1 2.75Å; H147-D188 PolarHBondContact CD2-OD1 2.86Å; E186-D188 PolarHBondContact O-N 3.44Å
189	I	86.4	Confident	79.2	Confident	14 Å²	14	85.5 Å²	85.5	7%	0.072	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	97.1	178	-49.9	180	0	0	0	109.2	M144 I146 H147 L166 F173 L177 V187 V191	M144-I189 HydrophobicContact CE-CD1 3.91Å; M144-I189 HydrophobicContact SD-CD1 4.1Å; I146-I189 CarbonylContact C-O 3.54Å; I146-I189 WeakPolarHBondContact CA-O 3.35Å; I146-I189 HydrophobicContact CG1-CB 4.39Å; I146-I189 HydrophobicContact CG1-CD1 4.47Å; I146-I189 HydrophobicContact CG1-CG2 4.28Å; I146-I189 HydrophobicContact CG2-CG2 4.01Å; H147-I189 PolarHBondContact N-O 3.26Å; L166-I189 HydrophobicContact CD2-CD1 4.46Å; F173-I189 HydrophobicContact CD1-CG2 4.4Å; F173-I189 HydrophobicContact CE1-CG2 3.63Å; F173-I189 HydrophobicContact CZ-CG2 4.22Å; L177-I189 HydrophobicContact CD2-CD1 4.39Å; V187-I189 HydrophobicContact CG1-CD1 4.47Å; V187-I189 HydrophobicContact CG1-CG1 3.89Å; I189-V191 HydrophobicContact CG2-CG2 4.32Å
190	S	88.4	Confident	80.8	Confident	70 Å²	70	80.6 Å²	80.6	49%	0.49	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	137	170.4	47.1	0	0	0	0	112	H147	H147-S190 WeakPolarHBondContact O-CA 3.37Å
191	V	89	Confident	82.2	Confident	29 Å²	29	76 Å²	76	18%	0.176	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	125.9	-178.9	-177	0	0	0	0	109.7	I146 H147 V148 C149 I189 C193 F198	I146-V191 HydrophobicContact CG2-CB 4.45Å; I146-V191 HydrophobicContact CG2-CG2 3.66Å; H147-V191 PolarHBondContact O-N 3.37Å; V148-V191 CarbonylContact C-O 3.56Å; V148-V191 WeakPolarHBondContact CA-O 3.38Å; V148-V191 HydrophobicContact CG2-CB 4.47Å; C149-V191 PolarHBondContact N-O 3.27Å; I189-V191 HydrophobicContact CG2-CG2 4.32Å; V191-C193 HydrophobicContact CG1-CB 4.44Å; V191-F198 HydrophobicContact CG1-CD2 4.32Å; V191-F198 HydrophobicContact CG1-CE2 4.19Å; V191-F198 HydrophobicContact CG2-CE2 4.39Å
192	H	89.3	Confident	83.6	Confident	117 Å²	117	69.6 Å²	69.6	54%	0.542	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	95.8	-178.9	-71.4	-123.5	0	0	0	109.8	C149 E151	C149-H192 WeakPolarHBondContact O-CA 3.37Å; E151-H192 IonicContact OE1-CE1 3.47Å; E151-H192 PolarHBondContact OE1-CE1 3.31Å; E151-H192 IonicContact OE1-CG 2.74Å; E151-H192 IonicContact OE1-ND1 3.62Å; E151-H192 PolarHBondContact OE1-ND1 3.42Å
193	C	90.3	Very high	85	Confident	32 Å²	32	64.1 Å²	64.1	22%	0.216	32%	0.317	C	S	.	.	S	Bend	trans	-160.2	176	-179.3	69.2	0	0	0	0	112	C149 D150 V191 V195	C149-C193 CarbonylContact C-O 3.58Å; C149-C193 PolarHBondContact O-N 3Å; C149-C193 VanDerWaalsContact O-N 3.16Å; D150-C193 VanDerWaalsContact CA-O 3.3Å; D150-C193 WeakPolarHBondContact CA-O 3.46Å; D150-C193 WeakPolarHBondContact CB-O 3.48Å; V191-C193 HydrophobicContact CG1-CB 4.44Å; C193-V195 PolarHBondContact O-N 2.93Å
194	D	91.4	Very high	86.4	Confident	50 Å²	50	56.5 Å²	56.5	27%	0.267	29%	0.288	S	S	.	.			trans	-63.8	115.8	173.1	-173.9	-28.2	0	0	0	110.7	K153 Q196 I197 F198	K153-D194 IonicContact NZ-OD1 3.62Å; K153-D194 PolarHBondContact NZ-OD1 3.13Å; K153-D194 IonicContact NZ-OD2 2.7Å; K153-D194 PolarHBondContact NZ-OD2 2.87Å; D194-Q196 PolarHBondContact O-N 3.29Å; D194-Q196 VanDerWaalsContact O-N 3.17Å; D194-Q196 WeakPolarHBondContact OD1-CB 3.32Å; D194-Q196 PolarHBondContact OD1-N 3.16Å; D194-I197 HydrophobicContact CB-CB 4.17Å; D194-I197 HydrophobicContact CB-CG1 3.82Å; D194-I197 PolarHBondContact O-N 3.41Å; D194-F198 PolarHBondContact O-N 3.31Å
195	V	93.1	Very high	87.6	Confident	6 Å²	6	54.7 Å²	54.7	4%	0.036	28%	0.282	C	S	.	.	H	α-helix	trans	-55.2	-33	-179.8	164.9	0	0	0	0	112.4	V148 D150 L155 Q157 F159 C193 F198 D199	V148-V195 HydrophobicContact CB-CG2 4.22Å; V148-V195 HydrophobicContact CG1-CG2 3.73Å; D150-V195 HydrophobicContact CB-CB 4.49Å; D150-V195 HydrophobicContact CB-CG2 3.93Å; L155-V195 HydrophobicContact CB-CG2 4.39Å; Q157-V195 HydrophobicContact CB-CG1 3.73Å; Q157-V195 HydrophobicContact CB-CG2 4.3Å; Q157-V195 HydrophobicContact CG-CG1 4.35Å; Q157-V195 VanDerWaalsContact OE1-CG1 3.25Å; F159-V195 HydrophobicContact CE2-CG1 4.38Å; F159-V195 HydrophobicContact CZ-CG1 4.23Å; C193-V195 PolarHBondContact O-N 2.93Å; V195-F198 PolarHBondContact O-N 2.99Å; V195-D199 WeakPolarHBondContact O-CB 3.49Å; V195-D199 PolarHBondContact O-N 3.22Å
196	Q	92.1	Very high	88.6	Confident	132 Å²	132	51.2 Å²	51.2	62%	0.617	26%	0.261	S	S	*	.	H	α-helix	trans	-74.6	-30.7	179.6	-60.1	178.1	-57.5	0	0	112.1	D194 W200	D194-Q196 PolarHBondContact O-N 3.29Å; D194-Q196 VanDerWaalsContact O-N 3.17Å; D194-Q196 WeakPolarHBondContact OD1-CB 3.32Å; D194-Q196 PolarHBondContact OD1-N 3.16Å; Q196-W200 PolarHBondContact O-N 3.04Å
197	I	93.6	Very high	89.4	Confident	16 Å²	16	47.1 Å²	47.1	8%	0.082	24%	0.238	C	C	.	.	H	α-helix	trans	-74.3	-38.9	172.7	-58.2	-61.2	0	0	0	109.8	D194 W200 L201 N224 I228	D194-I197 HydrophobicContact CB-CB 4.17Å; D194-I197 HydrophobicContact CB-CG1 3.82Å; D194-I197 PolarHBondContact O-N 3.41Å; I197-W200 WeakPolarHBondContact O-CB 3.29Å; I197-W200 PolarHBondContact O-N 3.4Å; I197-L201 HydrophobicContact CG2-CD1 4.3Å; I197-L201 VanDerWaalsContact O-CG 3.28Å; I197-L201 WeakPolarHBondContact O-CG 3.45Å; I197-L201 PolarHBondContact O-N 3.47Å; I197-N224 HydrophobicContact CD1-CB 4.04Å; I197-I228 HydrophobicContact CD1-CG1 4.3Å; I197-I228 HydrophobicContact CG2-CG1 4.12Å
198	F	93.9	Very high	89.3	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.009	25%	0.249	C	C	.	.	H	α-helix	trans	-66.8	-40.6	175.7	-156.2	-88.5	0	0	0	112.6	I146 V148 F159 V191 D194 V195 W200 L201 M202 L235	I146-F198 HydrophobicContact CB-CE1 4.46Å; I146-F198 HydrophobicContact CB-CZ 4.49Å; I146-F198 HydrophobicContact CD1-CE1 4.35Å; I146-F198 HydrophobicContact CD1-CZ 4.03Å; I146-F198 HydrophobicContact CG2-CE1 4.08Å; I146-F198 HydrophobicContact CG2-CZ 3.78Å; V148-F198 HydrophobicContact CG1-CB 4.04Å; V148-F198 HydrophobicContact CG1-CG 4.31Å; V148-F198 HydrophobicContact CG2-CB 4.11Å; V148-F198 HydrophobicContact CG2-CD1 3.44Å; V148-F198 VanDerWaalsContact CG2-CD1 3.44Å; V148-F198 HydrophobicContact CG2-CD2 4.09Å; V148-F198 HydrophobicContact CG2-CE1 3.8Å; V148-F198 HydrophobicContact CG2-CE2 4.42Å; V148-F198 HydrophobicContact CG2-CG 3.59Å; V148-F198 HydrophobicContact CG2-CZ 4.29Å; F159-F198 HydrophobicContact CB-CD1 4.41Å; F159-F198 HydrophobicContact CB-CE1 4.11Å; F159-F198 HydrophobicContact CD1-CD1 4.31Å; F159-F198 AromaticContact CD2-CD1 3.72Å; F159-F198 HydrophobicContact CD2-CD1 3.72Å; F159-F198 HydrophobicContact CD2-CE1 4.16Å; F159-F198 AromaticContact CE2-CD1 3.95Å; F159-F198 HydrophobicContact CE2-CD1 3.95Å; F159-F198 AromaticContact CG-CD1 3.89Å; F159-F198 HydrophobicContact CG-CD1 3.89Å; F159-F198 HydrophobicContact CG-CE1 4.1Å; F159-F198 HydrophobicContact CZ-CD1 4.34Å; V191-F198 HydrophobicContact CG1-CD2 4.32Å; V191-F198 HydrophobicContact CG1-CE2 4.19Å; V191-F198 HydrophobicContact CG2-CE2 4.39Å; D194-F198 PolarHBondContact O-N 3.31Å; V195-F198 PolarHBondContact O-N 2.99Å; F198-W200 PolarHBondContact O-N 3.36Å; F198-L201 WeakPolarHBondContact O-CB 3.43Å; F198-L201 PolarHBondContact O-N 3.13Å; F198-L201 VanDerWaalsContact O-N 3.16Å; F198-M202 HydrophobicContact CD1-CG 3.6Å; F198-M202 HydrophobicContact CD1-SD 4.27Å; F198-M202 HydrophobicContact CE1-CG 3.45Å; F198-M202 VanDerWaalsContact CE1-CG 3.45Å; F198-M202 HydrophobicContact CE1-SD 3.52Å; F198-M202 VanDerWaalsContact CE1-SD 3.52Å; F198-M202 HydrophobicContact CZ-CG 4.43Å; F198-M202 HydrophobicContact CZ-SD 4.03Å; F198-M202 WeakPolarHBondContact O-CG 3.19Å; F198-M202 PolarHBondContact O-N 3.01Å; F198-L235 HydrophobicContact CE2-CD1 4.47Å
199	D	92.9	Very high	89	Confident	65 Å²	65	46.7 Å²	46.7	35%	0.348	24%	0.239	S	C	.	.	H	α-helix	trans	-57.9	-46.1	172.2	-178.5	76.2	0	0	0	112	F159 V195 L201 M202 N203	F159-D199 HydrophobicContact CE1-CB 3.78Å; F159-D199 HydrophobicContact CZ-CB 3.9Å; V195-D199 WeakPolarHBondContact O-CB 3.49Å; V195-D199 PolarHBondContact O-N 3.22Å; D199-L201 VanDerWaalsContact C-N 3.3Å; D199-L201 PolarHBondContact O-N 3.14Å; D199-M202 PolarHBondContact O-N 3.32Å; D199-N203 WeakPolarHBondContact O-CB 3.28Å; D199-N203 PolarHBondContact O-N 3.47Å; D199-N203 PolarHBondContact O-ND2 3.03Å; D199-N203 PolarHBondContact OD2-ND2 3.49Å
200	W	94.4	Very high	87.5	Confident	24 Å²	24	51.6 Å²	51.6	9%	0.091	28%	0.281	C	S	.	.	H	α-helix	trans	-56	-44.8	173.9	-168.5	109.3	0	0	0	111.7	Q196 I197 F198 N203 Y204 P218 R219 L220 I228 L240	Q196-W200 PolarHBondContact O-N 3.04Å; I197-W200 WeakPolarHBondContact O-CB 3.29Å; I197-W200 PolarHBondContact O-N 3.4Å; F198-W200 PolarHBondContact O-N 3.36Å; W200-N203 PolarHBondContact O-N 3.12Å; W200-Y204 AromaticContact CH2-CD2 3.72Å; W200-Y204 HydrophobicContact CH2-CD2 3.72Å; W200-Y204 HydrophobicContact CH2-CE2 4.39Å; W200-Y204 HydrophobicContact CH2-CG 4.33Å; W200-Y204 AromaticContact CZ3-CD2 3.78Å; W200-Y204 HydrophobicContact CZ3-CD2 3.78Å; W200-Y204 AromaticContact CZ3-CG 3.93Å; W200-Y204 HydrophobicContact CZ3-CG 3.93Å; W200-Y204 PolarHBondContact O-N 2.85Å; W200-P218 HydrophobicContact CD2-CB 4.06Å; W200-P218 HydrophobicContact CD2-CG 4.18Å; W200-P218 HydrophobicContact CE3-CG 4.42Å; W200-P218 HydrophobicContact CG-CB 4.25Å; W200-P218 HydrophobicContact CH2-CG 4.26Å; W200-P218 HydrophobicContact CZ2-CB 4.01Å; W200-P218 HydrophobicContact CZ2-CG 4.04Å; W200-P218 VanDerWaalsContact CZ2-O 3.27Å; W200-P218 WeakPolarHBondContact CZ2-O 3.36Å; W200-P218 HydrophobicContact CZ3-CG 4.45Å; W200-R219 PolarHBondContact NE1-O 3.01Å; W200-L220 HydrophobicContact CH2-CD2 3.6Å; W200-L220 HydrophobicContact CH2-CG 4.23Å; W200-L220 HydrophobicContact CZ2-CD2 3.49Å; W200-L220 VanDerWaalsContact CZ2-CD2 3.49Å; W200-L220 HydrophobicContact CZ2-CG 3.99Å; W200-L220 HydrophobicContact CZ3-CD2 4.49Å; W200-I228 HydrophobicContact CD2-CD1 3.51Å; W200-I228 HydrophobicContact CD2-CG1 4.2Å; W200-I228 HydrophobicContact CE3-CD1 3.85Å; W200-I228 HydrophobicContact CE3-CG1 4.14Å; W200-I228 HydrophobicContact CE3-CG2 3.9Å; W200-I228 HydrophobicContact CG-CD1 3.92Å; W200-I228 HydrophobicContact CH2-CD1 4.36Å; W200-I228 HydrophobicContact CH2-CG2 4.2Å; W200-I228 HydrophobicContact CZ2-CD1 4.02Å; W200-I228 HydrophobicContact CZ3-CD1 4.27Å; W200-I228 HydrophobicContact CZ3-CG2 3.66Å; W200-L240 HydrophobicContact CH2-CD1 3.73Å; W200-L240 HydrophobicContact CZ3-CD1 3.71Å; W200-L240 HydrophobicContact CZ3-CD2 3.84Å; W200-L240 HydrophobicContact CZ3-CG 4.46Å
201	L	93.8	Very high	85.9	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-65.1	-40.6	177.7	-68.9	168.6	0	0	0	112.4	M170 I197 F198 D199 Y204 V205 I228 L235 M237 L240	M170-L201 HydrophobicContact CE-CB 3.85Å; I197-L201 HydrophobicContact CG2-CD1 4.3Å; I197-L201 VanDerWaalsContact O-CG 3.28Å; I197-L201 WeakPolarHBondContact O-CG 3.45Å; I197-L201 PolarHBondContact O-N 3.47Å; F198-L201 WeakPolarHBondContact O-CB 3.43Å; F198-L201 PolarHBondContact O-N 3.13Å; F198-L201 VanDerWaalsContact O-N 3.16Å; D199-L201 VanDerWaalsContact C-N 3.3Å; D199-L201 PolarHBondContact O-N 3.14Å; L201-Y204 WeakPolarHBondContact O-CB 3.46Å; L201-Y204 PolarHBondContact O-N 3.44Å; L201-V205 WeakPolarHBondContact O-CG2 3.45Å; L201-V205 PolarHBondContact O-N 2.72Å; L201-I228 HydrophobicContact CD2-CG2 4.13Å; L201-L235 HydrophobicContact CD1-CD1 4.13Å; L201-M237 HydrophobicContact CD2-CE 4.42Å; L201-M237 HydrophobicContact CD2-SD 3.97Å; L201-L240 HydrophobicContact CD2-CD2 3.4Å; L201-L240 VanDerWaalsContact CD2-CD2 3.4Å
202	M	90.9	Very high	84.2	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.02	32%	0.323	C	S	.	.	H	α-helix	trans	-66.6	-39	176.8	-70.1	-51	-55.7	0	0	112.1	F159 C161 M170 F198 D199 Y204 V205 R206	F159-M202 HydrophobicContact CB-CG 4.18Å; F159-M202 HydrophobicContact CD1-CB 4.19Å; F159-M202 HydrophobicContact CD1-CG 3.77Å; F159-M202 HydrophobicContact CE1-CG 4.45Å; F159-M202 HydrophobicContact CG-CG 4.13Å; C161-M202 HydrophobicContact CB-CE 3.63Å; M170-M202 HydrophobicContact CE-SD 4.18Å; F198-M202 HydrophobicContact CD1-CG 3.6Å; F198-M202 HydrophobicContact CD1-SD 4.27Å; F198-M202 HydrophobicContact CE1-CG 3.45Å; F198-M202 VanDerWaalsContact CE1-CG 3.45Å; F198-M202 HydrophobicContact CE1-SD 3.52Å; F198-M202 VanDerWaalsContact CE1-SD 3.52Å; F198-M202 HydrophobicContact CZ-CG 4.43Å; F198-M202 HydrophobicContact CZ-SD 4.03Å; F198-M202 WeakPolarHBondContact O-CG 3.19Å; F198-M202 PolarHBondContact O-N 3.01Å; D199-M202 PolarHBondContact O-N 3.32Å; M202-Y204 VanDerWaalsContact C-N 3.32Å; M202-V205 PolarHBondContact O-N 3.13Å; M202-R206 WeakPolarHBondContact O-CB 3.49Å; M202-R206 VanDerWaalsContact O-CG 3.32Å; M202-R206 WeakPolarHBondContact O-CG 3.35Å; M202-R206 PolarHBondContact O-N 2.96Å
203	N	90.4	Very high	82.1	Confident	69 Å²	69	56.1 Å²	56.1	37%	0.369	33%	0.332	S	S	.	.	H	α-helix	trans	-65.7	-34.9	172.4	-70.4	-42.8	0	0	0	111.7	D199 W200 R207 P218	D199-N203 WeakPolarHBondContact O-CB 3.28Å; D199-N203 PolarHBondContact O-N 3.47Å; D199-N203 PolarHBondContact O-ND2 3.03Å; D199-N203 PolarHBondContact OD2-ND2 3.49Å; W200-N203 PolarHBondContact O-N 3.12Å; N203-R207 PolarHBondContact O-N 3Å; N203-P218 HydrophobicContact CB-CG 4.28Å
204	Y	91.6	Very high	80.2	Confident	1 Å²	1	62.6 Å²	62.6	0%	0.004	37%	0.365	C	S	.	.	H	α-helix	trans	-68	-43.6	172.6	-177.1	-86.1	0	0	0	112.1	W200 L201 M202 R206 R207 P218 M237 T239 L240 E243	W200-Y204 AromaticContact CH2-CD2 3.72Å; W200-Y204 HydrophobicContact CH2-CD2 3.72Å; W200-Y204 HydrophobicContact CH2-CE2 4.39Å; W200-Y204 HydrophobicContact CH2-CG 4.33Å; W200-Y204 AromaticContact CZ3-CD2 3.78Å; W200-Y204 HydrophobicContact CZ3-CD2 3.78Å; W200-Y204 AromaticContact CZ3-CG 3.93Å; W200-Y204 HydrophobicContact CZ3-CG 3.93Å; W200-Y204 PolarHBondContact O-N 2.85Å; L201-Y204 WeakPolarHBondContact O-CB 3.46Å; L201-Y204 PolarHBondContact O-N 3.44Å; M202-Y204 VanDerWaalsContact C-N 3.32Å; Y204-R206 VanDerWaalsContact C-N 3.32Å; Y204-R206 PolarHBondContact O-N 3Å; Y204-R207 VanDerWaalsContact CE1-NH2 3.33Å; Y204-R207 VanDerWaalsContact O-CB 3.24Å; Y204-R207 WeakPolarHBondContact O-CB 3.28Å; Y204-R207 WeakPolarHBondContact O-CD 3.23Å; Y204-R207 WeakPolarHBondContact O-CG 3.47Å; Y204-R207 PolarHBondContact O-N 3.05Å; Y204-R207 PolarHBondContact O-NE 3.42Å; Y204-R207 PolarHBondContact OH-NH1 2.91Å; Y204-R207 PolarHBondContact OH-NH2 3.3Å; Y204-P218 HydrophobicContact CD2-CG 4.42Å; Y204-M237 HydrophobicContact CD1-CE 4.03Å; Y204-M237 HydrophobicContact CE1-CE 4.39Å; Y204-T239 PolarHBondContact OH-OG1 2.83Å; Y204-L240 HydrophobicContact CD1-CB 4.45Å; Y204-L240 HydrophobicContact CD1-CD2 4Å; Y204-L240 HydrophobicContact CD2-CD1 4.07Å; Y204-L240 HydrophobicContact CE1-CB 3.7Å; Y204-L240 HydrophobicContact CE1-CD1 4.35Å; Y204-L240 HydrophobicContact CE1-CD2 4.08Å; Y204-L240 HydrophobicContact CE1-CG 4.26Å; Y204-L240 HydrophobicContact CE2-CB 4.44Å; Y204-L240 HydrophobicContact CE2-CD1 3.7Å; Y204-L240 HydrophobicContact CE2-CG 4.47Å; Y204-L240 HydrophobicContact CG-CD2 4.25Å; Y204-L240 WeakPolarHBondContact OH-CA 3.4Å; Y204-L240 PolarHBondContact OH-N 2.81Å; Y204-E243 PolarHBondContact OH-OE1 3.07Å
205	V	89.5	Confident	78.3	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-60.8	-41.3	175.8	166.4	0	0	0	0	111.3	L165 E169 M170 L201 M202 R207 M237	L165-V205 HydrophobicContact CD1-CG1 4.26Å; L165-V205 HydrophobicContact CD2-CG1 3.92Å; L165-V205 HydrophobicContact CG-CG1 3.68Å; E169-V205 HydrophobicContact CB-CB 4.49Å; E169-V205 HydrophobicContact CB-CG1 4.18Å; E169-V205 HydrophobicContact CB-CG2 3.92Å; E169-V205 HydrophobicContact CG-CG1 4.25Å; M170-V205 HydrophobicContact CE-CG2 3.79Å; M170-V205 HydrophobicContact CG-CG2 4.03Å; M170-V205 HydrophobicContact SD-CG2 4.32Å; L201-V205 WeakPolarHBondContact O-CG2 3.45Å; L201-V205 PolarHBondContact O-N 2.72Å; M202-V205 PolarHBondContact O-N 3.13Å; V205-R207 VanDerWaalsContact C-N 3.29Å; V205-R207 PolarHBondContact O-N 3.38Å; V205-M237 HydrophobicContact CG2-CE 3.71Å
206	R	87.2	Confident	76.9	Confident	110 Å²	110	74 Å²	74	42%	0.415	42%	0.417	S	S	.	.	H	α-helix	trans	-71.9	-14.2	-179.8	-71.5	176	177.6	-155.6	3.7	114.6	T160 M202 Y204 N208 S209	T160-R206 PolarHBondContact O-NH2 3.48Å; M202-R206 WeakPolarHBondContact O-CB 3.49Å; M202-R206 VanDerWaalsContact O-CG 3.32Å; M202-R206 WeakPolarHBondContact O-CG 3.35Å; M202-R206 PolarHBondContact O-N 2.96Å; Y204-R206 VanDerWaalsContact C-N 3.32Å; Y204-R206 PolarHBondContact O-N 3Å; R206-N208 PolarHBondContact O-N 3Å; R206-S209 VanDerWaalsContact O-CB 3.26Å; R206-S209 WeakPolarHBondContact O-CB 3.35Å; R206-S209 PolarHBondContact O-N 2.82Å; R206-S209 PolarHBondContact O-OG 3.42Å
207	R	83.3	Confident	76	Confident	73 Å²	73	72.8 Å²	72.8	28%	0.275	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-27.2	-173.5	75.9	-166.6	156.4	153.5	-4.4	116.4	E169 N203 Y204 V205 T239 E243	E169-R207 IonicContact OE2-CZ 2.77Å; E169-R207 IonicContact OE2-NE 2.81Å; E169-R207 IonicContact OE2-NH2 3.34Å; E169-R207 PolarHBondContact OE2-NH2 3.01Å; N203-R207 PolarHBondContact O-N 3Å; Y204-R207 VanDerWaalsContact CE1-NH2 3.33Å; Y204-R207 VanDerWaalsContact O-CB 3.24Å; Y204-R207 WeakPolarHBondContact O-CB 3.28Å; Y204-R207 WeakPolarHBondContact O-CD 3.23Å; Y204-R207 WeakPolarHBondContact O-CG 3.47Å; Y204-R207 PolarHBondContact O-N 3.05Å; Y204-R207 PolarHBondContact O-NE 3.42Å; Y204-R207 PolarHBondContact OH-NH1 2.91Å; Y204-R207 PolarHBondContact OH-NH2 3.3Å; V205-R207 VanDerWaalsContact C-N 3.29Å; V205-R207 PolarHBondContact O-N 3.38Å; R207-T239 PolarHBondContact NH2-OG1 2.97Å; R207-E243 IonicContact NH1-OE1 2.63Å; R207-E243 PolarHBondContact NH1-OE1 2.98Å
208	N	73.4	Confident	75.6	Confident	107 Å²	107	73.1 Å²	73.1	57%	0.572	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	6.5	-175.7	-67.1	-37.2	0	0	0	113.2	R206 A210	R206-N208 PolarHBondContact O-N 3Å; N208-A210 PolarHBondContact O-N 3.12Å
209	S	74	Confident	75.4	Confident	58 Å²	58	83 Å²	83	41%	0.406	45%	0.451	S	S	.	.			trans	-77.5	121.9	-175.2	-51.4	0	0	0	0	111.1	R206 G211	R206-S209 VanDerWaalsContact O-CB 3.26Å; R206-S209 WeakPolarHBondContact O-CB 3.35Å; R206-S209 PolarHBondContact O-N 2.82Å; R206-S209 PolarHBondContact O-OG 3.42Å; S209-G211 PolarHBondContact O-N 2.86Å
210	A	54.4	Low	75.5	Confident	117 Å²	117	81 Å²	81	97%	0.967	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	82.3	-176.8	0	0	0	0	0	112.3	N208	N208-A210 PolarHBondContact O-N 3.12Å
211	G	55.8	Low	75.5	Confident	75 Å²	75	84.7 Å²	84.7	77%	0.773	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-166.4	-39.7	175.4	0	0	0	0	0	114.4	S209	S209-G211 PolarHBondContact O-N 2.86Å
212	E	53.9	Low	75.5	Confident	165 Å²	165	86.5 Å²	86.5	77%	0.771	47%	0.47	S	S	*	.	S	Bend	trans	-105	124.8	-178	-64.6	-175.5	129.6	0	0	111	N214	E212-N214 PolarHBondContact O-N 3.42Å
213	G	45.1	Very low	75.6	Confident	71 Å²	71	89.5 Å²	89.5	73%	0.732	49%	0.492	S	S	*	.			trans	-77.5	89.4	-162.6	0	0	0	0	0	115	K215	G213-K215 PolarHBondContact O-N 3.35Å; G213-K215 VanDerWaalsContact O-N 3.13Å
214	N	48.6	Very low	75.7	Confident	169 Å²	169	87.3 Å²	87.3	90%	0.904	48%	0.48	S	S	*	.	S	Bend	trans	53.1	36.7	163.5	-155.4	19.1	0	0	0	114.7	E212	E212-N214 PolarHBondContact O-N 3.42Å
215	K	52.2	Low	75.9	Confident	166 Å²	166	87.2 Å²	87.2	72%	0.722	48%	0.479	S	S	*	.			trans	-136.4	130.6	172.6	-73.6	-175.1	-179.8	-176.3	0	107.9	G213	G213-K215 PolarHBondContact O-N 3.35Å; G213-K215 VanDerWaalsContact O-N 3.13Å
216	D	63.5	Low	76.2	Confident	128 Å²	128	87.6 Å²	87.6	68%	0.684	48%	0.481	S	S	*	.			cis	-133.1	126.1	-18.3	-87.4	-73.7	0	0	0	105.5	P218	D216-P218 WeakPolarHBondContact O-CD 3.41Å; D216-P218 VanDerWaalsContact O-N 3.08Å
217	K	73.7	Confident	76.5	Confident	107 Å²	107	85 Å²	85	47%	0.465	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-61	118.6	173	177.9	176.6	175.8	176.3	0	107.1	R219 E243	K217-R219 PolarHBondContact O-N 3.16Å; K217-E243 VanDerWaalsContact CE-OE2 3.23Å; K217-E243 WeakPolarHBondContact CE-OE2 3.49Å; K217-E243 IonicContact NZ-OE1 3.98Å; K217-E243 PolarHBondContact NZ-OE1 3.07Å; K217-E243 IonicContact NZ-OE2 2.7Å; K217-E243 PolarHBondContact NZ-OE2 3.23Å
218	P	85.6	Confident	77	Confident	24 Å²	24	81.5 Å²	81.5	16%	0.156	47%	0.467	C	S	.	.	P	Polyproline II helix	trans	-64.4	137.5	-172.2	28.2	-36.2	0	0	0	109.3	W200 N203 Y204 D216	W200-P218 HydrophobicContact CD2-CB 4.06Å; W200-P218 HydrophobicContact CD2-CG 4.18Å; W200-P218 HydrophobicContact CE3-CG 4.42Å; W200-P218 HydrophobicContact CG-CB 4.25Å; W200-P218 HydrophobicContact CH2-CG 4.26Å; W200-P218 HydrophobicContact CZ2-CB 4.01Å; W200-P218 HydrophobicContact CZ2-CG 4.04Å; W200-P218 VanDerWaalsContact CZ2-O 3.27Å; W200-P218 WeakPolarHBondContact CZ2-O 3.36Å; W200-P218 HydrophobicContact CZ3-CG 4.45Å; N203-P218 HydrophobicContact CB-CG 4.28Å; Y204-P218 HydrophobicContact CD2-CG 4.42Å; D216-P218 WeakPolarHBondContact O-CD 3.41Å; D216-P218 VanDerWaalsContact O-N 3.08Å
219	R	89.8	Confident	78.1	Confident	209 Å²	209	76.4 Å²	76.4	79%	0.789	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-89.7	139	-172.5	-66.4	-175	177.4	-162.9	-1.3	110.5	W200 K217	W200-R219 PolarHBondContact NE1-O 3.01Å; K217-R219 PolarHBondContact O-N 3.16Å
220	L	95	Very high	79	Confident	22 Å²	22	76.4 Å²	76.4	12%	0.115	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-74	135.6	168	-66.4	175.1	0	0	0	109.2	W200 V225 I228 Y247	W200-L220 HydrophobicContact CH2-CD2 3.6Å; W200-L220 HydrophobicContact CH2-CG 4.23Å; W200-L220 HydrophobicContact CZ2-CD2 3.49Å; W200-L220 VanDerWaalsContact CZ2-CD2 3.49Å; W200-L220 HydrophobicContact CZ2-CG 3.99Å; W200-L220 HydrophobicContact CZ3-CD2 4.49Å; L220-V225 HydrophobicContact CB-CG2 4.49Å; L220-V225 HydrophobicContact CD1-CG2 4.26Å; L220-V225 HydrophobicContact CD2-CB 4.43Å; L220-V225 HydrophobicContact CD2-CG2 4.18Å; L220-I228 HydrophobicContact CD2-CB 4.47Å; L220-I228 HydrophobicContact CD2-CD1 3.78Å; L220-I228 HydrophobicContact CD2-CG2 4.13Å; L220-Y247 HydrophobicContact CB-CD1 4.4Å; L220-Y247 HydrophobicContact CB-CD2 3.56Å; L220-Y247 HydrophobicContact CB-CE1 4.45Å; L220-Y247 HydrophobicContact CB-CE2 3.59Å; L220-Y247 HydrophobicContact CB-CG 3.98Å; L220-Y247 HydrophobicContact CD1-CD2 4.01Å; L220-Y247 HydrophobicContact CD1-CG 4.01Å; L220-Y247 HydrophobicContact CG-CD2 4.44Å; L220-Y247 VanDerWaalsContact O-CE2 3.22Å; L220-Y247 WeakPolarHBondContact O-CE2 3.3Å; L220-Y247 VanDerWaalsContact O-CZ 3.28Å; L220-Y247 PolarHBondContact O-OH 3.34Å
221	E	94.3	Very high	80.9	Confident	103 Å²	103	72.2 Å²	72.2	48%	0.481	40%	0.398	S	S	.	.			trans	-125.4	153.6	178	-57.6	-167.6	146	0	0	110.1	S223 N224 V225 Y247	E221-S223 PolarHBondContact O-N 3.46Å; E221-N224 PolarHBondContact N-OD1 3.2Å; E221-N224 PolarHBondContact O-N 3.37Å; E221-N224 VanDerWaalsContact O-N 3.1Å; E221-N224 PolarHBondContact O-OD1 2.91Å; E221-V225 WeakPolarHBondContact O-CB 3.36Å; E221-V225 WeakPolarHBondContact O-CG1 3.48Å; E221-V225 PolarHBondContact O-N 3.01Å; E221-Y247 VanDerWaalsContact CA-OH 3.31Å; E221-Y247 WeakPolarHBondContact CA-OH 3.3Å
222	P	93.6	Very high	82.7	Confident	39 Å²	39	68.7 Å²	68.7	25%	0.253	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-19.9	-177.3	-22.8	35.3	0	0	0	114	Y247 A254 I255 T258	P222-Y247 WeakPolarHBondContact CD-OH 3.19Å; P222-A254 HydrophobicContact CB-CB 4.13Å; P222-A254 HydrophobicContact CG-CB 4.08Å; P222-I255 HydrophobicContact CB-CG1 4.03Å; P222-T258 HydrophobicContact CB-CG2 3.87Å; P222-T258 PolarHBondContact O-OG1 3.1Å
223	S	92.9	Very high	84.7	Confident	67 Å²	67	63.5 Å²	63.5	47%	0.469	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-34.5	177.4	46.4	0	0	0	0	114	E221	E221-S223 PolarHBondContact O-N 3.46Å
224	N	93.4	Very high	87	Confident	22 Å²	22	66.1 Å²	66.1	12%	0.118	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-24.5	-170.5	67	21.9	0	0	0	113.7	I197 E221 I226 S227 I228	I197-N224 HydrophobicContact CD1-CB 4.04Å; E221-N224 PolarHBondContact N-OD1 3.2Å; E221-N224 PolarHBondContact O-N 3.37Å; E221-N224 VanDerWaalsContact O-N 3.1Å; E221-N224 PolarHBondContact O-OD1 2.91Å; N224-I226 VanDerWaalsContact C-N 3.28Å; N224-I226 PolarHBondContact O-N 3.07Å; N224-I226 VanDerWaalsContact O-N 3.1Å; N224-S227 PolarHBondContact O-N 2.84Å; N224-S227 VanDerWaalsContact O-N 3.07Å; N224-I228 HydrophobicContact CB-CD1 3.9Å; N224-I228 WeakPolarHBondContact O-CG1 3.36Å; N224-I228 PolarHBondContact O-N 2.92Å; N224-I228 WeakPolarHBondContact OD1-CD1 3.2Å
225	V	95.4	Very high	89.1	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-56.5	-34.4	-169.2	61.5	0	0	0	0	114.3	L220 E221 L229 C244 Y247 I255	L220-V225 HydrophobicContact CB-CG2 4.49Å; L220-V225 HydrophobicContact CD1-CG2 4.26Å; L220-V225 HydrophobicContact CD2-CB 4.43Å; L220-V225 HydrophobicContact CD2-CG2 4.18Å; E221-V225 WeakPolarHBondContact O-CB 3.36Å; E221-V225 WeakPolarHBondContact O-CG1 3.48Å; E221-V225 PolarHBondContact O-N 3.01Å; V225-L229 VanDerWaalsContact O-CB 3.27Å; V225-L229 WeakPolarHBondContact O-CB 3.1Å; V225-L229 PolarHBondContact O-N 2.65Å; V225-C244 HydrophobicContact CG2-CB 4.14Å; V225-Y247 HydrophobicContact CB-CD1 4.05Å; V225-Y247 HydrophobicContact CB-CE1 4.25Å; V225-Y247 HydrophobicContact CG1-CD1 4Å; V225-Y247 HydrophobicContact CG1-CE1 4.06Å; V225-Y247 HydrophobicContact CG2-CD1 3.75Å; V225-Y247 HydrophobicContact CG2-CE1 4.44Å; V225-Y247 HydrophobicContact CG2-CG 4.21Å; V225-I255 HydrophobicContact CG1-CD1 3.64Å; V225-I255 HydrophobicContact CG1-CG1 3.79Å; V225-I255 HydrophobicContact CG1-CG2 4.48Å
226	I	94.9	Very high	91	Very high	7 Å²	7	53.8 Å²	53.8	4%	0.036	27%	0.267	C	S	.	.	H	α-helix	trans	-78.8	-35.3	-179.7	-55	-60.1	0	0	0	112.4	N224 I228 L229 I230 C248 I255 M262 I265	N224-I226 VanDerWaalsContact C-N 3.28Å; N224-I226 PolarHBondContact O-N 3.07Å; N224-I226 VanDerWaalsContact O-N 3.1Å; I226-I228 VanDerWaalsContact C-N 3.33Å; I226-L229 HydrophobicContact CD1-CD2 4.35Å; I226-L229 PolarHBondContact O-N 2.76Å; I226-I230 HydrophobicContact CG2-CD1 3.92Å; I226-I230 HydrophobicContact CG2-CG1 4.48Å; I226-I230 WeakPolarHBondContact O-CD1 3.27Å; I226-I230 VanDerWaalsContact O-CG1 3.3Å; I226-I230 WeakPolarHBondContact O-CG1 3.29Å; I226-I230 PolarHBondContact O-N 3.32Å; I226-C248 WeakPolarHBondContact CD1-SG 3.4Å; I226-I255 HydrophobicContact CD1-CG2 4.19Å; I226-I255 HydrophobicContact CG1-CG2 3.67Å; I226-M262 HydrophobicContact CB-CE 3.75Å; I226-M262 HydrophobicContact CD1-SD 4.47Å; I226-M262 HydrophobicContact CG1-CE 3.67Å; I226-M262 HydrophobicContact CG1-SD 3.9Å; I226-M262 HydrophobicContact CG2-CE 3.56Å; I226-M262 HydrophobicContact CG2-SD 4.32Å; I226-I265 HydrophobicContact CD1-CD1 4.25Å; I226-I265 HydrophobicContact CG2-CD1 3.87Å; I226-I265 HydrophobicContact CG2-CG1 3.81Å
227	S	93.2	Very high	92.5	Very high	56 Å²	56	47.9 Å²	47.9	39%	0.392	24%	0.236	S	C	.	.	H	α-helix	trans	-63.4	-43.7	170.4	-54.9	0	0	0	0	110.4	N224 I230 S231	N224-S227 PolarHBondContact O-N 2.84Å; N224-S227 VanDerWaalsContact O-N 3.07Å; S227-I230 PolarHBondContact O-N 3.16Å; S227-S231 WeakPolarHBondContact O-CB 3.5Å; S227-S231 PolarHBondContact O-N 3.21Å; S227-S231 PolarHBondContact O-OG 3.06Å
228	I	95.1	Very high	93.4	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.4	-42.3	174.8	-63.2	164	0	0	0	111	I197 W200 L201 L220 N224 I226 S231 S232 L240	I197-I228 HydrophobicContact CD1-CG1 4.3Å; I197-I228 HydrophobicContact CG2-CG1 4.12Å; W200-I228 HydrophobicContact CD2-CD1 3.51Å; W200-I228 HydrophobicContact CD2-CG1 4.2Å; W200-I228 HydrophobicContact CE3-CD1 3.85Å; W200-I228 HydrophobicContact CE3-CG1 4.14Å; W200-I228 HydrophobicContact CE3-CG2 3.9Å; W200-I228 HydrophobicContact CG-CD1 3.92Å; W200-I228 HydrophobicContact CH2-CD1 4.36Å; W200-I228 HydrophobicContact CH2-CG2 4.2Å; W200-I228 HydrophobicContact CZ2-CD1 4.02Å; W200-I228 HydrophobicContact CZ3-CD1 4.27Å; W200-I228 HydrophobicContact CZ3-CG2 3.66Å; L201-I228 HydrophobicContact CD2-CG2 4.13Å; L220-I228 HydrophobicContact CD2-CB 4.47Å; L220-I228 HydrophobicContact CD2-CD1 3.78Å; L220-I228 HydrophobicContact CD2-CG2 4.13Å; N224-I228 HydrophobicContact CB-CD1 3.9Å; N224-I228 WeakPolarHBondContact O-CG1 3.36Å; N224-I228 PolarHBondContact O-N 2.92Å; N224-I228 WeakPolarHBondContact OD1-CD1 3.2Å; I226-I228 VanDerWaalsContact C-N 3.33Å; I228-S231 PolarHBondContact O-N 2.87Å; I228-S232 WeakPolarHBondContact O-CB 3.32Å; I228-S232 PolarHBondContact O-N 3.46Å; I228-S232 PolarHBondContact O-OG 3.33Å; I228-L240 HydrophobicContact CG2-CD1 4.01Å; I228-L240 HydrophobicContact CG2-CD2 3.94Å; I228-L240 HydrophobicContact CG2-CG 4.16Å
229	L	95.5	Very high	93.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.6	-46.8	177.7	178	60.3	0	0	0	111.8	V225 I226 S232 E233 V241 C244 I245 L269 I273	V225-L229 VanDerWaalsContact O-CB 3.27Å; V225-L229 WeakPolarHBondContact O-CB 3.1Å; V225-L229 PolarHBondContact O-N 2.65Å; I226-L229 HydrophobicContact CD1-CD2 4.35Å; I226-L229 PolarHBondContact O-N 2.76Å; L229-S232 WeakPolarHBondContact CA-OG 3.41Å; L229-S232 PolarHBondContact O-N 2.83Å; L229-S232 PolarHBondContact O-OG 3.41Å; L229-S232 VanDerWaalsContact O-OG 3.11Å; L229-E233 WeakPolarHBondContact O-CB 3.27Å; L229-E233 PolarHBondContact O-N 3.01Å; L229-V241 HydrophobicContact CD1-CB 4.5Å; L229-V241 HydrophobicContact CD1-CG1 3.93Å; L229-C244 HydrophobicContact CB-CB 3.98Å; L229-C244 HydrophobicContact CD1-CB 3.74Å; L229-C244 HydrophobicContact CG-CB 4.36Å; L229-I245 HydrophobicContact CD1-CD1 4.43Å; L229-I245 HydrophobicContact CD1-CG1 3.9Å; L229-I245 HydrophobicContact CD2-CG1 4.44Å; L229-L269 HydrophobicContact CD1-CD2 4.06Å; L229-L269 HydrophobicContact CG-CD1 4.19Å; L229-I273 HydrophobicContact CD2-CD1 4.13Å
230	I	93.6	Very high	94.1	Very high	57 Å²	57	39.8 Å²	39.8	29%	0.292	22%	0.215	S	C	.	.	H	α-helix	trans	-65.8	-43.8	179.7	-66.6	161.6	0	0	0	110.7	I226 S227 F234 C264	I226-I230 HydrophobicContact CG2-CD1 3.92Å; I226-I230 HydrophobicContact CG2-CG1 4.48Å; I226-I230 WeakPolarHBondContact O-CD1 3.27Å; I226-I230 VanDerWaalsContact O-CG1 3.3Å; I226-I230 WeakPolarHBondContact O-CG1 3.29Å; I226-I230 PolarHBondContact O-N 3.32Å; S227-I230 PolarHBondContact O-N 3.16Å; I230-F234 WeakPolarHBondContact O-CB 3.36Å; I230-F234 PolarHBondContact O-N 3.42Å; I230-F234 VanDerWaalsContact O-N 3.12Å; I230-C264 HydrophobicContact CD1-CB 3.6Å
231	S	93.5	Very high	94.1	Very high	30 Å²	30	38.7 Å²	38.7	21%	0.21	21%	0.209	C	C	.	.	H	α-helix	trans	-69.2	-35.6	178	-62.9	0	0	0	0	113.4	S227 I228 F234 L235	S227-S231 WeakPolarHBondContact O-CB 3.5Å; S227-S231 PolarHBondContact O-N 3.21Å; S227-S231 PolarHBondContact O-OG 3.06Å; I228-S231 PolarHBondContact O-N 2.87Å; S231-F234 PolarHBondContact O-N 3.11Å; S231-L235 WeakPolarHBondContact O-CB 3.38Å; S231-L235 VanDerWaalsContact O-CG 3.28Å; S231-L235 WeakPolarHBondContact O-CG 3.41Å; S231-L235 PolarHBondContact O-N 3.01Å
232	S	94.7	Very high	94.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-74.6	-35	178.9	55.9	0	0	0	0	113	I228 L229 K236 M237	I228-S232 WeakPolarHBondContact O-CB 3.32Å; I228-S232 PolarHBondContact O-N 3.46Å; I228-S232 PolarHBondContact O-OG 3.33Å; L229-S232 WeakPolarHBondContact CA-OG 3.41Å; L229-S232 PolarHBondContact O-N 2.83Å; L229-S232 PolarHBondContact O-OG 3.41Å; L229-S232 VanDerWaalsContact O-OG 3.11Å; S232-K236 PolarHBondContact O-N 3.17Å; S232-K236 VanDerWaalsContact O-N 3.13Å; S232-M237 PolarHBondContact O-N 2.72Å
233	E	94.7	Very high	94.4	Very high	57 Å²	57	38.1 Å²	38.1	27%	0.266	20%	0.203	S	C	.	.	H	α-helix	trans	-60.5	-50.5	167.9	178.3	86.1	153.7	0	0	110.1	L229 L235 K236 V241 N266 L269	L229-E233 WeakPolarHBondContact O-CB 3.27Å; L229-E233 PolarHBondContact O-N 3.01Å; E233-L235 VanDerWaalsContact C-N 3.34Å; E233-L235 PolarHBondContact O-N 3.43Å; E233-K236 PolarHBondContact O-N 2.69Å; E233-V241 HydrophobicContact CB-CG2 4.25Å; E233-N266 PolarHBondContact OE1-ND2 2.85Å; E233-L269 HydrophobicContact CB-CD1 4.12Å; E233-L269 HydrophobicContact CG-CD1 3.99Å; E233-L269 HydrophobicContact CG-CD2 4.44Å; E233-L269 HydrophobicContact CG-CG 4.36Å
234	F	92.8	Very high	94.6	Very high	125 Å²	125	34.9 Å²	34.9	55%	0.548	18%	0.181	S	C	.	.	H	α-helix	trans	-59.4	-42.7	179.1	-178.2	-93.9	0	0	0	112.6	Y172 I230 S231 K236	Y172-F234 HydrophobicContact CD2-CE1 4.28Å; Y172-F234 HydrophobicContact CD2-CZ 4.48Å; Y172-F234 WeakPolarHBondContact CD2-O 3.01Å; Y172-F234 HydrophobicContact CE1-CE1 4.37Å; Y172-F234 AromaticContact CE2-CE1 3.9Å; Y172-F234 HydrophobicContact CE2-CE1 3.9Å; Y172-F234 HydrophobicContact CE2-CE2 4.41Å; Y172-F234 AromaticContact CE2-CZ 3.76Å; Y172-F234 HydrophobicContact CE2-CZ 3.76Å; Y172-F234 AromaticContact CZ-CE1 3.96Å; Y172-F234 AromaticContact CZ-CZ 3.92Å; I230-F234 WeakPolarHBondContact O-CB 3.36Å; I230-F234 PolarHBondContact O-N 3.42Å; I230-F234 VanDerWaalsContact O-N 3.12Å; S231-F234 PolarHBondContact O-N 3.11Å; F234-K236 PolarHBondContact O-N 3.18Å
235	L	92.9	Very high	94.7	Very high	9 Å²	9	34 Å²	34	5%	0.047	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	3.6	178.4	-65.4	172.9	0	0	0	113.9	M170 R171 Y172 F173 F198 L201 S231 E233 M237	M170-L235 CarbonylContact C-O 3.38Å; M170-L235 HydrophobicContact CE-CD1 3.82Å; M170-L235 HydrophobicContact CG-CB 4.43Å; M170-L235 HydrophobicContact SD-CD1 4.03Å; R171-L235 PolarHBondContact N-O 2.85Å; Y172-L235 WeakPolarHBondContact CB-O 3.47Å; Y172-L235 HydrophobicContact CD1-CD2 4.21Å; Y172-L235 HydrophobicContact CG-CD2 4.37Å; Y172-L235 PolarHBondContact N-O 3.47Å; Y172-L235 VanDerWaalsContact N-O 3.15Å; F173-L235 HydrophobicContact CE2-CD2 3.76Å; F173-L235 HydrophobicContact CZ-CD2 3.95Å; F198-L235 HydrophobicContact CE2-CD1 4.47Å; L201-L235 HydrophobicContact CD1-CD1 4.13Å; S231-L235 WeakPolarHBondContact O-CB 3.38Å; S231-L235 VanDerWaalsContact O-CG 3.28Å; S231-L235 WeakPolarHBondContact O-CG 3.41Å; S231-L235 PolarHBondContact O-N 3.01Å; E233-L235 VanDerWaalsContact C-N 3.34Å; E233-L235 PolarHBondContact O-N 3.43Å; L235-M237 HydrophobicContact CB-CG 3.82Å; L235-M237 HydrophobicContact CB-SD 4.03Å; L235-M237 HydrophobicContact CD1-SD 4.33Å; L235-M237 PolarHBondContact O-N 3.4Å
236	K	93.3	Very high	94.8	Very high	68 Å²	68	36.9 Å²	36.9	30%	0.296	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	43	179.5	-49.6	-173.9	-167.7	-176.7	0	113.4	R171 E175 S232 E233 F234 D238	R171-K236 HydrophobicContact CB-CB 4.26Å; R171-K236 PolarHBondContact NE-O 3.32Å; R171-K236 VanDerWaalsContact NE-O 3.08Å; R171-K236 PolarHBondContact NH2-O 2.97Å; E175-K236 IonicContact OE1-NZ 3.5Å; E175-K236 PolarHBondContact OE1-NZ 2.7Å; E175-K236 IonicContact OE2-NZ 3.79Å; E175-K236 PolarHBondContact OE2-NZ 2.8Å; S232-K236 PolarHBondContact O-N 3.17Å; S232-K236 VanDerWaalsContact O-N 3.13Å; E233-K236 PolarHBondContact O-N 2.69Å; F234-K236 PolarHBondContact O-N 3.18Å; K236-D238 PolarHBondContact O-N 3.01Å
237	M	94	Very high	94.9	Very high	4 Å²	4	38.8 Å²	38.8	2%	0.02	20%	0.196	C	C	.	.			trans	-94.6	61.8	-176.9	-53.1	179	71.3	0	0	112.3	E169 M170 L201 Y204 V205 S232 L235 T239 L240 V241	E169-M237 WeakPolarHBondContact O-CG 3.21Å; M170-M237 HydrophobicContact CE-CE 4.07Å; M170-M237 HydrophobicContact CE-SD 3.92Å; M170-M237 HydrophobicContact CG-CE 3.93Å; M170-M237 HydrophobicContact CG-CG 3.98Å; M170-M237 HydrophobicContact CG-SD 3.79Å; L201-M237 HydrophobicContact CD2-CE 4.42Å; L201-M237 HydrophobicContact CD2-SD 3.97Å; Y204-M237 HydrophobicContact CD1-CE 4.03Å; Y204-M237 HydrophobicContact CE1-CE 4.39Å; V205-M237 HydrophobicContact CG2-CE 3.71Å; S232-M237 PolarHBondContact O-N 2.72Å; L235-M237 HydrophobicContact CB-CG 3.82Å; L235-M237 HydrophobicContact CB-SD 4.03Å; L235-M237 HydrophobicContact CD1-SD 4.33Å; L235-M237 PolarHBondContact O-N 3.4Å; M237-T239 VanDerWaalsContact C-N 3.27Å; M237-T239 PolarHBondContact O-N 3.27Å; M237-L240 HydrophobicContact CB-CB 4.18Å; M237-L240 HydrophobicContact CE-CD2 3.95Å; M237-L240 WeakPolarHBondContact O-CB 3.27Å; M237-L240 PolarHBondContact O-N 3.24Å; M237-L240 HydrophobicContact SD-CD2 4.14Å; M237-V241 PolarHBondContact O-N 3.02Å; M237-V241 VanDerWaalsContact O-N 3.12Å
238	D	93.4	Very high	95	Very high	87 Å²	87	36.1 Å²	36.1	47%	0.465	18%	0.178	S	C	.	.	H	α-helix	trans	-44.4	-42.7	-167.3	-60.8	-11.5	0	0	0	115.6	R171 K236 L240 V241 E242	R171-D238 IonicContact CZ-OD1 3.84Å; R171-D238 IonicContact CZ-OD2 2.73Å; R171-D238 IonicContact NH1-OD2 3.51Å; R171-D238 PolarHBondContact NH1-OD2 3.15Å; R171-D238 IonicContact NH2-OD1 3.92Å; R171-D238 PolarHBondContact NH2-OD1 2.83Å; R171-D238 IonicContact NH2-OD2 3.56Å; R171-D238 PolarHBondContact NH2-OD2 2.94Å; K236-D238 PolarHBondContact O-N 3.01Å; D238-L240 VanDerWaalsContact C-N 3.32Å; D238-L240 PolarHBondContact O-N 2.91Å; D238-V241 PolarHBondContact O-N 3.39Å; D238-E242 PolarHBondContact O-N 3.37Å
239	T	94	Very high	95.1	Very high	82 Å²	82	38.3 Å²	38.3	50%	0.503	19%	0.188	S	C	.	.	H	α-helix	trans	-63.9	-36.8	-179.5	60.9	0	0	0	0	112.5	Y204 R207 M237 E243	Y204-T239 PolarHBondContact OH-OG1 2.83Å; R207-T239 PolarHBondContact NH2-OG1 2.97Å; M237-T239 VanDerWaalsContact C-N 3.27Å; M237-T239 PolarHBondContact O-N 3.27Å; T239-E243 WeakPolarHBondContact O-CG 3.38Å; T239-E243 PolarHBondContact O-N 2.68Å; T239-E243 VanDerWaalsContact O-N 3.07Å
240	L	95.3	Very high	95.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-75.4	-39	176	179.5	52.4	0	0	0	111.4	W200 L201 Y204 I228 M237 D238 E242 E243 C244	W200-L240 HydrophobicContact CH2-CD1 3.73Å; W200-L240 HydrophobicContact CZ3-CD1 3.71Å; W200-L240 HydrophobicContact CZ3-CD2 3.84Å; W200-L240 HydrophobicContact CZ3-CG 4.46Å; L201-L240 HydrophobicContact CD2-CD2 3.4Å; L201-L240 VanDerWaalsContact CD2-CD2 3.4Å; Y204-L240 HydrophobicContact CD1-CB 4.45Å; Y204-L240 HydrophobicContact CD1-CD2 4Å; Y204-L240 HydrophobicContact CD2-CD1 4.07Å; Y204-L240 HydrophobicContact CE1-CB 3.7Å; Y204-L240 HydrophobicContact CE1-CD1 4.35Å; Y204-L240 HydrophobicContact CE1-CD2 4.08Å; Y204-L240 HydrophobicContact CE1-CG 4.26Å; Y204-L240 HydrophobicContact CE2-CB 4.44Å; Y204-L240 HydrophobicContact CE2-CD1 3.7Å; Y204-L240 HydrophobicContact CE2-CG 4.47Å; Y204-L240 HydrophobicContact CG-CD2 4.25Å; Y204-L240 WeakPolarHBondContact OH-CA 3.4Å; Y204-L240 PolarHBondContact OH-N 2.81Å; I228-L240 HydrophobicContact CG2-CD1 4.01Å; I228-L240 HydrophobicContact CG2-CD2 3.94Å; I228-L240 HydrophobicContact CG2-CG 4.16Å; M237-L240 HydrophobicContact CB-CB 4.18Å; M237-L240 HydrophobicContact CE-CD2 3.95Å; M237-L240 WeakPolarHBondContact O-CB 3.27Å; M237-L240 PolarHBondContact O-N 3.24Å; M237-L240 HydrophobicContact SD-CD2 4.14Å; D238-L240 VanDerWaalsContact C-N 3.32Å; D238-L240 PolarHBondContact O-N 2.91Å; L240-E242 VanDerWaalsContact C-N 3.3Å; L240-E242 PolarHBondContact O-N 2.94Å; L240-E243 PolarHBondContact O-N 2.92Å; L240-C244 WeakPolarHBondContact O-CB 3.48Å; L240-C244 PolarHBondContact O-N 3.31Å; L240-C244 PolarHBondContact O-SG 2.83Å; L240-C244 VanDerWaalsContact O-SG 3.37Å
241	V	96.3	Very high	95.3	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-57.1	-46.3	175.4	175.8	0	0	0	0	110.3	L229 E233 M237 D238 C244 I245 L269	L229-V241 HydrophobicContact CD1-CB 4.5Å; L229-V241 HydrophobicContact CD1-CG1 3.93Å; E233-V241 HydrophobicContact CB-CG2 4.25Å; M237-V241 PolarHBondContact O-N 3.02Å; M237-V241 VanDerWaalsContact O-N 3.12Å; D238-V241 PolarHBondContact O-N 3.39Å; V241-C244 PolarHBondContact O-N 2.89Å; V241-I245 HydrophobicContact CG1-CD1 3.78Å; V241-I245 WeakPolarHBondContact O-CB 3.35Å; V241-I245 VanDerWaalsContact O-CG1 3.27Å; V241-I245 WeakPolarHBondContact O-CG1 3.41Å; V241-I245 PolarHBondContact O-N 3.12Å; V241-L269 HydrophobicContact CG1-CD2 3.95Å
242	E	96.8	Very high	95.4	Very high	69 Å²	69	44.9 Å²	44.9	32%	0.322	21%	0.212	S	C	.	.	H	α-helix	trans	-69	-42.4	177	-169	56.8	-144.5	0	0	112.4	D238 L240 C244 I245 Q246 R272	D238-E242 PolarHBondContact O-N 3.37Å; L240-E242 VanDerWaalsContact C-N 3.3Å; L240-E242 PolarHBondContact O-N 2.94Å; E242-C244 VanDerWaalsContact C-N 3.27Å; E242-C244 PolarHBondContact O-N 2.88Å; E242-I245 PolarHBondContact O-N 2.91Å; E242-Q246 HydrophobicContact CG-CG 4.33Å; E242-Q246 WeakPolarHBondContact O-CB 3.39Å; E242-Q246 WeakPolarHBondContact O-CG 3.47Å; E242-Q246 PolarHBondContact O-N 3.09Å; E242-Q246 WeakPolarHBondContact OE1-CG 3.29Å; E242-Q246 PolarHBondContact OE1-NE2 2.96Å; E242-R272 IonicContact OE2-CZ 3.4Å; E242-R272 IonicContact OE2-NH2 2.75Å; E242-R272 PolarHBondContact OE2-NH2 3.32Å
243	E	95.9	Very high	95.4	Very high	60 Å²	60	47.2 Å²	47.2	28%	0.28	23%	0.228	S	C	.	.	H	α-helix	trans	-55.5	-42	172.2	-78.8	-171.4	-133	0	0	112.2	Y204 R207 K217 T239 L240 Y247	Y204-E243 PolarHBondContact OH-OE1 3.07Å; R207-E243 IonicContact NH1-OE1 2.63Å; R207-E243 PolarHBondContact NH1-OE1 2.98Å; K217-E243 VanDerWaalsContact CE-OE2 3.23Å; K217-E243 WeakPolarHBondContact CE-OE2 3.49Å; K217-E243 IonicContact NZ-OE1 3.98Å; K217-E243 PolarHBondContact NZ-OE1 3.07Å; K217-E243 IonicContact NZ-OE2 2.7Å; K217-E243 PolarHBondContact NZ-OE2 3.23Å; T239-E243 WeakPolarHBondContact O-CG 3.38Å; T239-E243 PolarHBondContact O-N 2.68Å; T239-E243 VanDerWaalsContact O-N 3.07Å; L240-E243 PolarHBondContact O-N 2.92Å; E243-Y247 WeakPolarHBondContact O-CB 3.48Å; E243-Y247 PolarHBondContact O-N 3.04Å
244	C	96.8	Very high	95.5	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.9	-43.9	176.7	-76.6	0	0	0	0	112.5	V225 L229 L240 V241 E242 Y247 C248	V225-C244 HydrophobicContact CG2-CB 4.14Å; L229-C244 HydrophobicContact CB-CB 3.98Å; L229-C244 HydrophobicContact CD1-CB 3.74Å; L229-C244 HydrophobicContact CG-CB 4.36Å; L240-C244 WeakPolarHBondContact O-CB 3.48Å; L240-C244 PolarHBondContact O-N 3.31Å; L240-C244 PolarHBondContact O-SG 2.83Å; L240-C244 VanDerWaalsContact O-SG 3.37Å; V241-C244 PolarHBondContact O-N 2.89Å; E242-C244 VanDerWaalsContact C-N 3.27Å; E242-C244 PolarHBondContact O-N 2.88Å; C244-Y247 WeakPolarHBondContact O-CB 3.23Å; C244-Y247 PolarHBondContact O-N 3.4Å; C244-C248 PolarHBondContact O-N 3.26Å; C244-C248 PolarHBondContact O-SG 3.44Å
245	I	96.9	Very high	95.6	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	21%	0.208	C	C	.	.	H	α-helix	trans	-63.4	-43	177.6	-72	167.1	0	0	0	110.8	L229 V241 E242 Y247 C248 H249 L269 R272 I273 L276	L229-I245 HydrophobicContact CD1-CD1 4.43Å; L229-I245 HydrophobicContact CD1-CG1 3.9Å; L229-I245 HydrophobicContact CD2-CG1 4.44Å; V241-I245 HydrophobicContact CG1-CD1 3.78Å; V241-I245 WeakPolarHBondContact O-CB 3.35Å; V241-I245 VanDerWaalsContact O-CG1 3.27Å; V241-I245 WeakPolarHBondContact O-CG1 3.41Å; V241-I245 PolarHBondContact O-N 3.12Å; E242-I245 PolarHBondContact O-N 2.91Å; I245-Y247 VanDerWaalsContact C-N 3.31Å; I245-Y247 PolarHBondContact O-N 2.81Å; I245-C248 WeakPolarHBondContact O-CB 3.44Å; I245-C248 PolarHBondContact O-N 3.35Å; I245-C248 VanDerWaalsContact O-N 3.12Å; I245-H249 PolarHBondContact O-N 3.33Å; I245-L269 HydrophobicContact CD1-CD2 3.96Å; I245-R272 HydrophobicContact CD1-CB 4.08Å; I245-R272 VanDerWaalsContact CD1-CZ 3.47Å; I245-I273 HydrophobicContact CB-CG1 4.5Å; I245-I273 HydrophobicContact CG1-CG1 4.13Å; I245-I273 HydrophobicContact CG2-CG1 4.04Å; I245-L276 HydrophobicContact CG2-CD1 3.67Å; I245-L276 HydrophobicContact CG2-CG 4.49Å
246	Q	97.4	Very high	95.6	Very high	61 Å²	61	40.7 Å²	40.7	29%	0.285	21%	0.207	S	C	.	.	H	α-helix	trans	-65.2	-32.4	175.2	-67.6	-67.6	-29.7	0	0	112.8	E242 K250	E242-Q246 HydrophobicContact CG-CG 4.33Å; E242-Q246 WeakPolarHBondContact O-CB 3.39Å; E242-Q246 WeakPolarHBondContact O-CG 3.47Å; E242-Q246 PolarHBondContact O-N 3.09Å; E242-Q246 WeakPolarHBondContact OE1-CG 3.29Å; E242-Q246 PolarHBondContact OE1-NE2 2.96Å; Q246-K250 WeakPolarHBondContact O-CD 3.39Å; Q246-K250 WeakPolarHBondContact O-CG 3.42Å; Q246-K250 PolarHBondContact O-N 3.07Å
247	Y	96.8	Very high	95.6	Very high	48 Å²	48	41.3 Å²	41.3	19%	0.188	23%	0.225	C	C	.	.	H	α-helix	trans	-70.6	-39.2	170.8	-170.6	-78.5	0	0	0	111.5	L220 E221 P222 V225 E243 C244 I245 H249 K250 H251 I255	L220-Y247 HydrophobicContact CB-CD1 4.4Å; L220-Y247 HydrophobicContact CB-CD2 3.56Å; L220-Y247 HydrophobicContact CB-CE1 4.45Å; L220-Y247 HydrophobicContact CB-CE2 3.59Å; L220-Y247 HydrophobicContact CB-CG 3.98Å; L220-Y247 HydrophobicContact CD1-CD2 4.01Å; L220-Y247 HydrophobicContact CD1-CG 4.01Å; L220-Y247 HydrophobicContact CG-CD2 4.44Å; L220-Y247 VanDerWaalsContact O-CE2 3.22Å; L220-Y247 WeakPolarHBondContact O-CE2 3.3Å; L220-Y247 VanDerWaalsContact O-CZ 3.28Å; L220-Y247 PolarHBondContact O-OH 3.34Å; E221-Y247 VanDerWaalsContact CA-OH 3.31Å; E221-Y247 WeakPolarHBondContact CA-OH 3.3Å; P222-Y247 WeakPolarHBondContact CD-OH 3.19Å; V225-Y247 HydrophobicContact CB-CD1 4.05Å; V225-Y247 HydrophobicContact CB-CE1 4.25Å; V225-Y247 HydrophobicContact CG1-CD1 4Å; V225-Y247 HydrophobicContact CG1-CE1 4.06Å; V225-Y247 HydrophobicContact CG2-CD1 3.75Å; V225-Y247 HydrophobicContact CG2-CE1 4.44Å; V225-Y247 HydrophobicContact CG2-CG 4.21Å; E243-Y247 WeakPolarHBondContact O-CB 3.48Å; E243-Y247 PolarHBondContact O-N 3.04Å; C244-Y247 WeakPolarHBondContact O-CB 3.23Å; C244-Y247 PolarHBondContact O-N 3.4Å; I245-Y247 VanDerWaalsContact C-N 3.31Å; I245-Y247 PolarHBondContact O-N 2.81Å; Y247-H249 PolarHBondContact O-N 2.91Å; Y247-K250 PolarHBondContact O-N 3.08Å; Y247-H251 HydrophobicContact CD1-CB 4.18Å; Y247-H251 AromaticContact CD1-CD2 3.85Å; Y247-H251 AromaticContact CD2-CD2 3.76Å; Y247-H251 HydrophobicContact CE1-CB 3.89Å; Y247-H251 AromaticContact CE1-CD2 3.67Å; Y247-H251 AromaticContact CE2-CD2 3.59Å; Y247-H251 AromaticContact CG-CD2 3.9Å; Y247-H251 AromaticContact CZ-CD2 3.54Å; Y247-H251 WeakPolarHBondContact O-CB 3.46Å; Y247-H251 PolarHBondContact O-N 3.33Å; Y247-I255 HydrophobicContact CD1-CD1 4.23Å; Y247-I255 HydrophobicContact CE1-CD1 4.43Å
248	C	96.1	Very high	95.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.3	-45	177	-69.1	0	0	0	0	111.8	I226 C244 I245 K250 H251 M252 I255 I273	I226-C248 WeakPolarHBondContact CD1-SG 3.4Å; C244-C248 PolarHBondContact O-N 3.26Å; C244-C248 PolarHBondContact O-SG 3.44Å; I245-C248 WeakPolarHBondContact O-CB 3.44Å; I245-C248 PolarHBondContact O-N 3.35Å; I245-C248 VanDerWaalsContact O-N 3.12Å; C248-K250 PolarHBondContact O-N 2.64Å; C248-H251 PolarHBondContact O-N 2.87Å; C248-M252 HydrophobicContact CB-CE 4.02Å; C248-M252 WeakPolarHBondContact O-CA 3.37Å; C248-M252 WeakPolarHBondContact O-CB 3.47Å; C248-M252 PolarHBondContact O-N 2.88Å; C248-I255 HydrophobicContact CB-CD1 4.33Å; C248-I273 HydrophobicContact CB-CD1 4.47Å
249	H	96.7	Very high	95.2	Very high	45 Å²	45	44.9 Å²	44.9	21%	0.208	25%	0.253	C	S	.	.	H	α-helix	trans	-54.6	-53.4	174.3	177.3	-110.9	0	0	0	111.8	I245 Y247 H251 L276 F277 E281	I245-H249 PolarHBondContact O-N 3.33Å; Y247-H249 PolarHBondContact O-N 2.91Å; H249-H251 VanDerWaalsContact C-N 3.33Å; H249-H251 PolarHBondContact O-N 3.41Å; H249-L276 HydrophobicContact CB-CB 4.08Å; H249-L276 HydrophobicContact CB-CD1 3.88Å; H249-L276 PolarHBondContact NE2-O 3.01Å; H249-L276 VanDerWaalsContact NE2-O 3.16Å; H249-F277 HydrophobicContact CB-CE2 4.43Å; H249-F277 HydrophobicContact CB-CZ 4.43Å; H249-F277 AromaticContact CD2-CD1 3.68Å; H249-F277 AromaticContact CD2-CD2 3.92Å; H249-F277 AromaticContact CD2-CE1 3.68Å; H249-F277 AromaticContact CD2-CE2 3.93Å; H249-F277 AromaticContact CD2-CG 3.79Å; H249-F277 AromaticContact CD2-CZ 3.8Å; H249-F277 WeakPolarHBondContact O-CZ 3.28Å; H249-E281 IonicContact CD2-OE2 3.73Å; H249-E281 IonicContact CE1-OE2 2.73Å; H249-E281 IonicContact NE2-OE2 2.91Å; H249-E281 PolarHBondContact NE2-OE2 3.25Å
250	K	96.4	Very high	94.8	Very high	136 Å²	136	42.1 Å²	42.1	59%	0.591	24%	0.237	S	C	*	.	H	α-helix	trans	-70.1	-23.4	-174.4	-67.7	164.9	-169.6	162.4	0	114.6	Q246 Y247 C248	Q246-K250 WeakPolarHBondContact O-CD 3.39Å; Q246-K250 WeakPolarHBondContact O-CG 3.42Å; Q246-K250 PolarHBondContact O-N 3.07Å; Y247-K250 PolarHBondContact O-N 3.08Å; C248-K250 PolarHBondContact O-N 2.64Å
251	H	96	Very high	94.2	Very high	84 Å²	84	46.4 Å²	46.4	39%	0.389	26%	0.26	S	S	.	.	H	α-helix	trans	-130.1	13.5	-170	-59.9	-50.1	0	0	0	115.1	Y247 C248 H249 S253 A254 I255	Y247-H251 HydrophobicContact CD1-CB 4.18Å; Y247-H251 AromaticContact CD1-CD2 3.85Å; Y247-H251 AromaticContact CD2-CD2 3.76Å; Y247-H251 HydrophobicContact CE1-CB 3.89Å; Y247-H251 AromaticContact CE1-CD2 3.67Å; Y247-H251 AromaticContact CE2-CD2 3.59Å; Y247-H251 AromaticContact CG-CD2 3.9Å; Y247-H251 AromaticContact CZ-CD2 3.54Å; Y247-H251 WeakPolarHBondContact O-CB 3.46Å; Y247-H251 PolarHBondContact O-N 3.33Å; C248-H251 PolarHBondContact O-N 2.87Å; H249-H251 VanDerWaalsContact C-N 3.33Å; H249-H251 PolarHBondContact O-N 3.41Å; H251-S253 VanDerWaalsContact C-N 3.35Å; H251-S253 PolarHBondContact O-N 3.31Å; H251-A254 WeakPolarHBondContact O-CA 3.36Å; H251-A254 WeakPolarHBondContact O-CB 3.47Å; H251-A254 PolarHBondContact O-N 3.48Å; H251-I255 HydrophobicContact CB-CD1 4.38Å; H251-I255 WeakPolarHBondContact O-CG1 3.31Å; H251-I255 PolarHBondContact O-N 2.94Å
252	M	95.4	Very high	93.6	Very high	6 Å²	6	46.7 Å²	46.7	3%	0.03	26%	0.261	C	S	.	.	H	α-helix	trans	-49.6	-48.2	-175.6	-169.3	59.5	70.8	0	0	114	C248 A254 I255 V256 I273 F277 I285 F292	C248-M252 HydrophobicContact CB-CE 4.02Å; C248-M252 WeakPolarHBondContact O-CA 3.37Å; C248-M252 WeakPolarHBondContact O-CB 3.47Å; C248-M252 PolarHBondContact O-N 2.88Å; M252-A254 PolarHBondContact O-N 2.7Å; M252-I255 PolarHBondContact O-N 3.07Å; M252-V256 HydrophobicContact CG-CG1 4.27Å; M252-V256 WeakPolarHBondContact O-CG2 3.41Å; M252-V256 PolarHBondContact O-N 3.27Å; M252-V256 HydrophobicContact SD-CG1 3.97Å; M252-I273 HydrophobicContact CE-CG2 3.8Å; M252-F277 HydrophobicContact CB-CZ 3.81Å; M252-F277 HydrophobicContact CE-CE2 4.16Å; M252-F277 HydrophobicContact CE-CZ 4.41Å; M252-F277 HydrophobicContact CG-CZ 4.3Å; M252-I285 HydrophobicContact CB-CD1 4.45Å; M252-I285 HydrophobicContact CG-CD1 3.99Å; M252-I285 HydrophobicContact CG-CG1 4.41Å; M252-I285 HydrophobicContact CG-CG2 3.93Å; M252-F292 HydrophobicContact CE-CD1 3.72Å; M252-F292 HydrophobicContact CE-CE1 3.7Å; M252-F292 HydrophobicContact SD-CD1 3.82Å; M252-F292 HydrophobicContact SD-CE1 4.42Å; M252-F292 HydrophobicContact SD-CG 4.4Å
253	S	95.6	Very high	93.1	Very high	49 Å²	49	49.5 Å²	49.5	34%	0.343	28%	0.279	S	S	.	.	H	α-helix	trans	-59.5	-27	177.9	-72.6	0	0	0	0	114.1	H251 I285 R286	H251-S253 VanDerWaalsContact C-N 3.35Å; H251-S253 PolarHBondContact O-N 3.31Å; S253-I285 WeakPolarHBondContact OG-CA 3.4Å; S253-R286 PolarHBondContact OG-N 3.35Å
254	A	95.8	Very high	92.5	Very high	46 Å²	46	50.3 Å²	50.3	38%	0.38	29%	0.29	S	S	.	.	H	α-helix	trans	-82.8	-40	172.8	0	0	0	0	0	111.4	P222 H251 M252 A257 T258	P222-A254 HydrophobicContact CB-CB 4.13Å; P222-A254 HydrophobicContact CG-CB 4.08Å; H251-A254 WeakPolarHBondContact O-CA 3.36Å; H251-A254 WeakPolarHBondContact O-CB 3.47Å; H251-A254 PolarHBondContact O-N 3.48Å; M252-A254 PolarHBondContact O-N 2.7Å; A254-A257 WeakPolarHBondContact O-CB 3.47Å; A254-A257 PolarHBondContact O-N 2.95Å; A254-T258 WeakPolarHBondContact O-CG2 3.22Å; A254-T258 PolarHBondContact O-N 2.93Å
255	I	94.8	Very high	92.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-59.6	-53.3	177.9	-64.6	163.7	0	0	0	110.2	P222 V225 I226 Y247 C248 H251 M252 A257 T258 C260 M262	P222-I255 HydrophobicContact CB-CG1 4.03Å; V225-I255 HydrophobicContact CG1-CD1 3.64Å; V225-I255 HydrophobicContact CG1-CG1 3.79Å; V225-I255 HydrophobicContact CG1-CG2 4.48Å; I226-I255 HydrophobicContact CD1-CG2 4.19Å; I226-I255 HydrophobicContact CG1-CG2 3.67Å; Y247-I255 HydrophobicContact CD1-CD1 4.23Å; Y247-I255 HydrophobicContact CE1-CD1 4.43Å; C248-I255 HydrophobicContact CB-CD1 4.33Å; H251-I255 HydrophobicContact CB-CD1 4.38Å; H251-I255 WeakPolarHBondContact O-CG1 3.31Å; H251-I255 PolarHBondContact O-N 2.94Å; M252-I255 PolarHBondContact O-N 3.07Å; I255-A257 PolarHBondContact O-N 3.41Å; I255-A257 VanDerWaalsContact O-N 3.09Å; I255-T258 WeakPolarHBondContact O-CB 3.42Å; I255-T258 PolarHBondContact O-N 3.1Å; I255-T258 PolarHBondContact O-OG1 3.01Å; I255-C260 PolarHBondContact O-SG 3.03Å; I255-M262 HydrophobicContact CG2-SD 4.26Å
256	V	94.2	Very high	91.9	Very high	7 Å²	7	53.3 Å²	53.3	4%	0.042	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-15.5	179.7	-57	0	0	0	0	113.5	M252 D287 K291 F292	M252-V256 HydrophobicContact CG-CG1 4.27Å; M252-V256 WeakPolarHBondContact O-CG2 3.41Å; M252-V256 PolarHBondContact O-N 3.27Å; M252-V256 HydrophobicContact SD-CG1 3.97Å; V256-D287 HydrophobicContact CB-CB 4.44Å; V256-D287 HydrophobicContact CG2-CB 3.96Å; V256-K291 HydrophobicContact CB-CD 4.42Å; V256-K291 WeakPolarHBondContact O-CD 3.41Å; V256-K291 WeakPolarHBondContact O-CE 3.34Å; V256-K291 PolarHBondContact O-NZ 3.2Å; V256-F292 HydrophobicContact CG1-CB 4.23Å
257	A	93.7	Very high	91.7	Very high	81 Å²	81	53.5 Å²	53.5	67%	0.669	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-29.2	171.1	0	0	0	0	0	112.8	A254 I255	A254-A257 WeakPolarHBondContact O-CB 3.47Å; A254-A257 PolarHBondContact O-N 2.95Å; I255-A257 PolarHBondContact O-N 3.41Å; I255-A257 VanDerWaalsContact O-N 3.09Å
258	T	92.6	Very high	91.5	Very high	25 Å²	25	56.2 Å²	56.2	15%	0.153	33%	0.332	C	S	.	.	S	Bend	trans	-73.3	160.5	179.5	78.3	0	0	0	0	112.5	P222 A254 I255 C260 K291	P222-T258 HydrophobicContact CB-CG2 3.87Å; P222-T258 PolarHBondContact O-OG1 3.1Å; A254-T258 WeakPolarHBondContact O-CG2 3.22Å; A254-T258 PolarHBondContact O-N 2.93Å; I255-T258 WeakPolarHBondContact O-CB 3.42Å; I255-T258 PolarHBondContact O-N 3.1Å; I255-T258 PolarHBondContact O-OG1 3.01Å; T258-C260 PolarHBondContact O-N 3.1Å; T258-C260 PolarHBondContact OG1-SG 3.5Å; T258-K291 PolarHBondContact O-NZ 3Å
259	P	86.5	Confident	91.4	Very high	141 Å²	141	56.4 Å²	56.4	92%	0.916	33%	0.333	S	S	*	.	S	Bend	trans	-76.8	42.9	179.5	33.2	-36.8	0	0	0	114
260	C	83.9	Confident	91.3	Very high	24 Å²	24	54.3 Å²	54.3	16%	0.162	32%	0.323	C	S	.	.			trans	-87.2	150.3	180	60.4	0	0	0	0	113.6	I255 T258 M262	I255-C260 PolarHBondContact O-SG 3.03Å; T258-C260 PolarHBondContact O-N 3.1Å; T258-C260 PolarHBondContact OG1-SG 3.5Å; C260-M262 HydrophobicContact CB-CE 3.45Å; C260-M262 VanDerWaalsContact CB-CE 3.45Å; C260-M262 WeakPolarHBondContact SG-CE 3.14Å
261	N	83.2	Confident	91.3	Very high	91 Å²	91	49.6 Å²	49.6	49%	0.487	31%	0.306	S	S	.	.			trans	-99.2	105.7	177.9	-177.7	5.6	0	0	0	112.1	N263	N261-N263 WeakPolarHBondContact OD1-CB 3.42Å; N261-N263 PolarHBondContact OD1-N 3.24Å; N261-N263 PolarHBondContact OD1-ND2 3.42Å
262	M	84.8	Confident	91.2	Very high	5 Å²	5	49.7 Å²	49.7	3%	0.025	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-84.6	-10	-176.1	-55.8	-59.7	81.9	0	0	114.1	I226 I255 C260 C264 I265 K291 F292	I226-M262 HydrophobicContact CB-CE 3.75Å; I226-M262 HydrophobicContact CD1-SD 4.47Å; I226-M262 HydrophobicContact CG1-CE 3.67Å; I226-M262 HydrophobicContact CG1-SD 3.9Å; I226-M262 HydrophobicContact CG2-CE 3.56Å; I226-M262 HydrophobicContact CG2-SD 4.32Å; I255-M262 HydrophobicContact CG2-SD 4.26Å; C260-M262 HydrophobicContact CB-CE 3.45Å; C260-M262 VanDerWaalsContact CB-CE 3.45Å; C260-M262 WeakPolarHBondContact SG-CE 3.14Å; M262-C264 PolarHBondContact O-N 3.12Å; M262-I265 HydrophobicContact CB-CD1 4.35Å; M262-I265 PolarHBondContact O-N 2.85Å; M262-I265 HydrophobicContact SD-CD1 4.12Å; M262-K291 HydrophobicContact CB-CB 4.34Å; M262-K291 VanDerWaalsContact CB-O 3.27Å; M262-K291 WeakPolarHBondContact CB-O 3.19Å; M262-K291 HydrophobicContact CG-CB 3.77Å; M262-F292 HydrophobicContact CB-CD2 4.25Å; M262-F292 HydrophobicContact CG-CB 4.36Å
263	N	85.2	Confident	91.2	Very high	129 Å²	129	49.4 Å²	49.4	69%	0.69	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-66.7	-28.8	-177.9	-64.2	-42.7	0	0	0	112	N261 I265	N261-N263 WeakPolarHBondContact OD1-CB 3.42Å; N261-N263 PolarHBondContact OD1-N 3.24Å; N261-N263 PolarHBondContact OD1-ND2 3.42Å; N263-I265 VanDerWaalsContact C-N 3.26Å; N263-I265 PolarHBondContact O-N 3.01Å
264	C	84.3	Confident	91.2	Very high	76 Å²	76	47 Å²	47	51%	0.514	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-72.2	-10.9	178.9	-58.3	0	0	0	0	114.5	I230 M262 N266	I230-C264 HydrophobicContact CD1-CB 3.6Å; M262-C264 PolarHBondContact O-N 3.12Å; C264-N266 PolarHBondContact O-N 3.33Å
265	I	90.9	Very high	91.1	Very high	5 Å²	5	49.8 Å²	49.8	3%	0.026	29%	0.29	C	S	.	.	S	Bend	trans	-69.3	120.2	173.1	-57.2	172.7	0	0	0	108.3	I226 M262 N263 L269 A270 F292 K295	I226-I265 HydrophobicContact CD1-CD1 4.25Å; I226-I265 HydrophobicContact CG2-CD1 3.87Å; I226-I265 HydrophobicContact CG2-CG1 3.81Å; M262-I265 HydrophobicContact CB-CD1 4.35Å; M262-I265 PolarHBondContact O-N 2.85Å; M262-I265 HydrophobicContact SD-CD1 4.12Å; N263-I265 VanDerWaalsContact C-N 3.26Å; N263-I265 PolarHBondContact O-N 3.01Å; I265-L269 HydrophobicContact CG2-CB 3.65Å; I265-L269 HydrophobicContact CG2-CD1 4.45Å; I265-A270 HydrophobicContact CG2-CB 4.35Å; I265-F292 HydrophobicContact CD1-CD2 4.1Å; I265-F292 HydrophobicContact CD1-CE2 3.75Å; I265-F292 HydrophobicContact CG2-CE2 4.45Å; I265-K295 PolarHBondContact O-NZ 3.31Å
266	N	90.4	Very high	91.1	Very high	60 Å²	60	52.4 Å²	52.4	32%	0.321	30%	0.304	S	S	.	.			trans	-66.1	170.4	-179.7	76.1	36	0	0	0	112.2	E233 C264 N268 L269 A270	E233-N266 PolarHBondContact OE1-ND2 2.85Å; C264-N266 PolarHBondContact O-N 3.33Å; N266-N268 VanDerWaalsContact C-N 3.28Å; N266-N268 PolarHBondContact O-N 3Å; N266-N268 WeakPolarHBondContact OD1-CA 3.39Å; N266-N268 PolarHBondContact OD1-N 3.06Å; N266-L269 WeakPolarHBondContact OD1-CB 3.27Å; N266-L269 PolarHBondContact OD1-N 3.03Å; N266-A270 WeakPolarHBondContact O-CB 3.44Å; N266-A270 PolarHBondContact O-N 3.03Å; N266-A270 VanDerWaalsContact O-N 3.08Å
267	S	91.8	Very high	91.1	Very high	66 Å²	66	52.7 Å²	52.7	46%	0.462	30%	0.304	S	S	.	.	H	α-helix	trans	-58.1	-38.5	179.6	45.4	0	0	0	0	113.4	A270 T271	S267-A270 PolarHBondContact O-N 3.5Å; S267-T271 PolarHBondContact O-N 2.92Å; S267-T271 PolarHBondContact O-OG1 3.36Å; S267-T271 VanDerWaalsContact O-OG1 3.07Å
268	N	93.2	Very high	91.2	Very high	105 Å²	105	51.2 Å²	51.2	56%	0.561	29%	0.285	S	S	*	.	H	α-helix	trans	-79.2	-42.4	-168.4	-55	2.4	0	0	0	110.6	N266 A270 T271 R272	N266-N268 VanDerWaalsContact C-N 3.28Å; N266-N268 PolarHBondContact O-N 3Å; N266-N268 WeakPolarHBondContact OD1-CA 3.39Å; N266-N268 PolarHBondContact OD1-N 3.06Å; N268-A270 VanDerWaalsContact C-N 3.33Å; N268-T271 PolarHBondContact O-N 3.25Å; N268-R272 PolarHBondContact O-N 2.72Å
269	L	94.6	Very high	91.3	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.016	28%	0.28	C	S	.	.	H	α-helix	trans	-60.7	-41.5	168.1	-70.8	178	0	0	0	111.3	L229 E233 V241 I245 I265 N266 T271 R272 I273	L229-L269 HydrophobicContact CD1-CD2 4.06Å; L229-L269 HydrophobicContact CG-CD1 4.19Å; E233-L269 HydrophobicContact CB-CD1 4.12Å; E233-L269 HydrophobicContact CG-CD1 3.99Å; E233-L269 HydrophobicContact CG-CD2 4.44Å; E233-L269 HydrophobicContact CG-CG 4.36Å; V241-L269 HydrophobicContact CG1-CD2 3.95Å; I245-L269 HydrophobicContact CD1-CD2 3.96Å; I265-L269 HydrophobicContact CG2-CB 3.65Å; I265-L269 HydrophobicContact CG2-CD1 4.45Å; N266-L269 WeakPolarHBondContact OD1-CB 3.27Å; N266-L269 PolarHBondContact OD1-N 3.03Å; L269-T271 VanDerWaalsContact C-N 3.34Å; L269-T271 PolarHBondContact O-N 2.63Å; L269-R272 PolarHBondContact O-N 2.74Å; L269-I273 WeakPolarHBondContact O-CB 3.49Å; L269-I273 WeakPolarHBondContact O-CD1 3.4Å; L269-I273 VanDerWaalsContact O-CG1 3.23Å; L269-I273 WeakPolarHBondContact O-CG1 3.35Å; L269-I273 PolarHBondContact O-N 2.94Å
270	A	95	Very high	91.7	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.008	24%	0.244	C	C	.	.	H	α-helix	trans	-63.2	-39.6	176.1	0	0	0	0	0	112.1	I265 N266 S267 N268 A274 F292	I265-A270 HydrophobicContact CG2-CB 4.35Å; N266-A270 WeakPolarHBondContact O-CB 3.44Å; N266-A270 PolarHBondContact O-N 3.03Å; N266-A270 VanDerWaalsContact O-N 3.08Å; S267-A270 PolarHBondContact O-N 3.5Å; N268-A270 VanDerWaalsContact C-N 3.33Å; A270-A274 WeakPolarHBondContact O-CB 3.48Å; A270-A274 PolarHBondContact O-N 2.98Å; A270-F292 HydrophobicContact CB-CE2 4.47Å; A270-F292 HydrophobicContact CB-CZ 4.43Å
271	T	94.6	Very high	92.2	Very high	37 Å²	37	47.6 Å²	47.6	23%	0.227	25%	0.253	C	S	.	.	H	α-helix	trans	-65.9	-48.7	173.3	-57.1	0	0	0	0	111.9	S267 N268 L269 I273 A274 E275 K299	S267-T271 PolarHBondContact O-N 2.92Å; S267-T271 PolarHBondContact O-OG1 3.36Å; S267-T271 VanDerWaalsContact O-OG1 3.07Å; N268-T271 PolarHBondContact O-N 3.25Å; L269-T271 VanDerWaalsContact C-N 3.34Å; L269-T271 PolarHBondContact O-N 2.63Å; T271-I273 VanDerWaalsContact C-N 3.27Å; T271-I273 PolarHBondContact O-N 3.17Å; T271-A274 CarbonylContact O-C 3.58Å; T271-A274 WeakPolarHBondContact O-CA 3.3Å; T271-A274 WeakPolarHBondContact O-CB 3.35Å; T271-A274 PolarHBondContact O-N 3.15Å; T271-E275 HydrophobicContact CG2-CG 4.41Å; T271-E275 WeakPolarHBondContact O-CG 3.26Å; T271-E275 PolarHBondContact O-N 2.63Å; T271-K299 WeakPolarHBondContact OG1-CE 3.45Å
272	R	95.3	Very high	92.8	Very high	86 Å²	86	43.2 Å²	43.2	33%	0.325	23%	0.23	S	C	.	.	H	α-helix	trans	-57.9	-37.2	176.7	-75.9	175.8	66.4	-173.5	2.4	112.9	E242 I245 N268 L269	E242-R272 IonicContact OE2-CZ 3.4Å; E242-R272 IonicContact OE2-NH2 2.75Å; E242-R272 PolarHBondContact OE2-NH2 3.32Å; I245-R272 HydrophobicContact CD1-CB 4.08Å; I245-R272 VanDerWaalsContact CD1-CZ 3.47Å; N268-R272 PolarHBondContact O-N 2.72Å; L269-R272 PolarHBondContact O-N 2.74Å
273	I	95.5	Very high	93.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-68.4	-42.8	172.9	-66.7	164.4	0	0	0	110.3	L229 I245 C248 M252 L269 T271 E275 L276 F277 F292	L229-I273 HydrophobicContact CD2-CD1 4.13Å; I245-I273 HydrophobicContact CB-CG1 4.5Å; I245-I273 HydrophobicContact CG1-CG1 4.13Å; I245-I273 HydrophobicContact CG2-CG1 4.04Å; C248-I273 HydrophobicContact CB-CD1 4.47Å; M252-I273 HydrophobicContact CE-CG2 3.8Å; L269-I273 WeakPolarHBondContact O-CB 3.49Å; L269-I273 WeakPolarHBondContact O-CD1 3.4Å; L269-I273 VanDerWaalsContact O-CG1 3.23Å; L269-I273 WeakPolarHBondContact O-CG1 3.35Å; L269-I273 PolarHBondContact O-N 2.94Å; T271-I273 VanDerWaalsContact C-N 3.27Å; T271-I273 PolarHBondContact O-N 3.17Å; I273-E275 VanDerWaalsContact C-N 3.3Å; I273-E275 PolarHBondContact O-N 3.01Å; I273-L276 PolarHBondContact O-N 3.36Å; I273-F277 HydrophobicContact CG2-CD2 4.24Å; I273-F277 HydrophobicContact CG2-CE2 3.86Å; I273-F277 WeakPolarHBondContact O-CD2 3.27Å; I273-F292 HydrophobicContact CB-CE1 4.49Å; I273-F292 HydrophobicContact CB-CZ 4.34Å; I273-F292 HydrophobicContact CD1-CZ 4.16Å; I273-F292 HydrophobicContact CG2-CE1 3.75Å; I273-F292 HydrophobicContact CG2-CZ 4.07Å
274	A	94.8	Very high	93.8	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.5	-30.7	179.2	0	0	0	0	0	114.4	A270 T271 L276 F277 L296 K299	A270-A274 WeakPolarHBondContact O-CB 3.48Å; A270-A274 PolarHBondContact O-N 2.98Å; T271-A274 CarbonylContact O-C 3.58Å; T271-A274 WeakPolarHBondContact O-CA 3.3Å; T271-A274 WeakPolarHBondContact O-CB 3.35Å; T271-A274 PolarHBondContact O-N 3.15Å; A274-L276 VanDerWaalsContact C-N 3.28Å; A274-L276 PolarHBondContact O-N 2.84Å; A274-F277 PolarHBondContact O-N 3.34Å; A274-L296 HydrophobicContact CB-CD1 3.78Å; A274-K299 HydrophobicContact CB-CB 3.68Å; A274-K299 HydrophobicContact CB-CG 4.43Å
275	E	93.4	Very high	94.3	Very high	103 Å²	103	41.4 Å²	41.4	48%	0.481	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-19.5	177.1	-72.4	167.4	166.6	0	0	114.1	T271 I273	T271-E275 HydrophobicContact CG2-CG 4.41Å; T271-E275 WeakPolarHBondContact O-CG 3.26Å; T271-E275 PolarHBondContact O-N 2.63Å; I273-E275 VanDerWaalsContact C-N 3.3Å; I273-E275 PolarHBondContact O-N 3.01Å
276	L	94.9	Very high	94.5	Very high	56 Å²	56	50.8 Å²	50.8	29%	0.293	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-31	174.9	-63.7	-172.8	0	0	0	113.3	I245 H249 I273 A274	I245-L276 HydrophobicContact CG2-CD1 3.67Å; I245-L276 HydrophobicContact CG2-CG 4.49Å; H249-L276 HydrophobicContact CB-CB 4.08Å; H249-L276 HydrophobicContact CB-CD1 3.88Å; H249-L276 PolarHBondContact NE2-O 3.01Å; H249-L276 VanDerWaalsContact NE2-O 3.16Å; I273-L276 PolarHBondContact O-N 3.36Å; A274-L276 VanDerWaalsContact C-N 3.28Å; A274-L276 PolarHBondContact O-N 2.84Å
277	F	95.6	Very high	94.6	Very high	12 Å²	12	48.9 Å²	48.9	5%	0.053	24%	0.239	C	C	.	.	S	Bend	trans	-80.3	133.7	177.7	-75.3	-81.2	0	0	0	111	H249 M252 I273 A274 E281 A282 I285 L296 K300	H249-F277 HydrophobicContact CB-CE2 4.43Å; H249-F277 HydrophobicContact CB-CZ 4.43Å; H249-F277 AromaticContact CD2-CD1 3.68Å; H249-F277 AromaticContact CD2-CD2 3.92Å; H249-F277 AromaticContact CD2-CE1 3.68Å; H249-F277 AromaticContact CD2-CE2 3.93Å; H249-F277 AromaticContact CD2-CG 3.79Å; H249-F277 AromaticContact CD2-CZ 3.8Å; H249-F277 WeakPolarHBondContact O-CZ 3.28Å; M252-F277 HydrophobicContact CB-CZ 3.81Å; M252-F277 HydrophobicContact CE-CE2 4.16Å; M252-F277 HydrophobicContact CE-CZ 4.41Å; M252-F277 HydrophobicContact CG-CZ 4.3Å; I273-F277 HydrophobicContact CG2-CD2 4.24Å; I273-F277 HydrophobicContact CG2-CE2 3.86Å; I273-F277 WeakPolarHBondContact O-CD2 3.27Å; A274-F277 PolarHBondContact O-N 3.34Å; F277-E281 HydrophobicContact CD1-CB 3.87Å; F277-A282 HydrophobicContact CB-CB 4.26Å; F277-I285 HydrophobicContact CD1-CD1 4.19Å; F277-I285 HydrophobicContact CE1-CD1 3.82Å; F277-I285 HydrophobicContact CE1-CG1 4.22Å; F277-I285 HydrophobicContact CZ-CD1 4.01Å; F277-L296 HydrophobicContact CB-CD2 4.47Å; F277-L296 HydrophobicContact CD2-CD1 3.8Å; F277-L296 HydrophobicContact CD2-CD2 4.09Å; F277-L296 HydrophobicContact CE2-CD1 4.41Å; F277-L296 HydrophobicContact CG-CD1 4.44Å; F277-L296 HydrophobicContact CG-CD2 4.14Å; F277-K300 VanDerWaalsContact O-CE 3.23Å; F277-K300 WeakPolarHBondContact O-CE 3.46Å; F277-K300 PolarHBondContact O-NZ 3.42Å
278	N	93.9	Very high	94.6	Very high	51 Å²	51	55.7 Å²	55.7	27%	0.273	26%	0.261	S	S	.	.			trans	-77.4	162.9	155.6	73.2	62.4	0	0	0	110.5	N280 E281 A282 D313	N278-N280 VanDerWaalsContact C-N 3.26Å; N278-N280 PolarHBondContact O-N 3.38Å; N278-N280 WeakPolarHBondContact OD1-CA 3.48Å; N278-N280 WeakPolarHBondContact OD1-CB 3.32Å; N278-N280 PolarHBondContact OD1-N 3.45Å; N278-E281 PolarHBondContact N-OE2 3.25Å; N278-E281 VanDerWaalsContact ND2-CG 3.28Å; N278-E281 WeakPolarHBondContact ND2-CG 3.41Å; N278-E281 PolarHBondContact ND2-OE1 3.44Å; N278-E281 PolarHBondContact O-N 3.42Å; N278-E281 PolarHBondContact OD1-N 2.97Å; N278-A282 WeakPolarHBondContact O-CB 3.34Å; N278-A282 PolarHBondContact O-N 3.49Å; N278-D313 WeakPolarHBondContact CA-OD2 3.44Å; N278-D313 WeakPolarHBondContact CB-OD1 3.34Å
279	H	94.8	Very high	94.5	Very high	7 Å²	7	58.8 Å²	58.8	3%	0.032	27%	0.269	C	S	.	.	H	α-helix	trans	-59.4	-27.7	-177.7	61.2	172.6	0	0	0	115.4	D283 K300 D313 Y384 W385 W388 D482	H279-D283 PolarHBondContact O-N 3.21Å; H279-K300 HydrophobicContact CB-CD 4.23Å; H279-D313 HydrophobicContact CB-CB 4.16Å; H279-D313 PolarHBondContact CE1-O 2.76Å; H279-D313 IonicContact CG-OD2 2.7Å; H279-D313 PolarHBondContact N-OD2 3.31Å; H279-Y384 HydrophobicContact CB-CE1 3.78Å; H279-Y384 WeakPolarHBondContact CB-OH 3.48Å; H279-Y384 PolarHBondContact ND1-OH 3.35Å; H279-W385 HydrophobicContact CB-CH2 4.04Å; H279-W385 HydrophobicContact CB-CZ2 4.3Å; H279-W385 AromaticContact CE1-CH2 3.74Å; H279-W385 AromaticContact CE1-CZ3 3.95Å; H279-W385 AromaticContact CG-CH2 3.58Å; H279-W385 AromaticContact ND1-CH2 3.21Å; H279-W385 WeakPolarHBondContact ND1-CH2 3.4Å; H279-W385 AromaticContact ND1-CZ3 3.5Å; H279-W388 AromaticContact CE1-NE1 3.76Å; H279-W388 AromaticContact ND1-NE1 3.76Å; H279-D482 IonicContact CE1-OD1 3.44Å; H279-D482 IonicContact CE1-OD2 3.76Å; H279-D482 PolarHBondContact CE1-OD2 2.91Å; H279-D482 IonicContact NE2-OD1 2.82Å; H279-D482 IonicContact NE2-OD2 3.72Å
280	N	95.4	Very high	94.3	Very high	31 Å²	31	62.4 Å²	62.4	17%	0.166	29%	0.288	C	S	.	.	H	α-helix	trans	-81.4	-45.6	178	-66.9	-45.7	0	0	0	110.9	N278 A282 D283 D284 D482 H486	N278-N280 VanDerWaalsContact C-N 3.26Å; N278-N280 PolarHBondContact O-N 3.38Å; N278-N280 WeakPolarHBondContact OD1-CA 3.48Å; N278-N280 WeakPolarHBondContact OD1-CB 3.32Å; N278-N280 PolarHBondContact OD1-N 3.45Å; N280-A282 PolarHBondContact O-N 3.25Å; N280-D283 PolarHBondContact O-N 3.22Å; N280-D284 PolarHBondContact O-N 3.28Å; N280-D482 PolarHBondContact ND2-OD1 2.85Å; N280-H486 PolarHBondContact OD1-NE2 3.43Å
281	E	95.4	Very high	94.2	Very high	75 Å²	75	64.7 Å²	64.7	35%	0.35	30%	0.298	S	S	.	.	H	α-helix	trans	-56.5	-37.5	170.5	-73.3	171.2	-173.9	0	0	111.9	H249 F277 N278 D283 I285	H249-E281 IonicContact CD2-OE2 3.73Å; H249-E281 IonicContact CE1-OE2 2.73Å; H249-E281 IonicContact NE2-OE2 2.91Å; H249-E281 PolarHBondContact NE2-OE2 3.25Å; F277-E281 HydrophobicContact CD1-CB 3.87Å; N278-E281 PolarHBondContact N-OE2 3.25Å; N278-E281 VanDerWaalsContact ND2-CG 3.28Å; N278-E281 WeakPolarHBondContact ND2-CG 3.41Å; N278-E281 PolarHBondContact ND2-OE1 3.44Å; N278-E281 PolarHBondContact O-N 3.42Å; N278-E281 PolarHBondContact OD1-N 2.97Å; E281-D283 VanDerWaalsContact C-N 3.33Å; E281-I285 WeakPolarHBondContact O-CG1 3.46Å
282	A	95.4	Very high	94.2	Very high	0 Å²	0	63 Å²	63	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.4	-35.7	175	0	0	0	0	0	112.4	F277 N278 N280 K293 L296 F297 K300	F277-A282 HydrophobicContact CB-CB 4.26Å; N278-A282 WeakPolarHBondContact O-CB 3.34Å; N278-A282 PolarHBondContact O-N 3.49Å; N280-A282 PolarHBondContact O-N 3.25Å; A282-K293 WeakPolarHBondContact O-CE 3.45Å; A282-L296 HydrophobicContact CB-CD2 3.55Å; A282-L296 HydrophobicContact CB-CG 4.33Å; A282-F297 HydrophobicContact CB-CE2 3.78Å; A282-F297 HydrophobicContact CB-CZ 3.78Å; A282-F297 WeakPolarHBondContact O-CE2 3.44Å; A282-K300 HydrophobicContact CB-CD 4.34Å
283	D	94.9	Very high	94.2	Very high	37 Å²	37	60.4 Å²	60.4	20%	0.198	28%	0.279	C	S	.	.	H	α-helix	trans	-76.8	-35.2	178	-141.2	-25	0	0	0	112.3	H279 N280 E281 I285 K293 F297 V381 W385 H486	H279-D283 PolarHBondContact O-N 3.21Å; N280-D283 PolarHBondContact O-N 3.22Å; E281-D283 VanDerWaalsContact C-N 3.33Å; D283-I285 PolarHBondContact O-N 2.85Å; D283-K293 WeakPolarHBondContact O-CE 3.43Å; D283-K293 PolarHBondContact O-NZ 2.87Å; D283-K293 WeakPolarHBondContact OD1-CE 3.33Å; D283-K293 IonicContact OD1-NZ 3.44Å; D283-K293 PolarHBondContact OD1-NZ 3.02Å; D283-F297 HydrophobicContact CB-CZ 4.04Å; D283-V381 WeakPolarHBondContact OD1-CG1 3.5Å; D283-V381 WeakPolarHBondContact OD2-CG1 3.33Å; D283-W385 PolarHBondContact OD2-NE1 3.48Å; D283-H486 IonicContact OD2-CE1 2.65Å; D283-H486 PolarHBondContact OD2-CE1 3.18Å; D283-H486 IonicContact OD2-ND1 2.69Å
284	D	95.4	Very high	94.1	Very high	124 Å²	124	61 Å²	61	66%	0.663	28%	0.283	S	S	*	.	S	Bend	trans	-64.7	-9.8	175.7	-87.5	-34.8	0	0	0	114.4	N280 R286	N280-D284 PolarHBondContact O-N 3.28Å; D284-R286 PolarHBondContact O-N 3.34Å
285	I	95.9	Very high	94.1	Very high	10 Å²	10	63.3 Å²	63.3	5%	0.051	29%	0.293	C	S	.	.			trans	-63.9	122.7	177	-59.9	169.3	0	0	0	111	M252 S253 F277 E281 D283 D287 L296	M252-I285 HydrophobicContact CB-CD1 4.45Å; M252-I285 HydrophobicContact CG-CD1 3.99Å; M252-I285 HydrophobicContact CG-CG1 4.41Å; M252-I285 HydrophobicContact CG-CG2 3.93Å; S253-I285 WeakPolarHBondContact OG-CA 3.4Å; F277-I285 HydrophobicContact CD1-CD1 4.19Å; F277-I285 HydrophobicContact CE1-CD1 3.82Å; F277-I285 HydrophobicContact CE1-CG1 4.22Å; F277-I285 HydrophobicContact CZ-CD1 4.01Å; E281-I285 WeakPolarHBondContact O-CG1 3.46Å; D283-I285 PolarHBondContact O-N 2.85Å; I285-D287 VanDerWaalsContact C-N 3.25Å; I285-D287 HydrophobicContact CG2-CB 4.15Å; I285-D287 PolarHBondContact O-N 3.42Å; I285-L296 HydrophobicContact CD1-CD2 3.31Å
286	R	94.3	Very high	94.2	Very high	203 Å²	203	58.4 Å²	58.4	77%	0.766	27%	0.27	S	S	*	.			trans	-86.3	49.5	-173.3	-61	-169.4	173.3	-144	-6.9	113.9	S253 D284 K288	S253-R286 PolarHBondContact OG-N 3.35Å; D284-R286 PolarHBondContact O-N 3.34Å; R286-K288 PolarHBondContact O-N 3.08Å; R286-K288 VanDerWaalsContact O-N 3.09Å
287	D	93.5	Very high	94.3	Very high	19 Å²	19	55.8 Å²	55.8	10%	0.102	26%	0.256	C	S	.	.			trans	-83.6	77.2	-176.1	-166.3	-4.2	0	0	0	113.3	V256 I285 K289 D290 K291 F292 K293	V256-D287 HydrophobicContact CB-CB 4.44Å; V256-D287 HydrophobicContact CG2-CB 3.96Å; I285-D287 VanDerWaalsContact C-N 3.25Å; I285-D287 HydrophobicContact CG2-CB 4.15Å; I285-D287 PolarHBondContact O-N 3.42Å; D287-K289 PolarHBondContact O-N 3.34Å; D287-K289 PolarHBondContact OD1-N 3.16Å; D287-D290 PolarHBondContact O-N 3.32Å; D287-D290 PolarHBondContact OD1-N 3.48Å; D287-K291 VanDerWaalsContact CG-N 3.29Å; D287-K291 PolarHBondContact OD1-N 3.46Å; D287-K291 VanDerWaalsContact OD1-N 3.09Å; D287-K291 PolarHBondContact OD2-N 2.94Å; D287-F292 PolarHBondContact OD2-N 3.11Å; D287-K293 HydrophobicContact CB-CB 3.84Å; D287-K293 PolarHBondContact OD2-N 3.31Å
288	K	89.9	Confident	94.3	Very high	209 Å²	209	58.5 Å²	58.5	91%	0.909	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-7.3	179.4	-66.6	-169.4	178.4	-173.7	0	115.5	R286	R286-K288 PolarHBondContact O-N 3.08Å; R286-K288 VanDerWaalsContact O-N 3.09Å
289	K	91.4	Very high	94.4	Very high	170 Å²	170	57.4 Å²	57.4	74%	0.739	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.3	7.8	-178.8	-70.3	-169.3	174.5	-172.8	0	112.9	D287 K291	D287-K289 PolarHBondContact O-N 3.34Å; D287-K289 PolarHBondContact OD1-N 3.16Å; K289-K291 VanDerWaalsContact C-N 3.26Å; K289-K291 HydrophobicContact CB-CG 4.2Å; K289-K291 PolarHBondContact O-N 2.88Å
290	D	91.6	Very high	94.4	Very high	79 Å²	79	57.3 Å²	57.3	42%	0.422	26%	0.261	S	S	.	.			trans	43.9	47.8	-177.7	-161	21.4	0	0	0	114.1	D287 S294	D287-D290 PolarHBondContact O-N 3.32Å; D287-D290 PolarHBondContact OD1-N 3.48Å; D290-S294 VanDerWaalsContact CG-OG 3.25Å; D290-S294 VanDerWaalsContact OD1-CB 3.25Å; D290-S294 WeakPolarHBondContact OD1-CB 3.09Å; D290-S294 PolarHBondContact OD1-N 2.91Å; D290-S294 PolarHBondContact OD1-OG 3.28Å; D290-S294 WeakPolarHBondContact OD2-CB 3.38Å; D290-S294 PolarHBondContact OD2-OG 2.95Å
291	K	92.3	Very high	94.4	Very high	49 Å²	49	56.3 Å²	56.3	21%	0.213	26%	0.256	C	S	.	.	S	Bend	trans	-71.8	-31.2	178	-66.3	178.4	179.3	166.2	0	112.5	V256 T258 M262 D287 K289	V256-K291 HydrophobicContact CB-CD 4.42Å; V256-K291 WeakPolarHBondContact O-CD 3.41Å; V256-K291 WeakPolarHBondContact O-CE 3.34Å; V256-K291 PolarHBondContact O-NZ 3.2Å; T258-K291 PolarHBondContact O-NZ 3Å; M262-K291 HydrophobicContact CB-CB 4.34Å; M262-K291 VanDerWaalsContact CB-O 3.27Å; M262-K291 WeakPolarHBondContact CB-O 3.19Å; M262-K291 HydrophobicContact CG-CB 3.77Å; D287-K291 VanDerWaalsContact CG-N 3.29Å; D287-K291 PolarHBondContact OD1-N 3.46Å; D287-K291 VanDerWaalsContact OD1-N 3.09Å; D287-K291 PolarHBondContact OD2-N 2.94Å; K289-K291 VanDerWaalsContact C-N 3.26Å; K289-K291 HydrophobicContact CB-CG 4.2Å; K289-K291 PolarHBondContact O-N 2.88Å
292	F	94.3	Very high	94.3	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.009	26%	0.262	C	S	.	.	S	Bend	trans	-146.1	-23.8	-174.2	-160.7	-107.1	0	0	0	113.9	M252 V256 M262 I265 A270 I273 D287 S294 K295 L296	M252-F292 HydrophobicContact CE-CD1 3.72Å; M252-F292 HydrophobicContact CE-CE1 3.7Å; M252-F292 HydrophobicContact SD-CD1 3.82Å; M252-F292 HydrophobicContact SD-CE1 4.42Å; M252-F292 HydrophobicContact SD-CG 4.4Å; V256-F292 HydrophobicContact CG1-CB 4.23Å; M262-F292 HydrophobicContact CB-CD2 4.25Å; M262-F292 HydrophobicContact CG-CB 4.36Å; I265-F292 HydrophobicContact CD1-CD2 4.1Å; I265-F292 HydrophobicContact CD1-CE2 3.75Å; I265-F292 HydrophobicContact CG2-CE2 4.45Å; A270-F292 HydrophobicContact CB-CE2 4.47Å; A270-F292 HydrophobicContact CB-CZ 4.43Å; I273-F292 HydrophobicContact CB-CE1 4.49Å; I273-F292 HydrophobicContact CB-CZ 4.34Å; I273-F292 HydrophobicContact CD1-CZ 4.16Å; I273-F292 HydrophobicContact CG2-CE1 3.75Å; I273-F292 HydrophobicContact CG2-CZ 4.07Å; D287-F292 PolarHBondContact OD2-N 3.11Å; F292-S294 PolarHBondContact O-N 2.88Å; F292-K295 HydrophobicContact CD2-CB 4.42Å; F292-K295 HydrophobicContact CD2-CD 4.18Å; F292-K295 HydrophobicContact CE2-CD 4.12Å; F292-K295 HydrophobicContact CE2-CG 4.48Å; F292-K295 WeakPolarHBondContact O-CB 3.23Å; F292-K295 PolarHBondContact O-N 3.45Å; F292-L296 HydrophobicContact CD1-CB 4.42Å; F292-L296 HydrophobicContact CE1-CB 4.44Å; F292-L296 HydrophobicContact CE1-CD1 4.05Å; F292-L296 PolarHBondContact O-N 3.05Å
293	K	94.6	Very high	94.2	Very high	32 Å²	32	58.3 Å²	58.3	14%	0.139	27%	0.265	C	S	.	.	H	α-helix	trans	-59.6	-47.1	-175.4	-172	175.5	179.2	-177.9	0	113	A282 D283 D287 K295 L296 F297 V381	A282-K293 WeakPolarHBondContact O-CE 3.45Å; D283-K293 WeakPolarHBondContact O-CE 3.43Å; D283-K293 PolarHBondContact O-NZ 2.87Å; D283-K293 WeakPolarHBondContact OD1-CE 3.33Å; D283-K293 IonicContact OD1-NZ 3.44Å; D283-K293 PolarHBondContact OD1-NZ 3.02Å; D287-K293 HydrophobicContact CB-CB 3.84Å; D287-K293 PolarHBondContact OD2-N 3.31Å; K293-K295 VanDerWaalsContact C-N 3.31Å; K293-K295 PolarHBondContact O-N 3.47Å; K293-L296 WeakPolarHBondContact O-CB 3.44Å; K293-L296 PolarHBondContact O-N 2.94Å; K293-F297 HydrophobicContact CG-CD2 4.03Å; K293-F297 HydrophobicContact CG-CE2 4.14Å; K293-F297 WeakPolarHBondContact O-CD2 3.48Å; K293-F297 PolarHBondContact O-N 3.38Å; K293-V381 HydrophobicContact CD-CG2 4.28Å; K293-V381 HydrophobicContact CG-CG2 4.33Å
294	S	94.9	Very high	94.2	Very high	12 Å²	12	56.6 Å²	56.6	8%	0.084	26%	0.256	C	S	.	.	H	α-helix	trans	-61.5	-36.8	173.6	-83	0	0	0	0	113	D290 F292 L296 F297 Q298	D290-S294 VanDerWaalsContact CG-OG 3.25Å; D290-S294 VanDerWaalsContact OD1-CB 3.25Å; D290-S294 WeakPolarHBondContact OD1-CB 3.09Å; D290-S294 PolarHBondContact OD1-N 2.91Å; D290-S294 PolarHBondContact OD1-OG 3.28Å; D290-S294 WeakPolarHBondContact OD2-CB 3.38Å; D290-S294 PolarHBondContact OD2-OG 2.95Å; F292-S294 PolarHBondContact O-N 2.88Å; S294-L296 VanDerWaalsContact C-N 3.33Å; S294-F297 PolarHBondContact O-N 3.04Å; S294-Q298 WeakPolarHBondContact O-CB 3.26Å; S294-Q298 VanDerWaalsContact O-CG 3.23Å; S294-Q298 WeakPolarHBondContact O-CG 3.39Å; S294-Q298 PolarHBondContact O-N 2.87Å
295	K	94.6	Very high	94.2	Very high	48 Å²	48	53 Å²	53	21%	0.209	24%	0.235	C	C	.	.	H	α-helix	trans	-67.4	-34.9	177.6	-170.1	170.7	176.9	175.9	0	111.8	I265 F292 K293 K299	I265-K295 PolarHBondContact O-NZ 3.31Å; F292-K295 HydrophobicContact CD2-CB 4.42Å; F292-K295 HydrophobicContact CD2-CD 4.18Å; F292-K295 HydrophobicContact CE2-CD 4.12Å; F292-K295 HydrophobicContact CE2-CG 4.48Å; F292-K295 WeakPolarHBondContact O-CB 3.23Å; F292-K295 PolarHBondContact O-N 3.45Å; K293-K295 VanDerWaalsContact C-N 3.31Å; K293-K295 PolarHBondContact O-N 3.47Å; K295-K299 PolarHBondContact O-N 2.93Å
296	L	95.5	Very high	94	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-65.3	-46.9	172	-169.5	73.8	0	0	0	111.3	A274 F277 A282 I285 F292 K293 S294 K299 K300	A274-L296 HydrophobicContact CB-CD1 3.78Å; F277-L296 HydrophobicContact CB-CD2 4.47Å; F277-L296 HydrophobicContact CD2-CD1 3.8Å; F277-L296 HydrophobicContact CD2-CD2 4.09Å; F277-L296 HydrophobicContact CE2-CD1 4.41Å; F277-L296 HydrophobicContact CG-CD1 4.44Å; F277-L296 HydrophobicContact CG-CD2 4.14Å; A282-L296 HydrophobicContact CB-CD2 3.55Å; A282-L296 HydrophobicContact CB-CG 4.33Å; I285-L296 HydrophobicContact CD1-CD2 3.31Å; F292-L296 HydrophobicContact CD1-CB 4.42Å; F292-L296 HydrophobicContact CE1-CB 4.44Å; F292-L296 HydrophobicContact CE1-CD1 4.05Å; F292-L296 PolarHBondContact O-N 3.05Å; K293-L296 WeakPolarHBondContact O-CB 3.44Å; K293-L296 PolarHBondContact O-N 2.94Å; S294-L296 VanDerWaalsContact C-N 3.33Å; L296-K299 PolarHBondContact O-N 3.06Å; L296-K300 PolarHBondContact O-N 3.17Å
297	F	96.8	Very high	93.8	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-70.5	-31.2	177.5	-85.5	-82.4	0	0	0	113.5	A282 D283 K293 S294 K299 K300 I301 W380 V381 Y384	A282-F297 HydrophobicContact CB-CE2 3.78Å; A282-F297 HydrophobicContact CB-CZ 3.78Å; A282-F297 WeakPolarHBondContact O-CE2 3.44Å; D283-F297 HydrophobicContact CB-CZ 4.04Å; K293-F297 HydrophobicContact CG-CD2 4.03Å; K293-F297 HydrophobicContact CG-CE2 4.14Å; K293-F297 WeakPolarHBondContact O-CD2 3.48Å; K293-F297 PolarHBondContact O-N 3.38Å; S294-F297 PolarHBondContact O-N 3.04Å; F297-K299 VanDerWaalsContact C-N 3.35Å; F297-K300 PolarHBondContact O-N 3.41Å; F297-I301 VanDerWaalsContact O-CG1 3.29Å; F297-I301 WeakPolarHBondContact O-CG1 3.46Å; F297-I301 PolarHBondContact O-N 3.25Å; F297-W380 HydrophobicContact CB-CB 4.19Å; F297-V381 HydrophobicContact CD2-CB 4.41Å; F297-V381 HydrophobicContact CD2-CG1 4.5Å; F297-V381 HydrophobicContact CD2-CG2 3.77Å; F297-V381 HydrophobicContact CE1-CG1 4.24Å; F297-V381 HydrophobicContact CE2-CB 4.49Å; F297-V381 HydrophobicContact CE2-CG1 4.11Å; F297-V381 HydrophobicContact CE2-CG2 4Å; F297-V381 HydrophobicContact CG-CG2 4.23Å; F297-V381 HydrophobicContact CZ-CG1 3.97Å; F297-Y384 AromaticContact CD1-CD1 3.87Å; F297-Y384 HydrophobicContact CD1-CD1 3.87Å; F297-Y384 HydrophobicContact CD1-CD2 4.32Å; F297-Y384 AromaticContact CD1-CG 3.67Å; F297-Y384 HydrophobicContact CD1-CG 3.67Å; F297-Y384 AromaticContact CE1-CD1 3.67Å; F297-Y384 HydrophobicContact CE1-CD1 3.67Å; F297-Y384 HydrophobicContact CE1-CE1 4.25Å; F297-Y384 AromaticContact CE1-CG 3.98Å; F297-Y384 HydrophobicContact CE1-CG 3.98Å
298	Q	95.8	Very high	93.6	Very high	70 Å²	70	56 Å²	56	33%	0.327	27%	0.272	S	S	.	.	H	α-helix	trans	-57.3	-47.1	167.6	-76.1	164.2	2.1	0	0	111	S294 K300 I301 E302 W380	S294-Q298 WeakPolarHBondContact O-CB 3.26Å; S294-Q298 VanDerWaalsContact O-CG 3.23Å; S294-Q298 WeakPolarHBondContact O-CG 3.39Å; S294-Q298 PolarHBondContact O-N 2.87Å; Q298-K300 PolarHBondContact O-N 2.75Å; Q298-I301 PolarHBondContact O-N 2.93Å; Q298-I301 VanDerWaalsContact O-N 3.15Å; Q298-E302 WeakPolarHBondContact O-CG 3.29Å; Q298-E302 PolarHBondContact O-N 3.15Å; Q298-W380 HydrophobicContact CG-CD2 3.77Å; Q298-W380 HydrophobicContact CG-CE3 4.13Å; Q298-W380 HydrophobicContact CG-CG 3.93Å
299	K	95.3	Very high	93.4	Very high	28 Å²	28	48.5 Å²	48.5	12%	0.122	24%	0.24	C	C	.	.	H	α-helix	trans	-64.5	-36.8	174.8	-68.9	-44.5	-169.2	-170.6	0	113.4	T271 A274 K295 L296 F297 I301 E302 Q303	T271-K299 WeakPolarHBondContact OG1-CE 3.45Å; A274-K299 HydrophobicContact CB-CB 3.68Å; A274-K299 HydrophobicContact CB-CG 4.43Å; K295-K299 PolarHBondContact O-N 2.93Å; L296-K299 PolarHBondContact O-N 3.06Å; F297-K299 VanDerWaalsContact C-N 3.35Å; K299-I301 VanDerWaalsContact C-N 3.34Å; K299-I301 PolarHBondContact O-N 2.96Å; K299-E302 WeakPolarHBondContact CD-OE1 3.44Å; K299-E302 VanDerWaalsContact CD-OE2 3.27Å; K299-E302 WeakPolarHBondContact CD-OE2 3.34Å; K299-E302 IonicContact NZ-OE1 3.3Å; K299-E302 PolarHBondContact NZ-OE1 3.25Å; K299-E302 IonicContact NZ-OE2 2.71Å; K299-E302 PolarHBondContact NZ-OE2 3Å; K299-E302 PolarHBondContact O-N 2.91Å; K299-Q303 WeakPolarHBondContact O-CB 3.44Å; K299-Q303 VanDerWaalsContact O-CG 3.3Å; K299-Q303 WeakPolarHBondContact O-CG 3.47Å; K299-Q303 PolarHBondContact O-N 3.25Å
300	K	95	Very high	92.9	Very high	4 Å²	4	49.1 Å²	49.1	2%	0.017	25%	0.245	C	C	.	.	H	α-helix	trans	-66.2	-32.3	171.4	-74.4	-167.6	169.7	-70.3	0	113.4	F277 H279 A282 L296 F297 Q298 L304 D313 Y384	F277-K300 VanDerWaalsContact O-CE 3.23Å; F277-K300 WeakPolarHBondContact O-CE 3.46Å; F277-K300 PolarHBondContact O-NZ 3.42Å; H279-K300 HydrophobicContact CB-CD 4.23Å; A282-K300 HydrophobicContact CB-CD 4.34Å; L296-K300 PolarHBondContact O-N 3.17Å; F297-K300 PolarHBondContact O-N 3.41Å; Q298-K300 PolarHBondContact O-N 2.75Å; K300-L304 WeakPolarHBondContact O-CG 3.42Å; K300-L304 PolarHBondContact O-N 2.82Å; K300-D313 IonicContact NZ-OD2 2.8Å; K300-D313 PolarHBondContact NZ-OD2 2.99Å; K300-Y384 HydrophobicContact CB-CD2 3.91Å; K300-Y384 HydrophobicContact CB-CE2 3.76Å
301	I	95.6	Very high	92.5	Very high	11 Å²	11	46.4 Å²	46.4	6%	0.056	23%	0.231	C	C	.	.	H	α-helix	trans	-70.1	-45.3	173.3	-68.3	162.5	0	0	0	110.7	F297 Q298 K299 Q303 L304 F305 W380 V383 Y384 I387	F297-I301 VanDerWaalsContact O-CG1 3.29Å; F297-I301 WeakPolarHBondContact O-CG1 3.46Å; F297-I301 PolarHBondContact O-N 3.25Å; Q298-I301 PolarHBondContact O-N 2.93Å; Q298-I301 VanDerWaalsContact O-N 3.15Å; K299-I301 VanDerWaalsContact C-N 3.34Å; K299-I301 PolarHBondContact O-N 2.96Å; I301-Q303 VanDerWaalsContact C-N 3.27Å; I301-Q303 PolarHBondContact O-N 3.22Å; I301-L304 WeakPolarHBondContact O-CB 3.47Å; I301-L304 PolarHBondContact O-N 3.32Å; I301-F305 HydrophobicContact CG2-CD2 4.12Å; I301-F305 HydrophobicContact CG2-CE2 3.97Å; I301-F305 WeakPolarHBondContact O-CD2 3.44Å; I301-F305 PolarHBondContact O-N 3.01Å; I301-W380 HydrophobicContact CD1-CE3 3.7Å; I301-W380 HydrophobicContact CD1-CZ3 4.3Å; I301-V383 HydrophobicContact CD1-CB 4.2Å; I301-V383 HydrophobicContact CD1-CG1 3.88Å; I301-Y384 HydrophobicContact CG1-CD2 3.98Å; I301-Y384 HydrophobicContact CG1-CG 4.44Å; I301-I387 HydrophobicContact CG2-CD1 4.26Å
302	E	94.3	Very high	92	Very high	100 Å²	100	52.2 Å²	52.2	47%	0.467	26%	0.256	S	S	.	.	H	α-helix	trans	-53.3	-46.2	172.8	-70.7	173.6	-149.6	0	0	111.1	Q298 K299 L304 F305 D306	Q298-E302 WeakPolarHBondContact O-CG 3.29Å; Q298-E302 PolarHBondContact O-N 3.15Å; K299-E302 WeakPolarHBondContact CD-OE1 3.44Å; K299-E302 VanDerWaalsContact CD-OE2 3.27Å; K299-E302 WeakPolarHBondContact CD-OE2 3.34Å; K299-E302 IonicContact NZ-OE1 3.3Å; K299-E302 PolarHBondContact NZ-OE1 3.25Å; K299-E302 IonicContact NZ-OE2 2.71Å; K299-E302 PolarHBondContact NZ-OE2 3Å; K299-E302 PolarHBondContact O-N 2.91Å; E302-L304 PolarHBondContact O-N 2.85Å; E302-F305 PolarHBondContact O-N 3.48Å; E302-D306 PolarHBondContact O-N 3.24Å; E302-D306 VanDerWaalsContact O-N 3.15Å
303	Q	93.4	Very high	91.5	Very high	16 Å²	16	53.2 Å²	53.2	8%	0.075	26%	0.261	C	S	.	.	H	α-helix	trans	-63.9	-18.9	176	-74.7	169.8	-18.4	0	0	114.9	K299 I301	K299-Q303 WeakPolarHBondContact O-CB 3.44Å; K299-Q303 VanDerWaalsContact O-CG 3.3Å; K299-Q303 WeakPolarHBondContact O-CG 3.47Å; K299-Q303 PolarHBondContact O-N 3.25Å; I301-Q303 VanDerWaalsContact C-N 3.27Å; I301-Q303 PolarHBondContact O-N 3.22Å
304	L	94.3	Very high	91.1	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-78.4	-28.2	170.7	-65.9	-178.2	0	0	0	111.9	K300 I301 E302 A318 Y384 I387 W388 I391	K300-L304 WeakPolarHBondContact O-CG 3.42Å; K300-L304 PolarHBondContact O-N 2.82Å; I301-L304 WeakPolarHBondContact O-CB 3.47Å; I301-L304 PolarHBondContact O-N 3.32Å; E302-L304 PolarHBondContact O-N 2.85Å; L304-A318 HydrophobicContact CB-CB 4.1Å; L304-A318 WeakPolarHBondContact O-CA 3.39Å; L304-A318 VanDerWaalsContact O-CB 3.26Å; L304-A318 WeakPolarHBondContact O-CB 3.43Å; L304-A318 PolarHBondContact O-N 2.73Å; L304-Y384 HydrophobicContact CD1-CD2 3.87Å; L304-Y384 HydrophobicContact CD1-CE2 3.65Å; L304-Y384 HydrophobicContact CD2-CE2 4.32Å; L304-Y384 HydrophobicContact CG-CE2 4.01Å; L304-I387 HydrophobicContact CD1-CG2 4.01Å; L304-W388 HydrophobicContact CD1-CB 4.48Å; L304-I391 HydrophobicContact CB-CD1 4.31Å; L304-I391 HydrophobicContact CD1-CD1 3.95Å; L304-I391 HydrophobicContact CD2-CD1 3.97Å; L304-I391 HydrophobicContact CG-CD1 4.29Å
305	F	94.4	Very high	90.7	Very high	47 Å²	47	55.6 Å²	55.6	21%	0.206	28%	0.28	C	S	.	.	H	α-helix	trans	-94.8	-13.3	-176.7	-74.2	-75.3	0	0	0	114.5	I301 E302 P307 A318 S319 L321 V366 I387	I301-F305 HydrophobicContact CG2-CD2 4.12Å; I301-F305 HydrophobicContact CG2-CE2 3.97Å; I301-F305 WeakPolarHBondContact O-CD2 3.44Å; I301-F305 PolarHBondContact O-N 3.01Å; E302-F305 PolarHBondContact O-N 3.48Å; F305-P307 WeakPolarHBondContact O-CD 3.37Å; F305-A318 HydrophobicContact CD1-CB 3.52Å; F305-A318 WeakPolarHBondContact CD1-O 3.48Å; F305-A318 HydrophobicContact CD2-CB 4.36Å; F305-A318 HydrophobicContact CE1-CB 3.43Å; F305-A318 VanDerWaalsContact CE1-CB 3.43Å; F305-A318 WeakPolarHBondContact CE1-O 3.43Å; F305-A318 HydrophobicContact CE2-CB 4.3Å; F305-A318 HydrophobicContact CG-CB 3.99Å; F305-A318 HydrophobicContact CZ-CB 3.85Å; F305-S319 WeakPolarHBondContact O-CA 3.23Å; F305-S319 WeakPolarHBondContact O-CB 3.39Å; F305-L321 HydrophobicContact CE1-CB 4.37Å; F305-L321 HydrophobicContact CE1-CD2 4.06Å; F305-L321 HydrophobicContact CZ-CD2 4.16Å; F305-V366 HydrophobicContact CD1-CG1 4.04Å; F305-V366 HydrophobicContact CE1-CG1 3.38Å; F305-V366 HydrophobicContact CE2-CG1 4.34Å; F305-V366 HydrophobicContact CZ-CG1 3.56Å; F305-I387 HydrophobicContact CE2-CD1 4.2Å; F305-I387 HydrophobicContact CE2-CG2 4.33Å; F305-I387 HydrophobicContact CZ-CD1 4.47Å; F305-I387 HydrophobicContact CZ-CG2 4.24Å
306	D	92.3	Very high	90.4	Very high	63 Å²	63	53.6 Å²	53.6	34%	0.337	27%	0.273	S	S	.	.			trans	-67.2	121.3	172.2	-176.2	-9.2	0	0	0	110.9	E302 N308 H309 N317	E302-D306 PolarHBondContact O-N 3.24Å; E302-D306 VanDerWaalsContact O-N 3.15Å; D306-N308 PolarHBondContact O-N 3.38Å; D306-N308 WeakPolarHBondContact OD1-CB 3.48Å; D306-N308 PolarHBondContact OD1-N 2.88Å; D306-N308 PolarHBondContact OD1-ND2 3.42Å; D306-H309 HydrophobicContact CB-CB 3.77Å; D306-N317 PolarHBondContact O-ND2 2.64Å
307	P	89.8	Confident	90.2	Very high	92 Å²	92	55.3 Å²	55.3	60%	0.597	28%	0.282	S	S	*	.	S	Bend	trans	-64.5	-24.2	176.6	-16.7	28.3	0	0	0	114.4	F305	F305-P307 WeakPolarHBondContact O-CD 3.37Å
308	N	89.1	Confident	90	Very high	142 Å²	142	55.3 Å²	55.3	76%	0.759	28%	0.282	S	S	*	.	S	Bend	trans	-96.4	-15.8	-172.7	-50.8	-72.2	0	0	0	112.7	D306 Q310	D306-N308 PolarHBondContact O-N 3.38Å; D306-N308 WeakPolarHBondContact OD1-CB 3.48Å; D306-N308 PolarHBondContact OD1-N 2.88Å; D306-N308 PolarHBondContact OD1-ND2 3.42Å; N308-Q310 PolarHBondContact O-N 3.07Å
309	H	85.8	Confident	89.9	Confident	51 Å²	51	54.3 Å²	54.3	24%	0.236	28%	0.283	C	S	.	.			trans	-82.7	113.9	-176.1	-170	86.5	0	0	0	111.7	D306 N311	D306-H309 HydrophobicContact CB-CB 3.77Å; H309-N311 PolarHBondContact O-N 2.89Å
310	Q	81.8	Confident	89.8	Confident	182 Å²	182	54.3 Å²	54.3	85%	0.85	29%	0.285	S	S	*	.			trans	-81	95	170.1	-68.9	-172.5	-1.3	0	0	110.2	N308 K312	N308-Q310 PolarHBondContact O-N 3.07Å; Q310-K312 PolarHBondContact O-N 2.8Å
311	N	81.9	Confident	89.8	Confident	23 Å²	23	54.4 Å²	54.4	12%	0.123	29%	0.286	C	S	.	.			trans	-74.6	120.8	-178.4	-162.9	-35.1	0	0	0	111.6	H309 D313 S314	H309-N311 PolarHBondContact O-N 2.89Å; N311-D313 PolarHBondContact O-N 2.86Å; N311-D313 VanDerWaalsContact OD1-CB 3.28Å; N311-D313 WeakPolarHBondContact OD1-CB 3.44Å; N311-D313 PolarHBondContact OD1-N 2.92Å; N311-S314 PolarHBondContact O-N 2.76Å
312	K	81.8	Confident	89.8	Confident	171 Å²	171	54.3 Å²	54.3	74%	0.743	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-23.2	178.7	-62.4	172.5	-173.7	165.7	0	113.4	Q310 R478	Q310-K312 PolarHBondContact O-N 2.8Å; K312-R478 PolarHBondContact O-NH1 3.36Å; K312-R478 VanDerWaalsContact O-NH1 3.08Å
313	D	83.8	Confident	89.9	Confident	22 Å²	22	54 Å²	54	12%	0.118	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-8	-175.3	-55.4	-15	0	0	0	112.7	N278 H279 K300 N311 W388	N278-D313 WeakPolarHBondContact CA-OD2 3.44Å; N278-D313 WeakPolarHBondContact CB-OD1 3.34Å; H279-D313 HydrophobicContact CB-CB 4.16Å; H279-D313 PolarHBondContact CE1-O 2.76Å; H279-D313 IonicContact CG-OD2 2.7Å; H279-D313 PolarHBondContact N-OD2 3.31Å; K300-D313 IonicContact NZ-OD2 2.8Å; K300-D313 PolarHBondContact NZ-OD2 2.99Å; N311-D313 PolarHBondContact O-N 2.86Å; N311-D313 VanDerWaalsContact OD1-CB 3.28Å; N311-D313 WeakPolarHBondContact OD1-CB 3.44Å; N311-D313 PolarHBondContact OD1-N 2.92Å; D313-W388 PolarHBondContact O-NE1 2.91Å
314	S	86.9	Confident	90.1	Very high	5 Å²	5	53.2 Å²	53.2	4%	0.035	28%	0.276	C	S	.	.			trans	-155.1	104.8	-172.7	-175.9	0	0	0	0	111.5	N311 G316 N392	N311-S314 PolarHBondContact O-N 2.76Å; S314-G316 PolarHBondContact O-N 2.72Å; S314-G316 PolarHBondContact OG-O 2.91Å; S314-N392 PolarHBondContact OG-ND2 2.73Å
315	P	87.1	Confident	90.1	Very high	89 Å²	89	55 Å²	55	58%	0.578	29%	0.294	S	S	*	.	S	Bend	trans	-68.1	-19.8	172	28.2	-34.7	0	0	0	112.9	N392 V479	P315-N392 VanDerWaalsContact CD-OD1 3.27Å; P315-N392 WeakPolarHBondContact CD-OD1 3.28Å; P315-N392 WeakPolarHBondContact CG-OD1 3.35Å; P315-V479 HydrophobicContact CG-CG2 3.63Å
316	G	87.2	Confident	90	Very high	6 Å²	6	56.7 Å²	56.7	6%	0.062	31%	0.305	C	S	.	.	S	Bend	trans	-80.3	134.2	168.7	0	0	0	0	0	112.3	S314 I391 N392	S314-G316 PolarHBondContact O-N 2.72Å; S314-G316 PolarHBondContact OG-O 2.91Å; G316-I391 VanDerWaalsContact O-CD1 3.31Å; G316-I391 WeakPolarHBondContact O-CD1 3.3Å; G316-N392 PolarHBondContact N-OD1 3.06Å
317	N	91.1	Very high	90	Very high	37 Å²	37	55.3 Å²	55.3	20%	0.198	30%	0.3	C	S	.	.			trans	-114.3	135.5	175.9	-176.8	-66.1	0	0	0	110.6	D306 S319 T332	D306-N317 PolarHBondContact O-ND2 2.64Å; N317-S319 WeakPolarHBondContact OD1-CB 3.18Å; N317-S319 PolarHBondContact OD1-N 2.93Å; N317-S319 PolarHBondContact OD1-OG 3.48Å; N317-T332 WeakPolarHBondContact O-CG2 3.47Å
318	A	93.8	Very high	90.2	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.008	30%	0.295	C	S	.	.			trans	-91.7	-8.3	-172.7	0	0	0	0	0	114.5	L304 F305 T320 L321 I387 I391	L304-A318 HydrophobicContact CB-CB 4.1Å; L304-A318 WeakPolarHBondContact O-CA 3.39Å; L304-A318 VanDerWaalsContact O-CB 3.26Å; L304-A318 WeakPolarHBondContact O-CB 3.43Å; L304-A318 PolarHBondContact O-N 2.73Å; F305-A318 HydrophobicContact CD1-CB 3.52Å; F305-A318 WeakPolarHBondContact CD1-O 3.48Å; F305-A318 HydrophobicContact CD2-CB 4.36Å; F305-A318 HydrophobicContact CE1-CB 3.43Å; F305-A318 VanDerWaalsContact CE1-CB 3.43Å; F305-A318 WeakPolarHBondContact CE1-O 3.43Å; F305-A318 HydrophobicContact CE2-CB 4.3Å; F305-A318 HydrophobicContact CG-CB 3.99Å; F305-A318 HydrophobicContact CZ-CB 3.85Å; A318-T320 PolarHBondContact O-N 3.09Å; A318-L321 WeakPolarHBondContact O-CB 3.28Å; A318-L321 PolarHBondContact O-N 3.2Å; A318-I387 HydrophobicContact CB-CG2 4.42Å; A318-I391 HydrophobicContact CB-CD1 4.09Å; A318-I391 HydrophobicContact CB-CG2 3.87Å
319	S	93.3	Very high	90.3	Very high	49 Å²	49	51.4 Å²	51.4	34%	0.343	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-24.9	-179.3	61.9	0	0	0	0	114.8	F305 N317	F305-S319 WeakPolarHBondContact O-CA 3.23Å; F305-S319 WeakPolarHBondContact O-CB 3.39Å; N317-S319 WeakPolarHBondContact OD1-CB 3.18Å; N317-S319 PolarHBondContact OD1-N 2.93Å; N317-S319 PolarHBondContact OD1-OG 3.48Å
320	T	93.3	Very high	90.8	Very high	27 Å²	27	50.4 Å²	50.4	17%	0.166	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	3.9	-179.4	69.4	0	0	0	0	114.4	A318 K333 R360	A318-T320 PolarHBondContact O-N 3.09Å; T320-K333 HydrophobicContact CG2-CD 3.87Å; T320-K333 HydrophobicContact CG2-CG 4.05Å; T320-K333 PolarHBondContact OG1-N 3Å; T320-R360 PolarHBondContact O-NH1 3.47Å; T320-R360 PolarHBondContact O-NH2 3.26Å
321	L	95.7	Very high	91.4	Very high	7 Å²	7	41.8 Å²	41.8	4%	0.037	23%	0.227	C	C	.	.			trans	-54.4	138	-175.4	-174.2	66.3	0	0	0	112	F305 A318 L330 L331 T332 W364 Y369 T390 I391	F305-L321 HydrophobicContact CE1-CB 4.37Å; F305-L321 HydrophobicContact CE1-CD2 4.06Å; F305-L321 HydrophobicContact CZ-CD2 4.16Å; A318-L321 WeakPolarHBondContact O-CB 3.28Å; A318-L321 PolarHBondContact O-N 3.2Å; L321-L330 HydrophobicContact CD1-CB 4.19Å; L321-L331 CarbonylContact C-O 3.58Å; L321-L331 VanDerWaalsContact CA-O 3.3Å; L321-L331 WeakPolarHBondContact CA-O 3.13Å; L321-T332 HydrophobicContact CD1-CG2 4.28Å; L321-W364 HydrophobicContact CD2-CH2 4.22Å; L321-W364 HydrophobicContact CG-CH2 4.04Å; L321-Y369 HydrophobicContact CD2-CE1 4.34Å; L321-T390 HydrophobicContact CD1-CG2 4.14Å; L321-I391 HydrophobicContact CD1-CG2 4.24Å
322	Y	95.8	Very high	92	Very high	8 Å²	8	40.7 Å²	40.7	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	156.9	176	70.1	-84	0	0	0	112.6	C324 L330 L331 E336 H358 R360 W364	Y322-C324 HydrophobicContact CE2-CB 4.36Å; Y322-L330 CarbonylContact O-C 3.58Å; Y322-L330 WeakPolarHBondContact O-CA 3.38Å; Y322-L331 HydrophobicContact CD1-CB 4.43Å; Y322-L331 WeakPolarHBondContact CD1-O 3.28Å; Y322-L331 HydrophobicContact CE1-CB 4.04Å; Y322-L331 PolarHBondContact N-O 3.06Å; Y322-L331 PolarHBondContact O-N 3.03Å; Y322-E336 HydrophobicContact CE1-CB 4.4Å; Y322-E336 VanDerWaalsContact CE1-OE2 3.25Å; Y322-E336 WeakPolarHBondContact CE1-OE2 3.47Å; Y322-E336 VanDerWaalsContact CZ-OE2 3.31Å; Y322-E336 VanDerWaalsContact OH-CB 3.27Å; Y322-E336 WeakPolarHBondContact OH-CB 3.39Å; Y322-E336 PolarHBondContact OH-OE2 2.92Å; Y322-H358 HydrophobicContact CE2-CB 4.18Å; Y322-H358 WeakPolarHBondContact OH-CB 3.34Å; Y322-R360 HydrophobicContact CD1-CG 4.47Å; Y322-R360 HydrophobicContact CD2-CB 4.12Å; Y322-R360 HydrophobicContact CD2-CG 3.59Å; Y322-R360 HydrophobicContact CE2-CG 3.81Å; Y322-R360 HydrophobicContact CG-CG 3.9Å; Y322-W364 VanDerWaalsContact CA-CZ3 3.5Å
323	R	96.5	Very high	92.4	Very high	94 Å²	94	38.7 Å²	38.7	36%	0.355	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	129.6	166.9	-160.6	170.7	-165	172.7	2.9	111.6	L328 K329 L330 Q361 W364	R323-L328 WeakPolarHBondContact CG-O 3.32Å; R323-L328 PolarHBondContact NE-O 2.81Å; R323-K329 WeakPolarHBondContact CA-O 3.26Å; R323-L330 HydrophobicContact CB-CD2 3.87Å; R323-L330 HydrophobicContact CG-CD2 4.19Å; R323-Q361 WeakPolarHBondContact O-CB 3.44Å; R323-Q361 PolarHBondContact O-N 2.56Å; R323-W364 HydrophobicContact CB-CB 4.13Å; R323-W364 HydrophobicContact CB-CD2 3.73Å; R323-W364 HydrophobicContact CB-CE3 4.42Å; R323-W364 HydrophobicContact CB-CG 3.56Å
324	C	95.7	Very high	92.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-79.6	120.1	174.4	179.5	0	0	0	0	110.7	Y322 L326 L328 K329 L331 H358 T359	Y322-C324 HydrophobicContact CE2-CB 4.36Å; C324-L326 PolarHBondContact O-N 3.38Å; C324-L328 WeakPolarHBondContact O-CA 3.25Å; C324-L328 PolarHBondContact O-N 2.97Å; C324-K329 PolarHBondContact N-O 3.25Å; C324-L331 HydrophobicContact CB-CD1 4.22Å; C324-H358 HydrophobicContact CB-CB 4.24Å; C324-H358 PolarHBondContact SG-ND1 3.46Å; C324-H358 VanDerWaalsContact SG-ND1 3.36Å; C324-T359 CarbonylContact C-O 3.49Å; C324-T359 WeakPolarHBondContact CA-O 3.38Å
325	G	94.8	Very high	92.9	Very high	38 Å²	38	41.5 Å²	41.5	39%	0.392	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	5.6	-178.8	0	0	0	0	0	115.8	T359	G325-T359 PolarHBondContact N-O 3.34Å
326	L	93.4	Very high	93.2	Very high	84 Å²	84	39.2 Å²	39.2	44%	0.44	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-46.2	178.9	-63.5	177	0	0	0	113.1	C324 V342 K345	C324-L326 PolarHBondContact O-N 3.38Å; L326-V342 HydrophobicContact CB-CG2 4.37Å; L326-K345 HydrophobicContact CD1-CD 4.25Å; L326-K345 VanDerWaalsContact CD1-CE 3.45Å; L326-K345 HydrophobicContact CD1-CG 3.98Å
327	C	91.7	Very high	93.3	Very high	33 Å²	33	46.3 Å²	46.3	22%	0.223	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	0.1	177.9	65.3	0	0	0	0	113.6	K329 V342	C327-K329 PolarHBondContact O-N 2.93Å; C327-V342 HydrophobicContact CB-CG1 4.46Å
328	L	93.2	Very high	93.3	Very high	97 Å²	97	48.3 Å²	48.3	51%	0.508	24%	0.24	S	C	.	.			trans	57.3	1.7	-179.3	-57.2	-179.2	0	0	0	116.6	R323 C324	R323-L328 WeakPolarHBondContact CG-O 3.32Å; R323-L328 PolarHBondContact NE-O 2.81Å; C324-L328 WeakPolarHBondContact O-CA 3.25Å; C324-L328 PolarHBondContact O-N 2.97Å
329	K	92.9	Very high	93.1	Very high	56 Å²	56	48.4 Å²	48.4	24%	0.243	24%	0.241	C	C	.	.			trans	-65	152.2	172.8	-64.4	-159.6	176.1	-155.9	0	112	R323 C324 C327 L331 I339 E407	R323-K329 WeakPolarHBondContact CA-O 3.26Å; C324-K329 PolarHBondContact N-O 3.25Å; C327-K329 PolarHBondContact O-N 2.93Å; K329-L331 HydrophobicContact CB-CG 4.37Å; K329-I339 HydrophobicContact CD-CG2 4.08Å; K329-E407 WeakPolarHBondContact CE-OE1 3.27Å; K329-E407 IonicContact NZ-OE1 2.87Å; K329-E407 PolarHBondContact NZ-OE1 3.28Å; K329-E407 IonicContact NZ-OE2 3.94Å; K329-E407 PolarHBondContact NZ-OE2 3.19Å
330	L	95.1	Very high	93	Very high	30 Å²	30	47.6 Å²	47.6	16%	0.157	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	133.6	168.6	-68.4	166.9	0	0	0	109.3	L321 Y322 R323 W364 Y369 T390	L321-L330 HydrophobicContact CD1-CB 4.19Å; Y322-L330 CarbonylContact O-C 3.58Å; Y322-L330 WeakPolarHBondContact O-CA 3.38Å; R323-L330 HydrophobicContact CB-CD2 3.87Å; R323-L330 HydrophobicContact CG-CD2 4.19Å; L330-W364 HydrophobicContact CD2-CH2 4.07Å; L330-W364 HydrophobicContact CD2-CZ2 3.4Å; L330-W364 VanDerWaalsContact CD2-CZ2 3.4Å; L330-Y369 HydrophobicContact CD1-CD2 4.44Å; L330-Y369 HydrophobicContact CD1-CE1 4.02Å; L330-Y369 HydrophobicContact CD1-CE2 3.61Å; L330-Y369 VanDerWaalsContact CD1-OH 3.22Å; L330-Y369 WeakPolarHBondContact CD1-OH 3.46Å; L330-T390 HydrophobicContact CB-CG2 3.45Å; L330-T390 VanDerWaalsContact CB-CG2 3.45Å; L330-T390 HydrophobicContact CD1-CG2 4.12Å; L330-T390 HydrophobicContact CG-CG2 4.44Å
331	L	95.1	Very high	92.9	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	155.3	-169.9	-63.9	168.8	0	0	0	111.4	L321 Y322 C324 K329 I339 H358	L321-L331 CarbonylContact C-O 3.58Å; L321-L331 VanDerWaalsContact CA-O 3.3Å; L321-L331 WeakPolarHBondContact CA-O 3.13Å; Y322-L331 HydrophobicContact CD1-CB 4.43Å; Y322-L331 WeakPolarHBondContact CD1-O 3.28Å; Y322-L331 HydrophobicContact CE1-CB 4.04Å; Y322-L331 PolarHBondContact N-O 3.06Å; Y322-L331 PolarHBondContact O-N 3.03Å; C324-L331 HydrophobicContact CB-CD1 4.22Å; K329-L331 HydrophobicContact CB-CG 4.37Å; L331-I339 HydrophobicContact CD2-CB 4.02Å; L331-I339 HydrophobicContact CD2-CD1 4.05Å; L331-I339 HydrophobicContact CD2-CG2 4.16Å; L331-H358 HydrophobicContact CD1-CB 4.16Å; L331-H358 WeakPolarHBondContact CD1-CE1 3.43Å; L331-H358 VanDerWaalsContact CD1-CG 3.47Å; L331-H358 VanDerWaalsContact CD1-ND1 3.28Å; L331-H358 WeakPolarHBondContact CD1-ND1 3.48Å
332	T	94.4	Very high	92.5	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.006	25%	0.246	C	C	.	.			trans	-111.3	171.8	170.1	66.3	0	0	0	0	109.2	N317 L321 D334 T335 E336 I391	N317-T332 WeakPolarHBondContact O-CG2 3.47Å; L321-T332 HydrophobicContact CD1-CG2 4.28Å; T332-D334 PolarHBondContact O-N 3.21Å; T332-D334 PolarHBondContact OG1-N 2.97Å; T332-T335 PolarHBondContact N-OG1 3.08Å; T332-T335 PolarHBondContact O-N 3.4Å; T332-T335 PolarHBondContact O-OG1 3.32Å; T332-T335 PolarHBondContact OG1-N 3.37Å; T332-T335 PolarHBondContact OG1-OG1 3.4Å; T332-E336 WeakPolarHBondContact O-CB 3.3Å; T332-E336 PolarHBondContact O-N 3.17Å; T332-I391 HydrophobicContact CG2-CB 4.23Å; T332-I391 HydrophobicContact CG2-CG2 3.91Å
333	K	90.3	Very high	91.9	Very high	128 Å²	128	53.7 Å²	53.7	56%	0.557	28%	0.276	S	S	*	.	H	α-helix	trans	-56.6	-29.1	173	-74.7	-177.5	-170.3	173.6	0	112.8	T320	T320-K333 HydrophobicContact CG2-CD 3.87Å; T320-K333 HydrophobicContact CG2-CG 4.05Å; T320-K333 PolarHBondContact OG1-N 3Å
334	D	89	Confident	91.3	Very high	87 Å²	87	52.3 Å²	52.3	47%	0.465	29%	0.291	S	S	.	.	H	α-helix	trans	-82.9	-26.3	-178.2	-57.3	-56.4	0	0	0	113.8	T332 K338	T332-D334 PolarHBondContact O-N 3.21Å; T332-D334 PolarHBondContact OG1-N 2.97Å; D334-K338 VanDerWaalsContact O-CD 3.31Å; D334-K338 WeakPolarHBondContact O-CD 3.31Å; D334-K338 WeakPolarHBondContact O-CE 3.38Å; D334-K338 PolarHBondContact O-NZ 2.8Å
335	T	92.2	Very high	90.9	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-96.3	-26	179.8	57.9	0	0	0	0	113.1	T332 R337 K338 I339 Y393	T332-T335 PolarHBondContact N-OG1 3.08Å; T332-T335 PolarHBondContact O-N 3.4Å; T332-T335 PolarHBondContact O-OG1 3.32Å; T332-T335 PolarHBondContact OG1-N 3.37Å; T332-T335 PolarHBondContact OG1-OG1 3.4Å; T335-R337 VanDerWaalsContact C-N 3.28Å; T335-R337 PolarHBondContact O-N 2.75Å; T335-K338 PolarHBondContact O-N 3.5Å; T335-I339 HydrophobicContact CG2-CD1 4.34Å; T335-I339 PolarHBondContact O-N 3.36Å; T335-Y393 HydrophobicContact CG2-CD1 3.51Å; T335-Y393 HydrophobicContact CG2-CE1 4.16Å; T335-Y393 HydrophobicContact CG2-CG 4.07Å
336	E	92	Very high	90.6	Very high	41 Å²	41	55.8 Å²	55.8	19%	0.192	30%	0.297	C	S	.	.	H	α-helix	trans	-56.4	-38.6	-177.9	75.3	-173.3	-165	0	0	113.3	Y322 T332 H358	Y322-E336 HydrophobicContact CE1-CB 4.4Å; Y322-E336 VanDerWaalsContact CE1-OE2 3.25Å; Y322-E336 WeakPolarHBondContact CE1-OE2 3.47Å; Y322-E336 VanDerWaalsContact CZ-OE2 3.31Å; Y322-E336 VanDerWaalsContact OH-CB 3.27Å; Y322-E336 WeakPolarHBondContact OH-CB 3.39Å; Y322-E336 PolarHBondContact OH-OE2 2.92Å; T332-E336 WeakPolarHBondContact O-CB 3.3Å; T332-E336 PolarHBondContact O-N 3.17Å; E336-H358 PolarHBondContact O-CD2 3.11Å; E336-H358 PolarHBondContact O-NE2 3.29Å; E336-H358 VanDerWaalsContact O-NE2 3.13Å
337	R	90.4	Very high	90.4	Very high	155 Å²	155	55.3 Å²	55.3	59%	0.585	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-21.9	179.6	-64.3	-175	179.1	-124.3	-0.6	113.4	T335 Y356	T335-R337 VanDerWaalsContact C-N 3.28Å; T335-R337 PolarHBondContact O-N 2.75Å; R337-Y356 WeakPolarHBondContact O-CD2 3.37Å; R337-Y356 PolarHBondContact O-N 3.29Å
338	K	89.9	Confident	90.3	Very high	78 Å²	78	58.4 Å²	58.4	34%	0.339	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-27.7	-172.5	-60.8	177.5	-173.4	128.7	0	113.2	D334 T335 Y356 Y393 V402	D334-K338 VanDerWaalsContact O-CD 3.31Å; D334-K338 WeakPolarHBondContact O-CD 3.31Å; D334-K338 WeakPolarHBondContact O-CE 3.38Å; D334-K338 PolarHBondContact O-NZ 2.8Å; T335-K338 PolarHBondContact O-N 3.5Å; K338-Y356 WeakPolarHBondContact O-CE2 3.31Å; K338-Y393 HydrophobicContact CD-CD2 4.49Å; K338-Y393 HydrophobicContact CD-CE2 3.92Å; K338-Y393 PolarHBondContact NZ-OH 2.87Å; K338-V402 HydrophobicContact CB-CB 4.26Å; K338-V402 HydrophobicContact CB-CG1 4.09Å; K338-V402 HydrophobicContact CB-CG2 4.39Å
339	I	91.2	Very high	90	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.021	30%	0.296	C	S	.	.	S	Bend	trans	-102.1	129.9	-175	-61	-173.2	0	0	0	110.6	K329 L331 T335 C341 Y356 H358 V402 V404	K329-I339 HydrophobicContact CD-CG2 4.08Å; L331-I339 HydrophobicContact CD2-CB 4.02Å; L331-I339 HydrophobicContact CD2-CD1 4.05Å; L331-I339 HydrophobicContact CD2-CG2 4.16Å; T335-I339 HydrophobicContact CG2-CD1 4.34Å; T335-I339 PolarHBondContact O-N 3.36Å; I339-C341 PolarHBondContact O-N 2.8Å; I339-Y356 VanDerWaalsContact O-CB 3.31Å; I339-Y356 WeakPolarHBondContact O-CB 3.39Å; I339-Y356 WeakPolarHBondContact O-CD2 3.34Å; I339-H358 PolarHBondContact O-NE2 2.97Å; I339-V402 HydrophobicContact CG1-CG1 4.44Å; I339-V404 HydrophobicContact CD1-CG1 3.48Å; I339-V404 VanDerWaalsContact CD1-CG1 3.48Å
340	S	90.2	Very high	89.9	Confident	31 Å²	31	59.9 Å²	59.9	22%	0.217	33%	0.328	C	S	.	.			trans	-63.5	130.2	-176.1	52.1	0	0	0	0	113.2
341	C	91.3	Very high	89.6	Confident	14 Å²	14	66.9 Å²	66.9	10%	0.095	35%	0.352	C	S	.	.			trans	-86.8	-165.1	166.1	-157.2	0	0	0	0	110.2	I339 K345 T357 H358	I339-C341 PolarHBondContact O-N 2.8Å; C341-K345 HydrophobicContact CB-CB 3.77Å; C341-T357 WeakPolarHBondContact CB-O 3.27Å; C341-H358 WeakPolarHBondContact CB-CE1 3.46Å; C341-H358 PolarHBondContact SG-ND1 2.92Å
342	V	88.2	Confident	89.1	Confident	56 Å²	56	69.5 Å²	69.5	34%	0.339	38%	0.38	S	S	.	.			trans	-59.8	152.3	167.4	-62	0	0	0	0	111.2	L326 C327 G344 K345	L326-V342 HydrophobicContact CB-CG2 4.37Å; C327-V342 HydrophobicContact CB-CG1 4.46Å; V342-G344 PolarHBondContact O-N 3.27Å; V342-K345 HydrophobicContact CG2-CB 4.29Å; V342-K345 HydrophobicContact CG2-CG 3.87Å; V342-K345 WeakPolarHBondContact O-CB 3.33Å; V342-K345 PolarHBondContact O-N 3.39Å
343	P	82.4	Confident	88.7	Confident	101 Å²	101	74.4 Å²	74.4	66%	0.656	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-57	-29.6	-171.7	-29.3	36.6	0	0	0	115.8	K345 I346	P343-K345 PolarHBondContact O-N 3.12Å; P343-K345 VanDerWaalsContact O-N 3.13Å; P343-I346 WeakPolarHBondContact O-CG1 3.48Å
344	G	83.1	Confident	88.5	Confident	65 Å²	65	71.5 Å²	71.5	67%	0.67	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-75.6	15.2	175.7	0	0	0	0	0	115.4	V342	V342-G344 PolarHBondContact O-N 3.27Å
345	K	88.8	Confident	88.6	Confident	70 Å²	70	69.3 Å²	69.3	30%	0.304	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-131.6	15.7	-178	-73.1	-64.9	-176.6	-176.4	0	113.6	L326 C341 V342 P343 N347 T357	L326-K345 HydrophobicContact CD1-CD 4.25Å; L326-K345 VanDerWaalsContact CD1-CE 3.45Å; L326-K345 HydrophobicContact CD1-CG 3.98Å; C341-K345 HydrophobicContact CB-CB 3.77Å; V342-K345 HydrophobicContact CG2-CB 4.29Å; V342-K345 HydrophobicContact CG2-CG 3.87Å; V342-K345 WeakPolarHBondContact O-CB 3.33Å; V342-K345 PolarHBondContact O-N 3.39Å; P343-K345 PolarHBondContact O-N 3.12Å; P343-K345 VanDerWaalsContact O-N 3.13Å; K345-N347 PolarHBondContact O-ND2 3.48Å; K345-T357 WeakPolarHBondContact CB-O 3.47Å; K345-T357 WeakPolarHBondContact CD-OG1 3.25Å; K345-T357 PolarHBondContact O-N 2.93Å; K345-T357 PolarHBondContact O-OG1 3.23Å
346	I	88.3	Confident	88.5	Confident	41 Å²	41	70.1 Å²	70.1	21%	0.21	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	128.7	173	-51.9	-179.7	0	0	0	108.2	P343 I354 Y356 I450	P343-I346 WeakPolarHBondContact O-CG1 3.48Å; I346-I354 HydrophobicContact CG2-CG2 3.52Å; I346-Y356 HydrophobicContact CB-CD1 4.43Å; I346-Y356 HydrophobicContact CB-CE1 4.46Å; I346-Y356 HydrophobicContact CD1-CE1 4.25Å; I346-Y356 HydrophobicContact CG1-CD1 3.96Å; I346-Y356 HydrophobicContact CG1-CE1 3.88Å; I346-Y356 HydrophobicContact CG2-CD1 4.35Å; I346-Y356 HydrophobicContact CG2-CE1 4.07Å; I346-I450 HydrophobicContact CD1-CD1 3.52Å; I346-I450 HydrophobicContact CD1-CG1 3.8Å
347	N	88.4	Confident	88.5	Confident	74 Å²	74	70.6 Å²	70.6	40%	0.396	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	176.7	176.7	-63	-85.4	0	0	0	109.7	K345 I355 T357	K345-N347 PolarHBondContact O-ND2 3.48Å; N347-I355 HydrophobicContact CB-CD1 4.47Å; N347-I355 HydrophobicContact CB-CG1 4.07Å; N347-I355 PolarHBondContact N-O 3.21Å; N347-I355 PolarHBondContact O-N 3.37Å; N347-I355 VanDerWaalsContact O-O 3.13Å; N347-T357 VanDerWaalsContact ND2-CG2 3.3Å; N347-T357 WeakPolarHBondContact ND2-CG2 3.38Å; N347-T357 PolarHBondContact ND2-OG1 3.39Å
348	V	89.1	Confident	88.7	Confident	98 Å²	98	64.4 Å²	64.4	59%	0.594	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	134.6	179.2	-175.5	0	0	0	0	108.7	G352 Q353	V348-G352 VanDerWaalsContact CG1-C 3.48Å; V348-G352 VanDerWaalsContact CG1-CA 3.5Å; V348-Q353 CarbonylContact C-O 3.58Å; V348-Q353 WeakPolarHBondContact CA-O 3.46Å
349	D	87.6	Confident	88.9	Confident	30 Å²	30	64 Å²	64	16%	0.16	37%	0.371	C	S	.	.			trans	-79.4	172.7	176.9	92.1	-20.7	0	0	0	112.3	R351 G352 Q353 I355	D349-R351 PolarHBondContact O-N 2.7Å; D349-R351 VanDerWaalsContact OD1-CA 3.3Å; D349-R351 WeakPolarHBondContact OD1-CA 3.25Å; D349-R351 WeakPolarHBondContact OD1-CB 3.13Å; D349-R351 PolarHBondContact OD1-N 2.89Å; D349-R351 IonicContact OD2-CZ 3.12Å; D349-R351 VanDerWaalsContact OD2-CZ 3.25Å; D349-R351 IonicContact OD2-NE 2.8Å; D349-R351 PolarHBondContact OD2-NE 2.73Å; D349-R351 IonicContact OD2-NH2 3.67Å; D349-R351 PolarHBondContact OD2-NH2 2.85Å; D349-G352 PolarHBondContact O-N 2.59Å; D349-G352 PolarHBondContact OD1-N 2.84Å; D349-G352 VanDerWaalsContact OD1-N 3.12Å; D349-Q353 PolarHBondContact N-O 2.97Å; D349-Q353 WeakPolarHBondContact OD1-CB 3.3Å; D349-Q353 PolarHBondContact OD1-N 3.2Å; D349-I355 HydrophobicContact CB-CD1 4.07Å; D349-I355 HydrophobicContact CB-CG1 4.41Å; D349-I355 HydrophobicContact CB-CG2 4.13Å
350	V	90	Very high	89.1	Confident	153 Å²	153	69.4 Å²	69.4	93%	0.927	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-6.4	179.4	-63.8	0	0	0	0	114.6
351	R	90	Very high	89.4	Confident	177 Å²	177	70.8 Å²	70.8	67%	0.668	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	5.8	176.5	-58.1	169.4	-64.4	178.7	6.3	112.3	D349 Q353	D349-R351 PolarHBondContact O-N 2.7Å; D349-R351 VanDerWaalsContact OD1-CA 3.3Å; D349-R351 WeakPolarHBondContact OD1-CA 3.25Å; D349-R351 WeakPolarHBondContact OD1-CB 3.13Å; D349-R351 PolarHBondContact OD1-N 2.89Å; D349-R351 IonicContact OD2-CZ 3.12Å; D349-R351 VanDerWaalsContact OD2-CZ 3.25Å; D349-R351 IonicContact OD2-NE 2.8Å; D349-R351 PolarHBondContact OD2-NE 2.73Å; D349-R351 IonicContact OD2-NH2 3.67Å; D349-R351 PolarHBondContact OD2-NH2 2.85Å; R351-Q353 HydrophobicContact CB-CG 4.4Å
352	G	85.4	Confident	89.4	Confident	56 Å²	56	80.5 Å²	80.5	58%	0.577	44%	0.435	S	S	*	.	S	Bend	trans	82.4	9.5	-178	0	0	0	0	0	114.8	V348 D349	V348-G352 VanDerWaalsContact CG1-C 3.48Å; V348-G352 VanDerWaalsContact CG1-CA 3.5Å; D349-G352 PolarHBondContact O-N 2.59Å; D349-G352 PolarHBondContact OD1-N 2.84Å; D349-G352 VanDerWaalsContact OD1-N 3.12Å
353	Q	85.6	Confident	89.6	Confident	104 Å²	104	82.2 Å²	82.2	49%	0.486	45%	0.449	S	S	.	.			trans	-84.2	140.6	-179.3	-57.2	-173.8	-7.1	0	0	111.3	V348 D349 R351 I355	V348-Q353 CarbonylContact C-O 3.58Å; V348-Q353 WeakPolarHBondContact CA-O 3.46Å; D349-Q353 PolarHBondContact N-O 2.97Å; D349-Q353 WeakPolarHBondContact OD1-CB 3.3Å; D349-Q353 PolarHBondContact OD1-N 3.2Å; R351-Q353 HydrophobicContact CB-CG 4.4Å; Q353-I355 PolarHBondContact O-N 3.48Å
354	I	86.5	Confident	90.2	Very high	66 Å²	66	79.6 Å²	79.6	34%	0.338	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	125.8	175.4	-56.3	177.7	0	0	0	109.2	I346 Y356 P447	I346-I354 HydrophobicContact CG2-CG2 3.52Å; I354-Y356 HydrophobicContact CG2-CE1 3.93Å; I354-P447 WeakPolarHBondContact CD1-O 3.13Å
355	I	89.3	Confident	90.7	Very high	41 Å²	41	79.2 Å²	79.2	21%	0.21	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	143.9	175.7	54.5	166.5	0	0	0	110.5	N347 D349 Q353	N347-I355 HydrophobicContact CB-CD1 4.47Å; N347-I355 HydrophobicContact CB-CG1 4.07Å; N347-I355 PolarHBondContact N-O 3.21Å; N347-I355 PolarHBondContact O-N 3.37Å; N347-I355 VanDerWaalsContact O-O 3.13Å; D349-I355 HydrophobicContact CB-CD1 4.07Å; D349-I355 HydrophobicContact CB-CG1 4.41Å; D349-I355 HydrophobicContact CB-CG2 4.13Å; Q353-I355 PolarHBondContact O-N 3.48Å
356	Y	91.1	Very high	90.9	Very high	18 Å²	18	77.5 Å²	77.5	7%	0.071	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	150.8	-179.8	-54.7	-68.1	0	0	0	112.1	R337 K338 I339 I346 I354	R337-Y356 WeakPolarHBondContact O-CD2 3.37Å; R337-Y356 PolarHBondContact O-N 3.29Å; K338-Y356 WeakPolarHBondContact O-CE2 3.31Å; I339-Y356 VanDerWaalsContact O-CB 3.31Å; I339-Y356 WeakPolarHBondContact O-CB 3.39Å; I339-Y356 WeakPolarHBondContact O-CD2 3.34Å; I346-Y356 HydrophobicContact CB-CD1 4.43Å; I346-Y356 HydrophobicContact CB-CE1 4.46Å; I346-Y356 HydrophobicContact CD1-CE1 4.25Å; I346-Y356 HydrophobicContact CG1-CD1 3.96Å; I346-Y356 HydrophobicContact CG1-CE1 3.88Å; I346-Y356 HydrophobicContact CG2-CD1 4.35Å; I346-Y356 HydrophobicContact CG2-CE1 4.07Å; I354-Y356 HydrophobicContact CG2-CE1 3.93Å
357	T	92.1	Very high	91.2	Very high	51 Å²	51	82 Å²	82	31%	0.313	42%	0.424	S	S	.	.			trans	-122.7	139.6	176.3	53.7	0	0	0	0	109.8	C341 K345 N347	C341-T357 WeakPolarHBondContact CB-O 3.27Å; K345-T357 WeakPolarHBondContact CB-O 3.47Å; K345-T357 WeakPolarHBondContact CD-OG1 3.25Å; K345-T357 PolarHBondContact O-N 2.93Å; K345-T357 PolarHBondContact O-OG1 3.23Å; N347-T357 VanDerWaalsContact ND2-CG2 3.3Å; N347-T357 WeakPolarHBondContact ND2-CG2 3.38Å; N347-T357 PolarHBondContact ND2-OG1 3.39Å
358	H	94.7	Very high	91.5	Very high	25 Å²	25	85 Å²	85	12%	0.116	44%	0.436	C	S	.	.			trans	-129.5	171.3	-178.6	-68.5	-91.8	0	0	0	109.4	Y322 C324 L331 E336 I339 C341	Y322-H358 HydrophobicContact CE2-CB 4.18Å; Y322-H358 WeakPolarHBondContact OH-CB 3.34Å; C324-H358 HydrophobicContact CB-CB 4.24Å; C324-H358 PolarHBondContact SG-ND1 3.46Å; C324-H358 VanDerWaalsContact SG-ND1 3.36Å; L331-H358 HydrophobicContact CD1-CB 4.16Å; L331-H358 WeakPolarHBondContact CD1-CE1 3.43Å; L331-H358 VanDerWaalsContact CD1-CG 3.47Å; L331-H358 VanDerWaalsContact CD1-ND1 3.28Å; L331-H358 WeakPolarHBondContact CD1-ND1 3.48Å; E336-H358 PolarHBondContact O-CD2 3.11Å; E336-H358 PolarHBondContact O-NE2 3.29Å; E336-H358 VanDerWaalsContact O-NE2 3.13Å; I339-H358 PolarHBondContact O-NE2 2.97Å; C341-H358 WeakPolarHBondContact CB-CE1 3.46Å; C341-H358 PolarHBondContact SG-ND1 2.92Å
359	T	94.1	Very high	91.7	Very high	68 Å²	68	82 Å²	82	42%	0.417	41%	0.414	S	S	.	.			trans	-136.7	117	-177.2	-56.7	0	0	0	0	108.4	C324 G325 Q361	C324-T359 CarbonylContact C-O 3.49Å; C324-T359 WeakPolarHBondContact CA-O 3.38Å; G325-T359 PolarHBondContact N-O 3.34Å; T359-Q361 PolarHBondContact O-N 3.21Å
360	R	95.3	Very high	92.1	Very high	119 Å²	119	81.4 Å²	81.4	45%	0.449	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	-62.3	128.1	-176.4	-59.6	-163.4	163.9	-128.9	-11.1	110.4	T320 Y322 K362	T320-R360 PolarHBondContact O-NH1 3.47Å; T320-R360 PolarHBondContact O-NH2 3.26Å; Y322-R360 HydrophobicContact CD1-CG 4.47Å; Y322-R360 HydrophobicContact CD2-CB 4.12Å; Y322-R360 HydrophobicContact CD2-CG 3.59Å; Y322-R360 HydrophobicContact CE2-CG 3.81Å; Y322-R360 HydrophobicContact CG-CG 3.9Å; R360-K362 PolarHBondContact O-N 2.76Å
361	Q	95.3	Very high	92.4	Very high	60 Å²	60	77.7 Å²	77.7	28%	0.28	39%	0.389	S	S	.	.			trans	-71.2	113.3	171.9	-179.5	173.8	-5.7	0	0	109.1	R323 T359 S363 W364	R323-Q361 WeakPolarHBondContact O-CB 3.44Å; R323-Q361 PolarHBondContact O-N 2.56Å; T359-Q361 PolarHBondContact O-N 3.21Å; Q361-S363 PolarHBondContact NE2-OG 2.83Å; Q361-S363 PolarHBondContact O-N 3.23Å; Q361-W364 HydrophobicContact CB-CB 4.19Å; Q361-W364 HydrophobicContact CG-CB 4.16Å; Q361-W364 PolarHBondContact O-N 3.09Å
362	K	92.1	Very high	92.6	Very high	217 Å²	217	71.7 Å²	71.7	94%	0.943	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-18	-177.9	-66.6	-170.2	177.5	-172.5	0	114.5	R360	R360-K362 PolarHBondContact O-N 2.76Å
363	S	91.6	Very high	93.1	Very high	92 Å²	92	69.3 Å²	69.3	64%	0.643	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	27	-177.1	77.4	0	0	0	0	113	Q361	Q361-S363 PolarHBondContact NE2-OG 2.83Å; Q361-S363 PolarHBondContact O-N 3.23Å
364	W	95.1	Very high	93.6	Very high	46 Å²	46	68.2 Å²	68.2	17%	0.174	34%	0.343	C	S	.	.			trans	-122.6	126.1	-179.8	179	83.4	0	0	0	109.4	L321 Y322 R323 L330 Q361 V366 Y369	L321-W364 HydrophobicContact CD2-CH2 4.22Å; L321-W364 HydrophobicContact CG-CH2 4.04Å; Y322-W364 VanDerWaalsContact CA-CZ3 3.5Å; R323-W364 HydrophobicContact CB-CB 4.13Å; R323-W364 HydrophobicContact CB-CD2 3.73Å; R323-W364 HydrophobicContact CB-CE3 4.42Å; R323-W364 HydrophobicContact CB-CG 3.56Å; L330-W364 HydrophobicContact CD2-CH2 4.07Å; L330-W364 HydrophobicContact CD2-CZ2 3.4Å; L330-W364 VanDerWaalsContact CD2-CZ2 3.4Å; Q361-W364 HydrophobicContact CB-CB 4.19Å; Q361-W364 HydrophobicContact CG-CB 4.16Å; Q361-W364 PolarHBondContact O-N 3.09Å; W364-V366 HydrophobicContact CH2-CB 4.47Å; W364-V366 HydrophobicContact CH2-CG2 3.77Å; W364-V366 HydrophobicContact CZ3-CG2 3.61Å; W364-Y369 HydrophobicContact CH2-CD1 4.45Å; W364-Y369 AromaticContact CZ2-CD1 3.78Å; W364-Y369 HydrophobicContact CZ2-CD1 3.78Å; W364-Y369 HydrophobicContact CZ2-CD2 4.45Å; W364-Y369 AromaticContact CZ2-CG 3.71Å; W364-Y369 HydrophobicContact CZ2-CG 3.71Å
365	D	93.9	Very high	94.1	Very high	57 Å²	57	70.9 Å²	70.9	31%	0.305	35%	0.354	S	S	.	.			trans	-115.5	151.6	177	171.6	-108.3	0	0	0	112	H367 E368 Y369	D365-H367 VanDerWaalsContact OD1-CA 3.28Å; D365-H367 WeakPolarHBondContact OD1-CA 3.21Å; D365-H367 WeakPolarHBondContact OD1-CB 3.16Å; D365-H367 IonicContact OD1-CG 3.8Å; D365-H367 PolarHBondContact OD1-N 3.21Å; D365-H367 IonicContact OD1-ND1 3.73Å; D365-H367 PolarHBondContact OD1-ND1 2.84Å; D365-H367 IonicContact OD2-CE1 3.74Å; D365-H367 IonicContact OD2-ND1 2.7Å; D365-H367 PolarHBondContact OD2-ND1 2.82Å; D365-E368 HydrophobicContact CB-CB 4.28Å; D365-E368 HydrophobicContact CB-CG 4.17Å; D365-E368 PolarHBondContact OD1-N 2.91Å; D365-Y369 WeakPolarHBondContact O-CB 3.46Å; D365-Y369 PolarHBondContact O-N 3.05Å
366	V	93.6	Very high	94.4	Very high	35 Å²	35	74.5 Å²	74.5	21%	0.212	37%	0.37	C	S	.	.	H	α-helix	trans	-76	-36	-178.4	179.6	0	0	0	0	111.7	F305 W364 T370	F305-V366 HydrophobicContact CD1-CG1 4.04Å; F305-V366 HydrophobicContact CE1-CG1 3.38Å; F305-V366 HydrophobicContact CE2-CG1 4.34Å; F305-V366 HydrophobicContact CZ-CG1 3.56Å; W364-V366 HydrophobicContact CH2-CB 4.47Å; W364-V366 HydrophobicContact CH2-CG2 3.77Å; W364-V366 HydrophobicContact CZ3-CG2 3.61Å; V366-T370 WeakPolarHBondContact O-CB 3.26Å; V366-T370 PolarHBondContact O-N 2.98Å; V366-T370 PolarHBondContact O-OG1 3.12Å
367	H	93.9	Very high	94.5	Very high	136 Å²	136	75.2 Å²	75.2	63%	0.63	38%	0.375	S	S	*	.	H	α-helix	trans	-74.9	-43.1	-178.9	-46.1	84	0	0	0	110.6	D365 Y369 T370 T371	D365-H367 VanDerWaalsContact OD1-CA 3.28Å; D365-H367 WeakPolarHBondContact OD1-CA 3.21Å; D365-H367 WeakPolarHBondContact OD1-CB 3.16Å; D365-H367 IonicContact OD1-CG 3.8Å; D365-H367 PolarHBondContact OD1-N 3.21Å; D365-H367 IonicContact OD1-ND1 3.73Å; D365-H367 PolarHBondContact OD1-ND1 2.84Å; D365-H367 IonicContact OD2-CE1 3.74Å; D365-H367 IonicContact OD2-ND1 2.7Å; D365-H367 PolarHBondContact OD2-ND1 2.82Å; H367-Y369 VanDerWaalsContact C-N 3.34Å; H367-Y369 PolarHBondContact O-N 2.98Å; H367-T370 PolarHBondContact O-N 2.85Å; H367-T371 VanDerWaalsContact O-CB 3.26Å; H367-T371 WeakPolarHBondContact O-CB 3.3Å; H367-T371 PolarHBondContact O-N 2.85Å; H367-T371 PolarHBondContact O-OG1 3.4Å
368	E	95.1	Very high	94.6	Very high	135 Å²	135	79.8 Å²	79.8	63%	0.631	39%	0.391	S	S	*	.	H	α-helix	trans	-55.5	-49	169.5	-71.3	-174.4	172.1	0	0	110.9	D365 T371 A372	D365-E368 HydrophobicContact CB-CB 4.28Å; D365-E368 HydrophobicContact CB-CG 4.17Å; D365-E368 PolarHBondContact OD1-N 2.91Å; E368-T371 PolarHBondContact O-N 2.91Å; E368-A372 WeakPolarHBondContact O-CB 3.49Å; E368-A372 PolarHBondContact O-N 3.42Å
369	Y	94.6	Very high	94.7	Very high	37 Å²	37	80.1 Å²	80.1	15%	0.145	40%	0.396	C	S	.	.	H	α-helix	trans	-60.6	-47	177.6	170.6	-115.3	0	0	0	113	L321 L330 W364 D365 H367 T371 A372 L373 I387	L321-Y369 HydrophobicContact CD2-CE1 4.34Å; L330-Y369 HydrophobicContact CD1-CD2 4.44Å; L330-Y369 HydrophobicContact CD1-CE1 4.02Å; L330-Y369 HydrophobicContact CD1-CE2 3.61Å; L330-Y369 VanDerWaalsContact CD1-OH 3.22Å; L330-Y369 WeakPolarHBondContact CD1-OH 3.46Å; W364-Y369 HydrophobicContact CH2-CD1 4.45Å; W364-Y369 AromaticContact CZ2-CD1 3.78Å; W364-Y369 HydrophobicContact CZ2-CD1 3.78Å; W364-Y369 HydrophobicContact CZ2-CD2 4.45Å; W364-Y369 AromaticContact CZ2-CG 3.71Å; W364-Y369 HydrophobicContact CZ2-CG 3.71Å; D365-Y369 WeakPolarHBondContact O-CB 3.46Å; D365-Y369 PolarHBondContact O-N 3.05Å; H367-Y369 VanDerWaalsContact C-N 3.34Å; H367-Y369 PolarHBondContact O-N 2.98Å; Y369-T371 VanDerWaalsContact C-N 3.32Å; Y369-T371 PolarHBondContact O-N 3.08Å; Y369-A372 PolarHBondContact O-N 3.32Å; Y369-L373 HydrophobicContact CD1-CD1 4.5Å; Y369-L373 HydrophobicContact CD2-CG 4.33Å; Y369-L373 HydrophobicContact CE1-CD1 3.82Å; Y369-L373 HydrophobicContact CE1-CG 4.44Å; Y369-L373 HydrophobicContact CE2-CD1 4.04Å; Y369-L373 HydrophobicContact CE2-CD2 4.04Å; Y369-L373 HydrophobicContact CE2-CG 3.86Å; Y369-L373 WeakPolarHBondContact O-CG 3.46Å; Y369-L373 PolarHBondContact O-N 2.8Å; Y369-I387 HydrophobicContact CE1-CG1 4.37Å
370	T	95.3	Very high	94.8	Very high	17 Å²	17	79.1 Å²	79.1	10%	0.104	39%	0.385	C	S	.	.	H	α-helix	trans	-66.6	-36	-179.9	-55.4	0	0	0	0	111.6	V366 H367 Y374 W380 V383 I387	V366-T370 WeakPolarHBondContact O-CB 3.26Å; V366-T370 PolarHBondContact O-N 2.98Å; V366-T370 PolarHBondContact O-OG1 3.12Å; H367-T370 PolarHBondContact O-N 2.85Å; T370-Y374 PolarHBondContact O-N 3.39Å; T370-Y374 VanDerWaalsContact O-N 3.11Å; T370-W380 HydrophobicContact CG2-CZ3 4.07Å; T370-V383 HydrophobicContact CG2-CG1 4.21Å; T370-I387 HydrophobicContact CG2-CD1 4.38Å
371	T	95.1	Very high	94.8	Very high	74 Å²	74	74.2 Å²	74.2	45%	0.454	37%	0.368	S	S	.	.	H	α-helix	trans	-66.9	-47.6	174.7	-55.3	0	0	0	0	110.6	H367 E368 Y369 L373 Y374 E375	H367-T371 VanDerWaalsContact O-CB 3.26Å; H367-T371 WeakPolarHBondContact O-CB 3.3Å; H367-T371 PolarHBondContact O-N 2.85Å; H367-T371 PolarHBondContact O-OG1 3.4Å; E368-T371 PolarHBondContact O-N 2.91Å; Y369-T371 VanDerWaalsContact C-N 3.32Å; Y369-T371 PolarHBondContact O-N 3.08Å; T371-L373 VanDerWaalsContact C-N 3.32Å; T371-L373 PolarHBondContact O-N 3.35Å; T371-Y374 CarbonylContact O-C 3.55Å; T371-Y374 PolarHBondContact O-N 2.67Å; T371-E375 WeakPolarHBondContact O-CG 3.45Å; T371-E375 PolarHBondContact O-N 3.09Å
372	A	95.8	Very high	94.8	Very high	51 Å²	51	74.3 Å²	74.3	42%	0.421	37%	0.37	S	S	.	.	H	α-helix	trans	-60.4	-38.3	176.2	0	0	0	0	0	112.7	E368 Y369 E375 E376	E368-A372 WeakPolarHBondContact O-CB 3.49Å; E368-A372 PolarHBondContact O-N 3.42Å; Y369-A372 PolarHBondContact O-N 3.32Å; A372-E375 PolarHBondContact O-N 3.46Å; A372-E376 WeakPolarHBondContact O-CB 3.44Å; A372-E376 PolarHBondContact O-N 2.67Å
373	L	95.3	Very high	95.1	Very high	6 Å²	6	64 Å²	64	3%	0.031	33%	0.325	C	S	.	.	H	α-helix	trans	-61.7	-42.4	171.8	-76.6	-173.8	0	0	0	112.2	Y369 T371 E375 E376 L377 V383 R386 I387	Y369-L373 HydrophobicContact CD1-CD1 4.5Å; Y369-L373 HydrophobicContact CD2-CG 4.33Å; Y369-L373 HydrophobicContact CE1-CD1 3.82Å; Y369-L373 HydrophobicContact CE1-CG 4.44Å; Y369-L373 HydrophobicContact CE2-CD1 4.04Å; Y369-L373 HydrophobicContact CE2-CD2 4.04Å; Y369-L373 HydrophobicContact CE2-CG 3.86Å; Y369-L373 WeakPolarHBondContact O-CG 3.46Å; Y369-L373 PolarHBondContact O-N 2.8Å; T371-L373 VanDerWaalsContact C-N 3.32Å; T371-L373 PolarHBondContact O-N 3.35Å; L373-E375 VanDerWaalsContact C-N 3.32Å; L373-E376 PolarHBondContact O-N 3.25Å; L373-L377 HydrophobicContact CD2-CD1 4.5Å; L373-L377 VanDerWaalsContact O-CB 3.26Å; L373-L377 WeakPolarHBondContact O-CB 3.32Å; L373-L377 WeakPolarHBondContact O-CG 3.36Å; L373-L377 PolarHBondContact O-N 2.96Å; L373-V383 HydrophobicContact CB-CG1 4.12Å; L373-V383 HydrophobicContact CB-CG2 4.07Å; L373-V383 HydrophobicContact CD1-CG1 4.17Å; L373-R386 HydrophobicContact CD1-CB 4.39Å; L373-R386 HydrophobicContact CD1-CG 4.15Å; L373-R386 HydrophobicContact CD2-CG 3.88Å; L373-I387 HydrophobicContact CD1-CD1 4.15Å; L373-I387 HydrophobicContact CD1-CG1 3.76Å
374	Y	96.1	Very high	95.3	Very high	82 Å²	82	59.6 Å²	59.6	32%	0.322	29%	0.294	S	S	.	.	H	α-helix	trans	-69.5	-32.2	176	-175.8	-109.6	0	0	0	112	T370 T371 K378 W380 V383	T370-Y374 PolarHBondContact O-N 3.39Å; T370-Y374 VanDerWaalsContact O-N 3.11Å; T371-Y374 CarbonylContact O-C 3.55Å; T371-Y374 PolarHBondContact O-N 2.67Å; Y374-K378 VanDerWaalsContact O-CA 3.29Å; Y374-K378 WeakPolarHBondContact O-CA 3.35Å; Y374-K378 PolarHBondContact O-N 3.01Å; Y374-W380 AromaticContact CD1-CZ2 3.88Å; Y374-W380 HydrophobicContact CD1-CZ2 3.88Å; Y374-W380 AromaticContact CD2-CD1 3.88Å; Y374-W380 AromaticContact CD2-CD2 3.75Å; Y374-W380 HydrophobicContact CD2-CD2 3.75Å; Y374-W380 AromaticContact CD2-CE2 3.47Å; Y374-W380 VanDerWaalsContact CD2-CE2 3.47Å; Y374-W380 HydrophobicContact CD2-CE3 4.33Å; Y374-W380 HydrophobicContact CD2-CG 4.04Å; Y374-W380 HydrophobicContact CD2-CH2 4.43Å; Y374-W380 AromaticContact CD2-CZ2 3.85Å; Y374-W380 HydrophobicContact CD2-CZ2 3.85Å; Y374-W380 AromaticContact CD2-NE1 3.55Å; Y374-W380 HydrophobicContact CE1-CZ2 4.26Å; Y374-W380 AromaticContact CE2-CD1 3.37Å; Y374-W380 HydrophobicContact CE2-CD2 4.06Å; Y374-W380 AromaticContact CE2-CE2 3.6Å; Y374-W380 AromaticContact CE2-CG 3.95Å; Y374-W380 HydrophobicContact CE2-CG 3.95Å; Y374-W380 HydrophobicContact CE2-CZ2 4.25Å; Y374-W380 AromaticContact CE2-NE1 3.13Å; Y374-W380 HydrophobicContact CG-CD2 4.36Å; Y374-W380 AromaticContact CG-CE2 3.8Å; Y374-W380 HydrophobicContact CG-CH2 4.09Å; Y374-W380 AromaticContact CG-CZ2 3.65Å; Y374-W380 HydrophobicContact CG-CZ2 3.65Å; Y374-W380 AromaticContact CZ-CD1 3.98Å; Y374-W380 AromaticContact CZ-NE1 3.39Å; Y374-V383 HydrophobicContact CD2-CG2 4.26Å
375	E	96.5	Very high	95.4	Very high	122 Å²	122	57.4 Å²	57.4	57%	0.57	29%	0.286	S	S	*	.	H	α-helix	trans	-68.4	-36.4	172.8	-72.9	-175.9	171.9	0	0	113	T371 A372 L373 K378	T371-E375 WeakPolarHBondContact O-CG 3.45Å; T371-E375 PolarHBondContact O-N 3.09Å; A372-E375 PolarHBondContact O-N 3.46Å; L373-E375 VanDerWaalsContact C-N 3.32Å; E375-K378 WeakPolarHBondContact O-CD 3.33Å; E375-K378 WeakPolarHBondContact O-CE 3.41Å; E375-K378 PolarHBondContact O-NZ 3.06Å
376	E	95.2	Very high	95.5	Very high	116 Å²	116	56.1 Å²	56.1	54%	0.542	28%	0.277	S	S	.	.	H	α-helix	trans	-66.7	-52.8	171.3	-179.9	-167.7	131.4	0	0	111.1	A372 L373 R386	A372-E376 WeakPolarHBondContact O-CB 3.44Å; A372-E376 PolarHBondContact O-N 2.67Å; L373-E376 PolarHBondContact O-N 3.25Å; E376-R386 IonicContact OE1-CZ 3.7Å; E376-R386 VanDerWaalsContact OE1-CZ 3.3Å; E376-R386 IonicContact OE1-NH1 3.05Å; E376-R386 PolarHBondContact OE1-NH1 3.01Å; E376-R386 IonicContact OE1-NH2 3.31Å; E376-R386 PolarHBondContact OE1-NH2 2.84Å; E376-R386 IonicContact OE2-NH1 3.59Å
377	L	94.1	Very high	95.6	Very high	34 Å²	34	54.5 Å²	54.5	18%	0.178	27%	0.267	C	S	.	.	H	α-helix	trans	-97.3	-17.2	-162	-61.2	169.8	0	0	0	114.8	L373 S379 L382 V383 R386	L373-L377 HydrophobicContact CD2-CD1 4.5Å; L373-L377 VanDerWaalsContact O-CB 3.26Å; L373-L377 WeakPolarHBondContact O-CB 3.32Å; L373-L377 WeakPolarHBondContact O-CG 3.36Å; L373-L377 PolarHBondContact O-N 2.96Å; L377-S379 PolarHBondContact O-N 2.99Å; L377-L382 HydrophobicContact CB-CB 3.98Å; L377-L382 HydrophobicContact CB-CD1 4.33Å; L377-L382 HydrophobicContact CD1-CB 3.97Å; L377-L382 HydrophobicContact CD2-CB 4.42Å; L377-L382 HydrophobicContact CD2-CD1 4.44Å; L377-L382 HydrophobicContact CG-CB 4.35Å; L377-V383 HydrophobicContact CD1-CG2 4.3Å; L377-R386 HydrophobicContact CD1-CB 4.35Å
378	K	94.6	Very high	95.7	Very high	147 Å²	147	48 Å²	48	64%	0.639	24%	0.237	S	C	*	.	S	Bend	trans	51.1	19.3	-177.5	-51.9	-51.5	-167.9	-159.2	0	115.4	Y374 E375	Y374-K378 VanDerWaalsContact O-CA 3.29Å; Y374-K378 WeakPolarHBondContact O-CA 3.35Å; Y374-K378 PolarHBondContact O-N 3.01Å; E375-K378 WeakPolarHBondContact O-CD 3.33Å; E375-K378 WeakPolarHBondContact O-CE 3.41Å; E375-K378 PolarHBondContact O-NZ 3.06Å
379	S	95.4	Very high	95.7	Very high	32 Å²	32	41.6 Å²	41.6	22%	0.224	21%	0.207	C	C	.	.			trans	-149.6	120.6	-174.6	173.3	0	0	0	0	111	L377 V381 L382 V383	L377-S379 PolarHBondContact O-N 2.99Å; S379-V381 PolarHBondContact O-N 3.3Å; S379-V381 PolarHBondContact OG-N 2.99Å; S379-L382 PolarHBondContact O-N 2.94Å; S379-L382 VanDerWaalsContact O-N 3.14Å; S379-V383 WeakPolarHBondContact O-CG2 3.49Å; S379-V383 PolarHBondContact O-N 3.15Å; S379-V383 VanDerWaalsContact O-N 3.08Å
380	W	96.5	Very high	95.7	Very high	47 Å²	47	40.4 Å²	40.4	18%	0.178	20%	0.204	C	C	.	.	H	α-helix	trans	-64.9	-23.6	178.4	-70	101.3	0	0	0	113.2	F297 Q298 I301 T370 Y374 V383 Y384	F297-W380 HydrophobicContact CB-CB 4.19Å; Q298-W380 HydrophobicContact CG-CD2 3.77Å; Q298-W380 HydrophobicContact CG-CE3 4.13Å; Q298-W380 HydrophobicContact CG-CG 3.93Å; I301-W380 HydrophobicContact CD1-CE3 3.7Å; I301-W380 HydrophobicContact CD1-CZ3 4.3Å; T370-W380 HydrophobicContact CG2-CZ3 4.07Å; Y374-W380 AromaticContact CD1-CZ2 3.88Å; Y374-W380 HydrophobicContact CD1-CZ2 3.88Å; Y374-W380 AromaticContact CD2-CD1 3.88Å; Y374-W380 AromaticContact CD2-CD2 3.75Å; Y374-W380 HydrophobicContact CD2-CD2 3.75Å; Y374-W380 AromaticContact CD2-CE2 3.47Å; Y374-W380 VanDerWaalsContact CD2-CE2 3.47Å; Y374-W380 HydrophobicContact CD2-CE3 4.33Å; Y374-W380 HydrophobicContact CD2-CG 4.04Å; Y374-W380 HydrophobicContact CD2-CH2 4.43Å; Y374-W380 AromaticContact CD2-CZ2 3.85Å; Y374-W380 HydrophobicContact CD2-CZ2 3.85Å; Y374-W380 AromaticContact CD2-NE1 3.55Å; Y374-W380 HydrophobicContact CE1-CZ2 4.26Å; Y374-W380 AromaticContact CE2-CD1 3.37Å; Y374-W380 HydrophobicContact CE2-CD2 4.06Å; Y374-W380 AromaticContact CE2-CE2 3.6Å; Y374-W380 AromaticContact CE2-CG 3.95Å; Y374-W380 HydrophobicContact CE2-CG 3.95Å; Y374-W380 HydrophobicContact CE2-CZ2 4.25Å; Y374-W380 AromaticContact CE2-NE1 3.13Å; Y374-W380 HydrophobicContact CG-CD2 4.36Å; Y374-W380 AromaticContact CG-CE2 3.8Å; Y374-W380 HydrophobicContact CG-CH2 4.09Å; Y374-W380 AromaticContact CG-CZ2 3.65Å; Y374-W380 HydrophobicContact CG-CZ2 3.65Å; Y374-W380 AromaticContact CZ-CD1 3.98Å; Y374-W380 AromaticContact CZ-NE1 3.39Å; W380-V383 HydrophobicContact CE3-CB 4.3Å; W380-V383 HydrophobicContact CE3-CG1 4.24Å; W380-V383 HydrophobicContact CE3-CG2 4.46Å; W380-V383 HydrophobicContact CZ3-CG1 4.3Å; W380-Y384 WeakPolarHBondContact O-CB 3.22Å; W380-Y384 PolarHBondContact O-N 2.91Å
381	V	96.3	Very high	95.7	Very high	15 Å²	15	39.7 Å²	39.7	9%	0.091	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-48.8	171.9	-170.4	0	0	0	0	110.6	D283 K293 F297 S379 Y384 W385	D283-V381 WeakPolarHBondContact OD1-CG1 3.5Å; D283-V381 WeakPolarHBondContact OD2-CG1 3.33Å; K293-V381 HydrophobicContact CD-CG2 4.28Å; K293-V381 HydrophobicContact CG-CG2 4.33Å; F297-V381 HydrophobicContact CD2-CB 4.41Å; F297-V381 HydrophobicContact CD2-CG1 4.5Å; F297-V381 HydrophobicContact CD2-CG2 3.77Å; F297-V381 HydrophobicContact CE1-CG1 4.24Å; F297-V381 HydrophobicContact CE2-CB 4.49Å; F297-V381 HydrophobicContact CE2-CG1 4.11Å; F297-V381 HydrophobicContact CE2-CG2 4Å; F297-V381 HydrophobicContact CG-CG2 4.23Å; F297-V381 HydrophobicContact CZ-CG1 3.97Å; S379-V381 PolarHBondContact O-N 3.3Å; S379-V381 PolarHBondContact OG-N 2.99Å; V381-Y384 PolarHBondContact O-N 2.9Å; V381-W385 PolarHBondContact O-N 3.07Å; V381-W385 VanDerWaalsContact O-N 3.08Å
382	L	95.9	Very high	95.7	Very high	62 Å²	62	36.2 Å²	36.2	33%	0.325	18%	0.178	S	C	.	.	H	α-helix	trans	-70.4	-35.8	179.8	-60.9	-179.9	0	0	0	111.7	L377 S379 W385 R386 A489	L377-L382 HydrophobicContact CB-CB 3.98Å; L377-L382 HydrophobicContact CB-CD1 4.33Å; L377-L382 HydrophobicContact CD1-CB 3.97Å; L377-L382 HydrophobicContact CD2-CB 4.42Å; L377-L382 HydrophobicContact CD2-CD1 4.44Å; L377-L382 HydrophobicContact CG-CB 4.35Å; S379-L382 PolarHBondContact O-N 2.94Å; S379-L382 VanDerWaalsContact O-N 3.14Å; L382-W385 PolarHBondContact O-N 2.95Å; L382-R386 VanDerWaalsContact O-CB 3.3Å; L382-R386 WeakPolarHBondContact O-CB 3.4Å; L382-R386 PolarHBondContact O-N 3.5Å; L382-A489 HydrophobicContact CD2-CB 3.64Å
383	V	96.9	Very high	95.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.2	-45.7	172.4	177.5	0	0	0	0	110.7	I301 T370 L373 Y374 L377 S379 W380 R386 I387	I301-V383 HydrophobicContact CD1-CB 4.2Å; I301-V383 HydrophobicContact CD1-CG1 3.88Å; T370-V383 HydrophobicContact CG2-CG1 4.21Å; L373-V383 HydrophobicContact CB-CG1 4.12Å; L373-V383 HydrophobicContact CB-CG2 4.07Å; L373-V383 HydrophobicContact CD1-CG1 4.17Å; Y374-V383 HydrophobicContact CD2-CG2 4.26Å; L377-V383 HydrophobicContact CD1-CG2 4.3Å; S379-V383 WeakPolarHBondContact O-CG2 3.49Å; S379-V383 PolarHBondContact O-N 3.15Å; S379-V383 VanDerWaalsContact O-N 3.08Å; W380-V383 HydrophobicContact CE3-CB 4.3Å; W380-V383 HydrophobicContact CE3-CG1 4.24Å; W380-V383 HydrophobicContact CE3-CG2 4.46Å; W380-V383 HydrophobicContact CZ3-CG1 4.3Å; V383-R386 PolarHBondContact O-N 3.42Å; V383-I387 HydrophobicContact CG1-CD1 3.82Å; V383-I387 WeakPolarHBondContact O-CG1 3.47Å; V383-I387 PolarHBondContact O-N 3.43Å
384	Y	96.9	Very high	95.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.4	-52.7	175.7	173	-93.1	0	0	0	111.5	H279 F297 K300 I301 L304 W380 V381 R386 I387 W388	H279-Y384 HydrophobicContact CB-CE1 3.78Å; H279-Y384 WeakPolarHBondContact CB-OH 3.48Å; H279-Y384 PolarHBondContact ND1-OH 3.35Å; F297-Y384 AromaticContact CD1-CD1 3.87Å; F297-Y384 HydrophobicContact CD1-CD1 3.87Å; F297-Y384 HydrophobicContact CD1-CD2 4.32Å; F297-Y384 AromaticContact CD1-CG 3.67Å; F297-Y384 HydrophobicContact CD1-CG 3.67Å; F297-Y384 AromaticContact CE1-CD1 3.67Å; F297-Y384 HydrophobicContact CE1-CD1 3.67Å; F297-Y384 HydrophobicContact CE1-CE1 4.25Å; F297-Y384 AromaticContact CE1-CG 3.98Å; F297-Y384 HydrophobicContact CE1-CG 3.98Å; K300-Y384 HydrophobicContact CB-CD2 3.91Å; K300-Y384 HydrophobicContact CB-CE2 3.76Å; I301-Y384 HydrophobicContact CG1-CD2 3.98Å; I301-Y384 HydrophobicContact CG1-CG 4.44Å; L304-Y384 HydrophobicContact CD1-CD2 3.87Å; L304-Y384 HydrophobicContact CD1-CE2 3.65Å; L304-Y384 HydrophobicContact CD2-CE2 4.32Å; L304-Y384 HydrophobicContact CG-CE2 4.01Å; W380-Y384 WeakPolarHBondContact O-CB 3.22Å; W380-Y384 PolarHBondContact O-N 2.91Å; V381-Y384 PolarHBondContact O-N 2.9Å; Y384-R386 VanDerWaalsContact C-N 3.31Å; Y384-R386 PolarHBondContact O-N 2.83Å; Y384-I387 PolarHBondContact O-N 2.81Å; Y384-W388 HydrophobicContact CE1-CB 4.27Å; Y384-W388 HydrophobicContact CE1-CG 4.38Å; Y384-W388 AromaticContact CZ-CD1 3.97Å; Y384-W388 VanDerWaalsContact O-CB 3.25Å; Y384-W388 WeakPolarHBondContact O-CB 3.34Å; Y384-W388 PolarHBondContact O-N 2.69Å
385	W	96.9	Very high	95.4	Very high	1 Å²	1	36 Å²	36	0%	0.004	17%	0.172	C	C	.	.	H	α-helix	trans	-63.2	-34.8	-179.3	-71.8	123.9	0	0	0	113.1	H279 D283 V381 L382 W388 G389 H486 A489 V490	H279-W385 HydrophobicContact CB-CH2 4.04Å; H279-W385 HydrophobicContact CB-CZ2 4.3Å; H279-W385 AromaticContact CE1-CH2 3.74Å; H279-W385 AromaticContact CE1-CZ3 3.95Å; H279-W385 AromaticContact CG-CH2 3.58Å; H279-W385 AromaticContact ND1-CH2 3.21Å; H279-W385 WeakPolarHBondContact ND1-CH2 3.4Å; H279-W385 AromaticContact ND1-CZ3 3.5Å; D283-W385 PolarHBondContact OD2-NE1 3.48Å; V381-W385 PolarHBondContact O-N 3.07Å; V381-W385 VanDerWaalsContact O-N 3.08Å; L382-W385 PolarHBondContact O-N 2.95Å; W385-W388 HydrophobicContact CE3-CB 4.41Å; W385-W388 AromaticContact CE3-CD2 3.97Å; W385-W388 HydrophobicContact CE3-CD2 3.97Å; W385-W388 AromaticContact CE3-CE3 3.94Å; W385-W388 HydrophobicContact CE3-CE3 3.94Å; W385-W388 HydrophobicContact CE3-CG 4.18Å; W385-W388 AromaticContact CZ3-CD2 3.9Å; W385-W388 HydrophobicContact CZ3-CD2 3.9Å; W385-W388 HydrophobicContact CZ3-CE3 4.12Å; W385-W388 HydrophobicContact CZ3-CG 4.24Å; W385-W388 HydrophobicContact CZ3-CZ2 4.47Å; W385-G389 PolarHBondContact O-N 2.79Å; W385-H486 HydrophobicContact CD2-CB 3.98Å; W385-H486 AromaticContact CD2-CG 3.89Å; W385-H486 AromaticContact CE2-CD2 3.67Å; W385-H486 AromaticContact CE2-CE1 3.77Å; W385-H486 AromaticContact CE2-CG 3.57Å; W385-H486 AromaticContact CE2-ND1 3.68Å; W385-H486 AromaticContact CE2-NE2 3.78Å; W385-H486 HydrophobicContact CE3-CB 4.18Å; W385-H486 HydrophobicContact CG-CB 4.34Å; W385-H486 AromaticContact CH2-CD2 3.3Å; W385-H486 WeakPolarHBondContact CH2-CD2 3.39Å; W385-H486 AromaticContact CH2-NE2 3.54Å; W385-H486 AromaticContact CZ2-CD2 3.26Å; W385-H486 WeakPolarHBondContact CZ2-CD2 3.47Å; W385-H486 AromaticContact CZ2-CE1 3.55Å; W385-H486 AromaticContact CZ2-CG 3.68Å; W385-H486 AromaticContact CZ2-ND1 3.89Å; W385-H486 AromaticContact CZ2-NE2 3.16Å; W385-H486 WeakPolarHBondContact CZ2-NE2 3.38Å; W385-H486 AromaticContact CZ3-CD2 3.79Å; W385-H486 AromaticContact NE1-CE1 3.81Å; W385-H486 AromaticContact NE1-CG 3.9Å; W385-H486 AromaticContact NE1-ND1 3.58Å; W385-A489 HydrophobicContact CB-CB 3.91Å; W385-A489 HydrophobicContact CG-CB 4.26Å; W385-V490 HydrophobicContact CB-CG2 3.98Å; W385-V490 HydrophobicContact CE3-CG2 4.16Å
386	R	95.6	Very high	95.3	Very high	30 Å²	30	30.2 Å²	30.2	11%	0.113	15%	0.145	C	C	.	.	H	α-helix	trans	-65.8	-40.2	174.4	-170.8	71.3	69	76.6	-8.8	112.4	L373 E376 L377 L382 V383 Y384 T390	L373-R386 HydrophobicContact CD1-CB 4.39Å; L373-R386 HydrophobicContact CD1-CG 4.15Å; L373-R386 HydrophobicContact CD2-CG 3.88Å; E376-R386 IonicContact OE1-CZ 3.7Å; E376-R386 VanDerWaalsContact OE1-CZ 3.3Å; E376-R386 IonicContact OE1-NH1 3.05Å; E376-R386 PolarHBondContact OE1-NH1 3.01Å; E376-R386 IonicContact OE1-NH2 3.31Å; E376-R386 PolarHBondContact OE1-NH2 2.84Å; E376-R386 IonicContact OE2-NH1 3.59Å; L377-R386 HydrophobicContact CD1-CB 4.35Å; L382-R386 VanDerWaalsContact O-CB 3.3Å; L382-R386 WeakPolarHBondContact O-CB 3.4Å; L382-R386 PolarHBondContact O-N 3.5Å; V383-R386 PolarHBondContact O-N 3.42Å; Y384-R386 VanDerWaalsContact C-N 3.31Å; Y384-R386 PolarHBondContact O-N 2.83Å; R386-T390 PolarHBondContact O-N 3.14Å; R386-T390 PolarHBondContact O-OG1 3.48Å
387	I	95.8	Very high	95.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-73.2	-48.2	177	-65.6	171	0	0	0	110.7	I301 L304 F305 A318 Y369 T370 L373 V383 Y384 G389 T390 I391	I301-I387 HydrophobicContact CG2-CD1 4.26Å; L304-I387 HydrophobicContact CD1-CG2 4.01Å; F305-I387 HydrophobicContact CE2-CD1 4.2Å; F305-I387 HydrophobicContact CE2-CG2 4.33Å; F305-I387 HydrophobicContact CZ-CD1 4.47Å; F305-I387 HydrophobicContact CZ-CG2 4.24Å; A318-I387 HydrophobicContact CB-CG2 4.42Å; Y369-I387 HydrophobicContact CE1-CG1 4.37Å; T370-I387 HydrophobicContact CG2-CD1 4.38Å; L373-I387 HydrophobicContact CD1-CD1 4.15Å; L373-I387 HydrophobicContact CD1-CG1 3.76Å; V383-I387 HydrophobicContact CG1-CD1 3.82Å; V383-I387 WeakPolarHBondContact O-CG1 3.47Å; V383-I387 PolarHBondContact O-N 3.43Å; Y384-I387 PolarHBondContact O-N 2.81Å; I387-G389 PolarHBondContact O-N 3.36Å; I387-T390 WeakPolarHBondContact O-CA 3.45Å; I387-T390 WeakPolarHBondContact O-CB 3.48Å; I387-T390 PolarHBondContact O-N 3.44Å; I387-I391 PolarHBondContact O-N 3.19Å; I387-I391 VanDerWaalsContact O-N 3.11Å
388	W	96.4	Very high	94.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-53.7	-42.4	174.1	179.4	100.1	0	0	0	111.2	H279 L304 D313 Y384 W385 T390 I391 N392 C405 V479 D482 L483 V490	H279-W388 AromaticContact CE1-NE1 3.76Å; H279-W388 AromaticContact ND1-NE1 3.76Å; L304-W388 HydrophobicContact CD1-CB 4.48Å; D313-W388 PolarHBondContact O-NE1 2.91Å; Y384-W388 HydrophobicContact CE1-CB 4.27Å; Y384-W388 HydrophobicContact CE1-CG 4.38Å; Y384-W388 AromaticContact CZ-CD1 3.97Å; Y384-W388 VanDerWaalsContact O-CB 3.25Å; Y384-W388 WeakPolarHBondContact O-CB 3.34Å; Y384-W388 PolarHBondContact O-N 2.69Å; W385-W388 HydrophobicContact CE3-CB 4.41Å; W385-W388 AromaticContact CE3-CD2 3.97Å; W385-W388 HydrophobicContact CE3-CD2 3.97Å; W385-W388 AromaticContact CE3-CE3 3.94Å; W385-W388 HydrophobicContact CE3-CE3 3.94Å; W385-W388 HydrophobicContact CE3-CG 4.18Å; W385-W388 AromaticContact CZ3-CD2 3.9Å; W385-W388 HydrophobicContact CZ3-CD2 3.9Å; W385-W388 HydrophobicContact CZ3-CE3 4.12Å; W385-W388 HydrophobicContact CZ3-CG 4.24Å; W385-W388 HydrophobicContact CZ3-CZ2 4.47Å; W388-T390 PolarHBondContact O-N 2.76Å; W388-I391 PolarHBondContact O-N 2.94Å; W388-N392 PolarHBondContact NE1-ND2 3.36Å; W388-N392 WeakPolarHBondContact O-CB 3.31Å; W388-N392 PolarHBondContact O-N 2.98Å; W388-N392 VanDerWaalsContact O-N 3.08Å; W388-N392 PolarHBondContact O-ND2 3.26Å; W388-C405 HydrophobicContact CZ3-CB 4.28Å; W388-V479 HydrophobicContact CH2-CG1 3.92Å; W388-V479 WeakPolarHBondContact CH2-O 3.46Å; W388-V479 HydrophobicContact CZ2-CB 4.4Å; W388-V479 HydrophobicContact CZ2-CG1 4.13Å; W388-V479 HydrophobicContact CZ2-CG2 4.29Å; W388-D482 HydrophobicContact CH2-CB 3.68Å; W388-D482 HydrophobicContact CZ2-CB 3.67Å; W388-L483 HydrophobicContact CH2-CB 4.23Å; W388-L483 HydrophobicContact CZ3-CB 4.25Å; W388-V490 HydrophobicContact CE3-CG2 4.03Å; W388-V490 HydrophobicContact CZ3-CG2 4.12Å
389	G	95.3	Very high	94.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-65.9	-21.8	175.7	0	0	0	0	0	115.3	W385 I387 C405 A406	W385-G389 PolarHBondContact O-N 2.79Å; I387-G389 PolarHBondContact O-N 3.36Å; G389-C405 PolarHBondContact O-N 3.4Å; G389-C405 VanDerWaalsContact O-N 3.13Å; G389-A406 WeakPolarHBondContact O-CB 3.35Å; G389-A406 PolarHBondContact O-N 3.22Å
390	T	94.4	Very high	94.3	Very high	13 Å²	13	30.2 Å²	30.2	8%	0.08	15%	0.146	C	C	.	.	H	α-helix	trans	-90.4	-30.6	-179	-61.2	0	0	0	0	112.1	L321 L330 R386 I387 W388 V404	L321-T390 HydrophobicContact CD1-CG2 4.14Å; L330-T390 HydrophobicContact CB-CG2 3.45Å; L330-T390 VanDerWaalsContact CB-CG2 3.45Å; L330-T390 HydrophobicContact CD1-CG2 4.12Å; L330-T390 HydrophobicContact CG-CG2 4.44Å; R386-T390 PolarHBondContact O-N 3.14Å; R386-T390 PolarHBondContact O-OG1 3.48Å; I387-T390 WeakPolarHBondContact O-CA 3.45Å; I387-T390 WeakPolarHBondContact O-CB 3.48Å; I387-T390 PolarHBondContact O-N 3.44Å; W388-T390 PolarHBondContact O-N 2.76Å; T390-V404 WeakPolarHBondContact O-CG1 3.43Å
391	I	94.5	Very high	94	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-92.9	-27.7	-178.3	66.4	-170.7	0	0	0	113.2	L304 G316 A318 L321 T332 I387 W388	L304-I391 HydrophobicContact CB-CD1 4.31Å; L304-I391 HydrophobicContact CD1-CD1 3.95Å; L304-I391 HydrophobicContact CD2-CD1 3.97Å; L304-I391 HydrophobicContact CG-CD1 4.29Å; G316-I391 VanDerWaalsContact O-CD1 3.31Å; G316-I391 WeakPolarHBondContact O-CD1 3.3Å; A318-I391 HydrophobicContact CB-CD1 4.09Å; A318-I391 HydrophobicContact CB-CG2 3.87Å; L321-I391 HydrophobicContact CD1-CG2 4.24Å; T332-I391 HydrophobicContact CG2-CB 4.23Å; T332-I391 HydrophobicContact CG2-CG2 3.91Å; I387-I391 PolarHBondContact O-N 3.19Å; I387-I391 VanDerWaalsContact O-N 3.11Å; W388-I391 PolarHBondContact O-N 2.94Å
392	N	94.6	Very high	93.8	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.011	15%	0.151	C	C	.	.			trans	-86.8	145.7	174.9	-68.2	-70.3	0	0	0	111.3	S314 P315 G316 W388 V404 C405 V479	S314-N392 PolarHBondContact OG-ND2 2.73Å; P315-N392 VanDerWaalsContact CD-OD1 3.27Å; P315-N392 WeakPolarHBondContact CD-OD1 3.28Å; P315-N392 WeakPolarHBondContact CG-OD1 3.35Å; G316-N392 PolarHBondContact N-OD1 3.06Å; W388-N392 PolarHBondContact NE1-ND2 3.36Å; W388-N392 WeakPolarHBondContact O-CB 3.31Å; W388-N392 PolarHBondContact O-N 2.98Å; W388-N392 VanDerWaalsContact O-N 3.08Å; W388-N392 PolarHBondContact O-ND2 3.26Å; N392-V404 WeakPolarHBondContact O-CA 3.39Å; N392-C405 VanDerWaalsContact C-SG 3.58Å; N392-C405 PolarHBondContact O-N 3.04Å; N392-C405 PolarHBondContact O-SG 3.36Å; N392-C405 VanDerWaalsContact O-SG 3.41Å; N392-V479 HydrophobicContact CB-CG1 3.94Å
393	Y	94.5	Very high	93.7	Very high	76 Å²	76	27.9 Å²	27.9	30%	0.298	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	151.7	-175	63.8	-86.6	0	0	0	111.5	T335 K338 V402 F403	T335-Y393 HydrophobicContact CG2-CD1 3.51Å; T335-Y393 HydrophobicContact CG2-CE1 4.16Å; T335-Y393 HydrophobicContact CG2-CG 4.07Å; K338-Y393 HydrophobicContact CD-CD2 4.49Å; K338-Y393 HydrophobicContact CD-CE2 3.92Å; K338-Y393 PolarHBondContact NZ-OH 2.87Å; Y393-V402 HydrophobicContact CD2-CG1 3.55Å; Y393-V402 HydrophobicContact CE2-CG1 4.4Å; Y393-V402 HydrophobicContact CG-CG1 4.1Å; Y393-F403 CarbonylContact C-O 3.55Å; Y393-F403 WeakPolarHBondContact CA-O 3.33Å; Y393-F403 VanDerWaalsContact CB-O 3.32Å; Y393-F403 WeakPolarHBondContact CB-O 3.35Å
394	L	94.3	Very high	93.5	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	165.9	179.7	-64.2	171	0	0	0	110.4	V402 F403 V461 Q476 V479 L480 L483	L394-V402 WeakPolarHBondContact O-CA 3.29Å; L394-F403 HydrophobicContact CB-CE1 3.84Å; L394-F403 HydrophobicContact CB-CZ 3.81Å; L394-F403 PolarHBondContact N-O 3.35Å; L394-F403 WeakPolarHBondContact O-CD1 3.34Å; L394-F403 WeakPolarHBondContact O-CE1 3.34Å; L394-F403 PolarHBondContact O-N 2.93Å; L394-V461 HydrophobicContact CB-CG2 3.71Å; L394-V461 HydrophobicContact CD1-CG2 3.95Å; L394-V461 HydrophobicContact CG-CG2 4.37Å; L394-Q476 HydrophobicContact CD2-CB 4.25Å; L394-Q476 HydrophobicContact CD2-CG 4.47Å; L394-V479 HydrophobicContact CD1-CG1 4.21Å; L394-V479 HydrophobicContact CD2-CB 4.26Å; L394-V479 HydrophobicContact CD2-CG1 3.94Å; L394-V479 HydrophobicContact CG-CG1 4.1Å; L394-L480 HydrophobicContact CD1-CB 4.23Å; L394-L480 HydrophobicContact CD1-CD1 4.12Å; L394-L483 HydrophobicContact CD1-CD2 3.82Å
395	T	93.8	Very high	93.4	Very high	57 Å²	57	28.3 Å²	28.3	35%	0.35	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.2	179	-53.9	0	0	0	0	110.6
396	C	93.1	Very high	93.3	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.142	C	C	.	.			trans	-93.4	120.1	-174.3	177.1	0	0	0	0	112.6	R398 C399 Q400 Q401 F403 H459 I460	C396-R398 PolarHBondContact O-N 3.37Å; C396-C399 PolarHBondContact O-N 3.4Å; C396-Q400 WeakPolarHBondContact O-CA 3.22Å; C396-Q400 PolarHBondContact O-N 3.01Å; C396-Q401 PolarHBondContact N-O 2.72Å; C396-F403 HydrophobicContact CB-CD1 4.01Å; C396-F403 HydrophobicContact CB-CE1 3.82Å; C396-H459 HydrophobicContact CB-CB 3.99Å; C396-H459 WeakPolarHBondContact CB-ND1 3.36Å; C396-H459 PolarHBondContact SG-ND1 2.94Å; C396-H459 VanDerWaalsContact SG-ND1 3.37Å; C396-I460 CarbonylContact C-O 3.58Å; C396-I460 WeakPolarHBondContact CA-O 3.44Å; C396-I460 PolarHBondContact SG-N 3.29Å; C396-I460 VanDerWaalsContact SG-N 3.39Å; C396-I460 PolarHBondContact SG-O 2.95Å
397	S	92.5	Very high	93.2	Very high	47 Å²	47	28.8 Å²	28.8	33%	0.329	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-24.5	179.2	63.9	0	0	0	0	113.8	Q400 I460	S397-Q400 PolarHBondContact O-NE2 3.23Å; S397-I460 PolarHBondContact N-O 2.98Å; S397-I460 PolarHBondContact OG-O 3.13Å
398	R	89.3	Confident	93.1	Very high	116 Å²	116	29.1 Å²	29.1	44%	0.438	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-35.7	-179.5	-70.8	173.8	159.8	173.1	-3.7	114.5	C396 D458 I460	C396-R398 PolarHBondContact O-N 3.37Å; R398-D458 PolarHBondContact NH1-O 3.33Å; R398-I460 HydrophobicContact CG-CB 4.32Å; R398-I460 VanDerWaalsContact NH2-CD1 3.33Å
399	C	88.2	Confident	92.9	Very high	28 Å²	28	30.9 Å²	30.9	19%	0.189	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.2	-2.9	-175.8	62.8	0	0	0	0	113.8	C396 Q401	C396-C399 PolarHBondContact O-N 3.4Å; C399-Q401 HydrophobicContact CB-CG 4.21Å; C399-Q401 WeakPolarHBondContact O-CG 3.39Å; C399-Q401 PolarHBondContact O-N 3.23Å; C399-Q401 PolarHBondContact O-NE2 2.75Å
400	Q	89.1	Confident	92.7	Very high	138 Å²	138	33.7 Å²	33.7	65%	0.645	17%	0.17	S	C	*	.			trans	56.5	26.8	-179.6	-57.6	-64.6	-31.9	0	0	113.5	C396 S397	C396-Q400 WeakPolarHBondContact O-CA 3.22Å; C396-Q400 PolarHBondContact O-N 3.01Å; S397-Q400 PolarHBondContact O-NE2 3.23Å
401	Q	89.3	Confident	92.7	Very high	33 Å²	33	33.1 Å²	33.1	15%	0.154	17%	0.166	C	C	.	.			trans	-103.4	147.9	177.5	-55.3	-55.4	-64.3	0	0	111.7	C396 C399 G449 P451	C396-Q401 PolarHBondContact N-O 2.72Å; C399-Q401 HydrophobicContact CB-CG 4.21Å; C399-Q401 WeakPolarHBondContact O-CG 3.39Å; C399-Q401 PolarHBondContact O-N 3.23Å; C399-Q401 PolarHBondContact O-NE2 2.75Å; Q401-G449 PolarHBondContact NE2-O 3.2Å; Q401-P451 HydrophobicContact CG-CB 3.95Å; Q401-P451 HydrophobicContact CG-CG 3.91Å
402	V	92.5	Very high	92.5	Very high	38 Å²	38	38.1 Å²	38.1	23%	0.23	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	135.1	161.3	179.4	0	0	0	0	109.3	K338 I339 Y393 L394	K338-V402 HydrophobicContact CB-CB 4.26Å; K338-V402 HydrophobicContact CB-CG1 4.09Å; K338-V402 HydrophobicContact CB-CG2 4.39Å; I339-V402 HydrophobicContact CG1-CG1 4.44Å; Y393-V402 HydrophobicContact CD2-CG1 3.55Å; Y393-V402 HydrophobicContact CE2-CG1 4.4Å; Y393-V402 HydrophobicContact CG-CG1 4.1Å; L394-V402 WeakPolarHBondContact O-CA 3.29Å
403	F	93	Very high	92.4	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.018	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	148.4	178.1	66.7	-74.8	0	0	0	110.1	Y393 L394 C396 L408 H459 V461	Y393-F403 CarbonylContact C-O 3.55Å; Y393-F403 WeakPolarHBondContact CA-O 3.33Å; Y393-F403 VanDerWaalsContact CB-O 3.32Å; Y393-F403 WeakPolarHBondContact CB-O 3.35Å; L394-F403 HydrophobicContact CB-CE1 3.84Å; L394-F403 HydrophobicContact CB-CZ 3.81Å; L394-F403 PolarHBondContact N-O 3.35Å; L394-F403 WeakPolarHBondContact O-CD1 3.34Å; L394-F403 WeakPolarHBondContact O-CE1 3.34Å; L394-F403 PolarHBondContact O-N 2.93Å; C396-F403 HydrophobicContact CB-CD1 4.01Å; C396-F403 HydrophobicContact CB-CE1 3.82Å; F403-L408 HydrophobicContact CE2-CB 4.32Å; F403-L408 HydrophobicContact CE2-CD1 3.98Å; F403-L408 HydrophobicContact CZ-CD1 4.27Å; F403-H459 HydrophobicContact CD1-CB 4.18Å; F403-H459 AromaticContact CD1-CE1 3.91Å; F403-H459 AromaticContact CD1-CG 3.81Å; F403-H459 AromaticContact CD1-ND1 3.5Å; F403-H459 WeakPolarHBondContact CD1-ND1 3.14Å; F403-H459 HydrophobicContact CD2-CB 4.24Å; F403-H459 AromaticContact CD2-CD2 3.83Å; F403-H459 AromaticContact CD2-CG 3.92Å; F403-H459 HydrophobicContact CE1-CB 3.71Å; F403-H459 AromaticContact CE1-CG 3.88Å; F403-H459 AromaticContact CE1-ND1 3.87Å; F403-H459 HydrophobicContact CE2-CB 3.78Å; F403-H459 AromaticContact CE2-CG 3.99Å; F403-H459 HydrophobicContact CG-CB 4.45Å; F403-H459 AromaticContact CG-CD2 3.94Å; F403-H459 AromaticContact CG-CE1 3.82Å; F403-H459 AromaticContact CG-CG 3.85Å; F403-H459 AromaticContact CG-ND1 3.77Å; F403-H459 AromaticContact CG-NE2 3.97Å; F403-H459 HydrophobicContact CZ-CB 3.49Å; F403-H459 VanDerWaalsContact CZ-CB 3.49Å; F403-H459 AromaticContact CZ-CG 3.98Å; F403-V461 HydrophobicContact CE1-CG2 4.04Å; F403-V461 HydrophobicContact CZ-CG2 3.86Å
404	V	94.6	Very high	92.2	Very high	10 Å²	10	38.7 Å²	38.7	6%	0.061	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	148.6	169.1	-66.1	0	0	0	0	109.7	I339 T390 N392 A406 E407	I339-V404 HydrophobicContact CD1-CG1 3.48Å; I339-V404 VanDerWaalsContact CD1-CG1 3.48Å; T390-V404 WeakPolarHBondContact O-CG1 3.43Å; N392-V404 WeakPolarHBondContact O-CA 3.39Å; V404-A406 HydrophobicContact CG2-CB 4.47Å; V404-A406 PolarHBondContact O-N 3.44Å; V404-E407 HydrophobicContact CG2-CB 3.93Å; V404-E407 HydrophobicContact CG2-CG 3.58Å; V404-E407 PolarHBondContact O-N 3.29Å
405	C	95	Very high	92	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-56.7	-34.5	-177.4	-66.2	0	0	0	0	113	W388 G389 N392 E407 L408 L483 V490	W388-C405 HydrophobicContact CZ3-CB 4.28Å; G389-C405 PolarHBondContact O-N 3.4Å; G389-C405 VanDerWaalsContact O-N 3.13Å; N392-C405 VanDerWaalsContact C-SG 3.58Å; N392-C405 PolarHBondContact O-N 3.04Å; N392-C405 PolarHBondContact O-SG 3.36Å; N392-C405 VanDerWaalsContact O-SG 3.41Å; C405-E407 PolarHBondContact O-N 3.18Å; C405-L408 WeakPolarHBondContact O-CB 3.31Å; C405-L408 PolarHBondContact O-N 3.42Å; C405-L483 HydrophobicContact CB-CD1 4Å; C405-L483 HydrophobicContact CB-CD2 3.9Å; C405-L483 HydrophobicContact CB-CG 4.44Å; C405-V490 HydrophobicContact CB-CG1 4.18Å
406	A	94.4	Very high	91.8	Very high	6 Å²	6	42.1 Å²	42.1	5%	0.05	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-65.3	-15.7	174.8	0	0	0	0	0	114.7	G389 V404 V490	G389-A406 WeakPolarHBondContact O-CB 3.35Å; G389-A406 PolarHBondContact O-N 3.22Å; V404-A406 HydrophobicContact CG2-CB 4.47Å; V404-A406 PolarHBondContact O-N 3.44Å; A406-V490 WeakPolarHBondContact CB-O 3.42Å
407	E	92.8	Very high	91.5	Very high	34 Å²	34	46.6 Å²	46.6	16%	0.159	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-98.6	13.2	176.3	-70.9	-178.1	177.3	0	0	113.1	K329 V404 C405 T409 Q410 H459	K329-E407 WeakPolarHBondContact CE-OE1 3.27Å; K329-E407 IonicContact NZ-OE1 2.87Å; K329-E407 PolarHBondContact NZ-OE1 3.28Å; K329-E407 IonicContact NZ-OE2 3.94Å; K329-E407 PolarHBondContact NZ-OE2 3.19Å; V404-E407 HydrophobicContact CG2-CB 3.93Å; V404-E407 HydrophobicContact CG2-CG 3.58Å; V404-E407 PolarHBondContact O-N 3.29Å; C405-E407 PolarHBondContact O-N 3.18Å; E407-T409 PolarHBondContact O-N 2.94Å; E407-Q410 HydrophobicContact CB-CB 4.38Å; E407-Q410 HydrophobicContact CB-CG 4.3Å; E407-Q410 WeakPolarHBondContact O-CB 3.3Å; E407-Q410 PolarHBondContact O-N 3.14Å; E407-H459 PolarHBondContact O-CD2 3.4Å
408	L	93.9	Very high	91.3	Very high	8 Å²	8	46.1 Å²	46.1	4%	0.042	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-46.3	-38.8	-178.4	176.6	66.6	0	0	0	114.4	F403 C405 Q410 D458 H459 L483 R487	F403-L408 HydrophobicContact CE2-CB 4.32Å; F403-L408 HydrophobicContact CE2-CD1 3.98Å; F403-L408 HydrophobicContact CZ-CD1 4.27Å; C405-L408 WeakPolarHBondContact O-CB 3.31Å; C405-L408 PolarHBondContact O-N 3.42Å; L408-Q410 VanDerWaalsContact C-N 3.28Å; L408-Q410 PolarHBondContact O-N 2.99Å; L408-D458 CarbonylContact O-C 3.56Å; L408-D458 WeakPolarHBondContact O-CA 3.32Å; L408-H459 HydrophobicContact CD1-CB 4.27Å; L408-H459 PolarHBondContact O-CD2 3.08Å; L408-H459 PolarHBondContact O-N 3.47Å; L408-L483 HydrophobicContact CB-CD2 4.4Å; L408-L483 HydrophobicContact CD1-CD2 4.12Å; L408-L483 HydrophobicContact CD2-CD1 4.09Å; L408-L483 HydrophobicContact CD2-CD2 4.16Å; L408-L483 HydrophobicContact CD2-CG 4.01Å; L408-L483 HydrophobicContact CG-CD2 4.46Å; L408-R487 HydrophobicContact CD2-CG 4.47Å
409	T	92.1	Very high	91.3	Very high	37 Å²	37	45.8 Å²	45.8	23%	0.227	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-80.1	-2.6	-177.6	58.3	0	0	0	0	114.2	E407 R457 C491	E407-T409 PolarHBondContact O-N 2.94Å; T409-R457 CarbonylContact C-O 3.58Å; T409-R457 VanDerWaalsContact C-O 3.28Å; T409-R457 CarbonylContact O-C 3.59Å; T409-R457 VanDerWaalsContact O-O 3.06Å; T409-C491 HydrophobicContact CG2-CB 4.48Å
410	Q	91.4	Very high	91.1	Very high	59 Å²	59	47.9 Å²	47.9	28%	0.276	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-102.6	19.8	-166.2	-53.3	-167.7	17.9	0	0	114.8	E407 L408 K412	E407-Q410 HydrophobicContact CB-CB 4.38Å; E407-Q410 HydrophobicContact CB-CG 4.3Å; E407-Q410 WeakPolarHBondContact O-CB 3.3Å; E407-Q410 PolarHBondContact O-N 3.14Å; L408-Q410 VanDerWaalsContact C-N 3.28Å; L408-Q410 PolarHBondContact O-N 2.99Å; Q410-K412 PolarHBondContact O-N 3.02Å
411	C	92.9	Very high	90.5	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.234	C	C	.	.			trans	-66.4	97.1	178.6	-174.3	0	0	0	0	110.5	Y413 R457 H459	C411-Y413 PolarHBondContact O-N 3.26Å; C411-R457 WeakPolarHBondContact CA-O 3.38Å; C411-R457 HydrophobicContact CB-CG 4.07Å; C411-R457 WeakPolarHBondContact CB-O 3.4Å; C411-R457 PolarHBondContact N-O 3.03Å; C411-R457 WeakPolarHBondContact O-CG 3.32Å; C411-R457 PolarHBondContact O-N 2.82Å; C411-H459 WeakPolarHBondContact CA-NE2 3.47Å; C411-H459 HydrophobicContact CB-CB 4.25Å; C411-H459 PolarHBondContact N-CD2 3.44Å; C411-H459 VanDerWaalsContact N-CD2 3.33Å; C411-H459 PolarHBondContact N-NE2 3.14Å
412	K	91.7	Very high	89.4	Confident	106 Å²	106	44.9 Å²	44.9	46%	0.461	25%	0.252	S	S	.	.			trans	-62.6	135.2	178.8	-61.4	-176.2	-177.5	179.9	0	110.8	Q410 K455 T456	Q410-K412 PolarHBondContact O-N 3.02Å; K412-K455 CarbonylContact C-O 3.41Å; K412-K455 WeakPolarHBondContact CA-O 3.44Å; K412-T456 HydrophobicContact CG-CG2 4.23Å
413	Y	91.2	Very high	87.7	Confident	66 Å²	66	52.1 Å²	52.1	26%	0.259	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-151.8	165.1	172.7	78.9	-68.7	0	0	0	111.6	C411 P415 G453 C454 K455 R457	C411-Y413 PolarHBondContact O-N 3.26Å; Y413-P415 HydrophobicContact CE2-CB 4.3Å; Y413-G453 CarbonylContact O-C 3.46Å; Y413-G453 WeakPolarHBondContact O-CA 3.44Å; Y413-C454 PolarHBondContact O-N 3.43Å; Y413-C454 VanDerWaalsContact O-N 3.15Å; Y413-K455 HydrophobicContact CD1-CB 4.12Å; Y413-K455 WeakPolarHBondContact CD1-O 3.24Å; Y413-K455 HydrophobicContact CE1-CB 3.59Å; Y413-K455 PolarHBondContact N-O 2.79Å; Y413-K455 PolarHBondContact O-N 3Å; Y413-K455 VanDerWaalsContact O-N 3.08Å; Y413-R457 HydrophobicContact CD1-CB 4.21Å; Y413-R457 HydrophobicContact CD1-CG 3.67Å; Y413-R457 HydrophobicContact CE1-CB 3.86Å; Y413-R457 HydrophobicContact CE1-CG 3.82Å; Y413-R457 HydrophobicContact CG-CG 4.45Å
414	H	90.4	Very high	85.9	Confident	24 Å²	24	55.9 Å²	55.9	11%	0.111	33%	0.326	C	S	.	.			trans	-105.9	135.5	165	-65	-80.4	0	0	0	108.4	Y435 C438 Q440 G453 C454	H414-Y435 HydrophobicContact CB-CD1 3.62Å; H414-Y435 HydrophobicContact CB-CE1 3.81Å; H414-Y435 HydrophobicContact CB-CG 4.14Å; H414-Y435 AromaticContact CD2-CD1 3.84Å; H414-Y435 AromaticContact CD2-CD2 3.58Å; H414-Y435 AromaticContact CD2-CE1 3.66Å; H414-Y435 AromaticContact CD2-CE2 3.38Å; H414-Y435 WeakPolarHBondContact CD2-CE2 3.19Å; H414-Y435 AromaticContact CD2-CG 3.8Å; H414-Y435 AromaticContact CD2-CZ 3.42Å; H414-Y435 VanDerWaalsContact CD2-CZ 3.42Å; H414-Y435 AromaticContact CE1-CD2 3.68Å; H414-Y435 AromaticContact CE1-CG 3.94Å; H414-Y435 AromaticContact CG-CD1 3.59Å; H414-Y435 AromaticContact CG-CD2 3.89Å; H414-Y435 AromaticContact CG-CE1 3.8Å; H414-Y435 AromaticContact CG-CG 3.63Å; H414-Y435 AromaticContact ND1-CD2 3.95Å; H414-Y435 AromaticContact ND1-CG 3.74Å; H414-Y435 AromaticContact NE2-CD2 3.46Å; H414-Y435 WeakPolarHBondContact NE2-CD2 3.41Å; H414-Y435 AromaticContact NE2-CE2 3.45Å; H414-Y435 WeakPolarHBondContact NE2-CE2 3.15Å; H414-C438 PolarHBondContact CE1-SG 3.37Å; H414-C438 PolarHBondContact ND1-SG 2.87Å; H414-C438 VanDerWaalsContact ND1-SG 3.42Å; H414-Q440 PolarHBondContact CE1-OE1 3.38Å; H414-Q440 PolarHBondContact NE2-OE1 3.26Å; H414-G453 WeakPolarHBondContact NE2-CA 3.23Å; H414-G453 PolarHBondContact NE2-N 3.13Å; H414-C454 PolarHBondContact CE1-N 3.43Å; H414-C454 PolarHBondContact ND1-SG 3.28Å
415	P	89.9	Confident	83.9	Confident	62 Å²	62	57.4 Å²	57.4	40%	0.403	34%	0.339	S	S	.	.	S	Bend	trans	-71.1	-34.8	174.9	28.6	-34.7	0	0	0	112.1	Y413 C437 K455	Y413-P415 HydrophobicContact CE2-CB 4.3Å; P415-C437 HydrophobicContact CG-CB 3.72Å; P415-K455 HydrophobicContact CG-CD 4.21Å
416	D	89.8	Confident	81.9	Confident	69 Å²	69	65.7 Å²	65.7	37%	0.369	38%	0.378	S	S	.	.	S	Bend	trans	-93.6	149.9	-178.7	-56.3	-23.1	0	0	0	111.5	Y435 P436 C437	D416-Y435 WeakPolarHBondContact O-CD1 3.13Å; D416-P436 HydrophobicContact CB-CB 4.27Å; D416-P436 HydrophobicContact CB-CG 4.26Å; D416-C437 HydrophobicContact CB-CB 4.21Å; D416-C437 VanDerWaalsContact OD2-CA 3.25Å; D416-C437 WeakPolarHBondContact OD2-CA 3.23Å; D416-C437 WeakPolarHBondContact OD2-CB 3.5Å; D416-C437 PolarHBondContact OD2-N 3.36Å
417	S	87.4	Confident	80	Confident	94 Å²	94	74.1 Å²	74.1	66%	0.657	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-71.3	150.4	171.4	54	0	0	0	0	111.9	P436	S417-P436 WeakPolarHBondContact O-CD 3.47Å
418	V	88.9	Confident	78.2	Confident	36 Å²	36	74.6 Å²	74.6	22%	0.218	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-69.7	129.4	176.7	45.8	0	0	0	0	111.1	Y420 Y435 V442	V418-Y420 HydrophobicContact CB-CE2 4.21Å; V418-Y420 HydrophobicContact CG1-CD2 4.44Å; V418-Y420 HydrophobicContact CG1-CE2 3.55Å; V418-Y420 HydrophobicContact CG2-CD1 4.44Å; V418-Y420 HydrophobicContact CG2-CD2 4.07Å; V418-Y420 HydrophobicContact CG2-CE1 3.99Å; V418-Y420 HydrophobicContact CG2-CE2 3.62Å; V418-Y420 HydrophobicContact CG2-CG 4.46Å; V418-Y435 HydrophobicContact CB-CD1 4Å; V418-Y435 HydrophobicContact CB-CE1 3.8Å; V418-Y435 HydrophobicContact CG1-CE1 4.33Å; V418-V442 HydrophobicContact CB-CG1 4.09Å; V418-V442 HydrophobicContact CG2-CG1 3.42Å; V418-V442 VanDerWaalsContact CG2-CG1 3.42Å
419	L	88.4	Confident	76.3	Confident	110 Å²	110	79.2 Å²	79.2	58%	0.576	44%	0.444	S	S	*	.	B	Isolated β-bridge	trans	-91	125.8	168.8	-59.2	-177.2	0	0	0	109.8	G433 I434 P436	L419-G433 CarbonylContact O-C 3.5Å; L419-G433 WeakPolarHBondContact O-CA 3.37Å; L419-I434 PolarHBondContact N-O 2.83Å; L419-I434 PolarHBondContact O-N 2.9Å; L419-P436 HydrophobicContact CD1-CG 3.75Å; L419-P436 HydrophobicContact CG-CG 3.8Å
420	Y	85	Confident	75	Confident	72 Å²	72	83 Å²	83	28%	0.282	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-103.2	133	170.7	-66.9	-80.1	0	0	0	109.3	V418 R444	V418-Y420 HydrophobicContact CB-CE2 4.21Å; V418-Y420 HydrophobicContact CG1-CD2 4.44Å; V418-Y420 HydrophobicContact CG1-CE2 3.55Å; V418-Y420 HydrophobicContact CG2-CD1 4.44Å; V418-Y420 HydrophobicContact CG2-CD2 4.07Å; V418-Y420 HydrophobicContact CG2-CE1 3.99Å; V418-Y420 HydrophobicContact CG2-CE2 3.62Å; V418-Y420 HydrophobicContact CG2-CG 4.46Å; Y420-R444 HydrophobicContact CD1-CB 4.31Å; Y420-R444 HydrophobicContact CE1-CB 3.59Å; Y420-R444 HydrophobicContact CE1-CG 4.24Å; Y420-R444 VanDerWaalsContact CG-NH2 3.26Å; Y420-R444 WeakPolarHBondContact OH-CA 3.25Å
421	P	75.9	Confident	74.2	Confident	56 Å²	56	81.7 Å²	81.7	36%	0.364	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-56.6	143	171.1	-22.4	33.1	0	0	0	111.5	A425 W429 A432	P421-A425 HydrophobicContact CB-CB 3.77Å; P421-W429 HydrophobicContact CG-CB 4.47Å; P421-W429 HydrophobicContact CG-CE3 3.91Å; P421-A432 VanDerWaalsContact CD-O 3.27Å; P421-A432 WeakPolarHBondContact CD-O 3.41Å
422	G	66.6	Low	73.7	Confident	52 Å²	52	81.8 Å²	81.8	54%	0.536	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-64.9	159.4	174.9	0	0	0	0	0	112.3	G424 A425	G422-G424 PolarHBondContact O-N 2.98Å; G422-A425 WeakPolarHBondContact O-CB 3.48Å; G422-A425 PolarHBondContact O-N 2.95Å
423	M	56	Low	73.4	Confident	189 Å²	189	76.8 Å²	76.8	93%	0.931	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-14.6	-177	-86.1	176.9	164.7	0	0	115.4
424	G	54.8	Low	73.3	Confident	84 Å²	84	75.8 Å²	75.8	87%	0.866	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	2.4	174.5	0	0	0	0	0	115.7	G422	G422-G424 PolarHBondContact O-N 2.98Å
425	A	53.8	Low	73.2	Confident	41 Å²	41	76.8 Å²	76.8	34%	0.339	44%	0.443	S	S	.	.	S	Bend	trans	-69.3	152.9	172.9	0	0	0	0	0	111.5	P421 G422	P421-A425 HydrophobicContact CB-CB 3.77Å; G422-A425 WeakPolarHBondContact O-CB 3.48Å; G422-A425 PolarHBondContact O-N 2.95Å
426	E	52.8	Low	73.1	Confident	175 Å²	175	76.4 Å²	76.4	82%	0.818	44%	0.441	S	S	*	.			trans	-63.1	158.1	-170.7	-64.5	-153.8	147.9	0	0	114.8	G428	E426-G428 PolarHBondContact O-N 2.87Å; E426-G428 VanDerWaalsContact O-N 3.12Å
427	K	54.8	Low	73.2	Confident	183 Å²	183	75.1 Å²	75.1	80%	0.796	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	113.4	-171.1	-64.8	-177.2	176.8	-172.6	0	112
428	G	54.8	Low	73.2	Confident	43 Å²	43	73 Å²	73	44%	0.443	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	140.2	-18.2	170.7	0	0	0	0	0	115.1	E426	E426-G428 PolarHBondContact O-N 2.87Å; E426-G428 VanDerWaalsContact O-N 3.12Å
429	W	54.1	Low	73.1	Confident	106 Å²	106	77.1 Å²	77.1	40%	0.402	44%	0.442	S	S	.	.			trans	-98.5	4.1	-172.4	-69.8	60.4	0	0	0	114.7	P421 G431 A432 I434 R441	P421-W429 HydrophobicContact CG-CB 4.47Å; P421-W429 HydrophobicContact CG-CE3 3.91Å; W429-G431 PolarHBondContact O-N 3.18Å; W429-A432 PolarHBondContact O-N 3.38Å; W429-A432 VanDerWaalsContact O-N 3.15Å; W429-I434 HydrophobicContact CH2-CD1 4.33Å; W429-I434 HydrophobicContact CZ3-CD1 3.84Å; W429-R441 VanDerWaalsContact CZ2-NH2 3.27Å
430	H	64.9	Low	73	Confident	115 Å²	115	75.7 Å²	75.7	53%	0.532	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	108.5	-176.9	-53.8	-50.4	0	0	0	111.6
431	G	73.8	Confident	73	Confident	32 Å²	32	76.2 Å²	76.2	33%	0.33	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.5	-0.7	-179.7	0	0	0	0	0	115	W429 R444	W429-G431 PolarHBondContact O-N 3.18Å; G431-R444 WeakPolarHBondContact O-CB 3.32Å; G431-R444 PolarHBondContact O-N 3.48Å
432	A	82.1	Confident	73.5	Confident	3 Å²	3	74.1 Å²	74.1	3%	0.025	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	148	168.1	0	0	0	0	0	111.2	P421 W429 V442	P421-A432 VanDerWaalsContact CD-O 3.27Å; P421-A432 WeakPolarHBondContact CD-O 3.41Å; W429-A432 PolarHBondContact O-N 3.38Å; W429-A432 VanDerWaalsContact O-N 3.15Å; A432-V442 CarbonylContact C-O 3.58Å; A432-V442 WeakPolarHBondContact CA-O 3.21Å
433	G	86.6	Confident	74.3	Confident	1 Å²	1	72.6 Å²	72.6	1%	0.01	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	176.5	173.9	0	0	0	0	0	111.3	L419 R441 V442	L419-G433 CarbonylContact O-C 3.5Å; L419-G433 WeakPolarHBondContact O-CA 3.37Å; G433-R441 WeakPolarHBondContact O-CA 3.28Å; G433-V442 PolarHBondContact N-O 2.98Å; G433-V442 PolarHBondContact O-N 2.84Å
434	I	87.6	Confident	75.6	Confident	45 Å²	45	70 Å²	70	23%	0.231	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	138.2	-177.7	-65.4	-178.8	0	0	0	109.8	L419 W429 N439 Q440 R441	L419-I434 PolarHBondContact N-O 2.83Å; L419-I434 PolarHBondContact O-N 2.9Å; W429-I434 HydrophobicContact CH2-CD1 4.33Å; W429-I434 HydrophobicContact CZ3-CD1 3.84Å; I434-N439 HydrophobicContact CG2-CB 4.35Å; I434-Q440 WeakPolarHBondContact CA-O 3.43Å; I434-R441 HydrophobicContact CG1-CG 4.36Å
435	Y	88.9	Confident	76.8	Confident	45 Å²	45	74.2 Å²	74.2	18%	0.176	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	117.7	169.4	-74	-73.8	0	0	0	111.1	H414 D416 V418 C437 C438 N439 Q440 V442	H414-Y435 HydrophobicContact CB-CD1 3.62Å; H414-Y435 HydrophobicContact CB-CE1 3.81Å; H414-Y435 HydrophobicContact CB-CG 4.14Å; H414-Y435 AromaticContact CD2-CD1 3.84Å; H414-Y435 AromaticContact CD2-CD2 3.58Å; H414-Y435 AromaticContact CD2-CE1 3.66Å; H414-Y435 AromaticContact CD2-CE2 3.38Å; H414-Y435 WeakPolarHBondContact CD2-CE2 3.19Å; H414-Y435 AromaticContact CD2-CG 3.8Å; H414-Y435 AromaticContact CD2-CZ 3.42Å; H414-Y435 VanDerWaalsContact CD2-CZ 3.42Å; H414-Y435 AromaticContact CE1-CD2 3.68Å; H414-Y435 AromaticContact CE1-CG 3.94Å; H414-Y435 AromaticContact CG-CD1 3.59Å; H414-Y435 AromaticContact CG-CD2 3.89Å; H414-Y435 AromaticContact CG-CE1 3.8Å; H414-Y435 AromaticContact CG-CG 3.63Å; H414-Y435 AromaticContact ND1-CD2 3.95Å; H414-Y435 AromaticContact ND1-CG 3.74Å; H414-Y435 AromaticContact NE2-CD2 3.46Å; H414-Y435 WeakPolarHBondContact NE2-CD2 3.41Å; H414-Y435 AromaticContact NE2-CE2 3.45Å; H414-Y435 WeakPolarHBondContact NE2-CE2 3.15Å; D416-Y435 WeakPolarHBondContact O-CD1 3.13Å; V418-Y435 HydrophobicContact CB-CD1 4Å; V418-Y435 HydrophobicContact CB-CE1 3.8Å; V418-Y435 HydrophobicContact CG1-CE1 4.33Å; Y435-C437 PolarHBondContact O-N 2.88Å; Y435-C438 PolarHBondContact O-N 2.93Å; Y435-N439 WeakPolarHBondContact O-CA 3.27Å; Y435-N439 PolarHBondContact O-N 2.83Å; Y435-Q440 PolarHBondContact N-O 3.07Å; Y435-V442 HydrophobicContact CD2-CB 4.11Å; Y435-V442 HydrophobicContact CD2-CG1 3.9Å; Y435-V442 HydrophobicContact CE2-CB 3.63Å; Y435-V442 HydrophobicContact CE2-CG1 3.58Å; Y435-V442 HydrophobicContact CE2-CG2 3.87Å
436	P	89	Confident	78	Confident	54 Å²	54	74.1 Å²	74.1	35%	0.351	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-55.8	-47.2	-175.8	-27.6	35.7	0	0	0	113.9	D416 S417 L419 C438	D416-P436 HydrophobicContact CB-CB 4.27Å; D416-P436 HydrophobicContact CB-CG 4.26Å; S417-P436 WeakPolarHBondContact O-CD 3.47Å; L419-P436 HydrophobicContact CD1-CG 3.75Å; L419-P436 HydrophobicContact CG-CG 3.8Å; P436-C438 PolarHBondContact O-N 3.47Å
437	C	90.8	Very high	79.2	Confident	41 Å²	41	71.1 Å²	71.1	28%	0.277	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-49.8	-11.9	177.1	54.4	0	0	0	0	118.3	P415 D416 Y435 C454	P415-C437 HydrophobicContact CG-CB 3.72Å; D416-C437 HydrophobicContact CB-CB 4.21Å; D416-C437 VanDerWaalsContact OD2-CA 3.25Å; D416-C437 WeakPolarHBondContact OD2-CA 3.23Å; D416-C437 WeakPolarHBondContact OD2-CB 3.5Å; D416-C437 PolarHBondContact OD2-N 3.36Å; Y435-C437 PolarHBondContact O-N 2.88Å; C437-C454 PolarHBondContact SG-SG 2.92Å
438	C	88.4	Confident	80.2	Confident	49 Å²	49	64 Å²	64	33%	0.331	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-160.1	3.6	-176.6	56.4	0	0	0	0	114.8	H414 Y435 P436 Q440 C454	H414-C438 PolarHBondContact CE1-SG 3.37Å; H414-C438 PolarHBondContact ND1-SG 2.87Å; H414-C438 VanDerWaalsContact ND1-SG 3.42Å; Y435-C438 PolarHBondContact O-N 2.93Å; P436-C438 PolarHBondContact O-N 3.47Å; C438-Q440 PolarHBondContact O-N 3.27Å; C438-Q440 VanDerWaalsContact SG-CB 3.59Å; C438-C454 HydrophobicContact CB-CB 3.6Å
439	N	87.1	Confident	81.1	Confident	124 Å²	124	63.7 Å²	63.7	66%	0.663	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	17.8	-171.5	-66.1	-38	0	0	0	116	I434 Y435 R441	I434-N439 HydrophobicContact CG2-CB 4.35Å; Y435-N439 WeakPolarHBondContact O-CA 3.27Å; Y435-N439 PolarHBondContact O-N 2.83Å; N439-R441 PolarHBondContact O-N 3.2Å
440	Q	85.9	Confident	82.2	Confident	79 Å²	79	60.9 Å²	60.9	37%	0.369	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	126.3	179.6	-173.8	170.9	18.5	0	0	111.2	H414 I434 Y435 C438	H414-Q440 PolarHBondContact CE1-OE1 3.38Å; H414-Q440 PolarHBondContact NE2-OE1 3.26Å; I434-Q440 WeakPolarHBondContact CA-O 3.43Å; Y435-Q440 PolarHBondContact N-O 3.07Å; C438-Q440 PolarHBondContact O-N 3.27Å; C438-Q440 VanDerWaalsContact SG-CB 3.59Å
441	R	84.8	Confident	82.6	Confident	84 Å²	84	57.2 Å²	57.2	32%	0.317	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	137.6	171.4	-71.2	-177.2	180	-91.8	-3.3	111.2	W429 G433 I434 N439	W429-R441 VanDerWaalsContact CZ2-NH2 3.27Å; G433-R441 WeakPolarHBondContact O-CA 3.28Å; I434-R441 HydrophobicContact CG1-CG 4.36Å; N439-R441 PolarHBondContact O-N 3.2Å
442	V	86	Confident	82.9	Confident	11 Å²	11	58.1 Å²	58.1	7%	0.067	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	141.6	177.4	62	0	0	0	0	110.2	V418 A432 G433 Y435	V418-V442 HydrophobicContact CB-CG1 4.09Å; V418-V442 HydrophobicContact CG2-CG1 3.42Å; V418-V442 VanDerWaalsContact CG2-CG1 3.42Å; A432-V442 CarbonylContact C-O 3.58Å; A432-V442 WeakPolarHBondContact CA-O 3.21Å; G433-V442 PolarHBondContact N-O 2.98Å; G433-V442 PolarHBondContact O-N 2.84Å; Y435-V442 HydrophobicContact CD2-CB 4.11Å; Y435-V442 HydrophobicContact CD2-CG1 3.9Å; Y435-V442 HydrophobicContact CE2-CB 3.63Å; Y435-V442 HydrophobicContact CE2-CG1 3.58Å; Y435-V442 HydrophobicContact CE2-CG2 3.87Å
443	L	84.2	Confident	83.1	Confident	21 Å²	21	58.9 Å²	58.9	11%	0.11	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	139.4	174.2	-57.3	-180	0	0	0	109.4	F445 D446 M654	L443-F445 WeakPolarHBondContact CB-O 3.49Å; L443-F445 PolarHBondContact O-N 3.28Å; L443-D446 HydrophobicContact CB-CB 4.36Å; L443-M654 HydrophobicContact CD2-CB 4.02Å
444	R	82.7	Confident	83.3	Confident	134 Å²	134	61.5 Å²	61.5	51%	0.506	33%	0.331	S	S	.	.	S	Bend	trans	-59.3	-29.6	175.2	178.5	168.2	-83	-119.4	-1.6	112.6	Y420 G431	Y420-R444 HydrophobicContact CD1-CB 4.31Å; Y420-R444 HydrophobicContact CE1-CB 3.59Å; Y420-R444 HydrophobicContact CE1-CG 4.24Å; Y420-R444 VanDerWaalsContact CG-NH2 3.26Å; Y420-R444 WeakPolarHBondContact OH-CA 3.25Å; G431-R444 WeakPolarHBondContact O-CB 3.32Å; G431-R444 PolarHBondContact O-N 3.48Å
445	F	80.6	Confident	83.4	Confident	173 Å²	173	64.9 Å²	64.9	76%	0.759	34%	0.344	S	S	*	.	S	Bend	trans	-128.2	107.4	170.2	-53.6	-74.6	0	0	0	107	L443	L443-F445 WeakPolarHBondContact CB-O 3.49Å; L443-F445 PolarHBondContact O-N 3.28Å
446	D	79	Confident	83.6	Confident	39 Å²	39	66.8 Å²	66.8	21%	0.209	36%	0.361	C	S	.	.			trans	-114.3	99.2	173.3	-163.9	-17.5	0	0	0	109.4	L443 T448 K452 R655	L443-D446 HydrophobicContact CB-CB 4.36Å; D446-T448 PolarHBondContact O-N 3.11Å; D446-T448 VanDerWaalsContact O-N 3.14Å; D446-T448 WeakPolarHBondContact OD1-CB 3.38Å; D446-T448 WeakPolarHBondContact OD1-CG2 3.23Å; D446-T448 PolarHBondContact OD1-N 2.87Å; D446-T448 PolarHBondContact OD1-OG1 2.85Å; D446-K452 WeakPolarHBondContact OD2-CE 3.31Å; D446-K452 IonicContact OD2-NZ 3.58Å; D446-K452 PolarHBondContact OD2-NZ 3.04Å; D446-R655 VanDerWaalsContact CG-NH2 3.3Å; D446-R655 IonicContact OD1-CZ 3.45Å; D446-R655 IonicContact OD1-NH1 2.77Å; D446-R655 PolarHBondContact OD1-NH1 3.36Å; D446-R655 IonicContact OD1-NH2 2.73Å; D446-R655 PolarHBondContact OD1-NH2 3.08Å; D446-R655 IonicContact OD2-CZ 3.9Å; D446-R655 IonicContact OD2-NH1 3.63Å; D446-R655 PolarHBondContact OD2-NH1 3.46Å; D446-R655 IonicContact OD2-NH2 3.51Å; D446-R655 PolarHBondContact OD2-NH2 3.41Å
447	P	77.5	Confident	83.8	Confident	111 Å²	111	68.4 Å²	68.4	72%	0.721	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-4.6	-176.2	31	-36.5	0	0	0	113.3	I354 G449	I354-P447 WeakPolarHBondContact CD1-O 3.13Å; P447-G449 VanDerWaalsContact C-N 3.32Å; P447-G449 PolarHBondContact O-N 2.89Å
448	T	75.8	Confident	83.9	Confident	33 Å²	33	69.2 Å²	69.2	20%	0.202	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-13.5	-175.6	62.8	0	0	0	0	114.3	D446 I450	D446-T448 PolarHBondContact O-N 3.11Å; D446-T448 VanDerWaalsContact O-N 3.14Å; D446-T448 WeakPolarHBondContact OD1-CB 3.38Å; D446-T448 WeakPolarHBondContact OD1-CG2 3.23Å; D446-T448 PolarHBondContact OD1-N 2.87Å; D446-T448 PolarHBondContact OD1-OG1 2.85Å; T448-I450 PolarHBondContact O-N 2.92Å
449	G	73.6	Confident	84.1	Confident	37 Å²	37	67.9 Å²	67.9	38%	0.381	35%	0.35	S	S	.	.			trans	65.2	-1.7	177.7	0	0	0	0	0	116.5	Q401 P447	Q401-G449 PolarHBondContact NE2-O 3.2Å; P447-G449 VanDerWaalsContact C-N 3.32Å; P447-G449 PolarHBondContact O-N 2.89Å
450	I	77.1	Confident	84.4	Confident	47 Å²	47	65.3 Å²	65.3	24%	0.241	34%	0.336	C	S	.	.			trans	-63.5	132	-172.2	-52.8	168.5	0	0	0	110.9	I346 T448 K452	I346-I450 HydrophobicContact CD1-CD1 3.52Å; I346-I450 HydrophobicContact CD1-CG1 3.8Å; T448-I450 PolarHBondContact O-N 2.92Å; I450-K452 PolarHBondContact O-N 2.86Å
451	P	73.3	Confident	84.6	Confident	39 Å²	39	62.7 Å²	62.7	25%	0.253	33%	0.325	S	S	.	.			trans	-67.6	116.1	176.2	28.3	-35.1	0	0	0	111.3	Q401	Q401-P451 HydrophobicContact CG-CB 3.95Å; Q401-P451 HydrophobicContact CG-CG 3.91Å
452	K	80.3	Confident	84.6	Confident	51 Å²	51	64.1 Å²	64.1	22%	0.222	34%	0.339	C	S	.	.			trans	-104.5	149.5	173.6	-61.7	179.5	-167.4	170.3	0	110.9	D446 I450	D446-K452 WeakPolarHBondContact OD2-CE 3.31Å; D446-K452 IonicContact OD2-NZ 3.58Å; D446-K452 PolarHBondContact OD2-NZ 3.04Å; I450-K452 PolarHBondContact O-N 2.86Å
453	G	86.2	Confident	84	Confident	19 Å²	19	65.9 Å²	65.9	20%	0.196	35%	0.35	C	S	.	.			trans	172.3	142.3	179.7	0	0	0	0	0	112	Y413 H414	Y413-G453 CarbonylContact O-C 3.46Å; Y413-G453 WeakPolarHBondContact O-CA 3.44Å; H414-G453 WeakPolarHBondContact NE2-CA 3.23Å; H414-G453 PolarHBondContact NE2-N 3.13Å
454	C	89.8	Confident	83.1	Confident	56 Å²	56	72.5 Å²	72.5	38%	0.378	38%	0.38	S	S	.	.	S	Bend	trans	-90.9	-10.5	170	60	0	0	0	0	113	Y413 H414 C437 C438	Y413-C454 PolarHBondContact O-N 3.43Å; Y413-C454 VanDerWaalsContact O-N 3.15Å; H414-C454 PolarHBondContact CE1-N 3.43Å; H414-C454 PolarHBondContact ND1-SG 3.28Å; C437-C454 PolarHBondContact SG-SG 2.92Å; C438-C454 HydrophobicContact CB-CB 3.6Å
455	K	91.1	Very high	81.9	Confident	115 Å²	115	72.9 Å²	72.9	50%	0.5	39%	0.392	S	S	.	.	B	Isolated β-bridge	trans	-127	153.8	174.4	-63.5	-169.3	178	-172	0	110.5	K412 Y413 P415	K412-K455 CarbonylContact C-O 3.41Å; K412-K455 WeakPolarHBondContact CA-O 3.44Å; Y413-K455 HydrophobicContact CD1-CB 4.12Å; Y413-K455 WeakPolarHBondContact CD1-O 3.24Å; Y413-K455 HydrophobicContact CE1-CB 3.59Å; Y413-K455 PolarHBondContact N-O 2.79Å; Y413-K455 PolarHBondContact O-N 3Å; Y413-K455 VanDerWaalsContact O-N 3.08Å; P415-K455 HydrophobicContact CG-CD 4.21Å
456	T	93.6	Very high	80.5	Confident	85 Å²	85	72.3 Å²	72.3	52%	0.521	39%	0.392	S	S	.	.			trans	-108.6	158.1	171.8	48.4	0	0	0	0	110.6	K412	K412-T456 HydrophobicContact CG-CG2 4.23Å
457	R	91.8	Very high	79.3	Confident	88 Å²	88	79.3 Å²	79.3	33%	0.332	42%	0.423	S	S	.	.			trans	-156.9	173.8	174.5	61.6	-178.3	176.1	-174.9	-2.3	108.6	T409 C411 Y413 H459	T409-R457 CarbonylContact C-O 3.58Å; T409-R457 VanDerWaalsContact C-O 3.28Å; T409-R457 CarbonylContact O-C 3.59Å; T409-R457 VanDerWaalsContact O-O 3.06Å; C411-R457 WeakPolarHBondContact CA-O 3.38Å; C411-R457 HydrophobicContact CB-CG 4.07Å; C411-R457 WeakPolarHBondContact CB-O 3.4Å; C411-R457 PolarHBondContact N-O 3.03Å; C411-R457 WeakPolarHBondContact O-CG 3.32Å; C411-R457 PolarHBondContact O-N 2.82Å; Y413-R457 HydrophobicContact CD1-CB 4.21Å; Y413-R457 HydrophobicContact CD1-CG 3.67Å; Y413-R457 HydrophobicContact CE1-CB 3.86Å; Y413-R457 HydrophobicContact CE1-CG 3.82Å; Y413-R457 HydrophobicContact CG-CG 4.45Å; R457-H459 PolarHBondContact O-N 3.17Å
458	D	93.2	Very high	78.1	Confident	59 Å²	59	82.3 Å²	82.3	32%	0.316	43%	0.425	S	S	.	.			trans	-63	131.4	173.1	-61.3	-27.5	0	0	0	111.8	R398 L408 R487	R398-D458 PolarHBondContact NH1-O 3.33Å; L408-D458 CarbonylContact O-C 3.56Å; L408-D458 WeakPolarHBondContact O-CA 3.32Å; D458-R487 IonicContact OD1-NH2 3.86Å; D458-R487 PolarHBondContact OD1-NH2 2.96Å; D458-R487 IonicContact OD2-CZ 2.65Å; D458-R487 IonicContact OD2-NH1 2.68Å; D458-R487 IonicContact OD2-NH2 3.53Å; D458-R487 PolarHBondContact OD2-NH2 3.01Å
459	H	92.6	Very high	77.2	Confident	20 Å²	20	91.4 Å²	91.4	9%	0.093	46%	0.457	C	S	.	.			trans	-59.2	144.6	161.8	-75.7	-96.3	0	0	0	108.7	C396 F403 E407 L408 C411 R457	C396-H459 HydrophobicContact CB-CB 3.99Å; C396-H459 WeakPolarHBondContact CB-ND1 3.36Å; C396-H459 PolarHBondContact SG-ND1 2.94Å; C396-H459 VanDerWaalsContact SG-ND1 3.37Å; F403-H459 HydrophobicContact CD1-CB 4.18Å; F403-H459 AromaticContact CD1-CE1 3.91Å; F403-H459 AromaticContact CD1-CG 3.81Å; F403-H459 AromaticContact CD1-ND1 3.5Å; F403-H459 WeakPolarHBondContact CD1-ND1 3.14Å; F403-H459 HydrophobicContact CD2-CB 4.24Å; F403-H459 AromaticContact CD2-CD2 3.83Å; F403-H459 AromaticContact CD2-CG 3.92Å; F403-H459 HydrophobicContact CE1-CB 3.71Å; F403-H459 AromaticContact CE1-CG 3.88Å; F403-H459 AromaticContact CE1-ND1 3.87Å; F403-H459 HydrophobicContact CE2-CB 3.78Å; F403-H459 AromaticContact CE2-CG 3.99Å; F403-H459 HydrophobicContact CG-CB 4.45Å; F403-H459 AromaticContact CG-CD2 3.94Å; F403-H459 AromaticContact CG-CE1 3.82Å; F403-H459 AromaticContact CG-CG 3.85Å; F403-H459 AromaticContact CG-ND1 3.77Å; F403-H459 AromaticContact CG-NE2 3.97Å; F403-H459 HydrophobicContact CZ-CB 3.49Å; F403-H459 VanDerWaalsContact CZ-CB 3.49Å; F403-H459 AromaticContact CZ-CG 3.98Å; E407-H459 PolarHBondContact O-CD2 3.4Å; L408-H459 HydrophobicContact CD1-CB 4.27Å; L408-H459 PolarHBondContact O-CD2 3.08Å; L408-H459 PolarHBondContact O-N 3.47Å; C411-H459 WeakPolarHBondContact CA-NE2 3.47Å; C411-H459 HydrophobicContact CB-CB 4.25Å; C411-H459 PolarHBondContact N-CD2 3.44Å; C411-H459 VanDerWaalsContact N-CD2 3.33Å; C411-H459 PolarHBondContact N-NE2 3.14Å; R457-H459 PolarHBondContact O-N 3.17Å
460	I	92.8	Very high	77.2	Confident	70 Å²	70	94.5 Å²	94.5	36%	0.359	47%	0.465	S	S	.	.			trans	-117.1	127.7	170.5	-70.2	-168.7	0	0	0	108.1	C396 S397 R398	C396-I460 CarbonylContact C-O 3.58Å; C396-I460 WeakPolarHBondContact CA-O 3.44Å; C396-I460 PolarHBondContact SG-N 3.29Å; C396-I460 VanDerWaalsContact SG-N 3.39Å; C396-I460 PolarHBondContact SG-O 2.95Å; S397-I460 PolarHBondContact N-O 2.98Å; S397-I460 PolarHBondContact OG-O 3.13Å; R398-I460 HydrophobicContact CG-CB 4.32Å; R398-I460 VanDerWaalsContact NH2-CD1 3.33Å
461	V	91.4	Very high	77.2	Confident	24 Å²	24	99.8 Å²	99.8	15%	0.145	49%	0.489	C	S	.	.			trans	-97.9	134.2	170.7	-177	0	0	0	0	106.8	L394 F403 L480	L394-V461 HydrophobicContact CB-CG2 3.71Å; L394-V461 HydrophobicContact CD1-CG2 3.95Å; L394-V461 HydrophobicContact CG-CG2 4.37Å; F403-V461 HydrophobicContact CE1-CG2 4.04Å; F403-V461 HydrophobicContact CZ-CG2 3.86Å; V461-L480 HydrophobicContact CB-CD1 4.03Å; V461-L480 HydrophobicContact CB-CD2 4.01Å; V461-L480 HydrophobicContact CG1-CD2 4.19Å; V461-L480 HydrophobicContact CG2-CD1 4.13Å
462	N	84.1	Confident	77.4	Confident	115 Å²	115	102.7 Å²	102.7	62%	0.615	51%	0.505	S	S	*	.			trans	-107.5	102.6	177.5	-166.6	94.1	0	0	0	108.8
463	V	73.3	Confident	77.4	Confident	48 Å²	48	102.7 Å²	102.7	29%	0.291	51%	0.51	S	S	.	.			trans	-65.3	138.8	167.1	-176.1	0	0	0	0	107.8	T477 L480	V463-T477 HydrophobicContact CG1-CG2 4.3Å; V463-T477 WeakPolarHBondContact CG1-OG1 3.48Å; V463-T477 HydrophobicContact CG2-CG2 4.27Å; V463-L480 HydrophobicContact CG2-CD2 3.77Å
464	Q	65.7	Low	77.3	Confident	160 Å²	160	103.4 Å²	103.4	75%	0.748	51%	0.514	S	S	*	.			trans	-89	116.3	168.4	-71.7	-178.4	-23.3	0	0	107.8
465	D	58.1	Low	77	Confident	142 Å²	142	101.6 Å²	101.6	76%	0.759	50%	0.503	S	S	*	.			trans	-65.9	174	155.7	-65.3	-55.8	0	0	0	109.7
466	E	50.4	Low	76.8	Confident	160 Å²	160	99.9 Å²	99.9	75%	0.748	50%	0.497	S	S	*	.	S	Bend	trans	84	92.3	-178.6	-50.7	-65	92.8	0	0	117.4	K468	E466-K468 VanDerWaalsContact C-N 3.31Å; E466-K468 PolarHBondContact O-N 3.41Å
467	E	54.4	Low	76.7	Confident	186 Å²	186	97.7 Å²	97.7	87%	0.869	48%	0.484	S	S	*	.	S	Bend	trans	60.6	-11.8	138.5	-52.2	-158.6	138.7	0	0	122
468	K	51.6	Low	76.6	Confident	175 Å²	175	99.1 Å²	99.1	76%	0.761	49%	0.489	S	S	*	.			trans	-103.5	99.7	170.7	-85.4	-168.3	171.7	-171.9	0	112.9	E466 D470	E466-K468 VanDerWaalsContact C-N 3.31Å; E466-K468 PolarHBondContact O-N 3.41Å; K468-D470 PolarHBondContact O-N 2.85Å
469	Y	57.2	Low	76.6	Confident	224 Å²	224	96.5 Å²	96.5	88%	0.878	48%	0.475	S	S	*	.			trans	-74.2	65.9	174.6	-99.9	-96.9	0	0	0	112.9
470	D	73.6	Confident	76.7	Confident	101 Å²	101	96.6 Å²	96.6	54%	0.54	48%	0.476	S	S	.	.			trans	-75.8	124.7	165.3	-73.7	-15.2	0	0	0	109.5	K468 V472 T473 A474	K468-D470 PolarHBondContact O-N 2.85Å; D470-V472 PolarHBondContact O-N 3.11Å; D470-V472 VanDerWaalsContact O-N 3.11Å; D470-T473 WeakPolarHBondContact O-CB 3.46Å; D470-T473 PolarHBondContact O-N 2.86Å; D470-A474 PolarHBondContact O-N 2.8Å
471	E	77.3	Confident	76.7	Confident	159 Å²	159	97.7 Å²	97.7	74%	0.743	48%	0.483	S	S	*	.	H	α-helix	trans	-56.6	-32.7	-173.6	-175.5	173	-163.2	0	0	113.2	T473 A474 A475	E471-T473 VanDerWaalsContact C-N 3.35Å; E471-T473 PolarHBondContact O-N 3.08Å; E471-A474 PolarHBondContact O-N 2.98Å; E471-A475 WeakPolarHBondContact O-CB 3.5Å; E471-A475 PolarHBondContact O-N 2.96Å
472	V	77.1	Confident	76.9	Confident	99 Å²	99	97.3 Å²	97.3	60%	0.6	48%	0.48	S	S	*	.	H	α-helix	trans	-62.5	-39.7	176.3	-177.7	0	0	0	0	111.8	D470 A475 Q476	D470-V472 PolarHBondContact O-N 3.11Å; D470-V472 VanDerWaalsContact O-N 3.11Å; V472-A475 PolarHBondContact O-N 3.36Å; V472-Q476 WeakPolarHBondContact O-CG 3.32Å; V472-Q476 PolarHBondContact O-N 3Å
473	T	80.4	Confident	77.4	Confident	51 Å²	51	91.9 Å²	91.9	31%	0.313	45%	0.451	S	S	.	.	H	α-helix	trans	-70.5	-39.2	178.2	-52.5	0	0	0	0	110.6	D470 E471 A475 Q476 T477	D470-T473 WeakPolarHBondContact O-CB 3.46Å; D470-T473 PolarHBondContact O-N 2.86Å; E471-T473 VanDerWaalsContact C-N 3.35Å; E471-T473 PolarHBondContact O-N 3.08Å; T473-A475 VanDerWaalsContact C-N 3.35Å; T473-A475 PolarHBondContact O-N 2.92Å; T473-Q476 PolarHBondContact O-N 3.48Å; T473-T477 WeakPolarHBondContact O-CB 3.26Å; T473-T477 PolarHBondContact O-N 3.21Å; T473-T477 PolarHBondContact O-OG1 3.38Å
474	A	83.3	Confident	78.4	Confident	35 Å²	35	94.6 Å²	94.6	29%	0.289	46%	0.463	S	S	.	.	H	α-helix	trans	-65.7	-34.6	173.2	0	0	0	0	0	112.7	D470 E471 R478	D470-A474 PolarHBondContact O-N 2.8Å; E471-A474 PolarHBondContact O-N 2.98Å; A474-R478 WeakPolarHBondContact O-CG 3.48Å; A474-R478 PolarHBondContact O-N 3.5Å; A474-R478 VanDerWaalsContact O-N 3.17Å; A474-R478 PolarHBondContact O-NE 3.08Å
475	A	84.8	Confident	79.7	Confident	18 Å²	18	92.6 Å²	92.6	15%	0.149	46%	0.457	C	S	.	.	H	α-helix	trans	-67.7	-46.5	172.5	0	0	0	0	0	112.3	E471 V472 T473 T477 R478 V479	E471-A475 WeakPolarHBondContact O-CB 3.5Å; E471-A475 PolarHBondContact O-N 2.96Å; V472-A475 PolarHBondContact O-N 3.36Å; T473-A475 VanDerWaalsContact C-N 3.35Å; T473-A475 PolarHBondContact O-N 2.92Å; A475-T477 VanDerWaalsContact C-N 3.3Å; A475-T477 PolarHBondContact O-N 2.8Å; A475-R478 PolarHBondContact O-N 3.5Å; A475-V479 WeakPolarHBondContact O-CG2 3.18Å; A475-V479 PolarHBondContact O-N 3.08Å; A475-V479 VanDerWaalsContact O-N 3.08Å
476	Q	87.1	Confident	81.5	Confident	79 Å²	79	87.2 Å²	87.2	37%	0.369	43%	0.427	S	S	.	.	H	α-helix	trans	-62.8	-36.1	176.2	-71.6	179.8	22.8	0	0	112.5	L394 V472 T473 V479 L480	L394-Q476 HydrophobicContact CD2-CB 4.25Å; L394-Q476 HydrophobicContact CD2-CG 4.47Å; V472-Q476 WeakPolarHBondContact O-CG 3.32Å; V472-Q476 PolarHBondContact O-N 3Å; T473-Q476 PolarHBondContact O-N 3.48Å; Q476-V479 PolarHBondContact O-N 3.05Å; Q476-L480 WeakPolarHBondContact O-CB 3.16Å; Q476-L480 PolarHBondContact O-N 2.92Å
477	T	89.5	Confident	83.5	Confident	39 Å²	39	84.1 Å²	84.1	24%	0.239	41%	0.409	C	S	.	.	H	α-helix	trans	-67.6	-40.2	177.7	-55.9	0	0	0	0	111.9	V463 T473 A475 L480 N481	V463-T477 HydrophobicContact CG1-CG2 4.3Å; V463-T477 WeakPolarHBondContact CG1-OG1 3.48Å; V463-T477 HydrophobicContact CG2-CG2 4.27Å; T473-T477 WeakPolarHBondContact O-CB 3.26Å; T473-T477 PolarHBondContact O-N 3.21Å; T473-T477 PolarHBondContact O-OG1 3.38Å; A475-T477 VanDerWaalsContact C-N 3.3Å; A475-T477 PolarHBondContact O-N 2.8Å; T477-L480 PolarHBondContact O-N 2.69Å; T477-N481 VanDerWaalsContact O-CG 3.28Å; T477-N481 PolarHBondContact O-N 3.32Å; T477-N481 VanDerWaalsContact O-N 3.08Å; T477-N481 PolarHBondContact O-ND2 3.48Å
478	R	90.9	Very high	85.3	Confident	117 Å²	117	81.3 Å²	81.3	44%	0.442	40%	0.4	S	S	.	.	H	α-helix	trans	-59.8	-55.1	171.6	-77.1	-179.4	-76.5	163.2	-5.3	111.2	K312 A474 A475 L480 N481 D482	K312-R478 PolarHBondContact O-NH1 3.36Å; K312-R478 VanDerWaalsContact O-NH1 3.08Å; A474-R478 WeakPolarHBondContact O-CG 3.48Å; A474-R478 PolarHBondContact O-N 3.5Å; A474-R478 VanDerWaalsContact O-N 3.17Å; A474-R478 PolarHBondContact O-NE 3.08Å; A475-R478 PolarHBondContact O-N 3.5Å; R478-L480 PolarHBondContact O-N 3.27Å; R478-L480 VanDerWaalsContact O-N 3.15Å; R478-N481 WeakPolarHBondContact O-CA 3.13Å; R478-N481 WeakPolarHBondContact O-CB 3.35Å; R478-N481 PolarHBondContact O-N 2.91Å; R478-D482 VanDerWaalsContact C-OD2 3.29Å; R478-D482 VanDerWaalsContact O-CG 3.27Å; R478-D482 PolarHBondContact O-N 2.94Å
479	V	93.8	Very high	87.2	Confident	4 Å²	4	73.9 Å²	73.9	2%	0.024	37%	0.371	C	S	.	.	H	α-helix	trans	-55.6	-35.8	178.3	173.3	0	0	0	0	112.5	P315 W388 N392 L394 A475 Q476 L483	P315-V479 HydrophobicContact CG-CG2 3.63Å; W388-V479 HydrophobicContact CH2-CG1 3.92Å; W388-V479 WeakPolarHBondContact CH2-O 3.46Å; W388-V479 HydrophobicContact CZ2-CB 4.4Å; W388-V479 HydrophobicContact CZ2-CG1 4.13Å; W388-V479 HydrophobicContact CZ2-CG2 4.29Å; N392-V479 HydrophobicContact CB-CG1 3.94Å; L394-V479 HydrophobicContact CD1-CG1 4.21Å; L394-V479 HydrophobicContact CD2-CB 4.26Å; L394-V479 HydrophobicContact CD2-CG1 3.94Å; L394-V479 HydrophobicContact CG-CG1 4.1Å; A475-V479 WeakPolarHBondContact O-CG2 3.18Å; A475-V479 PolarHBondContact O-N 3.08Å; A475-V479 VanDerWaalsContact O-N 3.08Å; Q476-V479 PolarHBondContact O-N 3.05Å; V479-L483 WeakPolarHBondContact O-CB 3.39Å; V479-L483 PolarHBondContact O-N 3.12Å
480	L	93.8	Very high	88.9	Confident	23 Å²	23	63.2 Å²	63.2	12%	0.12	33%	0.329	C	S	.	.	H	α-helix	trans	-66.5	-44.5	173.4	179.6	61.6	0	0	0	112.3	L394 V461 V463 Q476 T477 R478 L483 L484	L394-L480 HydrophobicContact CD1-CB 4.23Å; L394-L480 HydrophobicContact CD1-CD1 4.12Å; V461-L480 HydrophobicContact CB-CD1 4.03Å; V461-L480 HydrophobicContact CB-CD2 4.01Å; V461-L480 HydrophobicContact CG1-CD2 4.19Å; V461-L480 HydrophobicContact CG2-CD1 4.13Å; V463-L480 HydrophobicContact CG2-CD2 3.77Å; Q476-L480 WeakPolarHBondContact O-CB 3.16Å; Q476-L480 PolarHBondContact O-N 2.92Å; T477-L480 PolarHBondContact O-N 2.69Å; R478-L480 PolarHBondContact O-N 3.27Å; R478-L480 VanDerWaalsContact O-N 3.15Å; L480-L483 PolarHBondContact O-N 2.91Å; L480-L484 HydrophobicContact CD1-CD1 4.12Å; L480-L484 HydrophobicContact CD1-CG 4.3Å; L480-L484 HydrophobicContact CG-CD1 4.11Å; L480-L484 VanDerWaalsContact O-CG 3.27Å; L480-L484 WeakPolarHBondContact O-CG 3.45Å; L480-L484 PolarHBondContact O-N 3.33Å
481	N	93.9	Very high	89.6	Confident	93 Å²	93	58.6 Å²	58.6	50%	0.497	31%	0.305	S	S	.	.	H	α-helix	trans	-64.8	-44.8	178.7	-68.5	-22	0	0	0	111.7	T477 R478 L483 L484 L485	T477-N481 VanDerWaalsContact O-CG 3.28Å; T477-N481 PolarHBondContact O-N 3.32Å; T477-N481 VanDerWaalsContact O-N 3.08Å; T477-N481 PolarHBondContact O-ND2 3.48Å; R478-N481 WeakPolarHBondContact O-CA 3.13Å; R478-N481 WeakPolarHBondContact O-CB 3.35Å; R478-N481 PolarHBondContact O-N 2.91Å; N481-L483 VanDerWaalsContact C-N 3.35Å; N481-L483 PolarHBondContact O-N 3.26Å; N481-L484 PolarHBondContact O-N 3.39Å; N481-L485 WeakPolarHBondContact O-CB 3.5Å; N481-L485 PolarHBondContact O-N 3.18Å
482	D	94.9	Very high	89.3	Confident	16 Å²	16	54.7 Å²	54.7	9%	0.086	29%	0.289	C	S	.	.	H	α-helix	trans	-63.9	-40.4	178.3	-56.4	-42.9	0	0	0	111.2	H279 N280 W388 R478 L484 L485 H486	H279-D482 IonicContact CE1-OD1 3.44Å; H279-D482 IonicContact CE1-OD2 3.76Å; H279-D482 PolarHBondContact CE1-OD2 2.91Å; H279-D482 IonicContact NE2-OD1 2.82Å; H279-D482 IonicContact NE2-OD2 3.72Å; N280-D482 PolarHBondContact ND2-OD1 2.85Å; W388-D482 HydrophobicContact CH2-CB 3.68Å; W388-D482 HydrophobicContact CZ2-CB 3.67Å; R478-D482 VanDerWaalsContact C-OD2 3.29Å; R478-D482 VanDerWaalsContact O-CG 3.27Å; R478-D482 PolarHBondContact O-N 2.94Å; D482-L484 PolarHBondContact O-N 3.43Å; D482-L485 PolarHBondContact O-N 2.59Å; D482-H486 WeakPolarHBondContact O-CB 3.15Å; D482-H486 PolarHBondContact O-CD2 3.43Å; D482-H486 PolarHBondContact O-N 2.81Å
483	L	94.7	Very high	88.2	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-63.8	-37.4	173.9	172.1	58.5	0	0	0	112.8	W388 L394 C405 L408 V479 L480 N481 R487 V490	W388-L483 HydrophobicContact CH2-CB 4.23Å; W388-L483 HydrophobicContact CZ3-CB 4.25Å; L394-L483 HydrophobicContact CD1-CD2 3.82Å; C405-L483 HydrophobicContact CB-CD1 4Å; C405-L483 HydrophobicContact CB-CD2 3.9Å; C405-L483 HydrophobicContact CB-CG 4.44Å; L408-L483 HydrophobicContact CB-CD2 4.4Å; L408-L483 HydrophobicContact CD1-CD2 4.12Å; L408-L483 HydrophobicContact CD2-CD1 4.09Å; L408-L483 HydrophobicContact CD2-CD2 4.16Å; L408-L483 HydrophobicContact CD2-CG 4.01Å; L408-L483 HydrophobicContact CG-CD2 4.46Å; V479-L483 WeakPolarHBondContact O-CB 3.39Å; V479-L483 PolarHBondContact O-N 3.12Å; L480-L483 PolarHBondContact O-N 2.91Å; N481-L483 VanDerWaalsContact C-N 3.35Å; N481-L483 PolarHBondContact O-N 3.26Å; L483-R487 VanDerWaalsContact O-CA 3.23Å; L483-R487 WeakPolarHBondContact O-CA 3.22Å; L483-R487 PolarHBondContact O-N 3.07Å; L483-R487 VanDerWaalsContact O-N 3.11Å; L483-V490 HydrophobicContact CD1-CB 4.04Å; L483-V490 HydrophobicContact CD1-CG1 3.51Å
484	L	93.3	Very high	86.3	Confident	105 Å²	105	58.3 Å²	58.3	55%	0.55	31%	0.309	S	S	.	.	H	α-helix	trans	-74.2	-34.3	177.4	-71.3	172.1	0	0	0	112	L480 N481 D482	L480-L484 HydrophobicContact CD1-CD1 4.12Å; L480-L484 HydrophobicContact CD1-CG 4.3Å; L480-L484 HydrophobicContact CG-CD1 4.11Å; L480-L484 VanDerWaalsContact O-CG 3.27Å; L480-L484 WeakPolarHBondContact O-CG 3.45Å; L480-L484 PolarHBondContact O-N 3.33Å; N481-L484 PolarHBondContact O-N 3.39Å; D482-L484 PolarHBondContact O-N 3.43Å
485	L	94.5	Very high	83.6	Confident	119 Å²	119	60.8 Å²	60.8	62%	0.623	33%	0.33	S	S	*	.	H	α-helix	trans	-68.5	-45.3	175.4	-178.4	60	0	0	0	111.8	N481 D482	N481-L485 WeakPolarHBondContact O-CB 3.5Å; N481-L485 PolarHBondContact O-N 3.18Å; D482-L485 PolarHBondContact O-N 2.59Å
486	H	94.5	Very high	80.8	Confident	28 Å²	28	64.8 Å²	64.8	13%	0.13	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	25.4	-175.2	-61.7	-72.3	0	0	0	113.7	N280 D283 W385 D482 D488 A489 V490	N280-H486 PolarHBondContact OD1-NE2 3.43Å; D283-H486 IonicContact OD2-CE1 2.65Å; D283-H486 PolarHBondContact OD2-CE1 3.18Å; D283-H486 IonicContact OD2-ND1 2.69Å; W385-H486 HydrophobicContact CD2-CB 3.98Å; W385-H486 AromaticContact CD2-CG 3.89Å; W385-H486 AromaticContact CE2-CD2 3.67Å; W385-H486 AromaticContact CE2-CE1 3.77Å; W385-H486 AromaticContact CE2-CG 3.57Å; W385-H486 AromaticContact CE2-ND1 3.68Å; W385-H486 AromaticContact CE2-NE2 3.78Å; W385-H486 HydrophobicContact CE3-CB 4.18Å; W385-H486 HydrophobicContact CG-CB 4.34Å; W385-H486 AromaticContact CH2-CD2 3.3Å; W385-H486 WeakPolarHBondContact CH2-CD2 3.39Å; W385-H486 AromaticContact CH2-NE2 3.54Å; W385-H486 AromaticContact CZ2-CD2 3.26Å; W385-H486 WeakPolarHBondContact CZ2-CD2 3.47Å; W385-H486 AromaticContact CZ2-CE1 3.55Å; W385-H486 AromaticContact CZ2-CG 3.68Å; W385-H486 AromaticContact CZ2-ND1 3.89Å; W385-H486 AromaticContact CZ2-NE2 3.16Å; W385-H486 WeakPolarHBondContact CZ2-NE2 3.38Å; W385-H486 AromaticContact CZ3-CD2 3.79Å; W385-H486 AromaticContact NE1-CE1 3.81Å; W385-H486 AromaticContact NE1-CG 3.9Å; W385-H486 AromaticContact NE1-ND1 3.58Å; D482-H486 WeakPolarHBondContact O-CB 3.15Å; D482-H486 PolarHBondContact O-CD2 3.43Å; D482-H486 PolarHBondContact O-N 2.81Å; H486-D488 VanDerWaalsContact C-N 3.28Å; H486-D488 PolarHBondContact O-N 2.9Å; H486-D488 VanDerWaalsContact O-N 3.1Å; H486-A489 PolarHBondContact O-N 2.88Å; H486-V490 HydrophobicContact CB-CG2 4.09Å; H486-V490 WeakPolarHBondContact O-CG2 3.22Å; H486-V490 PolarHBondContact O-N 2.87Å
487	R	93.6	Very high	78.1	Confident	95 Å²	95	66.7 Å²	66.7	36%	0.358	38%	0.376	S	S	.	.	H	α-helix	trans	-42.3	-52.8	-173.2	-175.5	-166.4	-176.8	152.2	10.5	112.9	L408 D458 L483 A489 V490 C491	L408-R487 HydrophobicContact CD2-CG 4.47Å; D458-R487 IonicContact OD1-NH2 3.86Å; D458-R487 PolarHBondContact OD1-NH2 2.96Å; D458-R487 IonicContact OD2-CZ 2.65Å; D458-R487 IonicContact OD2-NH1 2.68Å; D458-R487 IonicContact OD2-NH2 3.53Å; D458-R487 PolarHBondContact OD2-NH2 3.01Å; L483-R487 VanDerWaalsContact O-CA 3.23Å; L483-R487 WeakPolarHBondContact O-CA 3.22Å; L483-R487 PolarHBondContact O-N 3.07Å; L483-R487 VanDerWaalsContact O-N 3.11Å; R487-A489 VanDerWaalsContact C-N 3.33Å; R487-A489 PolarHBondContact O-N 2.92Å; R487-V490 PolarHBondContact O-N 2.72Å; R487-C491 WeakPolarHBondContact O-CB 3.45Å; R487-C491 PolarHBondContact O-N 2.7Å; R487-C491 PolarHBondContact O-SG 2.99Å
488	D	91.6	Very high	75.1	Confident	127 Å²	127	69.9 Å²	69.9	68%	0.679	41%	0.406	S	S	*	.	H	α-helix	trans	-79	-16.7	-169.6	-57.9	-22.3	0	0	0	113.3	H486	H486-D488 VanDerWaalsContact C-N 3.28Å; H486-D488 PolarHBondContact O-N 2.9Å; H486-D488 VanDerWaalsContact O-N 3.1Å
489	A	92.4	Very high	72.2	Confident	19 Å²	19	73.6 Å²	73.6	16%	0.157	43%	0.429	C	S	.	.	H	α-helix	trans	-86.5	-38.1	171.4	0	0	0	0	0	111.8	L382 W385 H486 R487	L382-A489 HydrophobicContact CD2-CB 3.64Å; W385-A489 HydrophobicContact CB-CB 3.91Å; W385-A489 HydrophobicContact CG-CB 4.26Å; H486-A489 PolarHBondContact O-N 2.88Å; R487-A489 VanDerWaalsContact C-N 3.33Å; R487-A489 PolarHBondContact O-N 2.92Å
490	V	92.6	Very high	69	Low	0 Å²	0	78.6 Å²	78.6	0%	0	46%	0.463	C	S	.	.	H	α-helix	trans	-77.4	-46.4	-178.9	172.4	0	0	0	0	112.2	W385 W388 C405 A406 L483 H486 R487	W385-V490 HydrophobicContact CB-CG2 3.98Å; W385-V490 HydrophobicContact CE3-CG2 4.16Å; W388-V490 HydrophobicContact CE3-CG2 4.03Å; W388-V490 HydrophobicContact CZ3-CG2 4.12Å; C405-V490 HydrophobicContact CB-CG1 4.18Å; A406-V490 WeakPolarHBondContact CB-O 3.42Å; L483-V490 HydrophobicContact CD1-CB 4.04Å; L483-V490 HydrophobicContact CD1-CG1 3.51Å; H486-V490 HydrophobicContact CB-CG2 4.09Å; H486-V490 WeakPolarHBondContact O-CG2 3.22Å; H486-V490 PolarHBondContact O-N 2.87Å; R487-V490 PolarHBondContact O-N 2.72Å
491	C	88.6	Confident	66	Low	4 Å²	4	82.5 Å²	82.5	3%	0.027	49%	0.493	C	S	.	.	S	Bend	trans	-77.5	139.2	-173.8	-61.4	0	0	0	0	111.5	T409 R487 S493	T409-C491 HydrophobicContact CG2-CB 4.48Å; R487-C491 WeakPolarHBondContact O-CB 3.45Å; R487-C491 PolarHBondContact O-N 2.7Å; R487-C491 PolarHBondContact O-SG 2.99Å; C491-S493 PolarHBondContact O-N 2.82Å
492	L	70.3	Confident	62.8	Low	78 Å²	78	87.7 Å²	87.7	41%	0.408	51%	0.514	S	S	.	.			trans	-73.5	96.5	165.1	-68.5	176.5	0	0	0	109.4	N494	L492-N494 PolarHBondContact O-N 3.13Å
493	S	54.1	Low	59.6	Low	84 Å²	84	95.9 Å²	95.9	59%	0.587	55%	0.552	S	S	*	*			trans	-64.5	95.9	171.5	-72.6	0	0	0	0	110.6	C491 A495	C491-S493 PolarHBondContact O-N 2.82Å; S493-A495 PolarHBondContact O-N 3.06Å
494	N	40.3	Very low	56.3	Low	141 Å²	141	101.7 Å²	101.7	75%	0.754	59%	0.592	S	S	*	*			trans	-65.5	79.3	163.2	-79.2	-3.6	0	0	0	109	L492 S496	L492-N494 PolarHBondContact O-N 3.13Å; N494-S496 VanDerWaalsContact C-N 3.32Å; N494-S496 PolarHBondContact O-N 3.01Å
495	A	26.7	Very low	53.4	Low	88 Å²	88	102.4 Å²	102.4	73%	0.727	60%	0.603	S	S	*	*			trans	-71.4	85.1	179.5	0	0	0	0	0	110.6	S493	S493-A495 PolarHBondContact O-N 3.06Å
496	S	25.3	Very low	50.7	Low	101 Å²	101	102.9 Å²	102.9	71%	0.706	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-57.1	128.1	150.6	52.6	0	0	0	0	107.7	N494 A498	N494-S496 VanDerWaalsContact C-N 3.32Å; N494-S496 PolarHBondContact O-N 3.01Å; S496-A498 PolarHBondContact O-N 2.89Å
497	P	30.3	Very low	47.3	Very low	120 Å²	120	105.5 Å²	105.5	78%	0.779	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-59.2	137.5	179.9	25.4	-33.9	0	0	0	110	E499	P497-E499 PolarHBondContact O-N 2.9Å
498	A	28.2	Very low	44.2	Very low	106 Å²	106	105.5 Å²	105.5	88%	0.876	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-73.7	119.4	-178.2	0	0	0	0	0	110.6	S496	S496-A498 PolarHBondContact O-N 2.89Å
499	E	28.3	Very low	41	Very low	195 Å²	195	107.1 Å²	107.1	91%	0.911	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-81.9	126.8	166.7	-68.5	-168.1	148.8	0	0	110.1	P497	P497-E499 PolarHBondContact O-N 2.9Å
500	S	26.8	Very low	37.9	Very low	108 Å²	108	114.5 Å²	114.5	76%	0.755	70%	0.701	S	S	*	*			trans	-91	111	175.9	55.4	0	0	0	0	111
501	S	30.8	Very low	34.9	Very low	106 Å²	106	121 Å²	121	74%	0.741	74%	0.74	S	S	*	*			trans	27.5	117.8	146.4	59.5	0	0	0	0	119.8
502	E	26.3	Very low	32	Very low	202 Å²	202	126.1 Å²	126.1	94%	0.944	77%	0.773	S	S	*	*				-163.4	161.4	111.5	-110	-179.9	-164.4	0	0	111.8
503	E	27.6	Very low	30	Very low	188 Å²	188	129.2 Å²	129.2	88%	0.879	79%	0.79	S	S	*	*			trans	-105.1	134.2	-175.8	-66.7	-175.8	103.4	0	0	113.1
504	S	26.7	Very low	28.6	Very low	121 Å²	121	130.6 Å²	130.6	85%	0.846	80%	0.798	S	S	*	*			trans	-169.1	159.2	145.8	-89.9	0	0	0	0	112.7
505	P	32.4	Very low	28.1	Very low	120 Å²	120	131.4 Å²	131.4	78%	0.779	80%	0.803	S	S	*	*			trans	-115.6	-156.6	-146.8	47.5	-37	0	0	0	113.5
506	P	36.9	Very low	28	Very low	130 Å²	130	131.3 Å²	131.3	84%	0.844	80%	0.802	S	S	*	*				-113.2	149.3	-115.1	23.1	-0.7	0	0	0	115.5
507	G	23.8	Very low	28.1	Very low	82 Å²	82	134.7 Å²	134.7	85%	0.845	81%	0.811	S	S	*	*			trans	-127.7	149.3	169.7	0	0	0	0	0	111.7
508	A	27.6	Very low	27.9	Very low	96 Å²	96	136.6 Å²	136.6	79%	0.793	81%	0.814	S	S	*	*			trans	-103	155.7	-169.8	0	0	0	0	0	114.4
509	E	25.2	Very low	27.8	Very low	161 Å²	161	139.7 Å²	139.7	75%	0.752	81%	0.81	S	S	*	*			trans	63.8	132.1	173.1	-66	-167.8	170.5	0	0	116.5
510	K	26.4	Very low	27.8	Very low	174 Å²	174	136.7 Å²	136.7	76%	0.757	81%	0.807	S	S	*	*			cis	-152.2	165.7	29	-113.2	132	-178.4	146.6	0	112.6
511	V	31.1	Very low	27.7	Very low	136 Å²	136	137.1 Å²	137.1	82%	0.824	81%	0.806	S	S	*	*			trans	-80.8	138.7	175	176.7	0	0	0	0	111.8
512	P	27	Very low	27.5	Very low	111 Å²	111	140.2 Å²	140.2	72%	0.721	81%	0.813	S	S	*	*			trans	-116.9	152.9	139.4	1.6	19.6	0	0	0	112.3
513	D	28.9	Very low	27.6	Very low	143 Å²	143	139 Å²	139	77%	0.765	81%	0.812	S	S	*	*			trans	-77.9	135.6	177.8	-177.5	19.8	0	0	0	111.7
514	C	23.8	Very low	27.4	Very low	113 Å²	113	133.1 Å²	133.1	76%	0.764	80%	0.802	S	S	*	*			trans	-147.3	98.5	-177	-91.2	0	0	0	0	112	A516	C514-A516 PolarHBondContact O-N 3.42Å
515	N	30.1	Very low	27.5	Very low	159 Å²	159	134 Å²	134	85%	0.85	81%	0.805	S	S	*	*			trans	-72.6	117.4	160.8	-82.2	-81.9	0	0	0	109.5
516	A	24.4	Very low	27	Very low	85 Å²	85	136 Å²	136	70%	0.702	81%	0.808	S	S	*	*			trans	-127	93.8	176.3	0	0	0	0	0	111.1	C514	C514-A516 PolarHBondContact O-N 3.42Å
517	L	28.7	Very low	26.5	Very low	172 Å²	172	141.7 Å²	141.7	90%	0.901	81%	0.813	S	S	*	*			trans	-76.8	115.7	162.2	-106.7	165.2	0	0	0	108.1
518	L	25.9	Very low	26.5	Very low	161 Å²	161	141.5 Å²	141.5	84%	0.843	81%	0.811	S	S	*	*			trans	-95.6	97.9	174.1	-74.7	170.1	0	0	0	110
519	E	26.1	Very low	26.4	Very low	170 Å²	170	145.5 Å²	145.5	79%	0.794	82%	0.819	S	S	*	*			trans	-86.7	136.7	158.6	-71.1	-164.1	133.9	0	0	109.9	T521	E519-T521 PolarHBondContact O-N 2.7Å
520	P	27.3	Very low	26.3	Very low	132 Å²	132	141.3 Å²	141.3	86%	0.857	82%	0.819	S	S	*	*			trans	-73.7	107.9	170.3	-17.3	32.2	0	0	0	111.6
521	T	24.7	Very low	26.6	Very low	118 Å²	118	139 Å²	139	72%	0.724	83%	0.825	S	S	*	*			trans	-65.8	131.6	176.8	-53.4	0	0	0	0	112.5	E519	E519-T521 PolarHBondContact O-N 2.7Å
522	L	27.2	Very low	26.3	Very low	171 Å²	171	137.1 Å²	137.1	90%	0.895	82%	0.818	S	S	*	*			trans	-106.6	142.3	153.2	-72.1	179.7	0	0	0	110
523	L	27.4	Very low	26.3	Very low	176 Å²	176	141.9 Å²	141.9	92%	0.921	83%	0.827	S	S	*	*			trans	-82.5	136.8	-168.4	-73.5	161	0	0	0	113
524	G	23.7	Very low	26.5	Very low	64 Å²	64	138.4 Å²	138.4	66%	0.66	82%	0.815	S	S	*	*			trans	-144.2	141.7	170.9	0	0	0	0	0	111.6
525	P	28.4	Very low	26.9	Very low	141 Å²	141	140.5 Å²	140.5	92%	0.916	82%	0.817	S	S	*	*			trans	-77.2	136.8	-171.6	-19.4	34.4	0	0	0	116.4
526	L	23.6	Very low	27	Very low	162 Å²	162	142.4 Å²	142.4	85%	0.848	82%	0.818	S	S	*	*			trans	-43.9	127	175.7	-59.5	159.6	0	0	0	117.3
527	R	25.1	Very low	27.3	Very low	248 Å²	248	146 Å²	146	94%	0.936	82%	0.818	S	S	*	*				161.1	140.3	104.2	-86.6	-164.6	-173.1	-99	2.1	112.8
528	G	23.9	Very low	27.5	Very low	78 Å²	78	142.7 Å²	142.7	80%	0.804	80%	0.801	S	S	*	*			trans	151.3	105.9	164.7	0	0	0	0	0	113.1
529	D	25.4	Very low	27.7	Very low	181 Å²	181	145 Å²	145	97%	0.968	80%	0.799	S	S	*	*			trans	-70.6	142.5	178.7	-78.5	-68.5	0	0	0	113
530	G	24.3	Very low	27.9	Very low	73 Å²	73	141.3 Å²	141.3	75%	0.753	79%	0.788	S	S	*	*			trans	175.4	78	178.4	0	0	0	0	0	115.9
531	S	30.9	Very low	28.1	Very low	126 Å²	126	140 Å²	140	88%	0.881	77%	0.773	S	S	*	*			trans	-34.6	128.3	173.6	179.5	0	0	0	0	116.6
532	S	25.4	Very low	28.5	Very low	96 Å²	96	140.9 Å²	140.9	67%	0.671	77%	0.769	S	S	*	*			trans	-159.6	88	157.2	-161.9	0	0	0	0	114.1	S534	S532-S534 VanDerWaalsContact C-N 3.34Å; S532-S534 PolarHBondContact O-N 2.71Å; S532-S534 WeakPolarHBondContact OG-CB 3.42Å; S532-S534 PolarHBondContact OG-OG 2.91Å
533	F	27.4	Very low	28.8	Very low	210 Å²	210	139.5 Å²	139.5	92%	0.921	76%	0.762	S	S	*	*			trans	-87.6	70.2	170.7	-159.7	-88.8	0	0	0	110.6
534	S	32.1	Very low	28.9	Very low	71 Å²	71	140.8 Å²	140.8	50%	0.497	76%	0.755	S	S	.	*			trans	-126.6	11.9	-157.5	-55.5	0	0	0	0	116.8	S532	S532-S534 VanDerWaalsContact C-N 3.34Å; S532-S534 PolarHBondContact O-N 2.71Å; S532-S534 WeakPolarHBondContact OG-CB 3.42Å; S532-S534 PolarHBondContact OG-OG 2.91Å
535	L	32.4	Very low	29.3	Very low	156 Å²	156	145.6 Å²	145.6	82%	0.817	76%	0.76	S	S	*	*	S	Bend	trans	-93.6	-9.2	-171.5	-69.1	177	0	0	0	116.7
536	F	32.7	Very low	29.4	Very low	200 Å²	200	147.2 Å²	147.2	88%	0.877	76%	0.755	S	S	*	*	S	Bend	trans	-100.2	23.5	180	-86.4	-77.3	0	0	0	115.4
537	K	29.8	Very low	29.8	Very low	161 Å²	161	144.1 Å²	144.1	70%	0.7	75%	0.747	S	S	*	*	S	Bend	trans	-116.9	-7.3	177	-75.4	-174.9	177.1	175.3	0	116.3
538	N	33.1	Very low	30.2	Very low	102 Å²	102	139.8 Å²	139.8	55%	0.545	74%	0.742	S	S	.	*	S	Bend	trans	-84.8	-20	-178.8	-77.7	-17.3	0	0	0	114.6	T540 L541 Q542	N538-T540 VanDerWaalsContact C-N 3.25Å; N538-T540 PolarHBondContact O-N 2.73Å; N538-L541 PolarHBondContact O-N 3.44Å; N538-L541 VanDerWaalsContact O-N 3.1Å; N538-Q542 PolarHBondContact O-N 2.95Å; N538-Q542 VanDerWaalsContact O-N 3.14Å
539	W	30.7	Very low	30.7	Very low	210 Å²	210	144 Å²	144	80%	0.795	75%	0.745	S	S	*	*	H	α-helix	trans	-59.3	-34.4	-177.3	-157.2	-74.1	0	0	0	113
540	T	30.9	Very low	30.8	Very low	92 Å²	92	141.2 Å²	141.2	56%	0.564	74%	0.739	S	S	*	*	H	α-helix	trans	-83.3	-15.3	-179.6	-28.2	0	0	0	0	113.8	N538	N538-T540 VanDerWaalsContact C-N 3.25Å; N538-T540 PolarHBondContact O-N 2.73Å
541	L	31.8	Very low	31.1	Very low	104 Å²	104	145.9 Å²	145.9	55%	0.545	74%	0.742	S	S	.	*	H	α-helix	trans	-91.9	-29.5	176.2	-81	165.8	0	0	0	112.3	N538 L543 R544 Q545	N538-L541 PolarHBondContact O-N 3.44Å; N538-L541 VanDerWaalsContact O-N 3.1Å; L541-L543 VanDerWaalsContact C-N 3.3Å; L541-L543 PolarHBondContact O-N 2.89Å; L541-R544 PolarHBondContact O-N 3.17Å; L541-Q545 PolarHBondContact O-N 3.01Å
542	Q	32.8	Very low	31.2	Very low	137 Å²	137	147 Å²	147	64%	0.64	74%	0.738	S	S	*	*	H	α-helix	trans	-66	-30.3	-174.8	-155.4	161.8	10.8	0	0	113	N538 R544	N538-Q542 PolarHBondContact O-N 2.95Å; N538-Q542 VanDerWaalsContact O-N 3.14Å; Q542-R544 PolarHBondContact O-N 3.21Å
543	L	32.1	Very low	31.5	Very low	142 Å²	142	152 Å²	152	74%	0.743	75%	0.751	S	S	*	*	H	α-helix	trans	-67.7	-16.3	169.9	-97.1	78.4	0	0	0	114.2	L541	L541-L543 VanDerWaalsContact C-N 3.3Å; L541-L543 PolarHBondContact O-N 2.89Å
544	R	31.2	Very low	31.8	Very low	203 Å²	203	150.3 Å²	150.3	77%	0.766	75%	0.746	S	S	*	*	H	α-helix	trans	-102.9	-15.8	-177.5	-156.1	172.7	-170.6	160.3	6.4	113.6	L541 Q542	L541-R544 PolarHBondContact O-N 3.17Å; Q542-R544 PolarHBondContact O-N 3.21Å
545	Q	31.6	Very low	31.6	Very low	164 Å²	164	156.9 Å²	156.9	77%	0.766	76%	0.761	S	S	*	*	H	α-helix	trans	-97.7	-11.8	178.3	-157.8	164.4	10.1	0	0	113.4	L541 S547	L541-Q545 PolarHBondContact O-N 3.01Å; Q545-S547 PolarHBondContact O-N 2.85Å
546	Q	30.8	Very low	31.6	Very low	176 Å²	176	154.2 Å²	154.2	82%	0.822	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	29.1	175	-153.7	172.1	17	0	0	113.6
547	S	31.4	Very low	31.7	Very low	97 Å²	97	150.1 Å²	150.1	68%	0.678	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127	4	-173.8	-174.7	0	0	0	0	113.8	Q545	Q545-S547 PolarHBondContact O-N 2.85Å
548	L	33.3	Very low	31.9	Very low	156 Å²	156	146.2 Å²	146.2	82%	0.817	75%	0.749	S	S	*	*	S	Bend	trans	-141.5	6.5	-172.6	-77.9	178.5	0	0	0	116
549	L	33.6	Very low	32	Very low	167 Å²	167	146.1 Å²	146.1	87%	0.874	76%	0.756	S	S	*	*			trans	-145.8	89.6	168.9	-76.2	-179.5	0	0	0	110.5
550	S	27.6	Very low	31.9	Very low	122 Å²	122	145 Å²	145	85%	0.853	76%	0.76	S	S	*	*			trans	-165.2	83.1	161.7	-170.6	0	0	0	0	107
551	E	31.9	Very low	32	Very low	171 Å²	171	146.2 Å²	146.2	80%	0.799	77%	0.766	S	S	*	*			trans	-77.4	141.2	169	-71.2	169.4	129.8	0	0	109
552	D	32.8	Very low	32	Very low	151 Å²	151	146.9 Å²	146.9	81%	0.807	78%	0.775	S	S	*	*			trans	55.9	82	156.8	-50.5	-16.1	0	0	0	120
553	E	30.9	Very low	32.4	Very low	200 Å²	200	149 Å²	149	94%	0.935	79%	0.785	S	S	*	*				-134.8	124.7	122.6	-81.6	-158.2	139.6	0	0	109.7	Y555	E553-Y555 PolarHBondContact O-N 3.43Å
554	E	34.2	Very low	32.4	Very low	174 Å²	174	148.7 Å²	148.7	81%	0.813	78%	0.784	S	S	*	*			trans	-92.5	89.7	-168.5	-168	-170.1	169.8	0	0	112	T556	E554-T556 HydrophobicContact CG-CG2 3.94Å; E554-T556 PolarHBondContact O-N 2.99Å; E554-T556 VanDerWaalsContact OE1-CG2 3.29Å; E554-T556 WeakPolarHBondContact OE1-CG2 3.49Å
555	Y	28.6	Very low	33	Very low	209 Å²	209	148.6 Å²	148.6	82%	0.82	79%	0.792	S	S	*	*			trans	-84.9	92.7	168.9	-165.2	-93.6	0	0	0	111	E553 T557	E553-Y555 PolarHBondContact O-N 3.43Å; Y555-T557 HydrophobicContact CD1-CG2 3.95Å; Y555-T557 HydrophobicContact CE1-CG2 3.99Å; Y555-T557 PolarHBondContact O-N 3.03Å
556	T	31.1	Very low	33.2	Very low	100 Å²	100	147.1 Å²	147.1	61%	0.613	79%	0.794	S	S	*	*			trans	-68.5	87.7	177.2	45.6	0	0	0	0	112.2	E554 G558	E554-T556 HydrophobicContact CG-CG2 3.94Å; E554-T556 PolarHBondContact O-N 2.99Å; E554-T556 VanDerWaalsContact OE1-CG2 3.29Å; E554-T556 WeakPolarHBondContact OE1-CG2 3.49Å; T556-G558 PolarHBondContact O-N 3.46Å
557	T	36.4	Very low	33.3	Very low	114 Å²	114	141.3 Å²	141.3	70%	0.699	78%	0.781	S	S	*	*			trans	-64.1	104.2	162	51.6	0	0	0	0	108.8	Y555 S559	Y555-T557 HydrophobicContact CD1-CG2 3.95Å; Y555-T557 HydrophobicContact CE1-CG2 3.99Å; Y555-T557 PolarHBondContact O-N 3.03Å; T557-S559 PolarHBondContact O-N 2.96Å
558	G	34	Very low	33.7	Very low	80 Å²	80	145.2 Å²	145.2	83%	0.825	80%	0.795	S	S	*	*			trans	-50.2	111.4	-173.9	0	0	0	0	0	113.2	T556	T556-G558 PolarHBondContact O-N 3.46Å
559	S	34.3	Very low	33.9	Very low	100 Å²	100	145.9 Å²	145.9	70%	0.699	79%	0.794	S	S	*	*			trans	-128.7	70	169.4	173.6	0	0	0	0	107.3	T557 V561	T557-S559 PolarHBondContact O-N 2.96Å; S559-V561 PolarHBondContact O-N 3.06Å; S559-V561 VanDerWaalsContact O-N 3.07Å
560	E	29.3	Very low	34.5	Very low	187 Å²	187	146.7 Å²	146.7	87%	0.874	79%	0.793	S	S	*	*			trans	-57.6	114.8	166.8	-71.2	-170.4	127.5	0	0	108.2	T562	E560-T562 PolarHBondContact O-N 3.18Å
561	V	32.7	Very low	34.9	Very low	116 Å²	116	148.4 Å²	148.4	70%	0.703	79%	0.788	S	S	*	*			trans	-79.9	89.6	178.4	179.9	0	0	0	0	107.4	S559 E563	S559-V561 PolarHBondContact O-N 3.06Å; S559-V561 VanDerWaalsContact O-N 3.07Å; V561-E563 HydrophobicContact CG1-CB 4.45Å; V561-E563 PolarHBondContact O-N 3.37Å; V561-E563 VanDerWaalsContact O-N 3.09Å
562	T	32.3	Very low	35	Very low	118 Å²	118	146.2 Å²	146.2	72%	0.724	78%	0.781	S	S	*	*			trans	-68.4	100.6	159	52.6	0	0	0	0	107.5	E560 D564	E560-T562 PolarHBondContact O-N 3.18Å; T562-D564 PolarHBondContact O-N 2.92Å
563	E	40.2	Very low	34.9	Very low	182 Å²	182	145.2 Å²	145.2	85%	0.85	79%	0.786	S	S	*	*			trans	-74.4	66.2	-177.6	50.9	-172.4	104.9	0	0	112.7	V561	V561-E563 HydrophobicContact CG1-CB 4.45Å; V561-E563 PolarHBondContact O-N 3.37Å; V561-E563 VanDerWaalsContact O-N 3.09Å
564	D	31.7	Very low	35	Very low	135 Å²	135	144.2 Å²	144.2	72%	0.722	78%	0.778	S	S	*	*			trans	-88.8	110.7	169.3	-90.9	-44	0	0	0	111.2	T562 V566	T562-D564 PolarHBondContact O-N 2.92Å; D564-V566 VanDerWaalsContact C-N 3.3Å; D564-V566 HydrophobicContact CB-CG2 4.29Å; D564-V566 PolarHBondContact O-N 3.48Å
565	E	44.8	Very low	35.1	Very low	201 Å²	201	144.9 Å²	144.9	94%	0.939	78%	0.778	S	S	*	*			trans	-70	81.4	165.6	-77.3	-162.9	113.2	0	0	111.1	G567	E565-G567 PolarHBondContact O-N 3.33Å; E565-G567 VanDerWaalsContact O-N 3.12Å
566	V	35.4	Very low	35.1	Very low	133 Å²	133	143.8 Å²	143.8	81%	0.806	78%	0.781	S	S	*	*			trans	-80.3	89.6	167.5	-170.1	0	0	0	0	109.3	D564	D564-V566 VanDerWaalsContact C-N 3.3Å; D564-V566 HydrophobicContact CB-CG2 4.29Å; D564-V566 PolarHBondContact O-N 3.48Å
567	G	33.6	Very low	35.1	Very low	54 Å²	54	143.6 Å²	143.6	56%	0.557	79%	0.79	S	S	*	*			trans	-69.2	155.2	178	0	0	0	0	0	114.5	E565 E569	E565-G567 PolarHBondContact O-N 3.33Å; E565-G567 VanDerWaalsContact O-N 3.12Å; G567-E569 PolarHBondContact O-N 3.33Å
568	D	39.8	Very low	34.7	Very low	179 Å²	179	142.5 Å²	142.5	96%	0.957	79%	0.792	S	S	*	*			trans	-70.4	87.4	171.3	-90	-40.6	0	0	0	111	E570	D568-E570 PolarHBondContact O-N 2.89Å
569	E	37.8	Very low	34.7	Very low	171 Å²	171	148.5 Å²	148.5	80%	0.799	80%	0.795	S	S	*	*			trans	-87	95.5	170.8	-77.5	-98.9	103.8	0	0	111.1	G567 E571	G567-E569 PolarHBondContact O-N 3.33Å; E569-E571 VanDerWaalsContact C-N 3.29Å; E569-E571 PolarHBondContact O-N 3.02Å
570	E	46	Very low	34.5	Very low	184 Å²	184	153.5 Å²	153.5	86%	0.86	80%	0.804	S	S	*	*			trans	-74.7	71.6	174.8	-166.1	-168.8	162.4	0	0	111.9	D568	D568-E570 PolarHBondContact O-N 2.89Å
571	E	35.3	Very low	34.5	Very low	158 Å²	158	148.8 Å²	148.8	74%	0.738	80%	0.797	S	S	*	*			trans	-77.9	142	-171.3	-124.8	-71.6	85.7	0	0	115.1	E569	E569-E571 VanDerWaalsContact C-N 3.29Å; E569-E571 PolarHBondContact O-N 3.02Å
572	L	33.8	Very low	34.4	Very low	124 Å²	124	153.4 Å²	153.4	65%	0.649	81%	0.808	S	S	*	*			trans	-102.3	93	-157.6	-75.4	163.9	0	0	0	114.3	K574	L572-K574 PolarHBondContact O-N 3.16Å
573	S	30.8	Very low	34.3	Very low	131 Å²	131	157.2 Å²	157.2	92%	0.916	81%	0.814	S	S	*	*			trans	-55.2	108.1	179.2	-78.8	0	0	0	0	115.7
574	K	33.4	Very low	34.2	Very low	179 Å²	179	154.3 Å²	154.3	78%	0.778	81%	0.811	S	S	*	*			trans	-158.2	130.6	177.2	-102.6	170.1	-171.6	157.4	0	106.3	L572	L572-K574 PolarHBondContact O-N 3.16Å
575	K	35.3	Very low	34.1	Very low	187 Å²	187	156.3 Å²	156.3	81%	0.813	82%	0.816	S	S	*	*			cis	-145.7	-172.2	13.9	-66.2	162.7	-175	159.9	0	106.4
576	Q	30.2	Very low	33.3	Very low	186 Å²	186	157.3 Å²	157.3	87%	0.869	81%	0.811	S	S	*	*			cis	-160.8	171.7	43.4	-65.8	-170.8	36.9	0	0	114.5
577	A	29.4	Very low	33.5	Very low	97 Å²	97	155.6 Å²	155.6	80%	0.802	80%	0.802	S	S	*	*			trans	-30.4	165.5	173	0	0	0	0	0	119.6
578	A	28.7	Very low	33.2	Very low	90 Å²	90	160.1 Å²	160.1	74%	0.744	81%	0.813	S	S	*	*			cis	-146.4	163.6	16.8	0	0	0	0	0	111.2
579	K	33.4	Very low	32.7	Very low	206 Å²	206	161 Å²	161	90%	0.896	81%	0.809	S	S	*	*				-154.7	177.1	60.9	-77.3	173.7	178.5	170.9	0	112.7
580	K	31.3	Very low	32.2	Very low	206 Å²	206	161.4 Å²	161.4	90%	0.896	81%	0.808	S	S	*	*			trans	-71.4	166.5	-179.6	-53	174	-180	173.8	0	111.2
581	A	28.8	Very low	31.3	Very low	87 Å²	87	160.4 Å²	160.4	72%	0.719	80%	0.803	S	S	*	*			cis	-162.1	173	23.9	0	0	0	0	0	115.7
582	K	30.6	Very low	30.8	Very low	213 Å²	213	159.1 Å²	159.1	93%	0.926	80%	0.801	S	S	*	*			trans	75	140.5	161.5	-66.6	-175.9	176.7	-179.5	0	120.3
583	K	29	Very low	30.5	Very low	198 Å²	198	157.8 Å²	157.8	86%	0.861	80%	0.801	S	S	*	*			trans	-129.5	179.8	172.8	-87.9	-176.1	177.7	179.2	0	106.7
584	P	39.2	Very low	30.4	Very low	121 Å²	121	157 Å²	157	79%	0.786	80%	0.796	S	S	*	*			cis	-111.2	-168	-1.8	12.1	15	0	0	0	111.4
585	H	29.5	Very low	30.4	Very low	177 Å²	177	154.5 Å²	154.5	82%	0.819	80%	0.798	S	S	*	*			cis	-160.4	167	36.5	-169.5	-112.9	0	0	0	113.5
586	R	28.4	Very low	30.1	Very low	222 Å²	222	152.2 Å²	152.2	84%	0.838	80%	0.795	S	S	*	*			trans	-141.4	154.8	172.9	-119.1	-169.2	-179	-171.8	2.4	105.6
587	P	38.3	Very low	30	Very low	97 Å²	97	152 Å²	152	63%	0.63	79%	0.791	S	S	*	*				-158	179.7	52.2	44.1	-22.9	0	0	0	118.8
588	L	27.5	Very low	30	Very low	149 Å²	149	154.5 Å²	154.5	78%	0.78	79%	0.786	S	S	*	*			trans	46.2	113.2	140.6	-71.3	162.8	0	0	0	122.3
589	K	30.4	Very low	30.1	Very low	199 Å²	199	162.3 Å²	162.3	87%	0.865	80%	0.797	S	S	*	*				-171	138.4	104.6	-90.7	150.7	-179.5	177.8	0	107.3
590	K	27	Very low	29.9	Very low	179 Å²	179	161.6 Å²	161.6	78%	0.778	79%	0.794	S	S	*	*			cis	81.6	115	41.4	-147.5	-169.2	-170.1	-173.4	0	112.4
591	Q	27.1	Very low	29.8	Very low	163 Å²	163	159.5 Å²	159.5	76%	0.762	79%	0.792	S	S	*	*			trans	73.6	153.6	170.1	-51.4	-136.5	-76.5	0	0	115.3
592	L	24.6	Very low	30	Very low	131 Å²	131	164.9 Å²	164.9	69%	0.686	80%	0.799	S	S	*	*			cis	-159.1	174.7	-10.6	-122.2	173.4	0	0	0	110.1
593	S	27	Very low	29.9	Very low	95 Å²	95	160.3 Å²	160.3	66%	0.664	79%	0.794	S	S	*	*			trans	57.5	117.6	152.9	-57.6	0	0	0	0	120.7
594	S	28.3	Very low	29.9	Very low	115 Å²	115	159.7 Å²	159.7	80%	0.804	79%	0.794	S	S	*	*			trans	-60.2	158.2	142.5	-44.9	0	0	0	0	110.2
595	P	35.1	Very low	29.5	Very low	127 Å²	127	163.1 Å²	163.1	83%	0.825	80%	0.797	S	S	*	*				-134.2	156.6	105.9	36.9	-28.6	0	0	0	114.3
596	N	28.1	Very low	29.5	Very low	139 Å²	139	160.9 Å²	160.9	74%	0.743	80%	0.798	S	S	*	*			trans	-79.5	132.6	176.4	174.7	2.2	0	0	0	110.3
597	F	28	Very low	29.7	Very low	181 Å²	181	158.8 Å²	158.8	79%	0.794	80%	0.798	S	S	*	*			trans	-142.6	142	148.5	-132.9	-84.3	0	0	0	113.7
598	Q	28.8	Very low	29.5	Very low	150 Å²	150	158.6 Å²	158.6	70%	0.701	80%	0.799	S	S	*	*			trans	-60.3	142.5	-171.7	-56.5	158.9	-3.8	0	0	113.5
599	R	31.3	Very low	29.9	Very low	253 Å²	253	163.1 Å²	163.1	96%	0.955	81%	0.806	S	S	*	*				-145	157.9	128	-110.2	165.9	-160.6	-156.4	2.3	110.8
600	K	30.5	Very low	29.9	Very low	192 Å²	192	159.9 Å²	159.9	84%	0.835	80%	0.798	S	S	*	*			trans	-126	104.2	-156.7	171.8	-168.1	179	-179	0	108.6
601	D	27.5	Very low	30.3	Very low	162 Å²	162	155.7 Å²	155.7	87%	0.866	79%	0.791	S	S	*	*			trans	-113	145.5	168.9	-95.8	-63	0	0	0	111.3
602	K	33.7	Very low	30.8	Very low	199 Å²	199	151.3 Å²	151.3	87%	0.865	78%	0.776	S	S	*	*			trans	-98.1	115.3	175.6	-81.1	179.3	169.5	-177.7	0	108.4
603	S	29	Very low	31.7	Very low	117 Å²	117	148.9 Å²	148.9	82%	0.818	77%	0.768	S	S	*	*			trans	-116.9	111	159.3	45.4	0	0	0	0	110.6
604	E	28.2	Very low	32.2	Very low	185 Å²	185	153.4 Å²	153.4	86%	0.864	78%	0.776	S	S	*	*			trans	-5.9	139.8	159.1	-59.5	172.2	136.7	0	0	118.9	P606	E604-P606 WeakPolarHBondContact O-CD 3.26Å
605	K	32.2	Very low	33.1	Very low	193 Å²	193	151.5 Å²	151.5	84%	0.839	76%	0.759	S	S	*	*			trans	-72.2	129.9	166.7	-65.1	177	179	177.7	0	110.3	Q607	K605-Q607 PolarHBondContact O-N 3.18Å
606	P	28.2	Very low	33.5	Very low	131 Å²	131	147.5 Å²	147.5	85%	0.851	73%	0.733	S	S	*	*			trans	-74.5	114.5	147.3	-6.6	24.9	0	0	0	107.8	E604	E604-P606 WeakPolarHBondContact O-CD 3.26Å
607	Q	33.3	Very low	34.2	Very low	177 Å²	177	144.1 Å²	144.1	83%	0.827	72%	0.719	S	S	*	*			trans	-85.7	166.1	166	-164.6	164.6	-18.5	0	0	109.1	K605	K605-Q607 PolarHBondContact O-N 3.18Å
608	S	34.3	Very low	35	Very low	94 Å²	94	141.7 Å²	141.7	66%	0.657	71%	0.714	S	S	*	*			trans	75.1	108.2	-175.3	-156.6	0	0	0	0	117
609	R	34.8	Very low	36.2	Very low	243 Å²	243	142.1 Å²	142.1	92%	0.917	72%	0.716	S	S	*	*			trans	-131	132.2	136.2	-87.4	-172	167.5	-175.7	-3.8	106.7	S611	R609-S611 PolarHBondContact O-N 3.1Å; R609-S611 VanDerWaalsContact O-N 3.12Å
610	D	31.1	Very low	37.5	Very low	131 Å²	131	136.9 Å²	136.9	70%	0.701	70%	0.7	S	S	*	*			trans	-70.2	108.2	-178.8	-63.2	-70.4	0	0	0	111.4	T612 T615	D610-T612 VanDerWaalsContact C-N 3.34Å; D610-T612 PolarHBondContact O-N 2.78Å; D610-T612 VanDerWaalsContact O-N 3.15Å; D610-T615 PolarHBondContact O-OG1 2.79Å
611	S	34.8	Very low	39.1	Very low	91 Å²	91	131 Å²	131	64%	0.636	68%	0.684	S	S	*	*			trans	-80.9	80.5	170.5	60.7	0	0	0	0	109.2	R609	R609-S611 PolarHBondContact O-N 3.1Å; R609-S611 VanDerWaalsContact O-N 3.12Å
612	T	37.5	Very low	41.2	Very low	72 Å²	72	131 Å²	131	44%	0.442	68%	0.676	S	S	.	*			trans	-74	153.7	165.1	70.2	0	0	0	0	108.5	D610 F614 T615	D610-T612 VanDerWaalsContact C-N 3.34Å; D610-T612 PolarHBondContact O-N 2.78Å; D610-T612 VanDerWaalsContact O-N 3.15Å; T612-F614 PolarHBondContact O-N 3.44Å; T612-T615 PolarHBondContact N-OG1 3.39Å; T612-T615 VanDerWaalsContact N-OG1 3.16Å; T612-T615 PolarHBondContact O-N 3.19Å; T612-T615 PolarHBondContact O-OG1 3.41Å; T612-T615 PolarHBondContact OG1-N 3.21Å; T612-T615 PolarHBondContact OG1-OG1 2.89Å
613	P	43.9	Very low	43.4	Very low	79 Å²	79	127.5 Å²	127.5	51%	0.513	66%	0.657	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.6	-10.4	178.2	26.2	-34.3	0	0	0	113.4	H650	P613-H650 WeakPolarHBondContact CB-NE2 3.45Å
614	F	38.1	Very low	45.9	Very low	191 Å²	191	124.5 Å²	124.5	84%	0.838	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-16	171.8	-68.5	-79.8	0	0	0	113.5	T612 V616	T612-F614 PolarHBondContact O-N 3.44Å; F614-V616 PolarHBondContact O-N 3.46Å
615	T	46.7	Very low	48.6	Very low	74 Å²	74	121.1 Å²	121.1	45%	0.454	63%	0.629	S	S	.	*	S	Bend	trans	-80.6	67.3	161.1	28.7	0	0	0	0	110.6	D610 T612	D610-T615 PolarHBondContact O-OG1 2.79Å; T612-T615 PolarHBondContact N-OG1 3.39Å; T612-T615 VanDerWaalsContact N-OG1 3.16Å; T612-T615 PolarHBondContact O-N 3.19Å; T612-T615 PolarHBondContact O-OG1 3.41Å; T612-T615 PolarHBondContact OG1-N 3.21Å; T612-T615 PolarHBondContact OG1-OG1 2.89Å
616	V	43.5	Very low	51.1	Low	44 Å²	44	117 Å²	117	27%	0.267	62%	0.624	S	S	.	*			trans	-39.6	139.8	155.3	169.8	0	0	0	0	109.1	F614 L618 R643	F614-V616 PolarHBondContact O-N 3.46Å; V616-L618 PolarHBondContact O-N 2.98Å; V616-R643 HydrophobicContact CG1-CG 3.84Å
617	S	43	Very low	53.7	Low	67 Å²	67	116.5 Å²	116.5	47%	0.469	61%	0.605	S	S	.	*			trans	-46.4	107.7	-177.7	177.5	0	0	0	0	111.6	Q619	S617-Q619 PolarHBondContact O-N 3.1Å
618	L	44.5	Very low	56.2	Low	130 Å²	130	111.2 Å²	111.2	68%	0.681	59%	0.588	S	S	*	*			trans	-75.5	34.2	178.1	-93.9	163.3	0	0	0	112.7	V616 K620	V616-L618 PolarHBondContact O-N 2.98Å; L618-K620 HydrophobicContact CD2-CD 4.4Å; L618-K620 HydrophobicContact CD2-CG 3.87Å; L618-K620 PolarHBondContact O-N 3.14Å
619	Q	54.1	Low	58.6	Low	159 Å²	159	112.2 Å²	112.2	74%	0.743	59%	0.585	S	S	*	*			trans	-64.6	77.5	151.7	-75	-166.1	-29.5	0	0	108.3	S617 S621	S617-Q619 PolarHBondContact O-N 3.1Å; Q619-S621 PolarHBondContact O-N 3.21Å
620	K	58.2	Low	61	Low	143 Å²	143	108 Å²	108	62%	0.622	57%	0.57	S	S	*	*			trans	-56.6	103.8	176.9	-63.7	-175.4	179.2	-169	0	108.8	L618 K622	L618-K620 HydrophobicContact CD2-CD 4.4Å; L618-K620 HydrophobicContact CD2-CG 3.87Å; L618-K620 PolarHBondContact O-N 3.14Å; K620-K622 HydrophobicContact CB-CG 3.81Å; K620-K622 PolarHBondContact O-N 2.7Å
621	S	63.6	Low	63.6	Low	70 Å²	70	103.7 Å²	103.7	49%	0.49	54%	0.543	S	S	.	.			trans	-59.7	86.1	150.6	-169.2	0	0	0	0	106.2	Q619	Q619-S621 PolarHBondContact O-N 3.21Å
622	K	71.6	Confident	66	Low	160 Å²	160	99.7 Å²	99.7	70%	0.696	52%	0.515	S	S	*	.			trans	-77.2	144.3	176.7	-68.7	-175.8	-176.5	178.5	0	107.1	K620 D624	K620-K622 HydrophobicContact CB-CG 3.81Å; K620-K622 PolarHBondContact O-N 2.7Å; K622-D624 PolarHBondContact O-N 2.77Å; K622-D624 VanDerWaalsContact O-N 3.07Å
623	W	80.3	Confident	68.4	Low	127 Å²	127	100.4 Å²	100.4	48%	0.481	51%	0.513	S	S	.	.			trans	-51	116.7	167.6	-162.7	-82.8	0	0	0	110.4	S625 L629 N632 Q633	W623-S625 PolarHBondContact O-N 3.26Å; W623-L629 HydrophobicContact CH2-CD1 3.79Å; W623-L629 HydrophobicContact CZ2-CD1 3.67Å; W623-N632 HydrophobicContact CD2-CB 3.65Å; W623-N632 HydrophobicContact CE3-CB 3.61Å; W623-N632 HydrophobicContact CG-CB 4.44Å; W623-N632 HydrophobicContact CH2-CB 3.49Å; W623-N632 VanDerWaalsContact CH2-CB 3.49Å; W623-N632 HydrophobicContact CZ2-CB 3.54Å; W623-N632 HydrophobicContact CZ3-CB 3.53Å; W623-Q633 HydrophobicContact CH2-CG 4.26Å
624	D	82.1	Confident	70.3	Confident	53 Å²	53	97.5 Å²	97.5	28%	0.283	49%	0.493	S	S	.	.			trans	-91.6	99.7	180	-173.1	-9.3	0	0	0	108.5	K622 S626 R627 N632	K622-D624 PolarHBondContact O-N 2.77Å; K622-D624 VanDerWaalsContact O-N 3.07Å; D624-S626 PolarHBondContact O-N 2.8Å; D624-S626 VanDerWaalsContact O-N 3.14Å; D624-S626 WeakPolarHBondContact OD1-CB 3.24Å; D624-S626 PolarHBondContact OD1-N 2.85Å; D624-S626 PolarHBondContact OD1-OG 2.84Å; D624-S626 PolarHBondContact OD2-OG 2.74Å; D624-R627 HydrophobicContact CB-CB 4.33Å; D624-R627 HydrophobicContact CB-CG 4.14Å; D624-R627 PolarHBondContact O-N 2.85Å; D624-R627 VanDerWaalsContact OD2-CD 3.23Å; D624-R627 WeakPolarHBondContact OD2-CD 3.5Å; D624-R627 WeakPolarHBondContact OD2-CG 3.43Å; D624-R627 IonicContact OD2-CZ 2.63Å; D624-R627 IonicContact OD2-NE 2.72Å; D624-R627 PolarHBondContact OD2-NE 3.48Å; D624-N632 PolarHBondContact N-OD1 3.25Å; D624-N632 PolarHBondContact O-ND2 3.01Å
625	S	83.8	Confident	72.4	Confident	115 Å²	115	88.8 Å²	88.8	80%	0.804	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-5.6	176.5	-56.7	0	0	0	0	114.1	W623 R627	W623-S625 PolarHBondContact O-N 3.26Å; S625-R627 VanDerWaalsContact C-N 3.31Å
626	S	84.8	Confident	74.3	Confident	105 Å²	105	90.2 Å²	90.2	73%	0.734	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	6.8	169.3	73.4	0	0	0	0	113.4	D624	D624-S626 PolarHBondContact O-N 2.8Å; D624-S626 VanDerWaalsContact O-N 3.14Å; D624-S626 WeakPolarHBondContact OD1-CB 3.24Å; D624-S626 PolarHBondContact OD1-N 2.85Å; D624-S626 PolarHBondContact OD1-OG 2.84Å; D624-S626 PolarHBondContact OD2-OG 2.74Å
627	R	83.6	Confident	76.3	Confident	122 Å²	122	94 Å²	94	46%	0.46	47%	0.468	S	S	.	.	S	Bend	trans	-131.3	159.7	-178.4	-61.4	-177.6	-173.4	-107.9	-7	112	D624 S625 Y631 N632	D624-R627 HydrophobicContact CB-CB 4.33Å; D624-R627 HydrophobicContact CB-CG 4.14Å; D624-R627 PolarHBondContact O-N 2.85Å; D624-R627 VanDerWaalsContact OD2-CD 3.23Å; D624-R627 WeakPolarHBondContact OD2-CD 3.5Å; D624-R627 WeakPolarHBondContact OD2-CG 3.43Å; D624-R627 IonicContact OD2-CZ 2.63Å; D624-R627 IonicContact OD2-NE 2.72Å; D624-R627 PolarHBondContact OD2-NE 3.48Å; S625-R627 VanDerWaalsContact C-N 3.31Å; R627-Y631 HydrophobicContact CB-CD1 3.95Å; R627-Y631 HydrophobicContact CB-CG 4.2Å; R627-Y631 HydrophobicContact CG-CD1 4.25Å; R627-Y631 VanDerWaalsContact NH1-CE2 3.29Å; R627-Y631 VanDerWaalsContact NH1-CZ 3.32Å; R627-Y631 PolarHBondContact NH1-OH 3.41Å; R627-N632 PolarHBondContact O-ND2 2.92Å
628	S	86.1	Confident	78.3	Confident	66 Å²	66	93.2 Å²	93.2	46%	0.462	46%	0.457	S	S	.	.			trans	-61.8	154.2	-179.4	66.8	0	0	0	0	113.2	R630 Y631 N632	S628-R630 PolarHBondContact O-N 3.44Å; S628-Y631 PolarHBondContact O-N 2.92Å; S628-Y631 PolarHBondContact OG-N 2.87Å; S628-N632 PolarHBondContact O-N 2.78Å; S628-N632 PolarHBondContact O-ND2 2.67Å
629	L	84.2	Confident	80.2	Confident	115 Å²	115	88 Å²	88	60%	0.602	43%	0.429	S	S	*	.	H	α-helix	trans	-48.1	-46.1	170.8	178.1	67.4	0	0	0	111.6	W623 N632 Q633	W623-L629 HydrophobicContact CH2-CD1 3.79Å; W623-L629 HydrophobicContact CZ2-CD1 3.67Å; L629-N632 PolarHBondContact O-N 3.18Å; L629-Q633 WeakPolarHBondContact O-CG 3.26Å; L629-Q633 PolarHBondContact O-N 2.95Å; L629-Q633 VanDerWaalsContact O-N 3.12Å
630	R	84.9	Confident	81.6	Confident	155 Å²	155	83.4 Å²	83.4	59%	0.585	41%	0.41	S	S	*	.	H	α-helix	trans	-66.4	-41.5	-178.5	-165.9	174.3	-171.8	152.7	3	113.2	S628 N632 Q633 D634	S628-R630 PolarHBondContact O-N 3.44Å; R630-N632 VanDerWaalsContact C-N 3.32Å; R630-N632 PolarHBondContact O-N 3.25Å; R630-Q633 PolarHBondContact O-N 2.89Å; R630-D634 PolarHBondContact O-N 3.31Å
631	Y	85.9	Confident	82.9	Confident	39 Å²	39	83.3 Å²	83.3	15%	0.153	41%	0.411	C	S	.	.	H	α-helix	trans	-59.4	-44.9	175.5	174.9	-80.2	0	0	0	111.2	R627 S628 D634 A635 A676	R627-Y631 HydrophobicContact CB-CD1 3.95Å; R627-Y631 HydrophobicContact CB-CG 4.2Å; R627-Y631 HydrophobicContact CG-CD1 4.25Å; R627-Y631 VanDerWaalsContact NH1-CE2 3.29Å; R627-Y631 VanDerWaalsContact NH1-CZ 3.32Å; R627-Y631 PolarHBondContact NH1-OH 3.41Å; S628-Y631 PolarHBondContact O-N 2.92Å; S628-Y631 PolarHBondContact OG-N 2.87Å; Y631-D634 PolarHBondContact O-N 3.2Å; Y631-A635 HydrophobicContact CE1-CB 4.15Å; Y631-A635 WeakPolarHBondContact O-CB 3.38Å; Y631-A635 PolarHBondContact O-N 3.49Å; Y631-A676 HydrophobicContact CE2-CB 4.33Å
632	N	86.1	Confident	84	Confident	8 Å²	8	85 Å²	85	4%	0.043	41%	0.407	C	S	.	.	H	α-helix	trans	-68.5	-35.5	-177.8	-74.1	-69.6	0	0	0	112	W623 D624 R627 S628 L629 R630 Q636	W623-N632 HydrophobicContact CD2-CB 3.65Å; W623-N632 HydrophobicContact CE3-CB 3.61Å; W623-N632 HydrophobicContact CG-CB 4.44Å; W623-N632 HydrophobicContact CH2-CB 3.49Å; W623-N632 VanDerWaalsContact CH2-CB 3.49Å; W623-N632 HydrophobicContact CZ2-CB 3.54Å; W623-N632 HydrophobicContact CZ3-CB 3.53Å; D624-N632 PolarHBondContact N-OD1 3.25Å; D624-N632 PolarHBondContact O-ND2 3.01Å; R627-N632 PolarHBondContact O-ND2 2.92Å; S628-N632 PolarHBondContact O-N 2.78Å; S628-N632 PolarHBondContact O-ND2 2.67Å; L629-N632 PolarHBondContact O-N 3.18Å; R630-N632 VanDerWaalsContact C-N 3.32Å; R630-N632 PolarHBondContact O-N 3.25Å; N632-Q636 WeakPolarHBondContact O-CB 3.42Å; N632-Q636 PolarHBondContact O-N 3.33Å
633	Q	86.5	Confident	84.6	Confident	86 Å²	86	81.1 Å²	81.1	40%	0.402	39%	0.388	S	S	.	.	H	α-helix	trans	-66.2	-40.5	170.7	-69.5	173.2	-5.3	0	0	112.9	W623 L629 R630 Q636 R637	W623-Q633 HydrophobicContact CH2-CG 4.26Å; L629-Q633 WeakPolarHBondContact O-CG 3.26Å; L629-Q633 PolarHBondContact O-N 2.95Å; L629-Q633 VanDerWaalsContact O-N 3.12Å; R630-Q633 PolarHBondContact O-N 2.89Å; Q633-Q636 PolarHBondContact O-N 3.14Å; Q633-R637 PolarHBondContact O-N 3.45Å
634	D	84.4	Confident	84.8	Confident	18 Å²	18	80.5 Å²	80.5	10%	0.096	39%	0.392	C	S	.	.	H	α-helix	trans	-62.2	-48	174	-93.7	33.3	0	0	0	111	R630 Y631 Q636 R637 E638 Y675	R630-D634 PolarHBondContact O-N 3.31Å; Y631-D634 PolarHBondContact O-N 3.2Å; D634-Q636 VanDerWaalsContact C-N 3.3Å; D634-Q636 PolarHBondContact O-N 3.38Å; D634-R637 PolarHBondContact O-N 2.84Å; D634-R637 IonicContact OD1-CZ 2.74Å; D634-R637 IonicContact OD1-NH1 3.16Å; D634-R637 PolarHBondContact OD1-NH1 3.29Å; D634-R637 IonicContact OD1-NH2 2.77Å; D634-R637 PolarHBondContact OD1-NH2 2.84Å; D634-E638 WeakPolarHBondContact O-CB 3.46Å; D634-E638 PolarHBondContact O-N 2.96Å; D634-Y675 VanDerWaalsContact OD2-CB 3.22Å; D634-Y675 WeakPolarHBondContact OD2-CB 3.4Å; D634-Y675 PolarHBondContact OD2-N 2.8Å
635	A	82.8	Confident	85	Confident	9 Å²	9	81.1 Å²	81.1	7%	0.074	40%	0.404	C	S	.	.	H	α-helix	trans	-64.5	-31.7	177.9	0	0	0	0	0	113	Y631 E639	Y631-A635 HydrophobicContact CE1-CB 4.15Å; Y631-A635 WeakPolarHBondContact O-CB 3.38Å; Y631-A635 PolarHBondContact O-N 3.49Å; A635-E639 VanDerWaalsContact O-CB 3.23Å; A635-E639 WeakPolarHBondContact O-CB 3.33Å; A635-E639 PolarHBondContact O-N 2.87Å
636	Q	85.4	Confident	85.1	Confident	104 Å²	104	80.3 Å²	80.3	49%	0.486	39%	0.388	S	S	.	.	H	α-helix	trans	-68.7	-47.1	170.5	-177.4	-179.6	-20.6	0	0	111.2	N632 Q633 D634 E638 E639 D640	N632-Q636 WeakPolarHBondContact O-CB 3.42Å; N632-Q636 PolarHBondContact O-N 3.33Å; Q633-Q636 PolarHBondContact O-N 3.14Å; D634-Q636 VanDerWaalsContact C-N 3.3Å; D634-Q636 PolarHBondContact O-N 3.38Å; Q636-E638 VanDerWaalsContact C-N 3.34Å; Q636-E638 PolarHBondContact O-N 2.75Å; Q636-E639 PolarHBondContact O-N 3.12Å; Q636-D640 WeakPolarHBondContact CG-OD2 3.35Å; Q636-D640 PolarHBondContact NE2-OD2 3.4Å; Q636-D640 PolarHBondContact O-N 2.89Å
637	R	86.3	Confident	85.1	Confident	124 Å²	124	79 Å²	79	47%	0.468	37%	0.371	S	S	.	.	H	α-helix	trans	-61	-40.8	178.5	-81.1	-177.6	-92.6	98.1	2	112.4	Q633 D634 E639 Q641	Q633-R637 PolarHBondContact O-N 3.45Å; D634-R637 PolarHBondContact O-N 2.84Å; D634-R637 IonicContact OD1-CZ 2.74Å; D634-R637 IonicContact OD1-NH1 3.16Å; D634-R637 PolarHBondContact OD1-NH1 3.29Å; D634-R637 IonicContact OD1-NH2 2.77Å; D634-R637 PolarHBondContact OD1-NH2 2.84Å; R637-E639 VanDerWaalsContact C-N 3.34Å; R637-Q641 WeakPolarHBondContact O-CB 3.09Å; R637-Q641 VanDerWaalsContact O-CG 3.24Å; R637-Q641 WeakPolarHBondContact O-CG 3.41Å; R637-Q641 PolarHBondContact O-N 3Å
638	E	84.4	Confident	85	Confident	49 Å²	49	76.9 Å²	76.9	23%	0.229	37%	0.372	C	S	.	.	H	α-helix	trans	-61.5	-41.1	174.6	-166	-156.2	109.2	0	0	111.7	D634 Q636 R642 G672 G673	D634-E638 WeakPolarHBondContact O-CB 3.46Å; D634-E638 PolarHBondContact O-N 2.96Å; Q636-E638 VanDerWaalsContact C-N 3.34Å; Q636-E638 PolarHBondContact O-N 2.75Å; E638-R642 WeakPolarHBondContact O-CB 3.37Å; E638-R642 PolarHBondContact O-N 2.92Å; E638-R642 IonicContact OE1-CZ 3.45Å; E638-R642 IonicContact OE1-NH1 2.92Å; E638-R642 IonicContact OE1-NH2 2.75Å; E638-R642 PolarHBondContact OE1-NH2 3.3Å; E638-G672 PolarHBondContact OE2-N 3.42Å; E638-G673 PolarHBondContact OE2-N 3.15Å
639	E	84.3	Confident	84.8	Confident	20 Å²	20	75.5 Å²	75.5	9%	0.093	37%	0.369	C	S	.	.	H	α-helix	trans	-72.4	-41.1	178.2	170.3	64.5	-177.2	0	0	112.9	A635 Q636 R637 Q641 R642 R643	A635-E639 VanDerWaalsContact O-CB 3.23Å; A635-E639 WeakPolarHBondContact O-CB 3.33Å; A635-E639 PolarHBondContact O-N 2.87Å; Q636-E639 PolarHBondContact O-N 3.12Å; R637-E639 VanDerWaalsContact C-N 3.34Å; E639-Q641 VanDerWaalsContact C-N 3.34Å; E639-R642 WeakPolarHBondContact O-CB 3.38Å; E639-R642 PolarHBondContact O-N 2.87Å; E639-R642 IonicContact OE2-CZ 3.25Å; E639-R642 IonicContact OE2-NH1 2.86Å; E639-R642 PolarHBondContact OE2-NH1 2.93Å; E639-R643 VanDerWaalsContact CG-CZ 3.4Å; E639-R643 VanDerWaalsContact O-CG 3.26Å; E639-R643 WeakPolarHBondContact O-CG 3.26Å; E639-R643 PolarHBondContact O-N 3.01Å; E639-R643 IonicContact OE1-CZ 3.68Å; E639-R643 IonicContact OE1-NE 3.86Å; E639-R643 PolarHBondContact OE1-NE 2.83Å; E639-R643 IonicContact OE1-NH2 2.76Å; E639-R643 PolarHBondContact OE1-NH2 2.91Å
640	D	85.2	Confident	84.7	Confident	64 Å²	64	72.7 Å²	72.7	34%	0.342	35%	0.352	S	S	.	.	H	α-helix	trans	-70.5	-31.5	176.2	-71.7	-32.5	0	0	0	111.5	Q636 R643 M644	Q636-D640 WeakPolarHBondContact CG-OD2 3.35Å; Q636-D640 PolarHBondContact NE2-OD2 3.4Å; Q636-D640 PolarHBondContact O-N 2.89Å; D640-R643 IonicContact OD1-CZ 3.33Å; D640-R643 IonicContact OD1-NE 2.85Å; D640-R643 IonicContact OD1-NH1 2.78Å; D640-R643 PolarHBondContact OD1-NH1 3.36Å; D640-M644 WeakPolarHBondContact O-CB 3.39Å; D640-M644 PolarHBondContact O-N 3.33Å
641	Q	84.9	Confident	84.4	Confident	140 Å²	140	69.3 Å²	69.3	65%	0.654	35%	0.345	S	S	*	.	H	α-helix	trans	-63.4	-45.6	167.1	-77.6	174.9	-8.9	0	0	112.3	R637 E639 M644 A645	R637-Q641 WeakPolarHBondContact O-CB 3.09Å; R637-Q641 VanDerWaalsContact O-CG 3.24Å; R637-Q641 WeakPolarHBondContact O-CG 3.41Å; R637-Q641 PolarHBondContact O-N 3Å; E639-Q641 VanDerWaalsContact C-N 3.34Å; Q641-M644 PolarHBondContact O-N 3.02Å; Q641-A645 PolarHBondContact O-N 3.09Å
642	R	85.6	Confident	84	Confident	105 Å²	105	70.8 Å²	70.8	40%	0.396	36%	0.359	S	S	.	.	H	α-helix	trans	-57.7	-48.1	175.1	175.9	-176.2	-61.6	108.7	11.5	111.6	E638 E639 M644 A645 E646	E638-R642 WeakPolarHBondContact O-CB 3.37Å; E638-R642 PolarHBondContact O-N 2.92Å; E638-R642 IonicContact OE1-CZ 3.45Å; E638-R642 IonicContact OE1-NH1 2.92Å; E638-R642 IonicContact OE1-NH2 2.75Å; E638-R642 PolarHBondContact OE1-NH2 3.3Å; E639-R642 WeakPolarHBondContact O-CB 3.38Å; E639-R642 PolarHBondContact O-N 2.87Å; E639-R642 IonicContact OE2-CZ 3.25Å; E639-R642 IonicContact OE2-NH1 2.86Å; E639-R642 PolarHBondContact OE2-NH1 2.93Å; R642-M644 VanDerWaalsContact C-N 3.34Å; R642-M644 PolarHBondContact O-N 2.87Å; R642-A645 WeakPolarHBondContact O-CB 3.42Å; R642-A645 PolarHBondContact O-N 2.97Å; R642-E646 WeakPolarHBondContact O-CG 3.43Å; R642-E646 PolarHBondContact O-N 3.45Å
643	R	85.2	Confident	83.7	Confident	79 Å²	79	74.8 Å²	74.8	30%	0.298	38%	0.377	S	S	.	.	H	α-helix	trans	-59.2	-43.1	175.7	-69.5	171.3	-171.1	161.3	-0.1	112.2	V616 E639 D640 A645 E646 I647	V616-R643 HydrophobicContact CG1-CG 3.84Å; E639-R643 VanDerWaalsContact CG-CZ 3.4Å; E639-R643 VanDerWaalsContact O-CG 3.26Å; E639-R643 WeakPolarHBondContact O-CG 3.26Å; E639-R643 PolarHBondContact O-N 3.01Å; E639-R643 IonicContact OE1-CZ 3.68Å; E639-R643 IonicContact OE1-NE 3.86Å; E639-R643 PolarHBondContact OE1-NE 2.83Å; E639-R643 IonicContact OE1-NH2 2.76Å; E639-R643 PolarHBondContact OE1-NH2 2.91Å; D640-R643 IonicContact OD1-CZ 3.33Å; D640-R643 IonicContact OD1-NE 2.85Å; D640-R643 IonicContact OD1-NH1 2.78Å; D640-R643 PolarHBondContact OD1-NH1 3.36Å; R643-A645 VanDerWaalsContact C-N 3.33Å; R643-A645 PolarHBondContact O-N 3.41Å; R643-E646 PolarHBondContact O-N 2.7Å; R643-I647 WeakPolarHBondContact O-CB 3.48Å; R643-I647 WeakPolarHBondContact O-CD1 3.34Å; R643-I647 VanDerWaalsContact O-CG1 3.24Å; R643-I647 WeakPolarHBondContact O-CG1 3.23Å; R643-I647 PolarHBondContact O-N 2.95Å
644	M	85.3	Confident	83.1	Confident	115 Å²	115	72.2 Å²	72.2	57%	0.567	37%	0.365	S	S	*	.	H	α-helix	trans	-62.9	-40.8	176.8	-170.1	58.5	65.2	0	0	111.4	D640 Q641 R642 I647 V648	D640-M644 WeakPolarHBondContact O-CB 3.39Å; D640-M644 PolarHBondContact O-N 3.33Å; Q641-M644 PolarHBondContact O-N 3.02Å; R642-M644 VanDerWaalsContact C-N 3.34Å; R642-M644 PolarHBondContact O-N 2.87Å; M644-I647 PolarHBondContact O-N 3.3Å; M644-V648 HydrophobicContact CG-CG2 4.49Å; M644-V648 WeakPolarHBondContact O-CB 3.36Å; M644-V648 VanDerWaalsContact O-CG2 3.26Å; M644-V648 WeakPolarHBondContact O-CG2 3.45Å; M644-V648 PolarHBondContact O-N 2.77Å; M644-V648 HydrophobicContact SD-CG2 4.43Å
645	A	85.1	Confident	82.6	Confident	65 Å²	65	74.7 Å²	74.7	54%	0.537	37%	0.373	S	S	.	.	H	α-helix	trans	-64.7	-41.4	174.7	0	0	0	0	0	112.6	Q641 R642 R643 V648 G649	Q641-A645 PolarHBondContact O-N 3.09Å; R642-A645 WeakPolarHBondContact O-CB 3.42Å; R642-A645 PolarHBondContact O-N 2.97Å; R643-A645 VanDerWaalsContact C-N 3.33Å; R643-A645 PolarHBondContact O-N 3.41Å; A645-V648 PolarHBondContact O-N 2.65Å; A645-G649 PolarHBondContact O-N 2.9Å
646	E	86.8	Confident	82.1	Confident	99 Å²	99	80.4 Å²	80.4	46%	0.463	40%	0.397	S	S	.	.	H	α-helix	trans	-61.8	-45	173.7	-72.9	176.6	-166.4	0	0	111.9	R642 R643 G649 H650	R642-E646 WeakPolarHBondContact O-CG 3.43Å; R642-E646 PolarHBondContact O-N 3.45Å; R643-E646 PolarHBondContact O-N 2.7Å; E646-G649 PolarHBondContact O-N 3.25Å; E646-H650 WeakPolarHBondContact O-CB 3.39Å; E646-H650 PolarHBondContact O-N 3.06Å
647	I	84.2	Confident	81.2	Confident	76 Å²	76	76.2 Å²	76.2	39%	0.39	38%	0.381	S	S	.	.	H	α-helix	trans	-63.2	-47.5	176.8	-70.4	163.3	0	0	0	110.9	R643 M644 G649 H650 L651	R643-I647 WeakPolarHBondContact O-CB 3.48Å; R643-I647 WeakPolarHBondContact O-CD1 3.34Å; R643-I647 VanDerWaalsContact O-CG1 3.24Å; R643-I647 WeakPolarHBondContact O-CG1 3.23Å; R643-I647 PolarHBondContact O-N 2.95Å; M644-I647 PolarHBondContact O-N 3.3Å; I647-G649 VanDerWaalsContact C-N 3.32Å; I647-G649 PolarHBondContact O-N 2.79Å; I647-H650 PolarHBondContact O-N 3.49Å; I647-L651 HydrophobicContact CG2-CD1 3.72Å; I647-L651 HydrophobicContact CG2-CG 4.28Å; I647-L651 WeakPolarHBondContact O-CB 3.47Å; I647-L651 VanDerWaalsContact O-CG 3.26Å; I647-L651 WeakPolarHBondContact O-CG 3.46Å; I647-L651 PolarHBondContact O-N 3.47Å
648	V	82.4	Confident	80	Confident	78 Å²	78	76.9 Å²	76.9	47%	0.473	39%	0.394	S	S	.	.	H	α-helix	trans	-62.5	-39.4	176.9	168.6	0	0	0	0	111.2	M644 A645 T652	M644-V648 HydrophobicContact CG-CG2 4.49Å; M644-V648 WeakPolarHBondContact O-CB 3.36Å; M644-V648 VanDerWaalsContact O-CG2 3.26Å; M644-V648 WeakPolarHBondContact O-CG2 3.45Å; M644-V648 PolarHBondContact O-N 2.77Å; M644-V648 HydrophobicContact SD-CG2 4.43Å; A645-V648 PolarHBondContact O-N 2.65Å; V648-T652 VanDerWaalsContact O-CB 3.23Å; V648-T652 WeakPolarHBondContact O-CB 3.34Å; V648-T652 PolarHBondContact O-N 2.8Å; V648-T652 PolarHBondContact O-OG1 2.88Å
649	G	81.1	Confident	78.4	Confident	38 Å²	38	81.9 Å²	81.9	39%	0.392	42%	0.418	S	S	.	.	H	α-helix	trans	-60	-50.3	173.6	0	0	0	0	0	112	A645 E646 I647 T652 Q653	A645-G649 PolarHBondContact O-N 2.9Å; E646-G649 PolarHBondContact O-N 3.25Å; I647-G649 VanDerWaalsContact C-N 3.32Å; I647-G649 PolarHBondContact O-N 2.79Å; G649-T652 WeakPolarHBondContact O-CB 3.36Å; G649-T652 PolarHBondContact O-N 3.32Å; G649-Q653 WeakPolarHBondContact O-CB 3.09Å; G649-Q653 PolarHBondContact O-N 2.87Å
650	H	81.6	Confident	76.1	Confident	56 Å²	56	88.2 Å²	88.2	26%	0.259	45%	0.447	S	S	.	.	H	α-helix	trans	-66	-40.7	179.8	-175.3	48	0	0	0	113.1	P613 E646 I647 Q653 M654	P613-H650 WeakPolarHBondContact CB-NE2 3.45Å; E646-H650 WeakPolarHBondContact O-CB 3.39Å; E646-H650 PolarHBondContact O-N 3.06Å; I647-H650 PolarHBondContact O-N 3.49Å; H650-Q653 PolarHBondContact O-N 3.18Å; H650-M654 WeakPolarHBondContact O-CG 3.39Å; H650-M654 PolarHBondContact O-N 2.8Å
651	L	78.4	Confident	73.9	Confident	84 Å²	84	89.7 Å²	89.7	44%	0.44	46%	0.46	S	S	.	.	H	α-helix	trans	-64.5	-39.2	174.9	-71.1	171.8	0	0	0	111.9	I647 M654 R655	I647-L651 HydrophobicContact CG2-CD1 3.72Å; I647-L651 HydrophobicContact CG2-CG 4.28Å; I647-L651 WeakPolarHBondContact O-CB 3.47Å; I647-L651 VanDerWaalsContact O-CG 3.26Å; I647-L651 WeakPolarHBondContact O-CG 3.46Å; I647-L651 PolarHBondContact O-N 3.47Å; L651-M654 HydrophobicContact CD2-CE 3.87Å; L651-R655 WeakPolarHBondContact O-CB 3.35Å; L651-R655 PolarHBondContact O-N 2.82Å; L651-R655 VanDerWaalsContact O-N 3.09Å
652	T	78	Confident	71.6	Confident	70 Å²	70	87.7 Å²	87.7	43%	0.429	46%	0.462	S	S	.	.	H	α-helix	trans	-61.3	-50.8	172.7	-62.3	0	0	0	0	110.7	V648 G649 M654 R655 F656	V648-T652 VanDerWaalsContact O-CB 3.23Å; V648-T652 WeakPolarHBondContact O-CB 3.34Å; V648-T652 PolarHBondContact O-N 2.8Å; V648-T652 PolarHBondContact O-OG1 2.88Å; G649-T652 WeakPolarHBondContact O-CB 3.36Å; G649-T652 PolarHBondContact O-N 3.32Å; T652-M654 PolarHBondContact O-N 3.26Å; T652-R655 PolarHBondContact O-N 2.91Å; T652-R655 VanDerWaalsContact O-N 3.08Å; T652-F656 HydrophobicContact CG2-CD2 3.91Å; T652-F656 HydrophobicContact CG2-CE2 4.42Å; T652-F656 WeakPolarHBondContact O-CD2 3.47Å; T652-F656 PolarHBondContact O-N 3.18Å
653	Q	79	Confident	69.2	Low	91 Å²	91	90.3 Å²	90.3	43%	0.425	48%	0.476	S	S	.	.	H	α-helix	trans	-58.9	-42.4	178.5	-169.8	-173.4	22	0	0	112.1	G649 H650 R655 G657 D658	G649-Q653 WeakPolarHBondContact O-CB 3.09Å; G649-Q653 PolarHBondContact O-N 2.87Å; H650-Q653 PolarHBondContact O-N 3.18Å; Q653-R655 VanDerWaalsContact C-N 3.35Å; Q653-R655 PolarHBondContact O-N 3.36Å; Q653-G657 CarbonylContact O-C 3.28Å; Q653-G657 WeakPolarHBondContact O-CA 3.31Å; Q653-G657 PolarHBondContact O-N 3.27Å; Q653-D658 PolarHBondContact NE2-OD1 2.82Å
654	M	75.8	Confident	67	Low	32 Å²	32	90.2 Å²	90.2	16%	0.158	49%	0.487	C	S	.	.	H	α-helix	trans	-66.1	-33.5	174.7	-75.1	-166.1	-69.2	0	0	113.4	L443 H650 L651 T652	L443-M654 HydrophobicContact CD2-CB 4.02Å; H650-M654 WeakPolarHBondContact O-CG 3.39Å; H650-M654 PolarHBondContact O-N 2.8Å; L651-M654 HydrophobicContact CD2-CE 3.87Å; T652-M654 PolarHBondContact O-N 3.26Å
655	R	73.8	Confident	64.6	Low	70 Å²	70	94.4 Å²	94.4	26%	0.264	50%	0.502	S	S	.	.	H	α-helix	trans	-78.5	-37.7	-178.9	-173.2	176.2	-69.9	-99	0.6	112.9	D446 L651 T652 Q653	D446-R655 VanDerWaalsContact CG-NH2 3.3Å; D446-R655 IonicContact OD1-CZ 3.45Å; D446-R655 IonicContact OD1-NH1 2.77Å; D446-R655 PolarHBondContact OD1-NH1 3.36Å; D446-R655 IonicContact OD1-NH2 2.73Å; D446-R655 PolarHBondContact OD1-NH2 3.08Å; D446-R655 IonicContact OD2-CZ 3.9Å; D446-R655 IonicContact OD2-NH1 3.63Å; D446-R655 PolarHBondContact OD2-NH1 3.46Å; D446-R655 IonicContact OD2-NH2 3.51Å; D446-R655 PolarHBondContact OD2-NH2 3.41Å; L651-R655 WeakPolarHBondContact O-CB 3.35Å; L651-R655 PolarHBondContact O-N 2.82Å; L651-R655 VanDerWaalsContact O-N 3.09Å; T652-R655 PolarHBondContact O-N 2.91Å; T652-R655 VanDerWaalsContact O-N 3.08Å; Q653-R655 VanDerWaalsContact C-N 3.35Å; Q653-R655 PolarHBondContact O-N 3.36Å
656	F	71.3	Confident	62.4	Low	129 Å²	129	98.4 Å²	98.4	57%	0.566	52%	0.515	S	S	*	.	H	α-helix	trans	-115.2	-10	-171.5	-58.2	-73.1	0	0	0	114.9	T652	T652-F656 HydrophobicContact CG2-CD2 3.91Å; T652-F656 HydrophobicContact CG2-CE2 4.42Å; T652-F656 WeakPolarHBondContact O-CD2 3.47Å; T652-F656 PolarHBondContact O-N 3.18Å
657	G	67.5	Low	60.2	Low	16 Å²	16	98.8 Å²	98.8	17%	0.165	52%	0.524	C	S	.	.			trans	81.3	-175.2	-172	0	0	0	0	0	113.1	Q653 Q659	Q653-G657 CarbonylContact O-C 3.28Å; Q653-G657 WeakPolarHBondContact O-CA 3.31Å; Q653-G657 PolarHBondContact O-N 3.27Å; G657-Q659 PolarHBondContact O-N 2.93Å
658	D	60	Low	58.3	Low	138 Å²	138	105.1 Å²	105.1	74%	0.738	55%	0.549	S	S	*	.			trans	-73.9	87.1	175.8	-69.9	-44.1	0	0	0	111.4	Q653	Q653-D658 PolarHBondContact NE2-OD1 2.82Å
659	Q	50.5	Low	56.8	Low	154 Å²	154	107.3 Å²	107.3	72%	0.72	55%	0.554	S	S	*	*			trans	-96.9	109.8	155.6	-67.9	-170.8	52.4	0	0	108	G657 P661	G657-Q659 PolarHBondContact O-N 2.93Å; Q659-P661 VanDerWaalsContact O-CD 3.31Å; Q659-P661 WeakPolarHBondContact O-CD 3.18Å; Q659-P661 VanDerWaalsContact O-N 3.11Å
660	E	36.2	Very low	55.2	Low	153 Å²	153	108 Å²	108	72%	0.715	55%	0.552	S	S	*	*			trans	-52.1	114.3	-179.9	-96.8	-81.1	124.5	0	0	110.7	S662 K663	E660-S662 PolarHBondContact O-N 3.4Å; E660-K663 IonicContact OE1-NZ 3.46Å; E660-K663 IonicContact OE2-NZ 2.67Å; E660-K663 PolarHBondContact OE2-NZ 2.99Å
661	P	40.2	Very low	53.7	Low	95 Å²	95	109.3 Å²	109.3	62%	0.617	57%	0.572	S	S	*	*			trans	-67.3	125.3	177.1	26.9	-32.7	0	0	0	108.9	Q659 K663	Q659-P661 VanDerWaalsContact O-CD 3.31Å; Q659-P661 WeakPolarHBondContact O-CD 3.18Å; Q659-P661 VanDerWaalsContact O-N 3.11Å; P661-K663 PolarHBondContact O-N 3.15Å
662	S	36.2	Very low	52.7	Low	98 Å²	98	105.4 Å²	105.4	69%	0.685	55%	0.552	S	S	*	*			trans	-63.8	101.5	179.7	60.6	0	0	0	0	110.1	E660 S664	E660-S662 PolarHBondContact O-N 3.4Å; S662-S664 PolarHBondContact O-N 3.16Å
663	K	33.8	Very low	51.9	Low	161 Å²	161	102.9 Å²	102.9	70%	0.7	54%	0.54	S	S	*	.			trans	-56.3	91.1	-169.7	-72.7	154.9	-179.5	135	0	112.5	E660 P661 K665	E660-K663 IonicContact OE1-NZ 3.46Å; E660-K663 IonicContact OE2-NZ 2.67Å; E660-K663 PolarHBondContact OE2-NZ 2.99Å; P661-K663 PolarHBondContact O-N 3.15Å; K663-K665 PolarHBondContact O-N 3.29Å
664	S	40	Very low	51.1	Low	76 Å²	76	103.3 Å²	103.3	53%	0.531	54%	0.544	S	S	.	.			trans	-61.1	130.6	163.4	45.5	0	0	0	0	108.6	S662 D666	S662-S664 PolarHBondContact O-N 3.16Å; S664-D666 PolarHBondContact O-N 2.88Å
665	K	34.6	Very low	50.4	Low	203 Å²	203	106 Å²	106	88%	0.883	55%	0.553	S	S	*	*			trans	-77.2	93.3	-169.5	-172.9	-178.8	-177.2	-179	0	110.8	K663 T667	K663-K665 PolarHBondContact O-N 3.29Å; K665-T667 PolarHBondContact O-N 3.35Å; K665-T667 VanDerWaalsContact O-N 3.12Å
666	D	38.5	Very low	50.1	Low	149 Å²	149	103.1 Å²	103.1	80%	0.797	54%	0.544	S	S	*	.			trans	-56.9	116	176.1	-75.2	-43.4	0	0	0	111.6	S664 K668	S664-D666 PolarHBondContact O-N 2.88Å; D666-K668 PolarHBondContact O-N 3.07Å
667	T	41.6	Very low	50.1	Low	108 Å²	108	101 Å²	101	66%	0.663	53%	0.532	S	S	*	.			trans	-69	112.1	161.2	42	0	0	0	0	107.8	K665 E669	K665-T667 PolarHBondContact O-N 3.35Å; K665-T667 VanDerWaalsContact O-N 3.12Å; T667-E669 PolarHBondContact O-N 3.49Å
668	K	44	Very low	50.1	Low	208 Å²	208	104.6 Å²	104.6	90%	0.904	55%	0.547	S	S	*	.			trans	-49.9	110.3	173.1	-78.1	-173.4	172.6	-174.4	0	110.5	D666	D666-K668 PolarHBondContact O-N 3.07Å
669	E	50.1	Low	50.5	Low	125 Å²	125	101 Å²	101	58%	0.584	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-71.8	150.6	163.7	-65.2	-141.1	91	0	0	110.1	T667 R677	T667-E669 PolarHBondContact O-N 3.49Å; E669-R677 VanDerWaalsContact OE1-CD 3.31Å; E669-R677 WeakPolarHBondContact OE1-CD 3.27Å; E669-R677 IonicContact OE1-CZ 3.79Å; E669-R677 IonicContact OE1-NE 3.62Å; E669-R677 IonicContact OE1-NH1 2.72Å; E669-R677 PolarHBondContact OE1-NH1 2.68Å; E669-R677 IonicContact OE2-NH1 2.7Å
670	P	48.7	Very low	51.4	Low	53 Å²	53	98.6 Å²	98.6	34%	0.344	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-68.2	141.1	172.4	30	-34.4	0	0	0	110.1	G672 R677 L680	P670-G672 PolarHBondContact O-N 3.22Å; P670-R677 HydrophobicContact CG-CB 4.15Å; P670-R677 HydrophobicContact CG-CG 4.22Å; P670-L680 HydrophobicContact CB-CD1 4.03Å; P670-L680 HydrophobicContact CG-CD1 4.33Å
671	A	49.4	Very low	53	Low	82 Å²	82	97.3 Å²	97.3	68%	0.678	51%	0.511	S	S	*	.	S	Bend	trans	-65.1	132.1	179.4	0	0	0	0	0	111.7
672	G	57.3	Low	54.2	Low	2 Å²	2	101.3 Å²	101.3	2%	0.021	52%	0.519	C	S	.	.	S	Bend	trans	117.4	20.9	-178.6	0	0	0	0	0	114.8	E638 P670 A676	E638-G672 PolarHBondContact OE2-N 3.42Å; P670-G672 PolarHBondContact O-N 3.22Å; G672-A676 WeakPolarHBondContact O-CB 3.47Å; G672-A676 PolarHBondContact O-N 3.08Å
673	G	61.7	Low	55.6	Low	17 Å²	17	105.2 Å²	105.2	18%	0.175	52%	0.519	C	S	.	.	H	α-helix	trans	63.1	-165.7	173.8	0	0	0	0	0	116.4	E638 Y675 A676 R677	E638-G673 PolarHBondContact OE2-N 3.15Å; G673-Y675 VanDerWaalsContact C-N 3.31Å; G673-Y675 PolarHBondContact O-N 3.48Å; G673-A676 PolarHBondContact O-N 3.49Å; G673-R677 PolarHBondContact O-N 3.15Å; G673-R677 VanDerWaalsContact O-N 3.12Å
674	I	62.8	Low	56.7	Low	100 Å²	100	100.8 Å²	100.8	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-63.9	-36.5	-175.4	-62.5	171.8	0	0	0	110.9	R677 L678	I674-R677 WeakPolarHBondContact O-CB 3.44Å; I674-R677 PolarHBondContact O-N 3.06Å; I674-L678 HydrophobicContact CG2-CD1 3.89Å; I674-L678 HydrophobicContact CG2-CG 4.33Å; I674-L678 WeakPolarHBondContact O-CB 3.47Å; I674-L678 WeakPolarHBondContact O-CG 3.19Å; I674-L678 PolarHBondContact O-N 2.99Å
675	Y	60.8	Low	57.1	Low	90 Å²	90	99.9 Å²	99.9	35%	0.353	52%	0.522	S	S	.	.	H	α-helix	trans	-65.8	-45.5	177.7	-172.1	-88.7	0	0	0	112.3	D634 G673 R677 L678 E679	D634-Y675 VanDerWaalsContact OD2-CB 3.22Å; D634-Y675 WeakPolarHBondContact OD2-CB 3.4Å; D634-Y675 PolarHBondContact OD2-N 2.8Å; G673-Y675 VanDerWaalsContact C-N 3.31Å; G673-Y675 PolarHBondContact O-N 3.48Å; Y675-R677 VanDerWaalsContact C-N 3.28Å; Y675-R677 PolarHBondContact O-N 3.49Å; Y675-L678 PolarHBondContact O-N 2.74Å; Y675-E679 HydrophobicContact CE1-CB 4.21Å; Y675-E679 HydrophobicContact CE1-CG 4.48Å; Y675-E679 WeakPolarHBondContact CE1-OE2 3.38Å; Y675-E679 WeakPolarHBondContact O-CB 3.45Å; Y675-E679 PolarHBondContact O-N 3.01Å
676	A	66.8	Low	57.4	Low	9 Å²	9	93.8 Å²	93.8	7%	0.074	51%	0.509	C	S	.	.	H	α-helix	trans	-64.4	-34.3	176.7	0	0	0	0	0	112.1	Y631 G672 G673 L680	Y631-A676 HydrophobicContact CE2-CB 4.33Å; G672-A676 WeakPolarHBondContact O-CB 3.47Å; G672-A676 PolarHBondContact O-N 3.08Å; G673-A676 PolarHBondContact O-N 3.49Å; A676-L680 VanDerWaalsContact O-CB 3.32Å; A676-L680 WeakPolarHBondContact O-CB 3.46Å; A676-L680 WeakPolarHBondContact O-CD1 3.34Å; A676-L680 VanDerWaalsContact O-CG 3.25Å; A676-L680 WeakPolarHBondContact O-CG 3.48Å; A676-L680 PolarHBondContact O-N 2.86Å
677	R	72.6	Confident	57.5	Low	84 Å²	84	92.4 Å²	92.4	32%	0.317	51%	0.509	S	S	.	.	H	α-helix	trans	-61.9	-45.3	172.7	-167.2	-179.3	73.1	-164.9	0.6	111.8	E669 P670 G673 I674 Y675 Q681	E669-R677 VanDerWaalsContact OE1-CD 3.31Å; E669-R677 WeakPolarHBondContact OE1-CD 3.27Å; E669-R677 IonicContact OE1-CZ 3.79Å; E669-R677 IonicContact OE1-NE 3.62Å; E669-R677 IonicContact OE1-NH1 2.72Å; E669-R677 PolarHBondContact OE1-NH1 2.68Å; E669-R677 IonicContact OE2-NH1 2.7Å; P670-R677 HydrophobicContact CG-CB 4.15Å; P670-R677 HydrophobicContact CG-CG 4.22Å; G673-R677 PolarHBondContact O-N 3.15Å; G673-R677 VanDerWaalsContact O-N 3.12Å; I674-R677 WeakPolarHBondContact O-CB 3.44Å; I674-R677 PolarHBondContact O-N 3.06Å; Y675-R677 VanDerWaalsContact C-N 3.28Å; Y675-R677 PolarHBondContact O-N 3.49Å; R677-Q681 VanDerWaalsContact O-CG 3.28Å; R677-Q681 WeakPolarHBondContact O-CG 3.15Å; R677-Q681 PolarHBondContact O-N 3.48Å; R677-Q681 VanDerWaalsContact O-N 3.08Å
678	L	66.6	Low	57.5	Low	91 Å²	91	94 Å²	94	48%	0.476	52%	0.518	S	S	.	.	H	α-helix	trans	-68.4	-41.6	176.3	-72	169.4	0	0	0	112.2	I674 Y675 L680 Q681 F682	I674-L678 HydrophobicContact CG2-CD1 3.89Å; I674-L678 HydrophobicContact CG2-CG 4.33Å; I674-L678 WeakPolarHBondContact O-CB 3.47Å; I674-L678 WeakPolarHBondContact O-CG 3.19Å; I674-L678 PolarHBondContact O-N 2.99Å; Y675-L678 PolarHBondContact O-N 2.74Å; L678-L680 PolarHBondContact O-N 3.12Å; L678-Q681 PolarHBondContact O-N 3.12Å; L678-F682 WeakPolarHBondContact O-CB 3.25Å; L678-F682 PolarHBondContact O-N 3.36Å
679	E	68.7	Low	57.1	Low	62 Å²	62	95.5 Å²	95.5	29%	0.29	52%	0.518	S	S	.	.	H	α-helix	trans	-65	-39.1	177.8	-164.8	-168	154.9	0	0	111.5	Y675 F682 R683	Y675-E679 HydrophobicContact CE1-CB 4.21Å; Y675-E679 HydrophobicContact CE1-CG 4.48Å; Y675-E679 WeakPolarHBondContact CE1-OE2 3.38Å; Y675-E679 WeakPolarHBondContact O-CB 3.45Å; Y675-E679 PolarHBondContact O-N 3.01Å; E679-F682 PolarHBondContact O-N 2.86Å; E679-R683 WeakPolarHBondContact O-CB 3.12Å; E679-R683 WeakPolarHBondContact O-CG 3.44Å; E679-R683 PolarHBondContact O-N 3.35Å; E679-R683 IonicContact OE1-CZ 2.72Å; E679-R683 IonicContact OE1-NE 2.84Å; E679-R683 PolarHBondContact OE1-NE 2.87Å; E679-R683 IonicContact OE1-NH2 3.87Å; E679-R683 PolarHBondContact OE1-NH2 2.84Å
680	L	68.6	Low	56.5	Low	105 Å²	105	95.4 Å²	95.4	55%	0.55	53%	0.529	S	S	.	.	H	α-helix	trans	-65.4	-39.5	172.7	-76.2	168	0	0	0	112.1	P670 A676 L678 G684	P670-L680 HydrophobicContact CB-CD1 4.03Å; P670-L680 HydrophobicContact CG-CD1 4.33Å; A676-L680 VanDerWaalsContact O-CB 3.32Å; A676-L680 WeakPolarHBondContact O-CB 3.46Å; A676-L680 WeakPolarHBondContact O-CD1 3.34Å; A676-L680 VanDerWaalsContact O-CG 3.25Å; A676-L680 WeakPolarHBondContact O-CG 3.48Å; A676-L680 PolarHBondContact O-N 2.86Å; L678-L680 PolarHBondContact O-N 3.12Å; L680-G684 PolarHBondContact O-N 2.84Å
681	Q	71	Confident	55.6	Low	125 Å²	125	99.8 Å²	99.8	58%	0.584	55%	0.554	S	S	*	*	H	α-helix	trans	-64.9	-40.8	173.4	-74.7	170.1	-20.6	0	0	111.6	R677 L678 G684 G685	R677-Q681 VanDerWaalsContact O-CG 3.28Å; R677-Q681 WeakPolarHBondContact O-CG 3.15Å; R677-Q681 PolarHBondContact O-N 3.48Å; R677-Q681 VanDerWaalsContact O-N 3.08Å; L678-Q681 PolarHBondContact O-N 3.12Å; Q681-G684 PolarHBondContact O-N 3.42Å; Q681-G685 PolarHBondContact O-N 2.96Å
682	F	65.3	Low	54.8	Low	179 Å²	179	100.3 Å²	100.3	79%	0.785	56%	0.559	S	S	*	*	H	α-helix	trans	-68.6	-47.4	179	-162.6	-98.1	0	0	0	112.1	L678 E679 G684 G685	L678-F682 WeakPolarHBondContact O-CB 3.25Å; L678-F682 PolarHBondContact O-N 3.36Å; E679-F682 PolarHBondContact O-N 2.86Å; F682-G684 VanDerWaalsContact C-N 3.3Å; F682-G684 PolarHBondContact O-N 3.29Å; F682-G685 PolarHBondContact O-N 3.43Å; F682-G685 VanDerWaalsContact O-N 3.14Å
683	R	66.1	Low	53.6	Low	180 Å²	180	109.1 Å²	109.1	68%	0.679	60%	0.599	S	S	*	*	H	α-helix	trans	-64.1	-33.9	173.9	-70.9	179.8	-175	-91.7	2.9	112.3	E679 G685	E679-R683 WeakPolarHBondContact O-CB 3.12Å; E679-R683 WeakPolarHBondContact O-CG 3.44Å; E679-R683 PolarHBondContact O-N 3.35Å; E679-R683 IonicContact OE1-CZ 2.72Å; E679-R683 IonicContact OE1-NE 2.84Å; E679-R683 PolarHBondContact OE1-NE 2.87Å; E679-R683 IonicContact OE1-NH2 3.87Å; E679-R683 PolarHBondContact OE1-NH2 2.84Å; R683-G685 VanDerWaalsContact C-N 3.31Å
684	G	55.6	Low	52.3	Low	68 Å²	68	118.4 Å²	118.4	70%	0.701	64%	0.635	S	S	*	*	H	α-helix	trans	-74.2	-17.4	174.2	0	0	0	0	0	114.5	L680 Q681 F682	L680-G684 PolarHBondContact O-N 2.84Å; Q681-G684 PolarHBondContact O-N 3.42Å; F682-G684 VanDerWaalsContact C-N 3.3Å; F682-G684 PolarHBondContact O-N 3.29Å
685	G	48.8	Very low	50.8	Low	58 Å²	58	118.1 Å²	118.1	60%	0.598	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-1.5	-178.4	0	0	0	0	0	115.6	Q681 F682 R683 P687	Q681-G685 PolarHBondContact O-N 2.96Å; F682-G685 PolarHBondContact O-N 3.43Å; F682-G685 VanDerWaalsContact O-N 3.14Å; R683-G685 VanDerWaalsContact C-N 3.31Å; G685-P687 WeakPolarHBondContact O-CD 3.42Å
686	A	39.7	Very low	49.5	Very low	74 Å²	74	120 Å²	120	61%	0.612	67%	0.671	S	S	*	*			trans	-72.6	116.2	-176.8	0	0	0	0	0	112.1	T688	A686-T688 PolarHBondContact O-N 3.44Å
687	P	42.4	Very low	47.8	Very low	121 Å²	121	131.6 Å²	131.6	79%	0.786	71%	0.712	S	S	*	*			trans	-75.4	128	-177.4	29.9	-34.2	0	0	0	111.7	G685 R689	G685-P687 WeakPolarHBondContact O-CD 3.42Å; P687-R689 PolarHBondContact O-N 2.98Å; P687-R689 VanDerWaalsContact O-N 3.07Å
688	T	40.5	Very low	45.7	Very low	140 Å²	140	133 Å²	133	86%	0.859	74%	0.735	S	S	*	*			trans	-67.8	103.2	172	35.2	0	0	0	0	110.8	A686	A686-T688 PolarHBondContact O-N 3.44Å
689	R	35.2	Very low	44	Very low	240 Å²	240	139 Å²	139	91%	0.906	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-59.9	132.4	172.1	-91.4	-177.7	163.5	-179.1	-5	110.7	P687	P687-R689 PolarHBondContact O-N 2.98Å; P687-R689 VanDerWaalsContact O-N 3.07Å
690	P	37.7	Very low	42	Very low	123 Å²	123	141 Å²	141	80%	0.799	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-75.2	145.1	177	31.2	-34.8	0	0	0	111.5
691	T	29.8	Very low	40.2	Very low	145 Å²	145	147 Å²	147	89%	0.89	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-80.7	144.2	166.4	41.9	0	0	0	0	110.7
692	A	33.9	Very low	38.2	Very low	93 Å²	93	151.4 Å²	151.4	77%	0.769	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-100.3	171.1	-175.3	0	0	0	0	0	113.3
693	E	32	Very low	36.5	Very low	187 Å²	187	147.2 Å²	147.2	87%	0.874	81%	0.805	S	S	*	*			trans	83.9	98.8	170.2	-53.8	-155.7	149.2	0	0	119.7
694	K	32.7	Very low	35.3	Very low	213 Å²	213	147.2 Å²	147.2	93%	0.926	81%	0.812	S	S	*	*				-151.8	146.5	110.1	-106.6	158.5	-171.7	170.2	0	111.2
695	A	31.3	Very low	34.1	Very low	94 Å²	94	152.6 Å²	152.6	78%	0.777	82%	0.824	S	S	*	*			trans	-83.1	153.2	-160.3	0	0	0	0	0	115
696	P	34.5	Very low	33.4	Very low	128 Å²	128	160.6 Å²	160.6	83%	0.831	84%	0.836	S	S	*	*			trans	-76.6	158.4	173.6	33.2	-36.1	0	0	0	112.4
697	R	29.9	Very low	33.2	Very low	253 Å²	253	163.1 Å²	163.1	96%	0.955	84%	0.844	S	S	*	*			trans	-111.2	125.4	166.1	-97.9	-176.5	169.1	175.3	-2.7	110.7
698	S	30.4	Very low	32.9	Very low	113 Å²	113	167.4 Å²	167.4	79%	0.79	87%	0.868	S	S	*	*			trans	-84.1	155.6	174.4	52.3	0	0	0	0	112.3
699	K	29.1	Very low	32.5	Very low	217 Å²	217	168.8 Å²	168.8	94%	0.943	87%	0.869	S	S	*	*			trans	-135.5	136.8	153	-83.3	-167.9	175.2	-177.3	0	108.5
700	S	28.6	Very low	32.3	Very low	104 Å²	104	165 Å²	165	73%	0.727	87%	0.867	S	S	*	*			trans	-131.1	139.3	-177.4	54.2	0	0	0	0	111.4
701	R	29.6	Very low	32	Very low	231 Å²	231	167.3 Å²	167.3	87%	0.872	87%	0.871	S	S	*	*			trans	169.1	124.3	150.9	-91.4	155.5	-167.3	-146.6	1.6	105.9
702	Y	29.1	Very low	32.2	Very low	219 Å²	219	168.6 Å²	168.6	86%	0.859	87%	0.869	S	S	*	*				54.7	131	81.1	-86.5	-92.5	0	0	0	112.2
703	A	29.8	Very low	32.1	Very low	90 Å²	90	173.4 Å²	173.4	74%	0.744	88%	0.876	S	S	*	*			cis	-142.5	175	26.8	0	0	0	0	0	114.5
704	Q	39.9	Very low	32.1	Very low	181 Å²	181	172.5 Å²	172.5	85%	0.846	88%	0.876	S	S	*	*			trans	-76.1	151.8	166	-59.9	163.4	-69.9	0	0	110.8
705	L	30.4	Very low	32	Very low	180 Å²	180	169.6 Å²	169.6	94%	0.942	87%	0.872	S	S	*	*			trans	-156.9	165	136	-107.7	163	0	0	0	108.6
706	R	35.2	Very low	32.1	Very low	226 Å²	226	175.4 Å²	175.4	85%	0.853	88%	0.88	S	S	*	*			trans	-128.3	171.1	-166	-152.6	-177.2	-172.4	-177.5	3.4	110.6
707	T	34.6	Very low	31.9	Very low	127 Å²	127	179.3 Å²	179.3	78%	0.779	88%	0.884	S	S	*	*			trans	70.6	146.5	179.8	68.6	0	0	0	0	114.8
708	T	35.9	Very low	32.1	Very low	211 Å²	211	172.6 Å²	172.6	100%	1.294	88%	0.877	S	S	*	*			cis	-95.8	0	-3.5	53.9	0	0	0	0	111.9

Retrieved 708 of 708 residues in 630.2 ms (Link to these results)

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