A0A077ZBD0_TRITR Loading...

Far upstream element-binding protein 1

AlphaFold DB , UniProt , Accession A0A077ZBD0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 531 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	32.6	Very low	30.3	Very low	232 Å²	232	138.8 Å²	138.8	100%	1.143	81%	0.809	S	S	*	*				0	115.7	0	-67.7	-164.7	172.7	0	0	107.3	F3	M1-F3 PolarHBondContact O-N 3.46Å
2	P	31.2	Very low	30.9	Very low	125 Å²	125	134.3 Å²	134.3	81%	0.812	79%	0.791	S	S	*	*			trans	-82.6	123.6	-167.3	31.6	-29.5	0	0	0	110.6	S4	P2-S4 PolarHBondContact O-N 3.4Å
3	F	26.1	Very low	31.5	Very low	205 Å²	205	130.6 Å²	130.6	90%	0.899	77%	0.765	S	S	*	*			trans	-65.5	103	156.8	-86	-93.9	0	0	0	107.6	M1 Q5	M1-F3 PolarHBondContact O-N 3.46Å; F3-Q5 PolarHBondContact O-N 2.65Å
4	S	29.8	Very low	32	Very low	117 Å²	117	127.4 Å²	127.4	82%	0.818	74%	0.743	S	S	*	*			trans	-66.2	117.1	166.5	-75	0	0	0	0	108.9	P2 A6	P2-S4 PolarHBondContact O-N 3.4Å; S4-A6 PolarHBondContact O-N 3.4Å
5	Q	25.8	Very low	32.7	Very low	166 Å²	166	128.7 Å²	128.7	78%	0.776	74%	0.737	S	S	*	*			trans	-58.7	120.9	175.6	-71.7	167.3	-29.9	0	0	111.1	F3 M7	F3-Q5 PolarHBondContact O-N 2.65Å; Q5-M7 VanDerWaalsContact C-N 3.3Å; Q5-M7 PolarHBondContact O-N 2.92Å; Q5-M7 VanDerWaalsContact O-N 3.07Å
6	A	27.4	Very low	33	Very low	102 Å²	102	122.4 Å²	122.4	84%	0.843	71%	0.705	S	S	*	*			trans	-74.8	83.7	160.6	0	0	0	0	0	109.1	S4	S4-A6 PolarHBondContact O-N 3.4Å
7	M	24.4	Very low	33.7	Very low	156 Å²	156	120.5 Å²	120.5	77%	0.768	68%	0.684	S	S	*	*			trans	-101.4	85.1	163.5	-80.9	-158.3	167.2	0	0	108.8	Q5	Q5-M7 VanDerWaalsContact C-N 3.3Å; Q5-M7 PolarHBondContact O-N 2.92Å; Q5-M7 VanDerWaalsContact O-N 3.07Å
8	T	27.4	Very low	34.2	Very low	142 Å²	142	117.6 Å²	117.6	87%	0.871	67%	0.672	S	S	*	*			trans	-173.6	70.8	162.4	34.9	0	0	0	0	111.1
9	S	32.4	Very low	34.9	Very low	91 Å²	91	114.8 Å²	114.8	64%	0.636	65%	0.653	S	S	*	*	S	Bend	trans	-157.3	-2.6	167.8	61.8	0	0	0	0	117.2
10	S	35.8	Very low	35.5	Very low	90 Å²	90	110 Å²	110	63%	0.629	63%	0.626	S	S	*	*	S	Bend	trans	-81.9	-26.7	-174.4	55	0	0	0	0	115.4
11	S	40.1	Very low	36.1	Very low	101 Å²	101	105.6 Å²	105.6	71%	0.706	61%	0.605	S	S	*	*	H	α-helix	trans	-79.1	-24.7	-169.7	59.1	0	0	0	0	115.5
12	S	38.3	Very low	36.9	Very low	84 Å²	84	101 Å²	101	59%	0.587	58%	0.581	S	S	*	*	H	α-helix	trans	-80.2	-27.7	-179.3	64.4	0	0	0	0	113	A16	S12-A16 PolarHBondContact O-N 2.99Å
13	L	37.9	Very low	37.6	Very low	87 Å²	87	95.7 Å²	95.7	46%	0.455	55%	0.546	S	S	.	.	H	α-helix	trans	-79.1	-38.3	-178.6	-100.3	148.5	0	0	0	112.5	F15 A16 R17	L13-F15 VanDerWaalsContact C-N 3.34Å; L13-A16 PolarHBondContact O-N 3.13Å; L13-R17 WeakPolarHBondContact O-CG 3.44Å; L13-R17 PolarHBondContact O-N 3.04Å; L13-R17 VanDerWaalsContact O-N 3.16Å
14	D	38.9	Very low	38.7	Very low	86 Å²	86	86.3 Å²	86.3	46%	0.46	51%	0.507	S	S	.	.	H	α-helix	trans	-69.1	-32.1	176.3	-73.2	-31.7	0	0	0	112.8	R17 S18	D14-R17 WeakPolarHBondContact O-CB 3.33Å; D14-R17 PolarHBondContact O-N 2.88Å; D14-R17 IonicContact OD1-CZ 3.61Å; D14-R17 IonicContact OD1-NE 3.99Å; D14-R17 IonicContact OD1-NH1 2.68Å; D14-R17 PolarHBondContact OD1-NH1 3.39Å; D14-S18 PolarHBondContact O-N 3.13Å
15	F	42	Very low	39.7	Very low	147 Å²	147	82.2 Å²	82.2	65%	0.645	48%	0.483	S	S	*	.	H	α-helix	trans	-67	-39.5	173.1	-173.8	-111.3	0	0	0	112.3	L13 R17 M19	L13-F15 VanDerWaalsContact C-N 3.34Å; F15-R17 VanDerWaalsContact C-N 3.32Å; F15-R17 PolarHBondContact O-N 2.97Å; F15-M19 HydrophobicContact CD1-CE 3.5Å; F15-M19 VanDerWaalsContact CD1-CE 3.5Å; F15-M19 HydrophobicContact CE1-CE 3.1Å; F15-M19 HydrophobicContact CG-CE 4.4Å; F15-M19 HydrophobicContact CZ-CE 3.72Å; F15-M19 WeakPolarHBondContact O-CB 3.27Å; F15-M19 PolarHBondContact O-N 2.98Å
16	A	38.3	Very low	40.8	Very low	28 Å²	28	75.8 Å²	75.8	23%	0.231	46%	0.458	C	S	.	.	H	α-helix	trans	-64.7	-36	174.8	0	0	0	0	0	112.1	S12 L13 M19 V20 V105	S12-A16 PolarHBondContact O-N 2.99Å; L13-A16 PolarHBondContact O-N 3.13Å; A16-M19 PolarHBondContact O-N 3.42Å; A16-V20 WeakPolarHBondContact O-CG2 3.49Å; A16-V20 PolarHBondContact O-N 3.43Å; A16-V20 VanDerWaalsContact O-N 3.09Å; A16-V105 HydrophobicContact CB-CG1 4.38Å
17	R	44	Very low	41.9	Very low	90 Å²	90	71.1 Å²	71.1	34%	0.34	42%	0.419	S	S	.	.	H	α-helix	trans	-62.5	-46.8	177	-72.7	172.8	-174.9	159.3	0.5	113	L13 D14 F15 M19 G21 L62	L13-R17 WeakPolarHBondContact O-CG 3.44Å; L13-R17 PolarHBondContact O-N 3.04Å; L13-R17 VanDerWaalsContact O-N 3.16Å; D14-R17 WeakPolarHBondContact O-CB 3.33Å; D14-R17 PolarHBondContact O-N 2.88Å; D14-R17 IonicContact OD1-CZ 3.61Å; D14-R17 IonicContact OD1-NE 3.99Å; D14-R17 IonicContact OD1-NH1 2.68Å; D14-R17 PolarHBondContact OD1-NH1 3.39Å; F15-R17 VanDerWaalsContact C-N 3.32Å; F15-R17 PolarHBondContact O-N 2.97Å; R17-M19 VanDerWaalsContact C-N 3.3Å; R17-M19 PolarHBondContact O-N 3.02Å; R17-G21 PolarHBondContact O-N 2.94Å; R17-L62 HydrophobicContact CG-CB 3.88Å; R17-L62 HydrophobicContact CG-CD1 4.31Å; R17-L62 PolarHBondContact NE-O 3.13Å; R17-L62 PolarHBondContact NH2-O 2.82Å; R17-L62 VanDerWaalsContact NH2-O 3.1Å
18	S	44.1	Very low	43.3	Very low	68 Å²	68	64.6 Å²	64.6	48%	0.476	39%	0.387	S	S	.	.	H	α-helix	trans	-62.5	-41	176.9	-160.7	0	0	0	0	111.3	D14 G21 E22	D14-S18 PolarHBondContact O-N 3.13Å; S18-G21 PolarHBondContact O-N 2.95Å; S18-E22 WeakPolarHBondContact O-CG 3.38Å; S18-E22 PolarHBondContact O-N 2.98Å; S18-E22 VanDerWaalsContact O-N 3.12Å; S18-E22 PolarHBondContact OG-OE1 3.46Å
19	M	46.4	Very low	44.6	Very low	65 Å²	65	62.2 Å²	62.2	32%	0.32	37%	0.369	S	S	.	.	H	α-helix	trans	-68	-40.1	-175.5	-154.7	-172.7	-50.9	0	0	112.6	F15 A16 R17 G21 V23	F15-M19 HydrophobicContact CD1-CE 3.5Å; F15-M19 VanDerWaalsContact CD1-CE 3.5Å; F15-M19 HydrophobicContact CE1-CE 3.1Å; F15-M19 HydrophobicContact CG-CE 4.4Å; F15-M19 HydrophobicContact CZ-CE 3.72Å; F15-M19 WeakPolarHBondContact O-CB 3.27Å; F15-M19 PolarHBondContact O-N 2.98Å; A16-M19 PolarHBondContact O-N 3.42Å; R17-M19 VanDerWaalsContact C-N 3.3Å; R17-M19 PolarHBondContact O-N 3.02Å; M19-G21 PolarHBondContact O-N 2.96Å; M19-V23 HydrophobicContact CG-CG2 4.22Å; M19-V23 WeakPolarHBondContact O-CB 3.3Å; M19-V23 WeakPolarHBondContact O-CG2 3.32Å; M19-V23 PolarHBondContact O-N 3.34Å
20	V	47.5	Very low	45.3	Very low	18 Å²	18	59.7 Å²	59.7	11%	0.109	35%	0.348	C	S	.	.	H	α-helix	trans	-65.2	-40.4	178.2	173.3	0	0	0	0	111.3	A16 A24 V105	A16-V20 WeakPolarHBondContact O-CG2 3.49Å; A16-V20 PolarHBondContact O-N 3.43Å; A16-V20 VanDerWaalsContact O-N 3.09Å; V20-A24 WeakPolarHBondContact O-CB 3.12Å; V20-A24 PolarHBondContact O-N 3.18Å; V20-V105 HydrophobicContact CG2-CG1 4.35Å
21	G	47.1	Very low	45.9	Very low	18 Å²	18	55.6 Å²	55.6	19%	0.186	32%	0.319	C	S	.	.	H	α-helix	trans	-64.8	-45.9	177.9	0	0	0	0	0	113.1	R17 S18 M19 G25	R17-G21 PolarHBondContact O-N 2.94Å; S18-G21 PolarHBondContact O-N 2.95Å; M19-G21 PolarHBondContact O-N 2.96Å; G21-G25 PolarHBondContact O-N 3.46Å
22	E	49.6	Very low	46.5	Very low	134 Å²	134	57 Å²	57	63%	0.626	31%	0.309	S	S	*	.	H	α-helix	trans	-65.5	-44.3	177.6	-74.4	175.9	-164.9	0	0	112	S18 G25 A26	S18-E22 WeakPolarHBondContact O-CG 3.38Å; S18-E22 PolarHBondContact O-N 2.98Å; S18-E22 VanDerWaalsContact O-N 3.12Å; S18-E22 PolarHBondContact OG-OE1 3.46Å; E22-G25 PolarHBondContact O-N 3.41Å; E22-A26 WeakPolarHBondContact O-CB 3.48Å; E22-A26 PolarHBondContact O-N 3.36Å
23	V	47	Very low	47	Very low	14 Å²	14	61.7 Å²	61.7	9%	0.085	31%	0.314	C	S	.	.	H	α-helix	trans	-69.8	-40.6	-176.9	176.2	0	0	0	0	111.4	M19 A26 L27 Y98 V102	M19-V23 HydrophobicContact CG-CG2 4.22Å; M19-V23 WeakPolarHBondContact O-CB 3.3Å; M19-V23 WeakPolarHBondContact O-CG2 3.32Å; M19-V23 PolarHBondContact O-N 3.34Å; V23-A26 PolarHBondContact O-N 3.01Å; V23-L27 WeakPolarHBondContact O-CB 3.19Å; V23-L27 PolarHBondContact O-N 3.35Å; V23-Y98 HydrophobicContact CB-CD1 4.3Å; V23-Y98 VanDerWaalsContact CG1-CB 3.49Å; V23-Y98 HydrophobicContact CG1-CD1 3.65Å; V23-Y98 HydrophobicContact CG1-CG 3.9Å; V23-Y98 WeakPolarHBondContact CG1-O 3.44Å; V23-Y98 HydrophobicContact CG2-CD1 3.91Å; V23-Y98 HydrophobicContact CG2-CE1 4.37Å; V23-V102 HydrophobicContact CB-CG2 3.95Å; V23-V102 HydrophobicContact CG1-CG2 3.36Å
24	A	49.4	Very low	47.2	Very low	9 Å²	9	58.2 Å²	58.2	7%	0.074	30%	0.297	C	S	.	.	H	α-helix	trans	-69.8	-38.6	175.7	0	0	0	0	0	112.4	V20 L27 I28 V55	V20-A24 WeakPolarHBondContact O-CB 3.12Å; V20-A24 PolarHBondContact O-N 3.18Å; A24-L27 WeakPolarHBondContact O-CB 3.22Å; A24-L27 PolarHBondContact O-N 3.35Å; A24-I28 WeakPolarHBondContact O-CD1 3.32Å; A24-I28 VanDerWaalsContact O-CG1 3.28Å; A24-I28 WeakPolarHBondContact O-CG1 3.44Å; A24-I28 PolarHBondContact O-N 3.31Å; A24-V55 HydrophobicContact CB-CB 4.24Å; A24-V55 HydrophobicContact CB-CG1 3.52Å; A24-V55 HydrophobicContact CB-CG2 3.61Å
25	G	50.7	Low	47.5	Very low	30 Å²	30	62.2 Å²	62.2	31%	0.309	31%	0.305	S	S	.	.	H	α-helix	trans	-61.2	-42.4	173.6	0	0	0	0	0	112.5	G21 E22 I28 N29	G21-G25 PolarHBondContact O-N 3.46Å; E22-G25 PolarHBondContact O-N 3.41Å; G25-I28 PolarHBondContact O-N 3.06Å; G25-N29 PolarHBondContact O-N 3.08Å; G25-N29 VanDerWaalsContact O-N 3.12Å
26	A	48.7	Very low	47.6	Very low	32 Å²	32	62.6 Å²	62.6	26%	0.264	31%	0.314	S	S	.	.	H	α-helix	trans	-63	-44.1	173.4	0	0	0	0	0	111.9	E22 V23 I28 N29 D30 Y98	E22-A26 WeakPolarHBondContact O-CB 3.48Å; E22-A26 PolarHBondContact O-N 3.36Å; V23-A26 PolarHBondContact O-N 3.01Å; A26-I28 VanDerWaalsContact C-N 3.34Å; A26-I28 PolarHBondContact O-N 3.46Å; A26-N29 PolarHBondContact O-N 3.42Å; A26-D30 PolarHBondContact O-N 3.32Å; A26-Y98 HydrophobicContact CB-CD2 4.44Å; A26-Y98 HydrophobicContact CB-CE2 4.46Å
27	L	50.8	Low	48	Very low	3 Å²	3	65.1 Å²	65.1	2%	0.016	33%	0.329	C	S	.	.	H	α-helix	trans	-58.7	-45	178.1	-156.3	98.9	0	0	0	112.2	V23 A24 L31 L51 L77 T95 A99	V23-L27 WeakPolarHBondContact O-CB 3.19Å; V23-L27 PolarHBondContact O-N 3.35Å; A24-L27 WeakPolarHBondContact O-CB 3.22Å; A24-L27 PolarHBondContact O-N 3.35Å; L27-L31 HydrophobicContact CD2-CD1 4.1Å; L27-L31 HydrophobicContact CG-CD1 4.26Å; L27-L31 WeakPolarHBondContact O-CB 3.43Å; L27-L31 VanDerWaalsContact O-CG 3.29Å; L27-L31 WeakPolarHBondContact O-CG 3.48Å; L27-L31 PolarHBondContact O-N 3.01Å; L27-L51 HydrophobicContact CD2-CD2 3.25Å; L27-L77 HydrophobicContact CD2-CD2 4.46Å; L27-T95 HydrophobicContact CD1-CG2 3.43Å; L27-T95 VanDerWaalsContact CD1-CG2 3.43Å; L27-T95 WeakPolarHBondContact CD1-O 3.48Å; L27-T95 HydrophobicContact CG-CG2 3.57Å; L27-A99 HydrophobicContact CD1-CB 3.74Å
28	I	52.4	Low	47.7	Very low	20 Å²	20	64.1 Å²	64.1	10%	0.103	35%	0.347	C	S	.	.	H	α-helix	trans	-65.9	-39	179.6	-72	162	0	0	0	111.3	A24 G25 A26 R32 K52	A24-I28 WeakPolarHBondContact O-CD1 3.32Å; A24-I28 VanDerWaalsContact O-CG1 3.28Å; A24-I28 WeakPolarHBondContact O-CG1 3.44Å; A24-I28 PolarHBondContact O-N 3.31Å; G25-I28 PolarHBondContact O-N 3.06Å; A26-I28 VanDerWaalsContact C-N 3.34Å; A26-I28 PolarHBondContact O-N 3.46Å; I28-R32 WeakPolarHBondContact O-CB 3.24Å; I28-R32 WeakPolarHBondContact O-CG 3.5Å; I28-R32 PolarHBondContact O-N 3.08Å; I28-R32 VanDerWaalsContact O-N 3.08Å; I28-K52 HydrophobicContact CD1-CG 3.77Å; I28-K52 HydrophobicContact CG1-CG 4.07Å; I28-K52 HydrophobicContact CG2-CD 4.48Å; I28-K52 HydrophobicContact CG2-CG 4.34Å
29	N	54.6	Low	47.6	Very low	91 Å²	91	63.6 Å²	63.6	49%	0.487	34%	0.341	S	S	.	.	H	α-helix	trans	-71.8	-39.6	179.8	-80.4	-19.6	0	0	0	112.5	G25 A26 R32 R33	G25-N29 PolarHBondContact O-N 3.08Å; G25-N29 VanDerWaalsContact O-N 3.12Å; A26-N29 PolarHBondContact O-N 3.42Å; N29-R32 PolarHBondContact O-N 2.96Å; N29-R33 PolarHBondContact O-N 3.32Å; N29-R33 VanDerWaalsContact O-N 3.08Å
30	D	47.6	Very low	47.3	Very low	39 Å²	39	66.2 Å²	66.2	21%	0.209	36%	0.363	C	S	.	.	H	α-helix	trans	-66	-45.9	175.6	-80.9	-14.9	0	0	0	111.3	A26 R32 R33 C34 T95	A26-D30 PolarHBondContact O-N 3.32Å; D30-R32 VanDerWaalsContact C-N 3.29Å; D30-R32 PolarHBondContact O-N 2.91Å; D30-R33 WeakPolarHBondContact O-CA 3.43Å; D30-R33 WeakPolarHBondContact O-CB 3.24Å; D30-R33 PolarHBondContact O-N 3.46Å; D30-C34 PolarHBondContact O-N 2.88Å; D30-C34 PolarHBondContact O-SG 3.18Å; D30-T95 VanDerWaalsContact CB-OG1 3.29Å; D30-T95 WeakPolarHBondContact CB-OG1 3.43Å; D30-T95 PolarHBondContact OD2-OG1 3.39Å
31	L	48.3	Very low	47.1	Very low	3 Å²	3	68.1 Å²	68.1	2%	0.016	37%	0.37	C	S	.	.	H	α-helix	trans	-62.2	-34.2	176.8	-72.9	169.9	0	0	0	113	L27 C34 R35 L44 L48 F80 T95	L27-L31 HydrophobicContact CD2-CD1 4.1Å; L27-L31 HydrophobicContact CG-CD1 4.26Å; L27-L31 WeakPolarHBondContact O-CB 3.43Å; L27-L31 VanDerWaalsContact O-CG 3.29Å; L27-L31 WeakPolarHBondContact O-CG 3.48Å; L27-L31 PolarHBondContact O-N 3.01Å; L31-C34 WeakPolarHBondContact O-CB 3.37Å; L31-C34 PolarHBondContact O-N 3.41Å; L31-R35 PolarHBondContact O-N 3.49Å; L31-L44 HydrophobicContact CD2-CD2 4.04Å; L31-L48 HydrophobicContact CB-CD1 4.17Å; L31-L48 HydrophobicContact CB-CD2 3.77Å; L31-L48 HydrophobicContact CB-CG 4.32Å; L31-L48 HydrophobicContact CD1-CD2 3.91Å; L31-L48 HydrophobicContact CD1-CG 4.42Å; L31-L48 HydrophobicContact CG-CD2 4.5Å; L31-F80 HydrophobicContact CD1-CE2 4.2Å; L31-F80 HydrophobicContact CD1-CZ 4.02Å; L31-F80 HydrophobicContact CD2-CE2 4.17Å; L31-F80 HydrophobicContact CD2-CZ 3.9Å; L31-T95 HydrophobicContact CD1-CG2 4.36Å; L31-T95 HydrophobicContact CD2-CG2 4.22Å; L31-T95 HydrophobicContact CG-CG2 3.95Å
32	R	53.5	Low	46.7	Very low	132 Å²	132	74.4 Å²	74.4	50%	0.498	40%	0.404	S	S	.	.	H	α-helix	trans	-64.4	-39	170.8	-82.6	173.7	162.8	159.9	-2.7	112.4	I28 N29 D30 C34 R35 K52	I28-R32 WeakPolarHBondContact O-CB 3.24Å; I28-R32 WeakPolarHBondContact O-CG 3.5Å; I28-R32 PolarHBondContact O-N 3.08Å; I28-R32 VanDerWaalsContact O-N 3.08Å; N29-R32 PolarHBondContact O-N 2.96Å; D30-R32 VanDerWaalsContact C-N 3.29Å; D30-R32 PolarHBondContact O-N 2.91Å; R32-C34 VanDerWaalsContact C-N 3.29Å; R32-C34 PolarHBondContact O-N 2.84Å; R32-R35 PolarHBondContact O-N 3.41Å; R32-K52 VanDerWaalsContact NH2-NZ 3.18Å
33	R	49.4	Very low	46.6	Very low	181 Å²	181	72.4 Å²	72.4	68%	0.683	40%	0.398	S	S	*	.	H	α-helix	trans	-65	-32.4	174.4	-75.4	177.1	173.5	175	-3	112.1	N29 D30 R35 L36	N29-R33 PolarHBondContact O-N 3.32Å; N29-R33 VanDerWaalsContact O-N 3.08Å; D30-R33 WeakPolarHBondContact O-CA 3.43Å; D30-R33 WeakPolarHBondContact O-CB 3.24Å; D30-R33 PolarHBondContact O-N 3.46Å; R33-R35 VanDerWaalsContact C-N 3.3Å; R33-R35 PolarHBondContact O-N 3.22Å; R33-L36 PolarHBondContact O-N 3.37Å
34	C	42	Very low	46.6	Very low	14 Å²	14	72.6 Å²	72.6	10%	0.095	40%	0.399	C	S	.	.	H	α-helix	trans	-66.8	-28.7	177.8	-52.5	0	0	0	0	113.7	D30 L31 R32 L36 S37 F92	D30-C34 PolarHBondContact O-N 2.88Å; D30-C34 PolarHBondContact O-SG 3.18Å; L31-C34 WeakPolarHBondContact O-CB 3.37Å; L31-C34 PolarHBondContact O-N 3.41Å; R32-C34 VanDerWaalsContact C-N 3.29Å; R32-C34 PolarHBondContact O-N 2.84Å; C34-L36 PolarHBondContact O-N 3.47Å; C34-S37 PolarHBondContact O-N 3.34Å; C34-S37 PolarHBondContact O-OG 2.98Å; C34-F92 HydrophobicContact CB-CD1 4.44Å; C34-F92 HydrophobicContact CB-CE1 3.67Å; C34-F92 HydrophobicContact CB-CZ 4.09Å; C34-F92 WeakPolarHBondContact SG-CD1 3.32Å; C34-F92 WeakPolarHBondContact SG-CE1 3.35Å
35	R	43.5	Very low	46.2	Very low	170 Å²	170	75.6 Å²	75.6	64%	0.642	41%	0.413	S	S	*	.	H	α-helix	trans	-65.5	-26.2	174.6	-169.9	172.4	173.7	174.9	-5.1	112.4	L31 R32 R33 N45	L31-R35 PolarHBondContact O-N 3.49Å; R32-R35 PolarHBondContact O-N 3.41Å; R33-R35 VanDerWaalsContact C-N 3.3Å; R33-R35 PolarHBondContact O-N 3.22Å; R35-N45 PolarHBondContact NH1-OD1 3.12Å
36	L	45.3	Very low	46	Very low	156 Å²	156	80.3 Å²	80.3	82%	0.817	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-11	-179.1	-65.9	166.7	0	0	0	113.4	R33 C34	R33-L36 PolarHBondContact O-N 3.37Å; C34-L36 PolarHBondContact O-N 3.47Å
37	S	46.2	Very low	45.9	Very low	80 Å²	80	82.9 Å²	82.9	56%	0.559	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	9.6	-176	56.3	0	0	0	0	115	C34 V39	C34-S37 PolarHBondContact O-N 3.34Å; C34-S37 PolarHBondContact O-OG 2.98Å; S37-V39 VanDerWaalsContact C-N 3.33Å; S37-V39 PolarHBondContact O-N 3.06Å
38	G	37	Very low	45.8	Very low	70 Å²	70	83.3 Å²	83.3	72%	0.722	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	18.2	169.9	0	0	0	0	0	115.8	P40	G38-P40 WeakPolarHBondContact O-CD 3.19Å
39	V	42.8	Very low	45.7	Very low	56 Å²	56	83.6 Å²	83.6	34%	0.339	44%	0.444	S	S	.	.			trans	-77.5	119.9	175.2	-177.1	0	0	0	0	108.9	S37 F41	S37-V39 VanDerWaalsContact C-N 3.33Å; S37-V39 PolarHBondContact O-N 3.06Å; V39-F41 HydrophobicContact CB-CD2 4.45Å; V39-F41 HydrophobicContact CG1-CD2 3.98Å; V39-F41 HydrophobicContact CG1-CE2 4.02Å; V39-F41 PolarHBondContact O-N 2.99Å; V39-F41 VanDerWaalsContact O-N 3.13Å
40	P	40.8	Very low	45.5	Very low	121 Å²	121	84.9 Å²	84.9	79%	0.786	45%	0.447	S	S	*	.			trans	-68.5	116	-179.9	27.5	-31.7	0	0	0	109	G38	G38-P40 WeakPolarHBondContact O-CD 3.19Å
41	F	42.6	Very low	45.7	Very low	57 Å²	57	83.6 Å²	83.6	25%	0.25	44%	0.44	C	S	.	.			trans	-119.5	132.8	170.2	-98.4	-93.7	0	0	0	107.5	V39 D43 L44 L84 Q88 F92	V39-F41 HydrophobicContact CB-CD2 4.45Å; V39-F41 HydrophobicContact CG1-CD2 3.98Å; V39-F41 HydrophobicContact CG1-CE2 4.02Å; V39-F41 PolarHBondContact O-N 2.99Å; V39-F41 VanDerWaalsContact O-N 3.13Å; F41-D43 PolarHBondContact O-N 3.49Å; F41-L44 HydrophobicContact CB-CB 4.25Å; F41-L44 HydrophobicContact CB-CD1 3.48Å; F41-L44 VanDerWaalsContact CB-CD1 3.48Å; F41-L44 HydrophobicContact CB-CG 3.83Å; F41-L44 HydrophobicContact CD1-CD1 3.68Å; F41-L44 HydrophobicContact CD1-CG 3.7Å; F41-L44 HydrophobicContact CD2-CD1 3.43Å; F41-L44 VanDerWaalsContact CD2-CD1 3.43Å; F41-L44 HydrophobicContact CD2-CG 4.36Å; F41-L44 HydrophobicContact CE1-CD1 4.17Å; F41-L44 HydrophobicContact CE1-CG 4.25Å; F41-L44 HydrophobicContact CE2-CD1 3.94Å; F41-L44 HydrophobicContact CG-CD1 3.25Å; F41-L44 HydrophobicContact CG-CG 3.74Å; F41-L44 HydrophobicContact CZ-CD1 4.26Å; F41-L84 HydrophobicContact CE1-CD2 4.42Å; F41-L84 HydrophobicContact CZ-CD2 4.28Å; F41-Q88 VanDerWaalsContact CE1-NE2 3.28Å; F41-Q88 HydrophobicContact CE2-CG 3.86Å; F41-Q88 VanDerWaalsContact CE2-NE2 3.29Å; F41-Q88 HydrophobicContact CZ-CB 4.19Å; F41-Q88 HydrophobicContact CZ-CG 3.65Å; F41-F92 AromaticContact CE2-CE2 3.55Å; F41-F92 HydrophobicContact CE2-CE2 3.55Å; F41-F92 AromaticContact CE2-CZ 3.75Å; F41-F92 HydrophobicContact CE2-CZ 3.75Å; F41-F92 HydrophobicContact CZ-CD2 4.38Å; F41-F92 AromaticContact CZ-CE2 3.53Å; F41-F92 HydrophobicContact CZ-CE2 3.53Å; F41-F92 HydrophobicContact CZ-CZ 4.19Å
42	V	39.1	Very low	45.9	Very low	151 Å²	151	86.4 Å²	86.4	92%	0.915	45%	0.452	S	S	*	.	S	Bend	trans	-67.1	124.1	162	-179.5	0	0	0	0	106.6	L44	V42-L44 PolarHBondContact O-N 2.97Å; V42-L44 VanDerWaalsContact O-N 3.13Å
43	D	47.1	Very low	45.9	Very low	91 Å²	91	84.3 Å²	84.3	49%	0.487	45%	0.451	S	S	.	.			trans	13	68.6	-174.9	-117.2	-34	0	0	0	120	F41 N45 E46	F41-D43 PolarHBondContact O-N 3.49Å; D43-N45 PolarHBondContact O-N 3.41Å; D43-N45 PolarHBondContact OD1-ND2 2.83Å; D43-E46 PolarHBondContact O-N 3.28Å
44	L	46.1	Very low	45.8	Very low	19 Å²	19	76 Å²	76	10%	0.099	42%	0.42	C	S	.	.	H	α-helix	trans	-53.2	-20.6	165.5	-108.4	163.6	0	0	0	113	L31 F41 V42 L48	L31-L44 HydrophobicContact CD2-CD2 4.04Å; F41-L44 HydrophobicContact CB-CB 4.25Å; F41-L44 HydrophobicContact CB-CD1 3.48Å; F41-L44 VanDerWaalsContact CB-CD1 3.48Å; F41-L44 HydrophobicContact CB-CG 3.83Å; F41-L44 HydrophobicContact CD1-CD1 3.68Å; F41-L44 HydrophobicContact CD1-CG 3.7Å; F41-L44 HydrophobicContact CD2-CD1 3.43Å; F41-L44 VanDerWaalsContact CD2-CD1 3.43Å; F41-L44 HydrophobicContact CD2-CG 4.36Å; F41-L44 HydrophobicContact CE1-CD1 4.17Å; F41-L44 HydrophobicContact CE1-CG 4.25Å; F41-L44 HydrophobicContact CE2-CD1 3.94Å; F41-L44 HydrophobicContact CG-CD1 3.25Å; F41-L44 HydrophobicContact CG-CG 3.74Å; F41-L44 HydrophobicContact CZ-CD1 4.26Å; V42-L44 PolarHBondContact O-N 2.97Å; V42-L44 VanDerWaalsContact O-N 3.13Å; L44-L48 HydrophobicContact CB-CD1 4.39Å; L44-L48 HydrophobicContact CD2-CD1 3.94Å; L44-L48 HydrophobicContact CD2-CG 4.35Å; L44-L48 WeakPolarHBondContact O-CB 3.47Å; L44-L48 VanDerWaalsContact O-CD1 3.3Å; L44-L48 WeakPolarHBondContact O-CD1 3.28Å; L44-L48 WeakPolarHBondContact O-CG 3.03Å; L44-L48 PolarHBondContact O-N 3.31Å
45	N	42.6	Very low	46.2	Very low	71 Å²	71	75.9 Å²	75.9	38%	0.38	42%	0.419	S	S	.	.	H	α-helix	trans	-75.6	-38	-174.3	-62.8	-42.4	0	0	0	113.7	R35 D43 G49	R35-N45 PolarHBondContact NH1-OD1 3.12Å; D43-N45 PolarHBondContact O-N 3.41Å; D43-N45 PolarHBondContact OD1-ND2 2.83Å; N45-G49 PolarHBondContact O-N 3.24Å
46	E	45.8	Very low	46.6	Very low	130 Å²	130	75.3 Å²	75.3	61%	0.607	42%	0.421	S	S	*	.	H	α-helix	trans	-67.7	-49.6	175.1	-78.7	-171.2	148.3	0	0	110.2	D43 L48 G49 H50	D43-E46 PolarHBondContact O-N 3.28Å; E46-L48 VanDerWaalsContact C-N 3.35Å; E46-L48 PolarHBondContact O-N 2.95Å; E46-G49 WeakPolarHBondContact O-CA 3.13Å; E46-G49 PolarHBondContact O-N 3.43Å; E46-H50 PolarHBondContact O-CD2 2.94Å; E46-H50 PolarHBondContact O-N 2.89Å
47	E	47.4	Very low	46.6	Very low	85 Å²	85	75.1 Å²	75.1	40%	0.397	41%	0.409	S	S	.	.	H	α-helix	trans	-64	-37.8	179	-67	-156.2	173.7	0	0	112.4	G49 L51	E47-G49 VanDerWaalsContact C-N 3.34Å; E47-L51 WeakPolarHBondContact O-CB 3.32Å; E47-L51 PolarHBondContact O-N 3Å
48	L	48.9	Very low	46.6	Very low	12 Å²	12	71.5 Å²	71.5	6%	0.063	38%	0.384	C	S	.	.	H	α-helix	trans	-65.8	-34.8	171.1	-89.6	158.9	0	0	0	112.7	L31 L44 E46 K52	L31-L48 HydrophobicContact CB-CD1 4.17Å; L31-L48 HydrophobicContact CB-CD2 3.77Å; L31-L48 HydrophobicContact CB-CG 4.32Å; L31-L48 HydrophobicContact CD1-CD2 3.91Å; L31-L48 HydrophobicContact CD1-CG 4.42Å; L31-L48 HydrophobicContact CG-CD2 4.5Å; L44-L48 HydrophobicContact CB-CD1 4.39Å; L44-L48 HydrophobicContact CD2-CD1 3.94Å; L44-L48 HydrophobicContact CD2-CG 4.35Å; L44-L48 WeakPolarHBondContact O-CB 3.47Å; L44-L48 VanDerWaalsContact O-CD1 3.3Å; L44-L48 WeakPolarHBondContact O-CD1 3.28Å; L44-L48 WeakPolarHBondContact O-CG 3.03Å; L44-L48 PolarHBondContact O-N 3.31Å; E46-L48 VanDerWaalsContact C-N 3.35Å; E46-L48 PolarHBondContact O-N 2.95Å; L48-K52 WeakPolarHBondContact O-CB 3.29Å; L48-K52 WeakPolarHBondContact O-CD 3.48Å; L48-K52 WeakPolarHBondContact O-CG 3.35Å; L48-K52 PolarHBondContact O-N 2.74Å
49	G	49.9	Very low	47	Very low	27 Å²	27	73.9 Å²	73.9	28%	0.278	38%	0.376	S	S	.	.	H	α-helix	trans	-66.7	-46.6	176.6	0	0	0	0	0	111.6	N45 E46 E47 K52 N53	N45-G49 PolarHBondContact O-N 3.24Å; E46-G49 WeakPolarHBondContact O-CA 3.13Å; E46-G49 PolarHBondContact O-N 3.43Å; E47-G49 VanDerWaalsContact C-N 3.34Å; G49-K52 PolarHBondContact O-N 3.41Å; G49-N53 WeakPolarHBondContact O-CB 3.41Å; G49-N53 PolarHBondContact O-N 2.89Å; G49-N53 PolarHBondContact O-ND2 2.96Å
50	H	50.5	Low	46.8	Very low	117 Å²	117	74.7 Å²	74.7	54%	0.542	40%	0.396	S	S	.	.	H	α-helix	trans	-61.7	-48.2	175.5	-71.8	-60.2	0	0	0	111.5	E46 K52 N53 L54	E46-H50 PolarHBondContact O-CD2 2.94Å; E46-H50 PolarHBondContact O-N 2.89Å; H50-K52 PolarHBondContact O-N 3.29Å; H50-N53 PolarHBondContact O-N 2.89Å; H50-L54 VanDerWaalsContact O-CB 3.24Å; H50-L54 WeakPolarHBondContact O-CB 3.28Å; H50-L54 PolarHBondContact O-N 3.49Å
51	L	51.3	Low	46.7	Very low	12 Å²	12	69.9 Å²	69.9	6%	0.063	37%	0.366	C	S	.	.	H	α-helix	trans	-64.3	-41.5	178.9	-163.6	81.9	0	0	0	112.1	L27 E47 L54 V55 L77	L27-L51 HydrophobicContact CD2-CD2 3.25Å; E47-L51 WeakPolarHBondContact O-CB 3.32Å; E47-L51 PolarHBondContact O-N 3Å; L51-L54 PolarHBondContact O-N 3.43Å; L51-V55 HydrophobicContact CG-CG2 4.37Å; L51-V55 VanDerWaalsContact O-CB 3.32Å; L51-V55 WeakPolarHBondContact O-CB 3.45Å; L51-V55 WeakPolarHBondContact O-CG2 3.38Å; L51-V55 PolarHBondContact O-N 3.03Å; L51-L77 HydrophobicContact CD1-CD2 3.77Å; L51-L77 HydrophobicContact CD1-CG 4.17Å
52	K	51.6	Low	46.6	Very low	63 Å²	63	70 Å²	70	27%	0.274	37%	0.369	S	S	.	.	H	α-helix	trans	-62	-44.3	175.2	-83.4	171.9	-178.8	166.9	0	112.6	I28 R32 L48 G49 H50 L54 K56	I28-K52 HydrophobicContact CD1-CG 3.77Å; I28-K52 HydrophobicContact CG1-CG 4.07Å; I28-K52 HydrophobicContact CG2-CD 4.48Å; I28-K52 HydrophobicContact CG2-CG 4.34Å; R32-K52 VanDerWaalsContact NH2-NZ 3.18Å; L48-K52 WeakPolarHBondContact O-CB 3.29Å; L48-K52 WeakPolarHBondContact O-CD 3.48Å; L48-K52 WeakPolarHBondContact O-CG 3.35Å; L48-K52 PolarHBondContact O-N 2.74Å; G49-K52 PolarHBondContact O-N 3.41Å; H50-K52 PolarHBondContact O-N 3.29Å; K52-L54 VanDerWaalsContact C-N 3.34Å; K52-K56 VanDerWaalsContact O-CB 3.24Å; K52-K56 WeakPolarHBondContact O-CB 3.41Å; K52-K56 PolarHBondContact O-N 3.42Å
53	N	53.4	Low	46.5	Very low	88 Å²	88	67.4 Å²	67.4	47%	0.471	36%	0.358	S	S	.	.	H	α-helix	trans	-66.8	-39.1	179.3	-77.9	-23.3	0	0	0	111.4	G49 H50 K56 R57	G49-N53 WeakPolarHBondContact O-CB 3.41Å; G49-N53 PolarHBondContact O-N 2.89Å; G49-N53 PolarHBondContact O-ND2 2.96Å; H50-N53 PolarHBondContact O-N 2.89Å; N53-K56 PolarHBondContact O-N 3.43Å; N53-R57 VanDerWaalsContact O-CG 3.27Å; N53-R57 WeakPolarHBondContact O-CG 3.31Å; N53-R57 PolarHBondContact O-N 3.35Å
54	L	47.8	Very low	46.5	Very low	5 Å²	5	68 Å²	68	3%	0.026	37%	0.365	C	S	.	.	H	α-helix	trans	-68.4	-46	178.3	-163.6	69.3	0	0	0	111.6	H50 L51 K52 K56 R57 C58 E72 L73 N76	H50-L54 VanDerWaalsContact O-CB 3.24Å; H50-L54 WeakPolarHBondContact O-CB 3.28Å; H50-L54 PolarHBondContact O-N 3.49Å; L51-L54 PolarHBondContact O-N 3.43Å; K52-L54 VanDerWaalsContact C-N 3.34Å; L54-K56 VanDerWaalsContact C-N 3.32Å; L54-K56 PolarHBondContact O-N 3.25Å; L54-R57 PolarHBondContact O-N 3.46Å; L54-C58 WeakPolarHBondContact O-CB 3.43Å; L54-C58 PolarHBondContact O-N 3.39Å; L54-C58 PolarHBondContact O-SG 3.45Å; L54-E72 HydrophobicContact CD1-CB 4.43Å; L54-E72 HydrophobicContact CD1-CG 3.94Å; L54-L73 HydrophobicContact CD2-CB 4.06Å; L54-L73 HydrophobicContact CD2-CD1 3.71Å; L54-L73 HydrophobicContact CG-CB 4.42Å; L54-L73 HydrophobicContact CG-CD1 4.12Å; L54-N76 HydrophobicContact CD2-CB 3.99Å; L54-N76 WeakPolarHBondContact CD2-ND2 3.28Å
55	V	51	Low	46.6	Very low	13 Å²	13	68.5 Å²	68.5	8%	0.079	37%	0.369	C	S	.	.	H	α-helix	trans	-60.4	-41.6	174.2	169.4	0	0	0	0	111.2	A24 L51 R57 C58 Q59	A24-V55 HydrophobicContact CB-CB 4.24Å; A24-V55 HydrophobicContact CB-CG1 3.52Å; A24-V55 HydrophobicContact CB-CG2 3.61Å; L51-V55 HydrophobicContact CG-CG2 4.37Å; L51-V55 VanDerWaalsContact O-CB 3.32Å; L51-V55 WeakPolarHBondContact O-CB 3.45Å; L51-V55 WeakPolarHBondContact O-CG2 3.38Å; L51-V55 PolarHBondContact O-N 3.03Å; V55-R57 VanDerWaalsContact C-N 3.35Å; V55-R57 PolarHBondContact O-N 2.96Å; V55-C58 PolarHBondContact O-N 3.07Å; V55-Q59 HydrophobicContact CG1-CG 4.49Å; V55-Q59 WeakPolarHBondContact O-CB 3.38Å; V55-Q59 WeakPolarHBondContact O-CG 3.29Å; V55-Q59 PolarHBondContact O-N 2.99Å
56	K	51.3	Low	47.1	Very low	158 Å²	158	71.7 Å²	71.7	69%	0.687	38%	0.381	S	S	*	.	H	α-helix	trans	-64.8	-37.2	176.7	-167.4	178.5	-178.3	-175.8	0	112.1	K52 N53 L54	K52-K56 VanDerWaalsContact O-CB 3.24Å; K52-K56 WeakPolarHBondContact O-CB 3.41Å; K52-K56 PolarHBondContact O-N 3.42Å; N53-K56 PolarHBondContact O-N 3.43Å; L54-K56 VanDerWaalsContact C-N 3.32Å; L54-K56 PolarHBondContact O-N 3.25Å
57	R	45.6	Very low	47.5	Very low	151 Å²	151	68.4 Å²	68.4	57%	0.57	37%	0.366	S	S	*	.	H	α-helix	trans	-70.1	-40.4	174.1	-72.8	175.3	-165.6	175.7	3.7	112	N53 L54 V55 G60	N53-R57 VanDerWaalsContact O-CG 3.27Å; N53-R57 WeakPolarHBondContact O-CG 3.31Å; N53-R57 PolarHBondContact O-N 3.35Å; L54-R57 PolarHBondContact O-N 3.46Å; V55-R57 VanDerWaalsContact C-N 3.35Å; V55-R57 PolarHBondContact O-N 2.96Å; R57-G60 PolarHBondContact O-N 3.18Å
58	C	46.7	Very low	47.7	Very low	4 Å²	4	67.5 Å²	67.5	3%	0.027	37%	0.369	C	S	.	.	H	α-helix	trans	-70.8	-35.8	177.3	-64.9	0	0	0	0	112.6	L54 V55 G60 A61 L62	L54-C58 WeakPolarHBondContact O-CB 3.43Å; L54-C58 PolarHBondContact O-N 3.39Å; L54-C58 PolarHBondContact O-SG 3.45Å; V55-C58 PolarHBondContact O-N 3.07Å; C58-G60 PolarHBondContact O-N 3.43Å; C58-A61 PolarHBondContact O-N 3.41Å; C58-L62 WeakPolarHBondContact O-CD1 3.38Å; C58-L62 VanDerWaalsContact O-CG 3.3Å; C58-L62 WeakPolarHBondContact O-CG 3.46Å
59	Q	44.9	Very low	47.8	Very low	121 Å²	121	69.1 Å²	69.1	57%	0.565	38%	0.377	S	S	*	.	H	α-helix	trans	-59.9	-31.8	175.1	-88.9	180	-28.8	0	0	113.1	V55	V55-Q59 HydrophobicContact CG1-CG 4.49Å; V55-Q59 WeakPolarHBondContact O-CB 3.38Å; V55-Q59 WeakPolarHBondContact O-CG 3.29Å; V55-Q59 PolarHBondContact O-N 2.99Å
60	G	38.1	Very low	48.1	Very low	72 Å²	72	68.3 Å²	68.3	74%	0.742	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-5.3	-177	0	0	0	0	0	115.8	R57 C58	R57-G60 PolarHBondContact O-N 3.18Å; C58-G60 PolarHBondContact O-N 3.43Å
61	A	38.8	Very low	48.3	Very low	21 Å²	21	64.5 Å²	64.5	17%	0.174	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-149.8	15.9	-161.4	0	0	0	0	0	115.9	C58 S63 T64 V65	C58-A61 PolarHBondContact O-N 3.41Å; A61-S63 PolarHBondContact O-N 3.02Å; A61-T64 WeakPolarHBondContact CA-OG1 3.3Å; A61-T64 WeakPolarHBondContact CB-OG1 3.42Å; A61-T64 CarbonylContact O-C 3.6Å; A61-T64 VanDerWaalsContact O-C 3.31Å; A61-T64 WeakPolarHBondContact O-CA 3.38Å; A61-T64 PolarHBondContact O-N 3.45Å; A61-T64 PolarHBondContact O-OG1 3.06Å; A61-T64 VanDerWaalsContact O-OG1 3.1Å; A61-V65 HydrophobicContact CB-CG2 3.7Å; A61-V65 WeakPolarHBondContact O-CG2 3.37Å; A61-V65 PolarHBondContact O-N 3.3Å
62	L	40.4	Very low	48.4	Very low	58 Å²	58	67.7 Å²	67.7	30%	0.304	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	7.4	-177.8	-81.2	156.8	0	0	0	116	R17 C58 V65	R17-L62 HydrophobicContact CG-CB 3.88Å; R17-L62 HydrophobicContact CG-CD1 4.31Å; R17-L62 PolarHBondContact NE-O 3.13Å; R17-L62 PolarHBondContact NH2-O 2.82Å; R17-L62 VanDerWaalsContact NH2-O 3.1Å; C58-L62 WeakPolarHBondContact O-CD1 3.38Å; C58-L62 VanDerWaalsContact O-CG 3.3Å; C58-L62 WeakPolarHBondContact O-CG 3.46Å; L62-V65 HydrophobicContact CD2-CG2 4.32Å; L62-V65 HydrophobicContact CG-CG2 4.27Å
63	S	37.6	Very low	48.7	Very low	97 Å²	97	65.2 Å²	65.2	68%	0.678	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-4.3	161.6	51.5	0	0	0	0	113.6	A61	A61-S63 PolarHBondContact O-N 3.02Å
64	T	46.5	Very low	49.1	Very low	105 Å²	105	61.7 Å²	61.7	64%	0.644	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.6	2.9	-175.4	52.4	0	0	0	0	113.6	A61 Q66	A61-T64 WeakPolarHBondContact CA-OG1 3.3Å; A61-T64 WeakPolarHBondContact CB-OG1 3.42Å; A61-T64 CarbonylContact O-C 3.6Å; A61-T64 VanDerWaalsContact O-C 3.31Å; A61-T64 WeakPolarHBondContact O-CA 3.38Å; A61-T64 PolarHBondContact O-N 3.45Å; A61-T64 PolarHBondContact O-OG1 3.06Å; A61-T64 VanDerWaalsContact O-OG1 3.1Å; T64-Q66 PolarHBondContact O-N 3.04Å
65	V	49.6	Very low	49.4	Very low	28 Å²	28	66 Å²	66	17%	0.17	36%	0.36	C	S	.	.			trans	-69.6	107.6	-176.3	173.7	0	0	0	0	108.6	A61 L62 L69 V70	A61-V65 HydrophobicContact CB-CG2 3.7Å; A61-V65 WeakPolarHBondContact O-CG2 3.37Å; A61-V65 PolarHBondContact O-N 3.3Å; L62-V65 HydrophobicContact CD2-CG2 4.32Å; L62-V65 HydrophobicContact CG-CG2 4.27Å; V65-L69 HydrophobicContact CG1-CB 3.5Å; V65-L69 VanDerWaalsContact CG1-CB 3.5Å; V65-L69 HydrophobicContact CG1-CD1 4.28Å; V65-V70 HydrophobicContact CB-CG2 4.49Å; V65-V70 HydrophobicContact CG1-CG2 3.51Å
66	Q	52	Low	49.5	Very low	139 Å²	139	67.8 Å²	67.8	65%	0.65	37%	0.37	S	S	*	.			trans	-51.3	140.6	166	-72.7	178.3	-16.8	0	0	109.8	T64 S68 L69	T64-Q66 PolarHBondContact O-N 3.04Å; Q66-S68 VanDerWaalsContact CB-OG 3.29Å; Q66-S68 WeakPolarHBondContact CB-OG 3.42Å; Q66-S68 PolarHBondContact O-N 3.1Å; Q66-S68 PolarHBondContact OE1-OG 2.74Å; Q66-L69 PolarHBondContact O-N 2.9Å
67	E	53.8	Low	49.9	Very low	61 Å²	61	60.5 Å²	60.5	29%	0.285	34%	0.338	S	S	.	.	H	α-helix	trans	-46.5	-32.4	175.8	-78.9	169.1	-136.6	0	0	113.1	L69 V70 S71 L110 S113 S116	E67-L69 VanDerWaalsContact C-N 3.28Å; E67-L69 PolarHBondContact O-N 2.83Å; E67-V70 PolarHBondContact O-N 3.3Å; E67-S71 VanDerWaalsContact O-CB 3.28Å; E67-S71 WeakPolarHBondContact O-CB 3.47Å; E67-S71 PolarHBondContact O-N 2.73Å; E67-L110 HydrophobicContact CB-CD2 4.31Å; E67-L110 HydrophobicContact CG-CD2 4.47Å; E67-S113 WeakPolarHBondContact OE1-CB 3.47Å; E67-S113 PolarHBondContact OE1-OG 2.94Å; E67-S113 PolarHBondContact OE2-OG 3.32Å; E67-S116 PolarHBondContact OE2-OG 3.39Å
68	S	51.7	Low	50.5	Low	65 Å²	65	57.7 Å²	57.7	46%	0.455	33%	0.33	S	S	.	.	H	α-helix	trans	-52.6	-41.7	175.3	56.3	0	0	0	0	113.4	Q66 E72	Q66-S68 VanDerWaalsContact CB-OG 3.29Å; Q66-S68 WeakPolarHBondContact CB-OG 3.42Å; Q66-S68 PolarHBondContact O-N 3.1Å; Q66-S68 PolarHBondContact OE1-OG 2.74Å; S68-E72 WeakPolarHBondContact O-CB 3.47Å; S68-E72 PolarHBondContact O-N 3.17Å
69	L	51.4	Low	50.8	Low	46 Å²	46	60.9 Å²	60.9	24%	0.241	35%	0.347	C	S	.	.	H	α-helix	trans	-79.1	-32.6	-178.6	-77.9	164.9	0	0	0	112.3	V65 Q66 E67 S71 L73	V65-L69 HydrophobicContact CG1-CB 3.5Å; V65-L69 VanDerWaalsContact CG1-CB 3.5Å; V65-L69 HydrophobicContact CG1-CD1 4.28Å; Q66-L69 PolarHBondContact O-N 2.9Å; E67-L69 VanDerWaalsContact C-N 3.28Å; E67-L69 PolarHBondContact O-N 2.83Å; L69-S71 VanDerWaalsContact C-N 3.34Å; L69-L73 WeakPolarHBondContact O-CB 3.3Å; L69-L73 PolarHBondContact O-N 3.43Å
70	V	55.9	Low	51.4	Low	11 Å²	11	55.9 Å²	55.9	7%	0.067	32%	0.323	C	S	.	.	H	α-helix	trans	-68.6	-39	171.2	-175.1	0	0	0	0	110.2	V65 E67 L73 Y74 C106 V109 L110	V65-V70 HydrophobicContact CB-CG2 4.49Å; V65-V70 HydrophobicContact CG1-CG2 3.51Å; E67-V70 PolarHBondContact O-N 3.3Å; V70-L73 PolarHBondContact O-N 2.84Å; V70-Y74 WeakPolarHBondContact O-CB 3.39Å; V70-Y74 PolarHBondContact O-N 3.19Å; V70-C106 HydrophobicContact CG1-CB 4Å; V70-V109 HydrophobicContact CG1-CB 4.33Å; V70-V109 HydrophobicContact CG1-CG1 4.24Å; V70-V109 HydrophobicContact CG2-CG1 4.23Å; V70-L110 HydrophobicContact CB-CD2 3.92Å; V70-L110 HydrophobicContact CB-CG 4.27Å; V70-L110 HydrophobicContact CG1-CD1 4.15Å; V70-L110 HydrophobicContact CG1-CD2 3.99Å; V70-L110 HydrophobicContact CG1-CG 3.76Å
71	S	55.7	Low	52.6	Low	36 Å²	36	54.2 Å²	54.2	25%	0.252	30%	0.297	S	S	.	.	H	α-helix	trans	-65.1	-41.9	174.7	-169.2	0	0	0	0	111.6	E67 L69 Y74 L75	E67-S71 VanDerWaalsContact O-CB 3.28Å; E67-S71 WeakPolarHBondContact O-CB 3.47Å; E67-S71 PolarHBondContact O-N 2.73Å; L69-S71 VanDerWaalsContact C-N 3.34Å; S71-Y74 WeakPolarHBondContact O-CB 3.41Å; S71-Y74 PolarHBondContact O-N 3.05Å; S71-L75 WeakPolarHBondContact O-CB 3.34Å; S71-L75 PolarHBondContact O-N 3.08Å
72	E	52	Low	53.3	Low	79 Å²	79	57.5 Å²	57.5	37%	0.369	31%	0.309	S	S	.	.	H	α-helix	trans	-64	-40.5	174.5	-171.1	-179	175.1	0	0	112.1	L54 S68 L75 N76	L54-E72 HydrophobicContact CD1-CB 4.43Å; L54-E72 HydrophobicContact CD1-CG 3.94Å; S68-E72 WeakPolarHBondContact O-CB 3.47Å; S68-E72 PolarHBondContact O-N 3.17Å; E72-L75 PolarHBondContact O-N 3.24Å; E72-N76 WeakPolarHBondContact CG-ND2 3.41Å; E72-N76 WeakPolarHBondContact O-CB 2.89Å; E72-N76 PolarHBondContact O-N 3.47Å; E72-N76 PolarHBondContact O-ND2 2.98Å
73	L	57.8	Low	53.9	Low	12 Å²	12	59.4 Å²	59.4	6%	0.063	32%	0.319	C	S	.	.	H	α-helix	trans	-63	-43.8	172.8	-179.1	63.3	0	0	0	112.3	L54 L69 V70 L77 V102	L54-L73 HydrophobicContact CD2-CB 4.06Å; L54-L73 HydrophobicContact CD2-CD1 3.71Å; L54-L73 HydrophobicContact CG-CB 4.42Å; L54-L73 HydrophobicContact CG-CD1 4.12Å; L69-L73 WeakPolarHBondContact O-CB 3.3Å; L69-L73 PolarHBondContact O-N 3.43Å; V70-L73 PolarHBondContact O-N 2.84Å; L73-L77 HydrophobicContact CD1-CD1 3.85Å; L73-L77 HydrophobicContact CD1-CG 4.26Å; L73-L77 HydrophobicContact CG-CD1 3.99Å; L73-L77 WeakPolarHBondContact O-CB 3.45Å; L73-L77 WeakPolarHBondContact O-CG 2.89Å; L73-L77 PolarHBondContact O-N 3.49Å; L73-V102 HydrophobicContact CD2-CG1 4.32Å
74	Y	63.1	Low	54.6	Low	14 Å²	14	55.8 Å²	55.8	6%	0.055	29%	0.292	C	S	.	.	H	α-helix	trans	-60.5	-50.2	175.1	179.5	-84.2	0	0	0	111	V70 S71 N76 L77 F78 L103 C106 F119 H123	V70-Y74 WeakPolarHBondContact O-CB 3.39Å; V70-Y74 PolarHBondContact O-N 3.19Å; S71-Y74 WeakPolarHBondContact O-CB 3.41Å; S71-Y74 PolarHBondContact O-N 3.05Å; Y74-N76 PolarHBondContact O-N 2.95Å; Y74-L77 PolarHBondContact O-N 2.96Å; Y74-F78 HydrophobicContact CE1-CB 4.43Å; Y74-F78 VanDerWaalsContact O-CB 3.23Å; Y74-F78 WeakPolarHBondContact O-CB 3.41Å; Y74-F78 PolarHBondContact O-N 3.12Å; Y74-L103 HydrophobicContact CD1-CD2 4.43Å; Y74-L103 HydrophobicContact CD2-CD2 3.41Å; Y74-L103 VanDerWaalsContact CD2-CD2 3.41Å; Y74-L103 HydrophobicContact CE2-CB 4.49Å; Y74-L103 HydrophobicContact CE2-CD2 3.62Å; Y74-L103 HydrophobicContact CG-CD2 3.84Å; Y74-L103 VanDerWaalsContact O-CD2 3.26Å; Y74-L103 WeakPolarHBondContact O-CD2 3.25Å; Y74-C106 HydrophobicContact CD2-CB 4Å; Y74-F119 HydrophobicContact CD1-CE1 4.18Å; Y74-F119 AromaticContact CD1-CZ 3.88Å; Y74-F119 HydrophobicContact CD1-CZ 3.88Å; Y74-F119 AromaticContact CE1-CE1 3.88Å; Y74-F119 HydrophobicContact CE1-CE1 3.88Å; Y74-F119 AromaticContact CE1-CZ 3.96Å; Y74-F119 HydrophobicContact CE1-CZ 3.96Å; Y74-H123 PolarHBondContact OH-O 3.48Å
75	L	53.3	Low	54.8	Low	94 Å²	94	54 Å²	54	49%	0.492	28%	0.281	S	S	.	.	H	α-helix	trans	-60.8	-45.8	-177.7	-162.3	92.5	0	0	0	111.7	S71 E72 F78 L79	S71-L75 WeakPolarHBondContact O-CB 3.34Å; S71-L75 PolarHBondContact O-N 3.08Å; E72-L75 PolarHBondContact O-N 3.24Å; L75-F78 PolarHBondContact O-N 2.9Å; L75-L79 HydrophobicContact CD2-CD1 4.25Å; L75-L79 HydrophobicContact CG-CD1 4.29Å; L75-L79 WeakPolarHBondContact O-CB 3.02Å; L75-L79 VanDerWaalsContact O-CG 3.31Å; L75-L79 WeakPolarHBondContact O-CG 3.42Å; L75-L79 PolarHBondContact O-N 3.28Å
76	N	54	Low	54.9	Low	51 Å²	51	56.2 Å²	56.2	27%	0.273	30%	0.295	S	S	.	.	H	α-helix	trans	-68.2	-40.4	-178.8	-75.9	-45.7	0	0	0	112.5	L54 E72 Y74 F78 F80	L54-N76 HydrophobicContact CD2-CB 3.99Å; L54-N76 WeakPolarHBondContact CD2-ND2 3.28Å; E72-N76 WeakPolarHBondContact CG-ND2 3.41Å; E72-N76 WeakPolarHBondContact O-CB 2.89Å; E72-N76 PolarHBondContact O-N 3.47Å; E72-N76 PolarHBondContact O-ND2 2.98Å; Y74-N76 PolarHBondContact O-N 2.95Å; N76-F78 VanDerWaalsContact C-N 3.32Å; N76-F80 VanDerWaalsContact O-CB 3.3Å; N76-F80 WeakPolarHBondContact O-CB 3.16Å; N76-F80 PolarHBondContact O-N 3.4Å
77	L	59.7	Low	54.8	Low	5 Å²	5	56.9 Å²	56.9	3%	0.026	30%	0.296	C	S	.	.	H	α-helix	trans	-67.4	-35.4	174.3	-77.7	168.7	0	0	0	112.1	L27 L51 L73 Y74 L81 A99 V102 L103	L27-L77 HydrophobicContact CD2-CD2 4.46Å; L51-L77 HydrophobicContact CD1-CD2 3.77Å; L51-L77 HydrophobicContact CD1-CG 4.17Å; L73-L77 HydrophobicContact CD1-CD1 3.85Å; L73-L77 HydrophobicContact CD1-CG 4.26Å; L73-L77 HydrophobicContact CG-CD1 3.99Å; L73-L77 WeakPolarHBondContact O-CB 3.45Å; L73-L77 WeakPolarHBondContact O-CG 2.89Å; L73-L77 PolarHBondContact O-N 3.49Å; Y74-L77 PolarHBondContact O-N 2.96Å; L77-L81 WeakPolarHBondContact O-CG 3.29Å; L77-L81 PolarHBondContact O-N 3.46Å; L77-A99 HydrophobicContact CD2-CB 4.01Å; L77-V102 HydrophobicContact CD1-CB 3.83Å; L77-V102 HydrophobicContact CD1-CG1 3.42Å; L77-V102 VanDerWaalsContact CD1-CG1 3.42Å; L77-L103 HydrophobicContact CB-CD1 4.22Å; L77-L103 HydrophobicContact CB-CD2 3.8Å; L77-L103 HydrophobicContact CB-CG 3.83Å
78	F	58.3	Low	54.7	Low	93 Å²	93	55.1 Å²	55.1	41%	0.408	29%	0.288	S	S	.	.	H	α-helix	trans	-65.6	-49.3	176.3	-178.1	-94.7	0	0	0	111.2	Y74 L75 N76 F80 L81 Q82 L103	Y74-F78 HydrophobicContact CE1-CB 4.43Å; Y74-F78 VanDerWaalsContact O-CB 3.23Å; Y74-F78 WeakPolarHBondContact O-CB 3.41Å; Y74-F78 PolarHBondContact O-N 3.12Å; L75-F78 PolarHBondContact O-N 2.9Å; N76-F78 VanDerWaalsContact C-N 3.32Å; F78-F80 VanDerWaalsContact C-N 3.34Å; F78-F80 PolarHBondContact O-N 3.48Å; F78-L81 PolarHBondContact O-N 2.83Å; F78-Q82 WeakPolarHBondContact O-CB 3.03Å; F78-Q82 PolarHBondContact O-N 2.84Å; F78-L103 HydrophobicContact CB-CD2 4.25Å
79	L	51.7	Low	55	Low	70 Å²	70	53.7 Å²	53.7	37%	0.366	28%	0.28	S	S	.	.	H	α-helix	trans	-59.8	-44	176	-72.9	171.1	0	0	0	111.7	L75 L81 Q82 N83	L75-L79 HydrophobicContact CD2-CD1 4.25Å; L75-L79 HydrophobicContact CG-CD1 4.29Å; L75-L79 WeakPolarHBondContact O-CB 3.02Å; L75-L79 VanDerWaalsContact O-CG 3.31Å; L75-L79 WeakPolarHBondContact O-CG 3.42Å; L75-L79 PolarHBondContact O-N 3.28Å; L79-L81 PolarHBondContact O-N 3.28Å; L79-Q82 WeakPolarHBondContact O-CB 3.39Å; L79-Q82 PolarHBondContact O-N 3.49Å; L79-N83 PolarHBondContact O-N 3.22Å
80	F	58.6	Low	55.1	Low	16 Å²	16	60.9 Å²	60.9	7%	0.07	30%	0.304	C	S	.	.	H	α-helix	trans	-56.5	-49.7	174.9	169.6	-101.4	0	0	0	111.7	L31 N76 F78 Q82 N83 L84	L31-F80 HydrophobicContact CD1-CE2 4.2Å; L31-F80 HydrophobicContact CD1-CZ 4.02Å; L31-F80 HydrophobicContact CD2-CE2 4.17Å; L31-F80 HydrophobicContact CD2-CZ 3.9Å; N76-F80 VanDerWaalsContact O-CB 3.3Å; N76-F80 WeakPolarHBondContact O-CB 3.16Å; N76-F80 PolarHBondContact O-N 3.4Å; F78-F80 VanDerWaalsContact C-N 3.34Å; F78-F80 PolarHBondContact O-N 3.48Å; F80-Q82 VanDerWaalsContact C-N 3.31Å; F80-Q82 PolarHBondContact O-N 3.46Å; F80-N83 PolarHBondContact O-N 2.89Å; F80-L84 HydrophobicContact CE1-CD1 4.17Å; F80-L84 HydrophobicContact CZ-CD1 4.32Å; F80-L84 HydrophobicContact CZ-CD2 4.34Å
81	L	61.9	Low	54.8	Low	37 Å²	37	68.4 Å²	68.4	19%	0.194	33%	0.332	C	S	.	.	H	α-helix	trans	-65.9	-34	178	-73	-176.8	0	0	0	112.7	L77 F78 L79 N83 L84 V96 A99 L103	L77-L81 WeakPolarHBondContact O-CG 3.29Å; L77-L81 PolarHBondContact O-N 3.46Å; F78-L81 PolarHBondContact O-N 2.83Å; L79-L81 PolarHBondContact O-N 3.28Å; L81-N83 VanDerWaalsContact C-N 3.34Å; L81-L84 HydrophobicContact CD2-CD1 3.97Å; L81-L84 PolarHBondContact O-N 2.88Å; L81-V96 HydrophobicContact CD2-CB 4.32Å; L81-V96 HydrophobicContact CD2-CG1 4.06Å; L81-V96 HydrophobicContact CD2-CG2 4.14Å; L81-A99 HydrophobicContact CD1-CB 4.2Å; L81-A99 HydrophobicContact CD2-CB 3.93Å; L81-A99 HydrophobicContact CG-CB 4.15Å; L81-L103 HydrophobicContact CD1-CD1 3.41Å; L81-L103 VanDerWaalsContact CD1-CD1 3.41Å; L81-L103 HydrophobicContact CG-CD1 4.42Å
82	Q	54.9	Low	54.8	Low	91 Å²	91	67.3 Å²	67.3	43%	0.425	32%	0.323	S	S	.	.	H	α-helix	trans	-67.1	-35.5	178.1	-172.9	177.5	-4.2	0	0	112.2	F78 L79 F80 L84	F78-Q82 WeakPolarHBondContact O-CB 3.03Å; F78-Q82 PolarHBondContact O-N 2.84Å; L79-Q82 WeakPolarHBondContact O-CB 3.39Å; L79-Q82 PolarHBondContact O-N 3.49Å; F80-Q82 VanDerWaalsContact C-N 3.31Å; F80-Q82 PolarHBondContact O-N 3.46Å; Q82-L84 VanDerWaalsContact C-N 3.28Å; Q82-L84 PolarHBondContact O-N 2.91Å
83	N	52.1	Low	54.8	Low	98 Å²	98	68.4 Å²	68.4	52%	0.524	33%	0.326	S	S	.	.	H	α-helix	trans	-78	-9.6	-179.3	-72	-16.1	0	0	0	113.5	L79 F80 L81 T85	L79-N83 PolarHBondContact O-N 3.22Å; F80-N83 PolarHBondContact O-N 2.89Å; L81-N83 VanDerWaalsContact C-N 3.34Å; N83-T85 PolarHBondContact O-N 3.37Å
84	L	52.7	Low	54.4	Low	20 Å²	20	71 Å²	71	11%	0.105	34%	0.344	C	S	.	.			trans	-72.6	124.9	177.5	-67	175.1	0	0	0	112.1	F41 F80 L81 Q82 Q88 A89 F92 V96	F41-L84 HydrophobicContact CE1-CD2 4.42Å; F41-L84 HydrophobicContact CZ-CD2 4.28Å; F80-L84 HydrophobicContact CE1-CD1 4.17Å; F80-L84 HydrophobicContact CZ-CD1 4.32Å; F80-L84 HydrophobicContact CZ-CD2 4.34Å; L81-L84 HydrophobicContact CD2-CD1 3.97Å; L81-L84 PolarHBondContact O-N 2.88Å; Q82-L84 VanDerWaalsContact C-N 3.28Å; Q82-L84 PolarHBondContact O-N 2.91Å; L84-Q88 HydrophobicContact CD2-CB 4.14Å; L84-A89 HydrophobicContact CB-CB 4.5Å; L84-F92 HydrophobicContact CD2-CD2 4.27Å; L84-V96 HydrophobicContact CD1-CG2 3.55Å
85	T	50.4	Low	53.8	Low	67 Å²	67	70.4 Å²	70.4	41%	0.411	34%	0.341	S	S	.	.			trans	-67.8	158.4	167.2	66.4	0	0	0	0	111.1	N83 K87 Q88 A89	N83-T85 PolarHBondContact O-N 3.37Å; T85-K87 PolarHBondContact O-N 2.96Å; T85-K87 VanDerWaalsContact O-N 3.13Å; T85-Q88 VanDerWaalsContact CG2-OE1 3.3Å; T85-Q88 CarbonylContact O-C 3.52Å; T85-Q88 WeakPolarHBondContact O-CB 3.48Å; T85-Q88 PolarHBondContact O-N 2.93Å; T85-Q88 WeakPolarHBondContact OG1-CB 3.35Å; T85-Q88 WeakPolarHBondContact OG1-CG 3.26Å; T85-Q88 PolarHBondContact OG1-N 3.31Å; T85-Q88 PolarHBondContact OG1-OE1 3.39Å; T85-A89 PolarHBondContact O-N 2.88Å
86	T	53	Low	54	Low	76 Å²	76	67.2 Å²	67.2	47%	0.466	33%	0.326	S	S	.	.	H	α-helix	trans	-60.2	-28.5	179.6	-27.3	0	0	0	0	112.9	R90	T86-R90 WeakPolarHBondContact O-CG 3.16Å; T86-R90 PolarHBondContact O-N 2.74Å
87	K	49.8	Very low	53.9	Low	152 Å²	152	68.4 Å²	68.4	66%	0.661	34%	0.338	S	S	*	.	H	α-helix	trans	-72.6	-47	175.1	-168.9	176.9	179.6	-176	0	109.8	T85 R90 Y91	T85-K87 PolarHBondContact O-N 2.96Å; T85-K87 VanDerWaalsContact O-N 3.13Å; K87-R90 PolarHBondContact O-N 3.32Å; K87-Y91 HydrophobicContact CG-CD2 4.09Å; K87-Y91 HydrophobicContact CG-CE2 4.07Å; K87-Y91 WeakPolarHBondContact O-CD2 3.23Å; K87-Y91 PolarHBondContact O-N 3.04Å; K87-Y91 VanDerWaalsContact O-N 3.08Å
88	Q	50.9	Low	53.5	Low	25 Å²	25	72.9 Å²	72.9	12%	0.117	36%	0.355	C	S	.	.	H	α-helix	trans	-61.4	-46.8	176.3	-71.5	163.7	-31.9	0	0	111.6	F41 L84 T85 R90 Y91 F92	F41-Q88 VanDerWaalsContact CE1-NE2 3.28Å; F41-Q88 HydrophobicContact CE2-CG 3.86Å; F41-Q88 VanDerWaalsContact CE2-NE2 3.29Å; F41-Q88 HydrophobicContact CZ-CB 4.19Å; F41-Q88 HydrophobicContact CZ-CG 3.65Å; L84-Q88 HydrophobicContact CD2-CB 4.14Å; T85-Q88 VanDerWaalsContact CG2-OE1 3.3Å; T85-Q88 CarbonylContact O-C 3.52Å; T85-Q88 WeakPolarHBondContact O-CB 3.48Å; T85-Q88 PolarHBondContact O-N 2.93Å; T85-Q88 WeakPolarHBondContact OG1-CB 3.35Å; T85-Q88 WeakPolarHBondContact OG1-CG 3.26Å; T85-Q88 PolarHBondContact OG1-N 3.31Å; T85-Q88 PolarHBondContact OG1-OE1 3.39Å; Q88-R90 PolarHBondContact O-N 3.47Å; Q88-Y91 PolarHBondContact O-N 3.32Å; Q88-F92 VanDerWaalsContact C-CD2 3.44Å; Q88-F92 HydrophobicContact CB-CD2 3.8Å; Q88-F92 HydrophobicContact CB-CE2 3.52Å; Q88-F92 HydrophobicContact CG-CE2 3.81Å; Q88-F92 WeakPolarHBondContact O-CB 3.48Å; Q88-F92 WeakPolarHBondContact O-CD2 3.28Å; Q88-F92 VanDerWaalsContact O-CG 3.28Å; Q88-F92 WeakPolarHBondContact O-CG 3.5Å; Q88-F92 PolarHBondContact O-N 3.43Å
89	A	57.4	Low	53.5	Low	35 Å²	35	68.5 Å²	68.5	29%	0.289	34%	0.336	S	S	.	.	H	α-helix	trans	-60.2	-29.9	177.2	0	0	0	0	0	113.7	L84 T85 V96	L84-A89 HydrophobicContact CB-CB 4.5Å; T85-A89 PolarHBondContact O-N 2.88Å; A89-V96 HydrophobicContact CB-CG2 4.4Å
90	R	54.8	Low	53.8	Low	197 Å²	197	65.5 Å²	65.5	74%	0.743	32%	0.321	S	S	*	.	H	α-helix	trans	-76	-37.4	173.8	-74.1	180	-159.7	177.3	6	112.8	T86 K87 Q88	T86-R90 WeakPolarHBondContact O-CG 3.16Å; T86-R90 PolarHBondContact O-N 2.74Å; K87-R90 PolarHBondContact O-N 3.32Å; Q88-R90 PolarHBondContact O-N 3.47Å
91	Y	49.6	Very low	53.5	Low	168 Å²	168	66.5 Å²	66.5	66%	0.659	33%	0.333	S	S	*	.	H	α-helix	trans	-71.6	-32.5	175.4	-88.8	-79.5	0	0	0	112.1	K87 Q88	K87-Y91 HydrophobicContact CG-CD2 4.09Å; K87-Y91 HydrophobicContact CG-CE2 4.07Å; K87-Y91 WeakPolarHBondContact O-CD2 3.23Å; K87-Y91 PolarHBondContact O-N 3.04Å; K87-Y91 VanDerWaalsContact O-N 3.08Å; Q88-Y91 PolarHBondContact O-N 3.32Å
92	F	54.8	Low	53.2	Low	13 Å²	13	65.3 Å²	65.3	6%	0.057	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	36.4	-175.9	-48.4	-46.3	0	0	0	112.5	C34 F41 L84 Q88 T95 V96	C34-F92 HydrophobicContact CB-CD1 4.44Å; C34-F92 HydrophobicContact CB-CE1 3.67Å; C34-F92 HydrophobicContact CB-CZ 4.09Å; C34-F92 WeakPolarHBondContact SG-CD1 3.32Å; C34-F92 WeakPolarHBondContact SG-CE1 3.35Å; F41-F92 AromaticContact CE2-CE2 3.55Å; F41-F92 HydrophobicContact CE2-CE2 3.55Å; F41-F92 AromaticContact CE2-CZ 3.75Å; F41-F92 HydrophobicContact CE2-CZ 3.75Å; F41-F92 HydrophobicContact CZ-CD2 4.38Å; F41-F92 AromaticContact CZ-CE2 3.53Å; F41-F92 HydrophobicContact CZ-CE2 3.53Å; F41-F92 HydrophobicContact CZ-CZ 4.19Å; L84-F92 HydrophobicContact CD2-CD2 4.27Å; Q88-F92 VanDerWaalsContact C-CD2 3.44Å; Q88-F92 HydrophobicContact CB-CD2 3.8Å; Q88-F92 HydrophobicContact CB-CE2 3.52Å; Q88-F92 HydrophobicContact CG-CE2 3.81Å; Q88-F92 WeakPolarHBondContact O-CB 3.48Å; Q88-F92 WeakPolarHBondContact O-CD2 3.28Å; Q88-F92 VanDerWaalsContact O-CG 3.28Å; Q88-F92 WeakPolarHBondContact O-CG 3.5Å; Q88-F92 PolarHBondContact O-N 3.43Å; F92-T95 WeakPolarHBondContact O-CB 3.42Å; F92-T95 PolarHBondContact O-N 3.1Å; F92-V96 HydrophobicContact CB-CG2 4.48Å; F92-V96 WeakPolarHBondContact O-CG2 3.49Å; F92-V96 PolarHBondContact O-N 3.13Å
93	K	52.6	Low	53.5	Low	102 Å²	102	61.4 Å²	61.4	44%	0.443	31%	0.309	S	S	.	.	H	α-helix	trans	-55.2	-43.7	-174.3	-170.7	-178.3	179.4	-172.9	0	114	S97	K93-S97 WeakPolarHBondContact O-CB 3.49Å; K93-S97 PolarHBondContact O-N 3.47Å; K93-S97 VanDerWaalsContact O-N 3.13Å
94	P	48.7	Very low	53.6	Low	66 Å²	66	61.3 Å²	61.3	43%	0.429	30%	0.304	S	S	.	.	H	α-helix	trans	-64.7	-48.1	175.9	-18.4	32.2	0	0	0	111.2	V96 S97 Y98	P94-V96 PolarHBondContact O-N 2.98Å; P94-S97 WeakPolarHBondContact O-CB 3.35Å; P94-S97 PolarHBondContact O-N 3.03Å; P94-S97 VanDerWaalsContact O-N 3.09Å; P94-Y98 HydrophobicContact CB-CD2 4.31Å; P94-Y98 HydrophobicContact CB-CE2 4.16Å; P94-Y98 WeakPolarHBondContact O-CB 3.34Å; P94-Y98 WeakPolarHBondContact O-CD2 3.38Å; P94-Y98 PolarHBondContact O-N 3.47Å
95	T	50.9	Low	53.6	Low	2 Å²	2	62 Å²	62	1%	0.012	31%	0.309	C	S	.	.	H	α-helix	trans	-56.4	-46.7	178.7	-40.9	0	0	0	0	112.2	L27 D30 L31 F92 S97 Y98 A99	L27-T95 HydrophobicContact CD1-CG2 3.43Å; L27-T95 VanDerWaalsContact CD1-CG2 3.43Å; L27-T95 WeakPolarHBondContact CD1-O 3.48Å; L27-T95 HydrophobicContact CG-CG2 3.57Å; D30-T95 VanDerWaalsContact CB-OG1 3.29Å; D30-T95 WeakPolarHBondContact CB-OG1 3.43Å; D30-T95 PolarHBondContact OD2-OG1 3.39Å; L31-T95 HydrophobicContact CD1-CG2 4.36Å; L31-T95 HydrophobicContact CD2-CG2 4.22Å; L31-T95 HydrophobicContact CG-CG2 3.95Å; F92-T95 WeakPolarHBondContact O-CB 3.42Å; F92-T95 PolarHBondContact O-N 3.1Å; T95-S97 VanDerWaalsContact C-N 3.35Å; T95-S97 PolarHBondContact O-N 2.9Å; T95-Y98 PolarHBondContact O-N 3Å; T95-A99 WeakPolarHBondContact O-CB 3.38Å; T95-A99 PolarHBondContact O-N 3.09Å
96	V	56.5	Low	54	Low	27 Å²	27	59.1 Å²	59.1	16%	0.164	29%	0.291	C	S	.	.	H	α-helix	trans	-63.6	-41.2	176.6	171.5	0	0	0	0	111.2	L81 L84 A89 F92 P94 Y98 S100	L81-V96 HydrophobicContact CD2-CB 4.32Å; L81-V96 HydrophobicContact CD2-CG1 4.06Å; L81-V96 HydrophobicContact CD2-CG2 4.14Å; L84-V96 HydrophobicContact CD1-CG2 3.55Å; A89-V96 HydrophobicContact CB-CG2 4.4Å; F92-V96 HydrophobicContact CB-CG2 4.48Å; F92-V96 WeakPolarHBondContact O-CG2 3.49Å; F92-V96 PolarHBondContact O-N 3.13Å; P94-V96 PolarHBondContact O-N 2.98Å; V96-Y98 VanDerWaalsContact C-N 3.31Å; V96-Y98 PolarHBondContact O-N 3.35Å; V96-S100 WeakPolarHBondContact O-CB 3.48Å; V96-S100 PolarHBondContact O-N 3.35Å; V96-S100 PolarHBondContact O-OG 3.24Å
97	S	52.9	Low	54	Low	76 Å²	76	55.8 Å²	55.8	53%	0.531	27%	0.272	S	S	.	.	H	α-helix	trans	-63.9	-37.9	177.3	-169	0	0	0	0	112.1	K93 P94 T95 S100 A101	K93-S97 WeakPolarHBondContact O-CB 3.49Å; K93-S97 PolarHBondContact O-N 3.47Å; K93-S97 VanDerWaalsContact O-N 3.13Å; P94-S97 WeakPolarHBondContact O-CB 3.35Å; P94-S97 PolarHBondContact O-N 3.03Å; P94-S97 VanDerWaalsContact O-N 3.09Å; T95-S97 VanDerWaalsContact C-N 3.35Å; T95-S97 PolarHBondContact O-N 2.9Å; S97-S100 WeakPolarHBondContact O-CB 3.02Å; S97-A101 WeakPolarHBondContact O-CB 3.49Å; S97-A101 PolarHBondContact O-N 3.09Å
98	Y	51.2	Low	54.1	Low	99 Å²	99	55.5 Å²	55.5	39%	0.388	27%	0.271	S	S	.	.	H	α-helix	trans	-73.2	-49.2	179.3	-80.3	-48.5	0	0	0	112.5	V23 A26 P94 T95 V96 S100 A101 V102	V23-Y98 HydrophobicContact CB-CD1 4.3Å; V23-Y98 VanDerWaalsContact CG1-CB 3.49Å; V23-Y98 HydrophobicContact CG1-CD1 3.65Å; V23-Y98 HydrophobicContact CG1-CG 3.9Å; V23-Y98 WeakPolarHBondContact CG1-O 3.44Å; V23-Y98 HydrophobicContact CG2-CD1 3.91Å; V23-Y98 HydrophobicContact CG2-CE1 4.37Å; A26-Y98 HydrophobicContact CB-CD2 4.44Å; A26-Y98 HydrophobicContact CB-CE2 4.46Å; P94-Y98 HydrophobicContact CB-CD2 4.31Å; P94-Y98 HydrophobicContact CB-CE2 4.16Å; P94-Y98 WeakPolarHBondContact O-CB 3.34Å; P94-Y98 WeakPolarHBondContact O-CD2 3.38Å; P94-Y98 PolarHBondContact O-N 3.47Å; T95-Y98 PolarHBondContact O-N 3Å; V96-Y98 VanDerWaalsContact C-N 3.31Å; V96-Y98 PolarHBondContact O-N 3.35Å; Y98-S100 PolarHBondContact O-N 2.68Å; Y98-A101 WeakPolarHBondContact O-CB 3.44Å; Y98-A101 PolarHBondContact O-N 3.26Å; Y98-V102 WeakPolarHBondContact O-CG2 3.47Å; Y98-V102 PolarHBondContact O-N 3.42Å
99	A	57.8	Low	54.2	Low	1 Å²	1	57.2 Å²	57.2	1%	0.008	28%	0.283	C	S	.	.	H	α-helix	trans	-57.6	-40.5	172.6	0	0	0	0	0	111.9	L27 L77 L81 T95 A101 V102 L103	L27-A99 HydrophobicContact CD1-CB 3.74Å; L77-A99 HydrophobicContact CD2-CB 4.01Å; L81-A99 HydrophobicContact CD1-CB 4.2Å; L81-A99 HydrophobicContact CD2-CB 3.93Å; L81-A99 HydrophobicContact CG-CB 4.15Å; T95-A99 WeakPolarHBondContact O-CB 3.38Å; T95-A99 PolarHBondContact O-N 3.09Å; A99-A101 VanDerWaalsContact C-N 3.35Å; A99-A101 PolarHBondContact O-N 3.16Å; A99-V102 PolarHBondContact O-N 3.39Å; A99-L103 WeakPolarHBondContact O-CG 3.46Å; A99-L103 PolarHBondContact O-N 3.4Å
100	S	57.8	Low	53.9	Low	7 Å²	7	56.2 Å²	56.2	5%	0.049	27%	0.272	C	S	.	.	H	α-helix	trans	-59.7	-41.2	173.1	-76.2	0	0	0	0	112.9	V96 S97 Y98 K104 V126	V96-S100 WeakPolarHBondContact O-CB 3.48Å; V96-S100 PolarHBondContact O-N 3.35Å; V96-S100 PolarHBondContact O-OG 3.24Å; S97-S100 WeakPolarHBondContact O-CB 3.02Å; Y98-S100 PolarHBondContact O-N 2.68Å; S100-K104 WeakPolarHBondContact O-CG 2.82Å; S100-K104 PolarHBondContact O-N 3.25Å; S100-V126 VanDerWaalsContact CB-CG1 3.41Å
101	A	52.4	Low	53.7	Low	38 Å²	38	50.2 Å²	50.2	31%	0.314	26%	0.255	S	S	.	.	H	α-helix	trans	-67.2	-41.6	176.3	0	0	0	0	0	111.8	S97 Y98 A99 K104 V105	S97-A101 WeakPolarHBondContact O-CB 3.49Å; S97-A101 PolarHBondContact O-N 3.09Å; Y98-A101 WeakPolarHBondContact O-CB 3.44Å; Y98-A101 PolarHBondContact O-N 3.26Å; A99-A101 VanDerWaalsContact C-N 3.35Å; A99-A101 PolarHBondContact O-N 3.16Å; A101-K104 WeakPolarHBondContact O-CB 3.36Å; A101-K104 PolarHBondContact O-N 3.43Å; A101-V105 WeakPolarHBondContact O-CG2 3.46Å; A101-V105 PolarHBondContact O-N 3.16Å; A101-V105 VanDerWaalsContact O-N 3.16Å
102	V	56.1	Low	53.4	Low	11 Å²	11	49.9 Å²	49.9	7%	0.067	26%	0.26	C	S	.	.	H	α-helix	trans	-64	-42.6	176.1	-179	0	0	0	0	111.1	V23 L73 L77 Y98 A99 K104 V105 C106	V23-V102 HydrophobicContact CB-CG2 3.95Å; V23-V102 HydrophobicContact CG1-CG2 3.36Å; L73-V102 HydrophobicContact CD2-CG1 4.32Å; L77-V102 HydrophobicContact CD1-CB 3.83Å; L77-V102 HydrophobicContact CD1-CG1 3.42Å; L77-V102 VanDerWaalsContact CD1-CG1 3.42Å; Y98-V102 WeakPolarHBondContact O-CG2 3.47Å; Y98-V102 PolarHBondContact O-N 3.42Å; A99-V102 PolarHBondContact O-N 3.39Å; V102-K104 VanDerWaalsContact C-N 3.28Å; V102-K104 PolarHBondContact O-N 2.91Å; V102-V105 PolarHBondContact O-N 3.26Å; V102-C106 PolarHBondContact O-N 3.38Å; V102-C106 PolarHBondContact O-SG 2.76Å; V102-C106 VanDerWaalsContact O-SG 3.39Å
103	L	60.8	Low	52.7	Low	9 Å²	9	50.8 Å²	50.8	5%	0.047	27%	0.268	C	S	.	.	H	α-helix	trans	-57.3	-39.8	173.9	-80.5	167.1	0	0	0	112.6	Y74 L77 F78 L81 A99 V105 C106 G107	Y74-L103 HydrophobicContact CD1-CD2 4.43Å; Y74-L103 HydrophobicContact CD2-CD2 3.41Å; Y74-L103 VanDerWaalsContact CD2-CD2 3.41Å; Y74-L103 HydrophobicContact CE2-CB 4.49Å; Y74-L103 HydrophobicContact CE2-CD2 3.62Å; Y74-L103 HydrophobicContact CG-CD2 3.84Å; Y74-L103 VanDerWaalsContact O-CD2 3.26Å; Y74-L103 WeakPolarHBondContact O-CD2 3.25Å; L77-L103 HydrophobicContact CB-CD1 4.22Å; L77-L103 HydrophobicContact CB-CD2 3.8Å; L77-L103 HydrophobicContact CB-CG 3.83Å; F78-L103 HydrophobicContact CB-CD2 4.25Å; L81-L103 HydrophobicContact CD1-CD1 3.41Å; L81-L103 VanDerWaalsContact CD1-CD1 3.41Å; L81-L103 HydrophobicContact CG-CD1 4.42Å; A99-L103 WeakPolarHBondContact O-CG 3.46Å; A99-L103 PolarHBondContact O-N 3.4Å; L103-V105 VanDerWaalsContact C-N 3.33Å; L103-V105 PolarHBondContact O-N 3.49Å; L103-C106 PolarHBondContact O-N 3.07Å; L103-G107 PolarHBondContact O-N 3.2Å
104	K	54.2	Low	51.7	Low	97 Å²	97	55.7 Å²	55.7	42%	0.422	29%	0.292	S	S	.	.	H	α-helix	trans	-62.2	-40.6	174.4	-70.8	-173.8	176	179	0	112	S100 A101 V102 K108 V126	S100-K104 WeakPolarHBondContact O-CG 2.82Å; S100-K104 PolarHBondContact O-N 3.25Å; A101-K104 WeakPolarHBondContact O-CB 3.36Å; A101-K104 PolarHBondContact O-N 3.43Å; V102-K104 VanDerWaalsContact C-N 3.28Å; V102-K104 PolarHBondContact O-N 2.91Å; K104-K108 WeakPolarHBondContact O-CG 3.18Å; K104-K108 PolarHBondContact O-N 3.31Å; K104-K108 VanDerWaalsContact O-N 3.08Å; K104-V126 HydrophobicContact CD-CB 4.43Å; K104-V126 HydrophobicContact CD-CG1 4.4Å; K104-V126 HydrophobicContact CD-CG2 4.46Å; K104-V126 VanDerWaalsContact CE-CB 3.41Å; K104-V126 VanDerWaalsContact CE-CG1 3.45Å; K104-V126 HydrophobicContact CG-CB 4.17Å; K104-V126 HydrophobicContact CG-CG1 4.37Å; K104-V126 HydrophobicContact CG-CG2 3.68Å
105	V	52.6	Low	50.9	Low	35 Å²	35	59.8 Å²	59.8	21%	0.212	31%	0.31	C	S	.	.	H	α-helix	trans	-68.7	-45.2	179.1	176.9	0	0	0	0	110.4	A16 V20 A101 V102 L103 G107 K108 V109	A16-V105 HydrophobicContact CB-CG1 4.38Å; V20-V105 HydrophobicContact CG2-CG1 4.35Å; A101-V105 WeakPolarHBondContact O-CG2 3.46Å; A101-V105 PolarHBondContact O-N 3.16Å; A101-V105 VanDerWaalsContact O-N 3.16Å; V102-V105 PolarHBondContact O-N 3.26Å; L103-V105 VanDerWaalsContact C-N 3.33Å; L103-V105 PolarHBondContact O-N 3.49Å; V105-G107 VanDerWaalsContact C-N 3.34Å; V105-G107 PolarHBondContact O-N 3.02Å; V105-K108 PolarHBondContact O-N 2.69Å; V105-K108 VanDerWaalsContact O-N 3.15Å; V105-V109 WeakPolarHBondContact O-CG2 3.33Å; V105-V109 PolarHBondContact O-N 3.2Å
106	C	58.9	Low	49.9	Very low	6 Å²	6	61.8 Å²	61.8	4%	0.041	32%	0.324	C	S	.	.	H	α-helix	trans	-56.8	-46.2	174.1	-67.7	0	0	0	0	111.8	V70 Y74 V102 L103 K108 V109 L110	V70-C106 HydrophobicContact CG1-CB 4Å; Y74-C106 HydrophobicContact CD2-CB 4Å; V102-C106 PolarHBondContact O-N 3.38Å; V102-C106 PolarHBondContact O-SG 2.76Å; V102-C106 VanDerWaalsContact O-SG 3.39Å; L103-C106 PolarHBondContact O-N 3.07Å; C106-K108 VanDerWaalsContact C-N 3.31Å; C106-K108 PolarHBondContact O-N 3.16Å; C106-V109 PolarHBondContact O-N 2.91Å; C106-L110 WeakPolarHBondContact O-CB 3.42Å; C106-L110 VanDerWaalsContact O-CG 3.31Å; C106-L110 WeakPolarHBondContact O-CG 3.03Å; C106-L110 PolarHBondContact O-N 3.41Å
107	G	53.8	Low	48.6	Very low	6 Å²	6	67 Å²	67	6%	0.062	36%	0.359	C	S	.	.	H	α-helix	trans	-63	-34.3	177.2	0	0	0	0	0	113.6	L103 V105 N111	L103-G107 PolarHBondContact O-N 3.2Å; V105-G107 VanDerWaalsContact C-N 3.34Å; V105-G107 PolarHBondContact O-N 3.02Å; G107-N111 WeakPolarHBondContact O-CB 3.31Å; G107-N111 PolarHBondContact O-N 3.41Å; G107-N111 PolarHBondContact O-ND2 3.01Å
108	K	51.8	Low	47.6	Very low	145 Å²	145	68.4 Å²	68.4	63%	0.63	36%	0.364	S	S	*	.	H	α-helix	trans	-68.1	-40.9	173.6	-77	-176.3	177.8	-171.6	0	112.6	K104 V105 C106 N111 Q112	K104-K108 WeakPolarHBondContact O-CG 3.18Å; K104-K108 PolarHBondContact O-N 3.31Å; K104-K108 VanDerWaalsContact O-N 3.08Å; V105-K108 PolarHBondContact O-N 2.69Å; V105-K108 VanDerWaalsContact O-N 3.15Å; C106-K108 VanDerWaalsContact C-N 3.31Å; C106-K108 PolarHBondContact O-N 3.16Å; K108-N111 PolarHBondContact O-N 3.17Å; K108-Q112 WeakPolarHBondContact O-CG 3.48Å
109	V	51.9	Low	46.6	Very low	62 Å²	62	66.2 Å²	66.2	38%	0.376	36%	0.356	S	S	.	.	H	α-helix	trans	-68	-42.8	179.1	173.8	0	0	0	0	110.9	V70 V105 C106 N111 Q112	V70-V109 HydrophobicContact CG1-CB 4.33Å; V70-V109 HydrophobicContact CG1-CG1 4.24Å; V70-V109 HydrophobicContact CG2-CG1 4.23Å; V105-V109 WeakPolarHBondContact O-CG2 3.33Å; V105-V109 PolarHBondContact O-N 3.2Å; C106-V109 PolarHBondContact O-N 2.91Å; V109-N111 VanDerWaalsContact C-N 3.29Å; V109-N111 PolarHBondContact O-N 3.49Å; V109-Q112 PolarHBondContact O-N 2.94Å
110	L	52.1	Low	45.2	Very low	13 Å²	13	70.3 Å²	70.3	7%	0.068	39%	0.385	C	S	.	.	H	α-helix	trans	-69.5	-23.3	178.6	-68.5	169.6	0	0	0	113.7	E67 V70 C106 S113	E67-L110 HydrophobicContact CB-CD2 4.31Å; E67-L110 HydrophobicContact CG-CD2 4.47Å; V70-L110 HydrophobicContact CB-CD2 3.92Å; V70-L110 HydrophobicContact CB-CG 4.27Å; V70-L110 HydrophobicContact CG1-CD1 4.15Å; V70-L110 HydrophobicContact CG1-CD2 3.99Å; V70-L110 HydrophobicContact CG1-CG 3.76Å; C106-L110 WeakPolarHBondContact O-CB 3.42Å; C106-L110 VanDerWaalsContact O-CG 3.31Å; C106-L110 WeakPolarHBondContact O-CG 3.03Å; C106-L110 PolarHBondContact O-N 3.41Å; L110-S113 PolarHBondContact O-OG 3.36Å
111	N	49.7	Very low	43.8	Very low	71 Å²	71	72.5 Å²	72.5	38%	0.38	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-6	177.1	-76.7	-9.8	0	0	0	113.8	G107 K108 V109	G107-N111 WeakPolarHBondContact O-CB 3.31Å; G107-N111 PolarHBondContact O-N 3.41Å; G107-N111 PolarHBondContact O-ND2 3.01Å; K108-N111 PolarHBondContact O-N 3.17Å; V109-N111 VanDerWaalsContact C-N 3.29Å; V109-N111 PolarHBondContact O-N 3.49Å
112	Q	43.1	Very low	42.8	Very low	161 Å²	161	73.1 Å²	73.1	75%	0.752	41%	0.413	S	S	*	.	S	Bend	trans	-95.3	-7.1	178.8	-75.9	-179.7	-5.2	0	0	113.2	K108 V109	K108-Q112 WeakPolarHBondContact O-CG 3.48Å; V109-Q112 PolarHBondContact O-N 2.94Å
113	S	40.8	Very low	41.4	Very low	33 Å²	33	76.2 Å²	76.2	23%	0.231	43%	0.427	C	S	.	.			trans	-90.8	122.5	178.1	55.8	0	0	0	0	112.2	E67 L110 L115	E67-S113 WeakPolarHBondContact OE1-CB 3.47Å; E67-S113 PolarHBondContact OE1-OG 2.94Å; E67-S113 PolarHBondContact OE2-OG 3.32Å; L110-S113 PolarHBondContact O-OG 3.36Å; S113-L115 PolarHBondContact O-N 3.22Å
114	E	32.8	Very low	39.7	Very low	204 Å²	204	79.1 Å²	79.1	95%	0.953	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-4.6	171.4	-66.8	-176.3	157.9	0	0	113.1
115	L	30.3	Very low	38.5	Very low	153 Å²	153	82.6 Å²	82.6	80%	0.801	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	35.1	-167.1	-81.6	159.8	0	0	0	114.5	S113	S113-L115 PolarHBondContact O-N 3.22Å
116	S	30.2	Very low	37.2	Very low	43 Å²	43	81.8 Å²	81.8	30%	0.301	45%	0.448	S	S	.	.			trans	-166.5	131.1	152.2	63.1	0	0	0	0	113.4	E67 T118	E67-S116 PolarHBondContact OE2-OG 3.39Å; S116-T118 WeakPolarHBondContact CB-OG1 3.44Å; S116-T118 PolarHBondContact O-N 3.17Å; S116-T118 VanDerWaalsContact O-N 3.16Å; S116-T118 PolarHBondContact OG-OG1 3.22Å; S116-T118 VanDerWaalsContact OG-OG1 3.07Å
117	P	29.1	Very low	35.6	Very low	138 Å²	138	85 Å²	85	90%	0.896	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	24.2	173	37.2	-34.6	0	0	0	111.7	F119	P117-F119 VanDerWaalsContact C-N 3.32Å; P117-F119 PolarHBondContact O-N 3.08Å
118	T	32.7	Very low	34.2	Very low	104 Å²	104	87.4 Å²	87.4	64%	0.638	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-10.9	-174.9	20.2	0	0	0	0	113.8	S116	S116-T118 WeakPolarHBondContact CB-OG1 3.44Å; S116-T118 PolarHBondContact O-N 3.17Å; S116-T118 VanDerWaalsContact O-N 3.16Å; S116-T118 PolarHBondContact OG-OG1 3.22Å; S116-T118 VanDerWaalsContact OG-OG1 3.07Å
119	F	28.9	Very low	32.9	Very low	53 Å²	53	84.7 Å²	84.7	23%	0.232	48%	0.48	C	S	.	.			trans	-130.4	105.9	-179.2	-98.1	-93.9	0	0	0	112.2	Y74 P117 H123	Y74-F119 HydrophobicContact CD1-CE1 4.18Å; Y74-F119 AromaticContact CD1-CZ 3.88Å; Y74-F119 HydrophobicContact CD1-CZ 3.88Å; Y74-F119 AromaticContact CE1-CE1 3.88Å; Y74-F119 HydrophobicContact CE1-CE1 3.88Å; Y74-F119 AromaticContact CE1-CZ 3.96Å; Y74-F119 HydrophobicContact CE1-CZ 3.96Å; P117-F119 VanDerWaalsContact C-N 3.32Å; P117-F119 PolarHBondContact O-N 3.08Å; F119-H123 HydrophobicContact CD1-CB 3.91Å; F119-H123 AromaticContact CD1-CG 3.8Å; F119-H123 AromaticContact CD1-ND1 3.73Å; F119-H123 HydrophobicContact CE1-CB 3.76Å; F119-H123 AromaticContact CE1-CG 3.65Å; F119-H123 AromaticContact CE1-ND1 3.98Å
120	S	29.6	Very low	31.6	Very low	88 Å²	88	90 Å²	90	62%	0.615	50%	0.501	S	S	*	.			trans	-74.8	138.6	162.3	176.1	0	0	0	0	109.3	G122 H123	S120-G122 PolarHBondContact O-N 3.15Å; S120-H123 PolarHBondContact O-ND1 3.02Å
121	A	27.8	Very low	30.3	Very low	52 Å²	52	96.1 Å²	96.1	43%	0.43	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	-56.3	-0.9	-176.8	0	0	0	0	0	115.9	H123	A121-H123 VanDerWaalsContact C-N 3.26Å; A121-H123 PolarHBondContact O-N 3.45Å
122	G	30.7	Very low	29.1	Very low	51 Å²	51	97.7 Å²	97.7	53%	0.526	55%	0.549	S	S	.	.	G	3₁₀ helix	trans	-72	-3.1	174.5	0	0	0	0	0	116.5	S120	S120-G122 PolarHBondContact O-N 3.15Å
123	H	28.5	Very low	28.1	Very low	76 Å²	76	93.6 Å²	93.6	35%	0.352	55%	0.55	S	S	.	*	G	3₁₀ helix	trans	-90	-0.9	-173.6	-70.2	91	0	0	0	115.3	Y74 F119 S120 A121 W125	Y74-H123 PolarHBondContact OH-O 3.48Å; F119-H123 HydrophobicContact CD1-CB 3.91Å; F119-H123 AromaticContact CD1-CG 3.8Å; F119-H123 AromaticContact CD1-ND1 3.73Å; F119-H123 HydrophobicContact CE1-CB 3.76Å; F119-H123 AromaticContact CE1-CG 3.65Å; F119-H123 AromaticContact CE1-ND1 3.98Å; S120-H123 PolarHBondContact O-ND1 3.02Å; A121-H123 VanDerWaalsContact C-N 3.26Å; A121-H123 PolarHBondContact O-N 3.45Å; H123-W125 PolarHBondContact O-N 3.16Å
124	L	24.8	Very low	27.4	Very low	71 Å²	71	101.8 Å²	101.8	37%	0.372	58%	0.582	S	S	.	*			trans	-91.3	72.5	179.6	-83.7	157.6	0	0	0	112.1
125	W	28.7	Very low	27	Very low	169 Å²	169	99.3 Å²	99.3	64%	0.64	57%	0.57	S	S	*	*			trans	-108.4	104.3	166	-73.6	94.9	0	0	0	110.5	H123 I140	H123-W125 PolarHBondContact O-N 3.16Å; W125-I140 HydrophobicContact CE3-CD1 4.04Å; W125-I140 HydrophobicContact CZ3-CB 4.21Å; W125-I140 HydrophobicContact CZ3-CD1 4.26Å; W125-I140 HydrophobicContact CZ3-CG2 4.34Å
126	V	25.8	Very low	26.6	Very low	19 Å²	19	96 Å²	96	12%	0.115	57%	0.565	C	S	.	*			trans	-122.3	121.1	174.3	176.6	0	0	0	0	109.7	S100 K104 S128 I140	S100-V126 VanDerWaalsContact CB-CG1 3.41Å; K104-V126 HydrophobicContact CD-CB 4.43Å; K104-V126 HydrophobicContact CD-CG1 4.4Å; K104-V126 HydrophobicContact CD-CG2 4.46Å; K104-V126 VanDerWaalsContact CE-CB 3.41Å; K104-V126 VanDerWaalsContact CE-CG1 3.45Å; K104-V126 HydrophobicContact CG-CB 4.17Å; K104-V126 HydrophobicContact CG-CG1 4.37Å; K104-V126 HydrophobicContact CG-CG2 3.68Å; V126-S128 PolarHBondContact O-N 2.77Å; V126-S128 VanDerWaalsContact O-N 3.12Å; V126-I140 VanDerWaalsContact O-CD1 3.28Å; V126-I140 WeakPolarHBondContact O-CD1 3.44Å
127	P	24.1	Very low	26.2	Very low	73 Å²	73	96.6 Å²	96.6	47%	0.474	57%	0.569	S	S	.	*			trans	-67.3	111.6	-179.5	25.9	-30.6	0	0	0	110.9
128	S	24.7	Very low	25.9	Very low	56 Å²	56	93.2 Å²	93.2	39%	0.392	55%	0.548	S	S	.	.			trans	-82	123.4	160.7	56.5	0	0	0	0	108.9	V126	V126-S128 PolarHBondContact O-N 2.77Å; V126-S128 VanDerWaalsContact O-N 3.12Å
129	V	25.5	Very low	25.4	Very low	88 Å²	88	94.2 Å²	94.2	53%	0.533	54%	0.544	S	S	.	.			trans	-96.2	95.6	172.9	-176.2	0	0	0	0	107.3	L131	V129-L131 HydrophobicContact CG1-CG 4.44Å; V129-L131 PolarHBondContact O-N 3.13Å
130	Q	23.9	Very low	25.3	Very low	174 Å²	174	95 Å²	95	81%	0.813	55%	0.549	S	S	*	.			trans	-79.8	114.6	162.6	-87.7	-174.8	-18	0	0	109	S132	Q130-S132 PolarHBondContact O-N 2.96Å
131	L	24.6	Very low	25.1	Very low	141 Å²	141	97.9 Å²	97.9	74%	0.738	56%	0.558	S	S	*	*			trans	-81.4	104.7	172	-80.5	158.1	0	0	0	108.8	V129	V129-L131 HydrophobicContact CG1-CG 4.44Å; V129-L131 PolarHBondContact O-N 3.13Å
132	S	24.3	Very low	25.2	Very low	105 Å²	105	98.5 Å²	98.5	73%	0.734	56%	0.557	S	S	*	*			trans	-134.2	146.9	149.8	79.2	0	0	0	0	109.3	Q130	Q130-S132 PolarHBondContact O-N 2.96Å
133	G	22.8	Very low	24.9	Very low	75 Å²	75	102.4 Å²	102.4	77%	0.773	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.1	148.3	-150.1	0	0	0	0	0	118	H135	G133-H135 PolarHBondContact O-N 3.03Å; G133-H135 VanDerWaalsContact O-N 3.16Å
134	K	25.6	Very low	24.9	Very low	204 Å²	204	104.2 Å²	104.2	89%	0.887	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	70.2	-16.7	166.8	-68.6	-174.9	176.7	178.7	0	119.5
135	H	23.6	Very low	24.9	Very low	152 Å²	152	105.6 Å²	105.6	70%	0.704	60%	0.598	S	S	*	*			trans	-144.7	118.3	170.8	-66.3	-63.5	0	0	0	112.3	G133 S137	G133-H135 PolarHBondContact O-N 3.03Å; G133-H135 VanDerWaalsContact O-N 3.16Å; H135-S137 PolarHBondContact O-N 3.28Å
136	A	22.4	Very low	24.9	Very low	84 Å²	84	102.6 Å²	102.6	69%	0.694	59%	0.594	S	S	*	*			trans	-75.6	93.6	173.3	0	0	0	0	0	110.1
137	S	22.4	Very low	24.9	Very low	55 Å²	55	106.7 Å²	106.7	39%	0.385	62%	0.615	S	S	.	*			trans	-92.7	109.5	165	47.4	0	0	0	0	109.2	H135 F139	H135-S137 PolarHBondContact O-N 3.28Å; S137-F139 PolarHBondContact O-N 3.24Å
138	C	22.6	Very low	24.9	Very low	67 Å²	67	111 Å²	111	45%	0.453	63%	0.634	S	S	.	*			trans	-78.8	107.3	170.7	-52.1	0	0	0	0	107.9
139	F	23.1	Very low	24.9	Very low	126 Å²	126	115 Å²	115	55%	0.553	66%	0.656	S	S	*	*			trans	-112.7	133.1	165.5	-79.8	-86.8	0	0	0	107.7	S137	S137-F139 PolarHBondContact O-N 3.24Å
140	I	26.4	Very low	24.8	Very low	68 Å²	68	115 Å²	115	35%	0.349	66%	0.66	S	S	.	*			trans	-125.7	116.8	168	-61.9	170.9	0	0	0	105.9	W125 V126	W125-I140 HydrophobicContact CE3-CD1 4.04Å; W125-I140 HydrophobicContact CZ3-CB 4.21Å; W125-I140 HydrophobicContact CZ3-CD1 4.26Å; W125-I140 HydrophobicContact CZ3-CG2 4.34Å; V126-I140 VanDerWaalsContact O-CD1 3.28Å; V126-I140 WeakPolarHBondContact O-CD1 3.44Å
141	D	24.9	Very low	24.9	Very low	150 Å²	150	112.5 Å²	112.5	80%	0.802	66%	0.657	S	S	*	*			trans	-73.5	122.1	159.5	-115.1	-29.7	0	0	0	107.1	D143	D141-D143 PolarHBondContact O-N 2.95Å
142	P	29.8	Very low	24.9	Very low	64 Å²	64	115.6 Å²	115.6	42%	0.416	66%	0.664	S	S	.	*			trans	-71.2	123.3	165.2	28.4	-26.7	0	0	0	107.7	T144	P142-T144 PolarHBondContact O-N 3.29Å
143	D	24.9	Very low	24.9	Very low	133 Å²	133	114 Å²	114	71%	0.711	66%	0.664	S	S	*	*			trans	-46.8	114.8	169	-94.3	-38	0	0	0	108.9	D141 S145	D141-D143 PolarHBondContact O-N 2.95Å; D143-S145 PolarHBondContact O-N 3.13Å
144	T	27.7	Very low	25	Very low	114 Å²	114	117.7 Å²	117.7	70%	0.699	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	1.7	-168.4	41.6	0	0	0	0	114.5	P142	P142-T144 PolarHBondContact O-N 3.29Å
145	S	25.2	Very low	25.1	Very low	100 Å²	100	115.5 Å²	115.5	70%	0.699	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-2.3	-172.4	53.6	0	0	0	0	115.5	D143	D143-S145 PolarHBondContact O-N 3.13Å
146	L	28.3	Very low	25.2	Very low	107 Å²	107	114.4 Å²	114.4	56%	0.56	65%	0.652	S	S	*	*	S	Bend	trans	-114.2	6.6	-170.2	-79.2	163.6	0	0	0	116.2
147	L	27.1	Very low	25.6	Very low	105 Å²	105	114.5 Å²	114.5	55%	0.55	65%	0.647	S	S	.	*			trans	-96.3	15.1	-174.8	-78.1	166.3	0	0	0	115.4	Q177	L147-Q177 HydrophobicContact CD1-CG 4.33Å
148	N	23.3	Very low	25.9	Very low	163 Å²	163	117.3 Å²	117.3	87%	0.872	66%	0.658	S	S	*	*			trans	-100.2	70.7	177.4	-111.1	7.5	0	0	0	111.4
149	V	23.9	Very low	26.2	Very low	139 Å²	139	116 Å²	116	84%	0.842	65%	0.648	S	S	*	*			trans	-147.4	126.8	157.2	-167.5	0	0	0	0	111.2
150	S	24.3	Very low	26.4	Very low	89 Å²	89	116.1 Å²	116.1	62%	0.622	65%	0.654	S	S	*	*			trans	-79.8	155.6	-175.3	52.9	0	0	0	0	113.8
151	T	25.1	Very low	26.7	Very low	122 Å²	122	121.2 Å²	121.2	75%	0.748	67%	0.668	S	S	*	*			trans	77.2	124.2	155.5	62.7	0	0	0	0	121.3
152	K	24.4	Very low	26.9	Very low	206 Å²	206	114.9 Å²	114.9	90%	0.896	63%	0.634	S	S	*	*			trans	95.1	118.2	152.1	-65.3	176.1	-178.1	179.2	0	119.6
153	G	25.7	Very low	26.8	Very low	71 Å²	71	117 Å²	117	73%	0.732	65%	0.651	S	S	*	*			trans	104.2	115	145.6	0	0	0	0	0	116.6
154	W	25.4	Very low	27	Very low	153 Å²	153	118.2 Å²	118.2	58%	0.58	65%	0.65	S	S	*	*			trans	-96	127.6	175.6	-74.1	71.8	0	0	0	111.1	P171 F218	W154-P171 HydrophobicContact CD2-CB 4.36Å; W154-P171 HydrophobicContact CE3-CB 3.7Å; W154-P171 HydrophobicContact CE3-CG 4.08Å; W154-P171 HydrophobicContact CH2-CB 3.25Å; W154-P171 HydrophobicContact CH2-CG 2.94Å; W154-P171 HydrophobicContact CZ2-CB 3.86Å; W154-P171 HydrophobicContact CZ2-CG 3.93Å; W154-P171 HydrophobicContact CZ3-CB 3.17Å; W154-P171 HydrophobicContact CZ3-CG 3.06Å; W154-F218 HydrophobicContact CZ3-CD2 4.32Å
155	H	25.9	Very low	27.1	Very low	157 Å²	157	119.4 Å²	119.4	73%	0.727	64%	0.641	S	S	*	*			trans	-136.6	143.9	168.3	-76.7	-50.5	0	0	0	113.1	S157	H155-S157 VanDerWaalsContact C-N 3.3Å; H155-S157 PolarHBondContact O-N 3.45Å
156	T	26.8	Very low	27.5	Very low	130 Å²	130	118.7 Å²	118.7	80%	0.798	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-73.6	-0.5	-167.6	39.5	0	0	0	0	115.9	N158 V159	T156-N158 VanDerWaalsContact C-N 3.3Å; T156-N158 PolarHBondContact O-N 2.97Å; T156-V159 WeakPolarHBondContact O-CG2 3.06Å
157	S	29.9	Very low	27.5	Very low	85 Å²	85	115.3 Å²	115.3	59%	0.594	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-74.4	-13.6	-179	44.5	0	0	0	0	114.5	H155 V159	H155-S157 VanDerWaalsContact C-N 3.3Å; H155-S157 PolarHBondContact O-N 3.45Å; S157-V159 PolarHBondContact O-N 3.22Å; S157-V159 VanDerWaalsContact O-N 3.16Å
158	N	29.9	Very low	27.7	Very low	115 Å²	115	110.9 Å²	110.9	62%	0.615	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-76	5	-179.1	-70	-32.8	0	0	0	115.1	T156	T156-N158 VanDerWaalsContact C-N 3.3Å; T156-N158 PolarHBondContact O-N 2.97Å
159	V	28.3	Very low	28	Very low	40 Å²	40	104.7 Å²	104.7	24%	0.242	56%	0.56	C	S	.	*	G	3₁₀ helix	trans	-96.5	-10.4	-167.3	176.9	0	0	0	0	113.6	T156 S157 W161 I162	T156-V159 WeakPolarHBondContact O-CG2 3.06Å; S157-V159 PolarHBondContact O-N 3.22Å; S157-V159 VanDerWaalsContact O-N 3.16Å; V159-W161 PolarHBondContact O-N 3.32Å; V159-I162 HydrophobicContact CG1-CD1 4.17Å; V159-I162 WeakPolarHBondContact O-CB 3.42Å; V159-I162 WeakPolarHBondContact O-CD1 3.31Å; V159-I162 VanDerWaalsContact O-CG1 3.25Å; V159-I162 WeakPolarHBondContact O-CG1 3.49Å
160	L	28	Very low	28.3	Very low	128 Å²	128	98.3 Å²	98.3	67%	0.67	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-80	-14.7	-167.3	-89.4	152.8	0	0	0	116.4	I162	L160-I162 PolarHBondContact O-N 2.79Å
161	W	31.9	Very low	28.6	Very low	174 Å²	174	95.8 Å²	95.8	66%	0.659	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-72.3	-12.6	177	-151.3	79.1	0	0	0	113.5	V159 S163 M167	V159-W161 PolarHBondContact O-N 3.32Å; W161-S163 PolarHBondContact O-N 3.12Å; W161-M167 HydrophobicContact CZ3-SD 4.1Å
162	I	29.3	Very low	29	Very low	17 Å²	17	94.8 Å²	94.8	9%	0.087	50%	0.496	C	S	.	.	G	3₁₀ helix	trans	-78.3	-17.2	-164.9	-60.2	-177.9	0	0	0	113.3	V159 L160 M167 A169 Q228	V159-I162 HydrophobicContact CG1-CD1 4.17Å; V159-I162 WeakPolarHBondContact O-CB 3.42Å; V159-I162 WeakPolarHBondContact O-CD1 3.31Å; V159-I162 VanDerWaalsContact O-CG1 3.25Å; V159-I162 WeakPolarHBondContact O-CG1 3.49Å; L160-I162 PolarHBondContact O-N 2.79Å; I162-M167 WeakPolarHBondContact CA-O 3.36Å; I162-M167 WeakPolarHBondContact CB-O 3.31Å; I162-M167 VanDerWaalsContact CG1-O 3.28Å; I162-M167 WeakPolarHBondContact CG1-O 3.28Å; I162-M167 VanDerWaalsContact CG2-O 3.31Å; I162-M167 WeakPolarHBondContact CG2-O 3.44Å; I162-A169 HydrophobicContact CD1-CB 4.23Å; I162-A169 HydrophobicContact CG1-CB 4.46Å; I162-Q228 HydrophobicContact CG2-CG 4.41Å
163	S	28.1	Very low	29.2	Very low	109 Å²	109	90.6 Å²	90.6	76%	0.762	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-76.2	-27.3	-166.8	174.4	0	0	0	0	115.6	W161	W161-S163 PolarHBondContact O-N 3.12Å
164	K	29.4	Very low	29.5	Very low	158 Å²	158	95.1 Å²	95.1	69%	0.687	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-9.9	-173.1	-82.3	-177.4	179.2	169.8	0	116
165	R	29.8	Very low	29.9	Very low	139 Å²	139	89.1 Å²	89.1	53%	0.525	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.8	12.4	-169.8	-85.3	-166.6	172.5	165.6	-1.1	117.4	M167	R165-M167 PolarHBondContact O-N 3.06Å
166	D	32	Very low	30.4	Very low	85 Å²	85	82.3 Å²	82.3	46%	0.455	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	37.2	-176.2	-62.5	-37.3	0	0	0	112.3	V231	D166-V231 HydrophobicContact CB-CG1 4.36Å
167	M	30	Very low	30.9	Very low	37 Å²	37	81.2 Å²	81.2	18%	0.182	43%	0.432	C	S	.	.			trans	-114.7	124.7	178.2	-97.2	-170.1	150.7	0	0	110.1	W161 I162 R165 I184	W161-M167 HydrophobicContact CZ3-SD 4.1Å; I162-M167 WeakPolarHBondContact CA-O 3.36Å; I162-M167 WeakPolarHBondContact CB-O 3.31Å; I162-M167 VanDerWaalsContact CG1-O 3.28Å; I162-M167 WeakPolarHBondContact CG1-O 3.28Å; I162-M167 VanDerWaalsContact CG2-O 3.31Å; I162-M167 WeakPolarHBondContact CG2-O 3.44Å; R165-M167 PolarHBondContact O-N 3.06Å; M167-I184 HydrophobicContact CE-CB 3.86Å; M167-I184 HydrophobicContact CE-CG1 3.42Å; M167-I184 VanDerWaalsContact CE-CG1 3.42Å; M167-I184 HydrophobicContact CE-CG2 4.03Å
168	I	30.9	Very low	31.3	Very low	12 Å²	12	80 Å²	80	6%	0.062	42%	0.416	C	S	.	.			trans	-88.8	123.5	176.5	-57.5	127.1	0	0	0	107.9	L170 V231 L232 T235	I168-L170 HydrophobicContact CG2-CD2 3.47Å; I168-L170 VanDerWaalsContact CG2-CD2 3.47Å; I168-L170 HydrophobicContact CG2-CG 3.71Å; I168-V231 HydrophobicContact CD1-CG1 3.97Å; I168-V231 HydrophobicContact CG1-CG1 4.15Å; I168-L232 HydrophobicContact CB-CD1 4.44Å; I168-L232 HydrophobicContact CB-CG 4.3Å; I168-L232 VanDerWaalsContact CD1-CA 3.49Å; I168-L232 HydrophobicContact CD1-CB 4.21Å; I168-L232 HydrophobicContact CD1-CG 3.83Å; I168-L232 HydrophobicContact CG1-CB 4.41Å; I168-L232 HydrophobicContact CG1-CD1 4.15Å; I168-L232 HydrophobicContact CG1-CG 3.82Å; I168-L232 HydrophobicContact CG2-CD1 3.44Å; I168-L232 VanDerWaalsContact CG2-CD1 3.44Å; I168-L232 HydrophobicContact CG2-CD2 4.32Å; I168-L232 HydrophobicContact CG2-CG 3.65Å; I168-T235 HydrophobicContact CD1-CG2 4.33Å; I168-T235 WeakPolarHBondContact CD1-OG1 3.28Å
169	A	30	Very low	31.5	Very low	33 Å²	33	74.6 Å²	74.6	27%	0.273	39%	0.387	S	S	.	.			trans	-88.8	124.6	160.9	0	0	0	0	0	108	I162 Y180	I162-A169 HydrophobicContact CD1-CB 4.23Å; I162-A169 HydrophobicContact CG1-CB 4.46Å; A169-Y180 WeakPolarHBondContact CA-OH 3.43Å
170	L	28.6	Very low	31.9	Very low	4 Å²	4	76.1 Å²	76.1	2%	0.021	39%	0.389	C	S	.	.			trans	-113.2	149.2	175.5	-76.7	-156.1	0	0	0	110.9	I168 F179 Y180 C215 F218 L232	I168-L170 HydrophobicContact CG2-CD2 3.47Å; I168-L170 VanDerWaalsContact CG2-CD2 3.47Å; I168-L170 HydrophobicContact CG2-CG 3.71Å; L170-F179 HydrophobicContact CB-CD1 4.43Å; L170-F179 HydrophobicContact CB-CE1 3.71Å; L170-F179 HydrophobicContact CB-CZ 4Å; L170-F179 HydrophobicContact CD1-CE1 3.88Å; L170-F179 HydrophobicContact CD1-CE2 3.81Å; L170-F179 HydrophobicContact CD1-CZ 3.24Å; L170-F179 HydrophobicContact CG-CE1 3.88Å; L170-F179 HydrophobicContact CG-CZ 3.76Å; L170-Y180 PolarHBondContact N-OH 3.38Å; L170-Y180 VanDerWaalsContact N-OH 3.13Å; L170-Y180 PolarHBondContact O-OH 3.05Å; L170-C215 HydrophobicContact CD1-CB 4.32Å; L170-F218 HydrophobicContact CD1-CB 4.09Å; L170-F218 HydrophobicContact CD1-CD1 4.35Å; L170-F218 HydrophobicContact CD1-CG 4.26Å; L170-F218 HydrophobicContact CD2-CB 4.09Å; L170-F218 HydrophobicContact CD2-CD1 3.1Å; L170-F218 HydrophobicContact CD2-CD2 3.8Å; L170-F218 HydrophobicContact CD2-CE1 3.13Å; L170-F218 HydrophobicContact CD2-CE2 3.84Å; L170-F218 HydrophobicContact CD2-CG 3.38Å; L170-F218 HydrophobicContact CD2-CZ 3.46Å; L170-F218 VanDerWaalsContact CD2-CZ 3.46Å; L170-F218 HydrophobicContact CG-CD1 4.38Å; L170-F218 HydrophobicContact CG-CG 4.43Å; L170-L232 HydrophobicContact CD1-CD2 4.14Å; L170-L232 HydrophobicContact CD2-CD1 4.02Å; L170-L232 HydrophobicContact CD2-CD2 4.29Å
171	P	30.6	Very low	32.6	Very low	36 Å²	36	72.7 Å²	72.7	23%	0.234	37%	0.373	C	S	.	.			trans	-72.5	140.3	-167.7	31.2	-39.5	0	0	0	112.1	W154 I176 F218	W154-P171 HydrophobicContact CD2-CB 4.36Å; W154-P171 HydrophobicContact CE3-CB 3.7Å; W154-P171 HydrophobicContact CE3-CG 4.08Å; W154-P171 HydrophobicContact CH2-CB 3.25Å; W154-P171 HydrophobicContact CH2-CG 2.94Å; W154-P171 HydrophobicContact CZ2-CB 3.86Å; W154-P171 HydrophobicContact CZ2-CG 3.93Å; W154-P171 HydrophobicContact CZ3-CB 3.17Å; W154-P171 HydrophobicContact CZ3-CG 3.06Å; P171-I176 WeakPolarHBondContact O-CD1 3.28Å; P171-F218 VanDerWaalsContact CD-CE2 3.46Å; P171-F218 HydrophobicContact CG-CD2 3.54Å; P171-F218 HydrophobicContact CG-CE2 3.86Å
172	T	34	Very low	33	Very low	102 Å²	102	64.4 Å²	64.4	63%	0.626	34%	0.342	S	S	*	.			trans	-92.9	114.7	-167.7	46	0	0	0	0	112.8	I176 Y180	T172-I176 HydrophobicContact CG2-CG2 4.01Å; T172-Y180 HydrophobicContact CG2-CE2 4.31Å
173	N	28.3	Very low	33.5	Very low	117 Å²	117	63.9 Å²	63.9	63%	0.626	34%	0.34	S	S	*	.	S	Bend	trans	-136.5	128	152.7	-120.8	6.9	0	0	0	107.3	G175	N173-G175 PolarHBondContact O-N 3.16Å
174	D	33.3	Very low	34.1	Very low	167 Å²	167	62 Å²	62	89%	0.893	32%	0.32	S	S	*	.	S	Bend	trans	25.3	-8.1	168.7	-60.4	-18	0	0	0	123.6
175	G	32.3	Very low	34.7	Very low	27 Å²	27	56 Å²	56	28%	0.278	29%	0.294	S	S	.	.	S	Bend	trans	-118.2	9.6	176.8	0	0	0	0	0	115	N173	N173-G175 PolarHBondContact O-N 3.16Å
176	I	37.2	Very low	35.3	Very low	14 Å²	14	49.6 Å²	49.6	7%	0.072	27%	0.269	C	S	.	.			trans	-108.4	-7.2	-158.7	-75.4	174.7	0	0	0	115.5	P171 T172 E178 F179 Y180 C214	P171-I176 WeakPolarHBondContact O-CD1 3.28Å; T172-I176 HydrophobicContact CG2-CG2 4.01Å; I176-E178 PolarHBondContact O-N 3.47Å; I176-F179 HydrophobicContact CB-CB 4.02Å; I176-F179 HydrophobicContact CG1-CB 3.91Å; I176-F179 HydrophobicContact CG1-CG 4.33Å; I176-F179 HydrophobicContact CG2-CB 3.98Å; I176-F179 HydrophobicContact CG2-CD1 4.35Å; I176-F179 HydrophobicContact CG2-CG 4.39Å; I176-F179 WeakPolarHBondContact O-CB 3.41Å; I176-F179 PolarHBondContact O-N 3.45Å; I176-Y180 HydrophobicContact CG2-CD2 3.51Å; I176-Y180 HydrophobicContact CG2-CE2 3.5Å; I176-Y180 PolarHBondContact O-N 3.21Å; I176-C214 HydrophobicContact CD1-CB 4.39Å
177	Q	37.5	Very low	35.7	Very low	107 Å²	107	45.8 Å²	45.8	50%	0.5	25%	0.25	S	C	.	.	H	α-helix	trans	-58.1	-39.2	168	-142.3	179.9	14.7	0	0	110.3	L147 V181	L147-Q177 HydrophobicContact CD1-CG 4.33Å; Q177-V181 VanDerWaalsContact O-CG2 3.32Å; Q177-V181 WeakPolarHBondContact O-CG2 3.42Å; Q177-V181 PolarHBondContact O-N 3.3Å
178	E	37.3	Very low	36.1	Very low	58 Å²	58	45 Å²	45	27%	0.271	25%	0.248	S	C	.	.	H	α-helix	trans	-73.4	-32.1	174.5	-59.6	-174.5	143.7	0	0	112.5	I176 V181 V182 R207	I176-E178 PolarHBondContact O-N 3.47Å; E178-V181 PolarHBondContact O-N 2.79Å; E178-V182 WeakPolarHBondContact O-CB 3.24Å; E178-V182 WeakPolarHBondContact O-CG2 3.11Å; E178-V182 PolarHBondContact O-N 3.46Å; E178-R207 HydrophobicContact CB-CG 3.95Å; E178-R207 HydrophobicContact CG-CG 4.17Å; E178-R207 IonicContact OE1-CZ 3.68Å; E178-R207 IonicContact OE1-NE 3.03Å; E178-R207 PolarHBondContact OE1-NE 2.72Å; E178-R207 IonicContact OE1-NH2 2.7Å; E178-R207 PolarHBondContact OE1-NH2 2.75Å; E178-R207 VanDerWaalsContact OE2-CG 3.26Å; E178-R207 WeakPolarHBondContact OE2-CG 3.22Å; E178-R207 IonicContact OE2-NE 3.11Å
179	F	35.6	Very low	36.3	Very low	2 Å²	2	46.5 Å²	46.5	1%	0.009	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-46.9	176.9	178.7	-78.5	0	0	0	112.7	L170 I176 V182 V183 T211 C214 C215	L170-F179 HydrophobicContact CB-CD1 4.43Å; L170-F179 HydrophobicContact CB-CE1 3.71Å; L170-F179 HydrophobicContact CB-CZ 4Å; L170-F179 HydrophobicContact CD1-CE1 3.88Å; L170-F179 HydrophobicContact CD1-CE2 3.81Å; L170-F179 HydrophobicContact CD1-CZ 3.24Å; L170-F179 HydrophobicContact CG-CE1 3.88Å; L170-F179 HydrophobicContact CG-CZ 3.76Å; I176-F179 HydrophobicContact CB-CB 4.02Å; I176-F179 HydrophobicContact CG1-CB 3.91Å; I176-F179 HydrophobicContact CG1-CG 4.33Å; I176-F179 HydrophobicContact CG2-CB 3.98Å; I176-F179 HydrophobicContact CG2-CD1 4.35Å; I176-F179 HydrophobicContact CG2-CG 4.39Å; I176-F179 WeakPolarHBondContact O-CB 3.41Å; I176-F179 PolarHBondContact O-N 3.45Å; F179-V182 CarbonylContact O-C 3.6Å; F179-V182 PolarHBondContact O-N 2.95Å; F179-V183 HydrophobicContact CD1-CG2 3.9Å; F179-V183 HydrophobicContact CE1-CB 4.2Å; F179-V183 HydrophobicContact CE1-CG2 3.33Å; F179-V183 HydrophobicContact CE2-CG2 4.2Å; F179-V183 HydrophobicContact CZ-CG2 3.43Å; F179-V183 VanDerWaalsContact CZ-CG2 3.43Å; F179-V183 WeakPolarHBondContact O-CG2 3.47Å; F179-V183 PolarHBondContact O-N 2.85Å; F179-T211 HydrophobicContact CB-CG2 4.41Å; F179-T211 HydrophobicContact CD2-CG2 3.18Å; F179-T211 HydrophobicContact CE2-CG2 3.31Å; F179-T211 VanDerWaalsContact CE2-O 3.29Å; F179-T211 WeakPolarHBondContact CE2-O 3.42Å; F179-T211 HydrophobicContact CG-CG2 3.89Å; F179-T211 HydrophobicContact CZ-CG2 4.18Å; F179-C214 HydrophobicContact CD2-CB 4.03Å; F179-C214 HydrophobicContact CE2-CB 4.25Å; F179-C215 HydrophobicContact CE2-CB 4.5Å; F179-C215 WeakPolarHBondContact CE2-SG 3.45Å; F179-C215 WeakPolarHBondContact CZ-SG 3.03Å
180	Y	35.5	Very low	36.4	Very low	72 Å²	72	51.1 Å²	51.1	28%	0.282	29%	0.289	S	S	.	.	H	α-helix	trans	-65.7	-41.8	178.6	-86.9	-81.8	0	0	0	111.3	A169 L170 T172 I176 V182 V183 I184	A169-Y180 WeakPolarHBondContact CA-OH 3.43Å; L170-Y180 PolarHBondContact N-OH 3.38Å; L170-Y180 VanDerWaalsContact N-OH 3.13Å; L170-Y180 PolarHBondContact O-OH 3.05Å; T172-Y180 HydrophobicContact CG2-CE2 4.31Å; I176-Y180 HydrophobicContact CG2-CD2 3.51Å; I176-Y180 HydrophobicContact CG2-CE2 3.5Å; I176-Y180 PolarHBondContact O-N 3.21Å; Y180-V182 VanDerWaalsContact C-N 3.27Å; Y180-V182 PolarHBondContact O-N 3.15Å; Y180-V183 PolarHBondContact O-N 3.46Å; Y180-I184 VanDerWaalsContact O-CB 3.31Å; Y180-I184 WeakPolarHBondContact O-CB 3.45Å; Y180-I184 WeakPolarHBondContact O-CD1 3.46Å; Y180-I184 WeakPolarHBondContact O-CG1 3.27Å; Y180-I184 PolarHBondContact O-N 3.35Å
181	V	42	Very low	36.5	Very low	56 Å²	56	54.7 Å²	54.7	34%	0.339	31%	0.308	S	S	.	.	H	α-helix	trans	-54.1	-49.5	171.6	170.8	0	0	0	0	109.3	Q177 E178 R185	Q177-V181 VanDerWaalsContact O-CG2 3.32Å; Q177-V181 WeakPolarHBondContact O-CG2 3.42Å; Q177-V181 PolarHBondContact O-N 3.3Å; E178-V181 PolarHBondContact O-N 2.79Å; V181-R185 VanDerWaalsContact CG1-NH2 3.32Å; V181-R185 VanDerWaalsContact O-CB 3.29Å; V181-R185 WeakPolarHBondContact O-CB 3.31Å; V181-R185 WeakPolarHBondContact O-CG 2.86Å; V181-R185 PolarHBondContact O-N 3.21Å
182	V	41.2	Very low	36.7	Very low	1 Å²	1	53.8 Å²	53.8	1%	0.006	30%	0.303	C	S	.	.	H	α-helix	trans	-65.6	-47.2	179.8	169.7	0	0	0	0	112.8	E178 F179 Y180 I184 R185 F186 R207 L208 T211 I239	E178-V182 WeakPolarHBondContact O-CB 3.24Å; E178-V182 WeakPolarHBondContact O-CG2 3.11Å; E178-V182 PolarHBondContact O-N 3.46Å; F179-V182 CarbonylContact O-C 3.6Å; F179-V182 PolarHBondContact O-N 2.95Å; Y180-V182 VanDerWaalsContact C-N 3.27Å; Y180-V182 PolarHBondContact O-N 3.15Å; V182-I184 PolarHBondContact O-N 2.93Å; V182-R185 CarbonylContact O-C 3.46Å; V182-R185 WeakPolarHBondContact O-CB 3Å; V182-R185 PolarHBondContact O-N 3.07Å; V182-R185 VanDerWaalsContact O-N 3.17Å; V182-F186 HydrophobicContact CG1-CD2 3.91Å; V182-F186 HydrophobicContact CG1-CE2 4.31Å; V182-F186 VanDerWaalsContact O-CD2 3.27Å; V182-F186 WeakPolarHBondContact O-CD2 3.18Å; V182-F186 PolarHBondContact O-N 3.08Å; V182-R207 HydrophobicContact CG2-CB 4.23Å; V182-L208 HydrophobicContact CG1-CD2 3.39Å; V182-L208 HydrophobicContact CG1-CG 4.3Å; V182-T211 HydrophobicContact CB-CG2 4.27Å; V182-T211 HydrophobicContact CG1-CG2 3.82Å; V182-I239 HydrophobicContact CG1-CD1 4.39Å; V182-I239 HydrophobicContact CG1-CG1 4.34Å
183	V	39.3	Very low	36.6	Very low	5 Å²	5	52.1 Å²	52.1	3%	0.03	30%	0.3	C	S	.	.	H	α-helix	trans	-66.7	-37.7	-179	169.9	0	0	0	0	112	F179 Y180 R185 F186 S187 T211 T235 I239	F179-V183 HydrophobicContact CD1-CG2 3.9Å; F179-V183 HydrophobicContact CE1-CB 4.2Å; F179-V183 HydrophobicContact CE1-CG2 3.33Å; F179-V183 HydrophobicContact CE2-CG2 4.2Å; F179-V183 HydrophobicContact CZ-CG2 3.43Å; F179-V183 VanDerWaalsContact CZ-CG2 3.43Å; F179-V183 WeakPolarHBondContact O-CG2 3.47Å; F179-V183 PolarHBondContact O-N 2.85Å; Y180-V183 PolarHBondContact O-N 3.46Å; V183-R185 VanDerWaalsContact C-N 3.32Å; V183-F186 CarbonylContact O-C 3.54Å; V183-F186 PolarHBondContact O-N 2.05Å; V183-S187 WeakPolarHBondContact O-CA 2.97Å; V183-S187 VanDerWaalsContact O-CB 3.3Å; V183-S187 WeakPolarHBondContact O-CB 3.44Å; V183-S187 PolarHBondContact O-N 3.16Å; V183-T211 HydrophobicContact CG2-CG2 4.42Å; V183-T235 HydrophobicContact CG1-CG2 4.29Å; V183-I239 HydrophobicContact CG2-CD1 4.08Å
184	I	40.5	Very low	37.1	Very low	69 Å²	69	47.5 Å²	47.5	35%	0.354	28%	0.276	S	S	.	.	H	α-helix	trans	-61	-45.7	172.3	-65.9	163.9	0	0	0	109.8	M167 Y180 V182 F186 S187 A192	M167-I184 HydrophobicContact CE-CB 3.86Å; M167-I184 HydrophobicContact CE-CG1 3.42Å; M167-I184 VanDerWaalsContact CE-CG1 3.42Å; M167-I184 HydrophobicContact CE-CG2 4.03Å; Y180-I184 VanDerWaalsContact O-CB 3.31Å; Y180-I184 WeakPolarHBondContact O-CB 3.45Å; Y180-I184 WeakPolarHBondContact O-CD1 3.46Å; Y180-I184 WeakPolarHBondContact O-CG1 3.27Å; Y180-I184 PolarHBondContact O-N 3.35Å; V182-I184 PolarHBondContact O-N 2.93Å; I184-F186 VanDerWaalsContact C-N 3.32Å; I184-F186 PolarHBondContact O-N 2.98Å; I184-S187 PolarHBondContact O-N 3.22Å; I184-S187 PolarHBondContact O-OG 2.78Å; I184-S187 VanDerWaalsContact O-OG 3.1Å; I184-A192 WeakPolarHBondContact O-CB 3.49Å
185	R	43.8	Very low	37.2	Very low	34 Å²	34	42.5 Å²	42.5	13%	0.128	25%	0.246	C	C	.	.	H	α-helix	trans	-64.2	-28.8	178.7	-72.4	-176.6	-172.1	-178.3	10.3	114.2	V181 V182 V183 A192 A193 L194 E199	V181-R185 VanDerWaalsContact CG1-NH2 3.32Å; V181-R185 VanDerWaalsContact O-CB 3.29Å; V181-R185 WeakPolarHBondContact O-CB 3.31Å; V181-R185 WeakPolarHBondContact O-CG 2.86Å; V181-R185 PolarHBondContact O-N 3.21Å; V182-R185 CarbonylContact O-C 3.46Å; V182-R185 WeakPolarHBondContact O-CB 3Å; V182-R185 PolarHBondContact O-N 3.07Å; V182-R185 VanDerWaalsContact O-N 3.17Å; V183-R185 VanDerWaalsContact C-N 3.32Å; R185-A192 WeakPolarHBondContact O-CB 3.49Å; R185-A193 WeakPolarHBondContact CG-O 3.38Å; R185-L194 VanDerWaalsContact O-CD2 3.3Å; R185-L194 WeakPolarHBondContact O-CD2 3.1Å; R185-E199 IonicContact CZ-OE1 2.88Å; R185-E199 IonicContact CZ-OE2 3.06Å; R185-E199 IonicContact NH1-OE1 2.75Å; R185-E199 IonicContact NH1-OE2 3.12Å; R185-E199 PolarHBondContact NH1-OE2 3.36Å; R185-E199 IonicContact NH2-OE1 3.98Å; R185-E199 PolarHBondContact NH2-OE1 3.48Å; R185-E199 IonicContact NH2-OE2 3.35Å; R185-E199 PolarHBondContact NH2-OE2 2.92Å; R185-E199 VanDerWaalsContact NH2-OE2 3.11Å
186	F	41.8	Very low	37.4	Very low	3 Å²	3	42.8 Å²	42.8	1%	0.013	25%	0.249	C	C	.	.	H	α-helix	trans	-106	5.5	177.2	-73.6	-78.9	0	0	0	114	V182 V183 I184 L194 L208 I239 A242 M246 L263	V182-F186 HydrophobicContact CG1-CD2 3.91Å; V182-F186 HydrophobicContact CG1-CE2 4.31Å; V182-F186 VanDerWaalsContact O-CD2 3.27Å; V182-F186 WeakPolarHBondContact O-CD2 3.18Å; V182-F186 PolarHBondContact O-N 3.08Å; V183-F186 CarbonylContact O-C 3.54Å; V183-F186 PolarHBondContact O-N 2.05Å; I184-F186 VanDerWaalsContact C-N 3.32Å; I184-F186 PolarHBondContact O-N 2.98Å; F186-L194 HydrophobicContact CD1-CD2 3.55Å; F186-L194 HydrophobicContact CD2-CD2 4.42Å; F186-L194 HydrophobicContact CE1-CD2 3.19Å; F186-L194 HydrophobicContact CE2-CD2 4.14Å; F186-L194 HydrophobicContact CG-CD2 4.15Å; F186-L194 HydrophobicContact CZ-CD2 3.52Å; F186-L208 HydrophobicContact CD2-CD2 4.15Å; F186-L208 HydrophobicContact CE2-CD2 3.76Å; F186-L208 HydrophobicContact CZ-CD2 4.41Å; F186-I239 HydrophobicContact CB-CG1 4.21Å; F186-I239 HydrophobicContact CD2-CG1 4.41Å; F186-I239 HydrophobicContact CG-CG1 4.34Å; F186-A242 HydrophobicContact CD1-CB 4.04Å; F186-A242 HydrophobicContact CE1-CB 3.17Å; F186-A242 HydrophobicContact CE2-CB 4.47Å; F186-A242 HydrophobicContact CZ-CB 3.45Å; F186-A242 VanDerWaalsContact CZ-CB 3.45Å; F186-M246 HydrophobicContact CZ-CE 3.79Å; F186-L263 HydrophobicContact CE1-CD2 3.93Å
187	S	40.1	Very low	37.2	Very low	6 Å²	6	54.2 Å²	54.2	4%	0.042	29%	0.291	C	S	.	.	S	Bend	trans	-68.4	156.5	175.9	83.6	0	0	0	0	110.1	V183 I184 A189	V183-S187 WeakPolarHBondContact O-CA 2.97Å; V183-S187 VanDerWaalsContact O-CB 3.3Å; V183-S187 WeakPolarHBondContact O-CB 3.44Å; V183-S187 PolarHBondContact O-N 3.16Å; I184-S187 PolarHBondContact O-N 3.22Å; I184-S187 PolarHBondContact O-OG 2.78Å; I184-S187 VanDerWaalsContact O-OG 3.1Å; S187-A189 PolarHBondContact O-N 3.13Å; S187-A189 WeakPolarHBondContact OG-CB 3.3Å; S187-A189 PolarHBondContact OG-N 2.78Å
188	S	38.2	Very low	37	Very low	20 Å²	20	56.8 Å²	56.8	14%	0.14	31%	0.308	C	S	.	.	S	Bend	trans	-73.3	12.4	-179.1	81.4	0	0	0	0	113.9	K269	S188-K269 WeakPolarHBondContact O-CE 3.49Å; S188-K269 PolarHBondContact O-NZ 2.96Å; S188-K269 WeakPolarHBondContact OG-CE 3.34Å; S188-K269 PolarHBondContact OG-NZ 3.41Å
189	A	36.4	Very low	37.4	Very low	44 Å²	44	57 Å²	57	36%	0.364	31%	0.309	S	S	.	.			trans	-80.4	138.4	-179	0	0	0	0	0	111.1	S187 N191 A192	S187-A189 PolarHBondContact O-N 3.13Å; S187-A189 WeakPolarHBondContact OG-CB 3.3Å; S187-A189 PolarHBondContact OG-N 2.78Å; A189-N191 PolarHBondContact O-N 3.2Å; A189-A192 WeakPolarHBondContact O-CB 3.49Å; A189-A192 PolarHBondContact O-N 3.21Å
190	P	31.7	Very low	38.2	Very low	129 Å²	129	66.3 Å²	66.3	84%	0.838	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-8.3	-177.7	24.3	-33.3	0	0	0	114.8
191	N	30	Very low	39.2	Very low	80 Å²	80	63.2 Å²	63.2	43%	0.428	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	11.9	-176.2	-54.5	-11.6	0	0	0	112.7	A189 A193	A189-N191 PolarHBondContact O-N 3.2Å; N191-A193 PolarHBondContact O-N 2.83Å
192	A	33.9	Very low	40	Very low	16 Å²	16	63.7 Å²	63.7	13%	0.132	34%	0.339	C	S	.	.			trans	-71.3	99.5	178.3	0	0	0	0	0	109.8	I184 R185 A189 L194	I184-A192 WeakPolarHBondContact O-CB 3.49Å; R185-A192 WeakPolarHBondContact O-CB 3.49Å; A189-A192 WeakPolarHBondContact O-CB 3.49Å; A189-A192 PolarHBondContact O-N 3.21Å; A192-L194 PolarHBondContact O-N 3.14Å; A192-L194 VanDerWaalsContact O-N 3.11Å
193	A	32.1	Very low	40.7	Very low	68 Å²	68	66.4 Å²	66.4	56%	0.562	36%	0.355	S	S	*	.			trans	-76	95.4	178.7	0	0	0	0	0	110.3	R185 N191 F195	R185-A193 WeakPolarHBondContact CG-O 3.38Å; N191-A193 PolarHBondContact O-N 2.83Å; A193-F195 PolarHBondContact O-N 2.87Å; A193-F195 VanDerWaalsContact O-N 3.12Å
194	L	38.7	Very low	41.6	Very low	20 Å²	20	66.2 Å²	66.2	11%	0.105	35%	0.354	C	S	.	.			trans	-56.9	-27.9	-172.9	-81.1	150.8	0	0	0	115.5	R185 F186 A192 L263 N267	R185-L194 VanDerWaalsContact O-CD2 3.3Å; R185-L194 WeakPolarHBondContact O-CD2 3.1Å; F186-L194 HydrophobicContact CD1-CD2 3.55Å; F186-L194 HydrophobicContact CD2-CD2 4.42Å; F186-L194 HydrophobicContact CE1-CD2 3.19Å; F186-L194 HydrophobicContact CE2-CD2 4.14Å; F186-L194 HydrophobicContact CG-CD2 4.15Å; F186-L194 HydrophobicContact CZ-CD2 3.52Å; A192-L194 PolarHBondContact O-N 3.14Å; A192-L194 VanDerWaalsContact O-N 3.11Å; L194-L263 HydrophobicContact CD1-CB 3.5Å; L194-L263 HydrophobicContact CD2-CB 4.33Å; L194-L263 HydrophobicContact CD2-CD1 4.29Å; L194-L263 HydrophobicContact CG-CB 4.48Å; L194-N267 VanDerWaalsContact CD1-ND2 3.34Å; L194-N267 WeakPolarHBondContact CD1-ND2 3.31Å
195	F	36.9	Very low	42.5	Very low	61 Å²	61	64 Å²	64	27%	0.268	34%	0.343	S	S	.	.			trans	-137.8	126.9	-176.7	-59.4	-80.9	0	0	0	111.1	A193 L201 L204 M246 L259 L263	A193-F195 PolarHBondContact O-N 2.87Å; A193-F195 VanDerWaalsContact O-N 3.12Å; F195-L201 HydrophobicContact CE1-CD1 4.39Å; F195-L204 HydrophobicContact CD1-CD1 3.84Å; F195-L204 HydrophobicContact CE1-CD1 4.19Å; F195-M246 HydrophobicContact CE1-CE 3.57Å; F195-M246 HydrophobicContact CZ-CE 3.67Å; F195-L259 HydrophobicContact CE2-CB 4.3Å; F195-L259 HydrophobicContact CZ-CB 4Å; F195-L263 HydrophobicContact CE2-CD1 3.49Å; F195-L263 VanDerWaalsContact CE2-CD1 3.49Å; F195-L263 HydrophobicContact CZ-CD1 3.36Å
196	G	34.9	Very low	43.3	Very low	34 Å²	34	68.4 Å²	68.4	35%	0.351	37%	0.366	S	S	.	.			trans	-71.5	134.8	158.2	0	0	0	0	0	108.3	N198 E199	G196-N198 PolarHBondContact O-N 3.44Å; G196-E199 PolarHBondContact O-N 3.1Å
197	R	33.5	Very low	43.8	Very low	254 Å²	254	70.6 Å²	70.6	96%	0.958	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-9.7	-170.5	-81.5	-176.6	174.2	174.1	-2.2	116.1
198	N	34	Very low	44.7	Very low	160 Å²	160	70.3 Å²	70.3	86%	0.856	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.3	7.8	-171.8	-63.6	-13.8	0	0	0	114.8	G196	G196-N198 PolarHBondContact O-N 3.44Å
199	E	45.5	Very low	45.8	Very low	63 Å²	63	71.1 Å²	71.1	29%	0.294	38%	0.378	S	S	.	.			trans	-85.5	128	179.4	-76.8	-179.4	173.4	0	0	111.4	R185 G196 L204 R207	R185-E199 IonicContact CZ-OE1 2.88Å; R185-E199 IonicContact CZ-OE2 3.06Å; R185-E199 IonicContact NH1-OE1 2.75Å; R185-E199 IonicContact NH1-OE2 3.12Å; R185-E199 PolarHBondContact NH1-OE2 3.36Å; R185-E199 IonicContact NH2-OE1 3.98Å; R185-E199 PolarHBondContact NH2-OE1 3.48Å; R185-E199 IonicContact NH2-OE2 3.35Å; R185-E199 PolarHBondContact NH2-OE2 2.92Å; R185-E199 VanDerWaalsContact NH2-OE2 3.11Å; G196-E199 PolarHBondContact O-N 3.1Å; E199-L204 HydrophobicContact CB-CD1 3.99Å; E199-R207 IonicContact OE1-NH1 3.97Å; E199-R207 PolarHBondContact OE1-NH1 3.2Å; E199-R207 IonicContact OE2-NH1 2.67Å
200	R	53.1	Low	46.6	Very low	197 Å²	197	73.4 Å²	73.4	74%	0.743	38%	0.381	S	S	*	.			trans	-64.8	135.8	174.8	-77.7	-176.3	175.5	174.8	-0.9	110.6	S202 T203 L204	R200-S202 PolarHBondContact O-N 3.4Å; R200-T203 WeakPolarHBondContact O-CB 2.78Å; R200-T203 PolarHBondContact O-N 3.25Å; R200-T203 VanDerWaalsContact O-N 3.12Å; R200-L204 PolarHBondContact O-N 3.2Å
201	L	56.1	Low	47.7	Very low	8 Å²	8	67.4 Å²	67.4	4%	0.042	34%	0.342	C	S	.	.	H	α-helix	trans	-59.5	-33.9	-176.4	-135.4	101.2	0	0	0	113.5	F195 L204 V205 M246 V249 I250 E256 L259	F195-L201 HydrophobicContact CE1-CD1 4.39Å; L201-L204 WeakPolarHBondContact O-CB 3.2Å; L201-L204 PolarHBondContact O-N 3.36Å; L201-V205 PolarHBondContact O-N 3.4Å; L201-M246 HydrophobicContact CD2-CB 3.7Å; L201-M246 HydrophobicContact CD2-CG 3.95Å; L201-M246 HydrophobicContact CG-CG 4.43Å; L201-V249 HydrophobicContact CD2-CB 4.35Å; L201-V249 HydrophobicContact CD2-CG1 4.17Å; L201-I250 HydrophobicContact CB-CD1 4.05Å; L201-I250 HydrophobicContact CB-CG1 4.01Å; L201-I250 HydrophobicContact CD2-CD1 3.92Å; L201-I250 HydrophobicContact CD2-CG1 3.61Å; L201-I250 HydrophobicContact CG-CD1 4.49Å; L201-I250 HydrophobicContact CG-CG1 4.43Å; L201-E256 HydrophobicContact CD1-CB 4.37Å; L201-E256 HydrophobicContact CD1-CG 3.98Å; L201-L259 HydrophobicContact CD1-CD1 3.41Å; L201-L259 VanDerWaalsContact CD1-CD1 3.41Å; L201-L259 HydrophobicContact CD2-CD1 3.52Å; L201-L259 HydrophobicContact CG-CD1 4.03Å
202	S	57.5	Low	49	Very low	66 Å²	66	64 Å²	64	46%	0.462	32%	0.324	S	S	.	.	H	α-helix	trans	-60.9	-44.4	176.8	51.7	0	0	0	0	112.2	R200 L204 V205 E206	R200-S202 PolarHBondContact O-N 3.4Å; S202-L204 VanDerWaalsContact C-N 3.28Å; S202-L204 PolarHBondContact O-N 3.07Å; S202-V205 PolarHBondContact O-N 2.99Å; S202-E206 PolarHBondContact O-N 3.3Å; S202-E206 VanDerWaalsContact O-N 3.1Å
203	T	57.2	Low	50.1	Low	57 Å²	57	67.9 Å²	67.9	35%	0.35	34%	0.342	S	S	.	.	H	α-helix	trans	-63.7	-36.4	177.4	-36.9	0	0	0	0	111	R200 E206 R207	R200-T203 WeakPolarHBondContact O-CB 2.78Å; R200-T203 PolarHBondContact O-N 3.25Å; R200-T203 VanDerWaalsContact O-N 3.12Å; T203-E206 PolarHBondContact O-N 2.98Å; T203-R207 WeakPolarHBondContact O-CB 3.35Å; T203-R207 VanDerWaalsContact O-CG 3.27Å; T203-R207 WeakPolarHBondContact O-CG 3.44Å; T203-R207 PolarHBondContact O-N 3.43Å
204	L	57.8	Low	51	Low	1 Å²	1	66.3 Å²	66.3	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-66.7	-39	174.5	-100.2	152.4	0	0	0	113.3	F195 E199 R200 L201 S202 E206 R207 L208 M246	F195-L204 HydrophobicContact CD1-CD1 3.84Å; F195-L204 HydrophobicContact CE1-CD1 4.19Å; E199-L204 HydrophobicContact CB-CD1 3.99Å; R200-L204 PolarHBondContact O-N 3.2Å; L201-L204 WeakPolarHBondContact O-CB 3.2Å; L201-L204 PolarHBondContact O-N 3.36Å; S202-L204 VanDerWaalsContact C-N 3.28Å; S202-L204 PolarHBondContact O-N 3.07Å; L204-E206 VanDerWaalsContact C-N 3.33Å; L204-R207 PolarHBondContact O-N 3.49Å; L204-L208 WeakPolarHBondContact O-CB 3.34Å; L204-L208 VanDerWaalsContact O-CG 3.28Å; L204-L208 WeakPolarHBondContact O-CG 3.4Å; L204-L208 PolarHBondContact O-N 3.48Å; L204-M246 HydrophobicContact CB-SD 4.22Å
205	V	59.4	Low	51.7	Low	22 Å²	22	65.6 Å²	65.6	13%	0.133	32%	0.323	C	S	.	.	H	α-helix	trans	-65.2	-39.2	175	169	0	0	0	0	111.5	L201 S202 L208 S209 K243 M246 I250	L201-V205 PolarHBondContact O-N 3.4Å; S202-V205 PolarHBondContact O-N 2.99Å; V205-L208 PolarHBondContact O-N 3.01Å; V205-S209 WeakPolarHBondContact O-CB 3.04Å; V205-S209 PolarHBondContact O-N 3.45Å; V205-S209 PolarHBondContact O-OG 3.49Å; V205-K243 HydrophobicContact CG1-CG 4.31Å; V205-M246 HydrophobicContact CG2-CB 3.46Å; V205-M246 VanDerWaalsContact CG2-CB 3.46Å; V205-M246 HydrophobicContact CG2-SD 4.37Å; V205-I250 HydrophobicContact CB-CD1 4.44Å; V205-I250 HydrophobicContact CG2-CD1 3.71Å
206	E	60.3	Low	52.6	Low	128 Å²	128	67.4 Å²	67.4	60%	0.598	33%	0.332	S	S	*	.	H	α-helix	trans	-65.9	-46.3	177.7	-153.6	166.3	-158.6	0	0	110.8	S202 T203 L204 L208 S209 Q210	S202-E206 PolarHBondContact O-N 3.3Å; S202-E206 VanDerWaalsContact O-N 3.1Å; T203-E206 PolarHBondContact O-N 2.98Å; L204-E206 VanDerWaalsContact C-N 3.33Å; E206-L208 PolarHBondContact O-N 3.28Å; E206-S209 WeakPolarHBondContact O-CA 3.49Å; E206-S209 VanDerWaalsContact O-CB 3.27Å; E206-S209 WeakPolarHBondContact O-CB 3.5Å; E206-S209 PolarHBondContact O-N 2.95Å; E206-Q210 PolarHBondContact O-N 2.79Å
207	R	53.3	Low	53.5	Low	49 Å²	49	71.8 Å²	71.8	19%	0.185	34%	0.342	C	S	.	.	H	α-helix	trans	-55.1	-48	170.8	-77.1	177.5	172.9	-172.3	-6.8	113	E178 V182 E199 T203 L204 S209 Q210 T211	E178-R207 HydrophobicContact CB-CG 3.95Å; E178-R207 HydrophobicContact CG-CG 4.17Å; E178-R207 IonicContact OE1-CZ 3.68Å; E178-R207 IonicContact OE1-NE 3.03Å; E178-R207 PolarHBondContact OE1-NE 2.72Å; E178-R207 IonicContact OE1-NH2 2.7Å; E178-R207 PolarHBondContact OE1-NH2 2.75Å; E178-R207 VanDerWaalsContact OE2-CG 3.26Å; E178-R207 WeakPolarHBondContact OE2-CG 3.22Å; E178-R207 IonicContact OE2-NE 3.11Å; V182-R207 HydrophobicContact CG2-CB 4.23Å; E199-R207 IonicContact OE1-NH1 3.97Å; E199-R207 PolarHBondContact OE1-NH1 3.2Å; E199-R207 IonicContact OE2-NH1 2.67Å; T203-R207 WeakPolarHBondContact O-CB 3.35Å; T203-R207 VanDerWaalsContact O-CG 3.27Å; T203-R207 WeakPolarHBondContact O-CG 3.44Å; T203-R207 PolarHBondContact O-N 3.43Å; L204-R207 PolarHBondContact O-N 3.49Å; R207-S209 PolarHBondContact O-N 3.48Å; R207-Q210 PolarHBondContact O-N 3.06Å; R207-T211 VanDerWaalsContact O-CB 3.24Å; R207-T211 WeakPolarHBondContact O-CB 3.45Å; R207-T211 PolarHBondContact O-N 3.34Å; R207-T211 PolarHBondContact O-OG1 2.68Å
208	L	59	Low	54.3	Low	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62.3	-32.6	176.5	-76.2	164.5	0	0	0	111.9	V182 F186 L204 V205 E206 T212 I239 K243 M246	V182-L208 HydrophobicContact CG1-CD2 3.39Å; V182-L208 HydrophobicContact CG1-CG 4.3Å; F186-L208 HydrophobicContact CD2-CD2 4.15Å; F186-L208 HydrophobicContact CE2-CD2 3.76Å; F186-L208 HydrophobicContact CZ-CD2 4.41Å; L204-L208 WeakPolarHBondContact O-CB 3.34Å; L204-L208 VanDerWaalsContact O-CG 3.28Å; L204-L208 WeakPolarHBondContact O-CG 3.4Å; L204-L208 PolarHBondContact O-N 3.48Å; V205-L208 PolarHBondContact O-N 3.01Å; E206-L208 PolarHBondContact O-N 3.28Å; L208-T212 WeakPolarHBondContact O-CB 3.49Å; L208-T212 PolarHBondContact O-N 3.35Å; L208-T212 PolarHBondContact O-OG1 3.04Å; L208-I239 HydrophobicContact CD2-CB 4.27Å; L208-I239 HydrophobicContact CD2-CG1 4.26Å; L208-I239 HydrophobicContact CD2-CG2 3.69Å; L208-K243 HydrophobicContact CB-CB 4.1Å; L208-K243 HydrophobicContact CB-CD 4.44Å; L208-K243 HydrophobicContact CB-CG 4.35Å; L208-K243 HydrophobicContact CD1-CB 4.13Å; L208-M246 HydrophobicContact CD1-CE 3.95Å; L208-M246 HydrophobicContact CD1-SD 3.49Å; L208-M246 WeakPolarHBondContact CD1-SD 3.33Å
209	S	60.2	Low	55.2	Low	37 Å²	37	55.7 Å²	55.7	26%	0.259	27%	0.273	S	S	.	.	H	α-helix	trans	-68.8	-50.8	178.4	-58.7	0	0	0	0	111.7	V205 E206 R207 T211 T212 L213 K243	V205-S209 WeakPolarHBondContact O-CB 3.04Å; V205-S209 PolarHBondContact O-N 3.45Å; V205-S209 PolarHBondContact O-OG 3.49Å; E206-S209 WeakPolarHBondContact O-CA 3.49Å; E206-S209 VanDerWaalsContact O-CB 3.27Å; E206-S209 WeakPolarHBondContact O-CB 3.5Å; E206-S209 PolarHBondContact O-N 2.95Å; R207-S209 PolarHBondContact O-N 3.48Å; S209-T211 PolarHBondContact O-N 3.03Å; S209-T212 PolarHBondContact O-N 3.14Å; S209-L213 PolarHBondContact O-N 3.18Å; S209-L213 VanDerWaalsContact O-N 3.1Å; S209-K243 WeakPolarHBondContact OG-CE 3.29Å; S209-K243 PolarHBondContact OG-NZ 3.35Å
210	Q	54	Low	55.7	Low	92 Å²	92	56.8 Å²	56.8	43%	0.43	29%	0.293	S	S	.	.	H	α-helix	trans	-58.9	-42.1	173.6	-69.8	-177.8	-3.6	0	0	110.6	E206 R207 T212 L213 C214	E206-Q210 PolarHBondContact O-N 2.79Å; R207-Q210 PolarHBondContact O-N 3.06Å; Q210-T212 VanDerWaalsContact C-N 3.35Å; Q210-T212 PolarHBondContact O-N 3.24Å; Q210-L213 WeakPolarHBondContact O-CB 3.27Å; Q210-L213 PolarHBondContact O-N 2.93Å; Q210-L213 VanDerWaalsContact O-N 3.16Å; Q210-C214 PolarHBondContact O-N 3.42Å; Q210-C214 PolarHBondContact O-SG 3.31Å; Q210-C214 VanDerWaalsContact O-SG 3.39Å
211	T	53.4	Low	55.4	Low	2 Å²	2	53.7 Å²	53.7	1%	0.012	29%	0.287	C	S	.	.	H	α-helix	trans	-60.1	-45.2	178.8	-60.9	0	0	0	0	112	F179 V182 V183 R207 S209 L213 C214 C215 I239	F179-T211 HydrophobicContact CB-CG2 4.41Å; F179-T211 HydrophobicContact CD2-CG2 3.18Å; F179-T211 HydrophobicContact CE2-CG2 3.31Å; F179-T211 VanDerWaalsContact CE2-O 3.29Å; F179-T211 WeakPolarHBondContact CE2-O 3.42Å; F179-T211 HydrophobicContact CG-CG2 3.89Å; F179-T211 HydrophobicContact CZ-CG2 4.18Å; V182-T211 HydrophobicContact CB-CG2 4.27Å; V182-T211 HydrophobicContact CG1-CG2 3.82Å; V183-T211 HydrophobicContact CG2-CG2 4.42Å; R207-T211 VanDerWaalsContact O-CB 3.24Å; R207-T211 WeakPolarHBondContact O-CB 3.45Å; R207-T211 PolarHBondContact O-N 3.34Å; R207-T211 PolarHBondContact O-OG1 2.68Å; S209-T211 PolarHBondContact O-N 3.03Å; T211-L213 VanDerWaalsContact C-N 3.32Å; T211-L213 PolarHBondContact O-N 3.34Å; T211-C214 PolarHBondContact O-N 2.89Å; T211-C215 PolarHBondContact O-N 3.16Å; T211-I239 HydrophobicContact CG2-CD1 3.97Å
212	T	57.5	Low	54.8	Low	8 Å²	8	54.5 Å²	54.5	5%	0.049	30%	0.295	C	S	.	.	H	α-helix	trans	-61.3	-42.5	177.4	-53.9	0	0	0	0	111.3	L208 S209 Q210 C215 Q216 I239 L240	L208-T212 WeakPolarHBondContact O-CB 3.49Å; L208-T212 PolarHBondContact O-N 3.35Å; L208-T212 PolarHBondContact O-OG1 3.04Å; S209-T212 PolarHBondContact O-N 3.14Å; Q210-T212 VanDerWaalsContact C-N 3.35Å; Q210-T212 PolarHBondContact O-N 3.24Å; T212-C215 PolarHBondContact O-N 3.34Å; T212-Q216 WeakPolarHBondContact O-CG 3.29Å; T212-Q216 PolarHBondContact O-N 3.31Å; T212-I239 WeakPolarHBondContact OG1-CG2 3.37Å; T212-L240 HydrophobicContact CG2-CD2 3.59Å; T212-L240 HydrophobicContact CG2-CG 4.04Å
213	L	56.8	Low	54.2	Low	99 Å²	99	59.7 Å²	59.7	52%	0.518	32%	0.317	S	S	.	.	H	α-helix	trans	-62.9	-43	179.9	-154.6	98.5	0	0	0	111.4	S209 Q210 T211 Q216 K217	S209-L213 PolarHBondContact O-N 3.18Å; S209-L213 VanDerWaalsContact O-N 3.1Å; Q210-L213 WeakPolarHBondContact O-CB 3.27Å; Q210-L213 PolarHBondContact O-N 2.93Å; Q210-L213 VanDerWaalsContact O-N 3.16Å; T211-L213 VanDerWaalsContact C-N 3.32Å; T211-L213 PolarHBondContact O-N 3.34Å; L213-Q216 PolarHBondContact O-N 3.21Å; L213-K217 PolarHBondContact O-N 2.97Å
214	C	51.5	Low	53.8	Low	35 Å²	35	58.6 Å²	58.6	24%	0.236	31%	0.309	C	S	.	.	H	α-helix	trans	-62.8	-44.7	175.8	-67.7	0	0	0	0	112.1	I176 F179 Q210 T211 Q216 K217 F218	I176-C214 HydrophobicContact CD1-CB 4.39Å; F179-C214 HydrophobicContact CD2-CB 4.03Å; F179-C214 HydrophobicContact CE2-CB 4.25Å; Q210-C214 PolarHBondContact O-N 3.42Å; Q210-C214 PolarHBondContact O-SG 3.31Å; Q210-C214 VanDerWaalsContact O-SG 3.39Å; T211-C214 PolarHBondContact O-N 2.89Å; C214-Q216 VanDerWaalsContact C-N 3.33Å; C214-Q216 PolarHBondContact O-N 2.99Å; C214-K217 PolarHBondContact O-N 3.29Å; C214-F218 WeakPolarHBondContact O-CB 3.34Å; C214-F218 PolarHBondContact O-N 2.83Å
215	C	53.3	Low	53.2	Low	4 Å²	4	65.2 Å²	65.2	3%	0.027	34%	0.344	C	S	.	.	H	α-helix	trans	-58.9	-42.9	173.8	-81.1	0	0	0	0	112.3	L170 F179 T211 T212 F218 I219 L232 M236	L170-C215 HydrophobicContact CD1-CB 4.32Å; F179-C215 HydrophobicContact CE2-CB 4.5Å; F179-C215 WeakPolarHBondContact CE2-SG 3.45Å; F179-C215 WeakPolarHBondContact CZ-SG 3.03Å; T211-C215 PolarHBondContact O-N 3.16Å; T212-C215 PolarHBondContact O-N 3.34Å; C215-F218 PolarHBondContact O-N 2.91Å; C215-I219 VanDerWaalsContact O-CG1 3.27Å; C215-I219 WeakPolarHBondContact O-CG1 3.11Å; C215-I219 PolarHBondContact O-N 3.37Å; C215-L232 HydrophobicContact CB-CD2 4.3Å; C215-M236 HydrophobicContact CB-CG 4.32Å; C215-M236 HydrophobicContact CB-SD 3.34Å; C215-M236 WeakPolarHBondContact CB-SD 3Å
216	Q	56.2	Low	52.5	Low	99 Å²	99	66.1 Å²	66.1	46%	0.463	36%	0.358	S	S	.	.	H	α-helix	trans	-65.4	-45.5	-179	-76.2	176.5	-21	0	0	111.8	T212 L213 C214 F218 I219 A220 M236	T212-Q216 WeakPolarHBondContact O-CG 3.29Å; T212-Q216 PolarHBondContact O-N 3.31Å; L213-Q216 PolarHBondContact O-N 3.21Å; C214-Q216 VanDerWaalsContact C-N 3.33Å; C214-Q216 PolarHBondContact O-N 2.99Å; Q216-F218 VanDerWaalsContact C-N 3.33Å; Q216-F218 PolarHBondContact O-N 3.4Å; Q216-I219 PolarHBondContact O-N 3.05Å; Q216-A220 WeakPolarHBondContact O-CB 3.31Å; Q216-A220 PolarHBondContact O-N 3.46Å; Q216-M236 HydrophobicContact CG-CE 4.12Å; Q216-M236 HydrophobicContact CG-SD 3.93Å
217	K	53	Low	51.7	Low	127 Å²	127	70.3 Å²	70.3	55%	0.552	37%	0.369	S	S	*	.	H	α-helix	trans	-59.3	-45	174.2	-78.8	-170.1	173.7	-172.7	0	111.5	L213 C214 I219 A220 E221	L213-K217 PolarHBondContact O-N 2.97Å; C214-K217 PolarHBondContact O-N 3.29Å; K217-I219 PolarHBondContact O-N 3.17Å; K217-A220 WeakPolarHBondContact O-CB 3.24Å; K217-A220 PolarHBondContact O-N 2.89Å; K217-A220 VanDerWaalsContact O-N 3.15Å; K217-E221 WeakPolarHBondContact O-CB 3.42Å; K217-E221 WeakPolarHBondContact O-CG 3.48Å; K217-E221 PolarHBondContact O-N 2.78Å
218	F	51.6	Low	51.3	Low	22 Å²	22	70.3 Å²	70.3	10%	0.096	37%	0.371	C	S	.	.	H	α-helix	trans	-60.9	-45.8	177.2	-178.4	-102.1	0	0	0	113.1	W154 L170 P171 C214 C215 Q216 A220 E221 A222 I224 L232	W154-F218 HydrophobicContact CZ3-CD2 4.32Å; L170-F218 HydrophobicContact CD1-CB 4.09Å; L170-F218 HydrophobicContact CD1-CD1 4.35Å; L170-F218 HydrophobicContact CD1-CG 4.26Å; L170-F218 HydrophobicContact CD2-CB 4.09Å; L170-F218 HydrophobicContact CD2-CD1 3.1Å; L170-F218 HydrophobicContact CD2-CD2 3.8Å; L170-F218 HydrophobicContact CD2-CE1 3.13Å; L170-F218 HydrophobicContact CD2-CE2 3.84Å; L170-F218 HydrophobicContact CD2-CG 3.38Å; L170-F218 HydrophobicContact CD2-CZ 3.46Å; L170-F218 VanDerWaalsContact CD2-CZ 3.46Å; L170-F218 HydrophobicContact CG-CD1 4.38Å; L170-F218 HydrophobicContact CG-CG 4.43Å; P171-F218 VanDerWaalsContact CD-CE2 3.46Å; P171-F218 HydrophobicContact CG-CD2 3.54Å; P171-F218 HydrophobicContact CG-CE2 3.86Å; C214-F218 WeakPolarHBondContact O-CB 3.34Å; C214-F218 PolarHBondContact O-N 2.83Å; C215-F218 PolarHBondContact O-N 2.91Å; Q216-F218 VanDerWaalsContact C-N 3.33Å; Q216-F218 PolarHBondContact O-N 3.4Å; F218-A220 PolarHBondContact O-N 3.38Å; F218-E221 PolarHBondContact O-N 3.49Å; F218-A222 HydrophobicContact CD1-CB 4.15Å; F218-A222 HydrophobicContact CD2-CB 3.98Å; F218-A222 HydrophobicContact CE1-CB 3.97Å; F218-A222 HydrophobicContact CE2-CB 3.8Å; F218-A222 HydrophobicContact CG-CB 4.23Å; F218-A222 HydrophobicContact CZ-CB 3.85Å; F218-A222 WeakPolarHBondContact O-CB 3.17Å; F218-A222 PolarHBondContact O-N 3.47Å; F218-I224 HydrophobicContact CD1-CD1 4.41Å; F218-I224 HydrophobicContact CE1-CD1 3.28Å; F218-I224 HydrophobicContact CE2-CD1 4.12Å; F218-I224 HydrophobicContact CZ-CD1 3.14Å; F218-L232 HydrophobicContact CD1-CD1 3.85Å; F218-L232 HydrophobicContact CD1-CD2 4.43Å; F218-L232 HydrophobicContact CE1-CD1 3.61Å
219	I	53.4	Low	50.7	Low	53 Å²	53	73.4 Å²	73.4	27%	0.272	39%	0.387	S	S	.	.	H	α-helix	trans	-61.2	-33.8	177.6	-71.6	166.1	0	0	0	111.2	C215 Q216 K217 L229 L232 M236	C215-I219 VanDerWaalsContact O-CG1 3.27Å; C215-I219 WeakPolarHBondContact O-CG1 3.11Å; C215-I219 PolarHBondContact O-N 3.37Å; Q216-I219 PolarHBondContact O-N 3.05Å; K217-I219 PolarHBondContact O-N 3.17Å; I219-L229 HydrophobicContact CB-CD2 4.36Å; I219-L229 HydrophobicContact CG1-CD2 4.09Å; I219-L229 HydrophobicContact CG2-CD2 3.76Å; I219-L232 HydrophobicContact CD1-CD2 4.01Å; I219-L232 HydrophobicContact CG1-CD2 4.04Å; I219-M236 HydrophobicContact CD1-CE 3.42Å; I219-M236 VanDerWaalsContact CD1-CE 3.42Å; I219-M236 HydrophobicContact CD1-SD 4.06Å
220	A	54.5	Low	50.2	Low	87 Å²	87	75 Å²	75	72%	0.719	40%	0.395	S	S	*	.	H	α-helix	trans	-74.9	-32.2	177.9	0	0	0	0	0	113.1	Q216 K217 F218	Q216-A220 WeakPolarHBondContact O-CB 3.31Å; Q216-A220 PolarHBondContact O-N 3.46Å; K217-A220 WeakPolarHBondContact O-CB 3.24Å; K217-A220 PolarHBondContact O-N 2.89Å; K217-A220 VanDerWaalsContact O-N 3.15Å; F218-A220 PolarHBondContact O-N 3.38Å
221	E	46.6	Very low	50	Low	131 Å²	131	72 Å²	72	61%	0.612	38%	0.383	S	S	*	.	H	α-helix	trans	-97.9	-20.3	-173.4	-70.2	173.3	-169	0	0	113.9	K217 F218	K217-E221 WeakPolarHBondContact O-CB 3.42Å; K217-E221 WeakPolarHBondContact O-CG 3.48Å; K217-E221 PolarHBondContact O-N 2.78Å; F218-E221 PolarHBondContact O-N 3.49Å
222	A	43.7	Very low	49.9	Very low	25 Å²	25	72.2 Å²	72.2	21%	0.207	38%	0.384	C	S	.	.			trans	-98.1	118.3	-169.8	0	0	0	0	0	112.8	F218 I224	F218-A222 HydrophobicContact CD1-CB 4.15Å; F218-A222 HydrophobicContact CD2-CB 3.98Å; F218-A222 HydrophobicContact CE1-CB 3.97Å; F218-A222 HydrophobicContact CE2-CB 3.8Å; F218-A222 HydrophobicContact CG-CB 4.23Å; F218-A222 HydrophobicContact CZ-CB 3.85Å; F218-A222 WeakPolarHBondContact O-CB 3.17Å; F218-A222 PolarHBondContact O-N 3.47Å; A222-I224 VanDerWaalsContact C-N 3.31Å; A222-I224 HydrophobicContact CB-CD1 3.34Å; A222-I224 HydrophobicContact CB-CG1 3.6Å; A222-I224 PolarHBondContact O-N 3.39Å
223	D	46.3	Very low	49.6	Very low	176 Å²	176	73.1 Å²	73.1	94%	0.941	40%	0.395	S	S	*	.			trans	-79.5	78.5	171.6	-164.6	18.3	0	0	0	109.9
224	I	48.9	Very low	49.5	Very low	34 Å²	34	73.4 Å²	73.4	17%	0.174	39%	0.389	C	S	.	.			trans	-118.6	138.4	-170.7	-59.1	176.8	0	0	0	110.9	F218 A222 Q228 L229	F218-I224 HydrophobicContact CD1-CD1 4.41Å; F218-I224 HydrophobicContact CE1-CD1 3.28Å; F218-I224 HydrophobicContact CE2-CD1 4.12Å; F218-I224 HydrophobicContact CZ-CD1 3.14Å; A222-I224 VanDerWaalsContact C-N 3.31Å; A222-I224 HydrophobicContact CB-CD1 3.34Å; A222-I224 HydrophobicContact CB-CG1 3.6Å; A222-I224 PolarHBondContact O-N 3.39Å; I224-Q228 HydrophobicContact CG2-CB 3.63Å; I224-Q228 HydrophobicContact CG2-CG 4.23Å; I224-L229 VanDerWaalsContact O-CD1 3.31Å; I224-L229 WeakPolarHBondContact O-CD1 3.25Å
225	D	45.3	Very low	49.5	Very low	139 Å²	139	72.4 Å²	72.4	74%	0.743	38%	0.382	S	S	*	.			trans	-49.8	134.6	177.6	-147.1	-8.5	0	0	0	113.1	R227 Q228	D225-R227 PolarHBondContact O-N 3.3Å; D225-Q228 PolarHBondContact O-N 3.05Å
226	G	44.2	Very low	49.7	Very low	42 Å²	42	73.5 Å²	73.5	43%	0.433	39%	0.387	S	S	.	.	H	α-helix	trans	-58.8	-22.3	-162.1	0	0	0	0	0	115.7	T230	G226-T230 PolarHBondContact O-N 3.21Å; G226-T230 VanDerWaalsContact O-N 3.13Å; G226-T230 PolarHBondContact O-OG1 3.43Å
227	R	42.2	Very low	49.7	Very low	216 Å²	216	70.2 Å²	70.2	82%	0.815	38%	0.375	S	S	*	.	H	α-helix	trans	-68.2	-38.5	175.2	-75.7	-174.5	-176.2	-175.6	4.1	112.9	D225 T230 V231	D225-R227 PolarHBondContact O-N 3.3Å; R227-T230 WeakPolarHBondContact O-CB 3.42Å; R227-T230 PolarHBondContact O-N 2.8Å; R227-V231 PolarHBondContact O-N 3.06Å
228	Q	45.2	Very low	49.8	Very low	49 Å²	49	65.6 Å²	65.6	23%	0.229	35%	0.354	C	S	.	.	H	α-helix	trans	-73.5	-38	-179.9	-65.2	-171.3	-7.6	0	0	111.3	I162 I224 D225 T230 V231 L232	I162-Q228 HydrophobicContact CG2-CG 4.41Å; I224-Q228 HydrophobicContact CG2-CB 3.63Å; I224-Q228 HydrophobicContact CG2-CG 4.23Å; D225-Q228 PolarHBondContact O-N 3.05Å; Q228-T230 PolarHBondContact O-N 3.15Å; Q228-V231 PolarHBondContact O-N 2.62Å; Q228-V231 VanDerWaalsContact O-N 3.13Å; Q228-L232 PolarHBondContact O-N 2.9Å
229	L	48	Very low	50	Low	64 Å²	64	64.5 Å²	64.5	34%	0.335	35%	0.349	S	S	.	.	H	α-helix	trans	-54.5	-37.4	167.3	-90.8	160	0	0	0	112.3	I219 I224 L232 G233	I219-L229 HydrophobicContact CB-CD2 4.36Å; I219-L229 HydrophobicContact CG1-CD2 4.09Å; I219-L229 HydrophobicContact CG2-CD2 3.76Å; I224-L229 VanDerWaalsContact O-CD1 3.31Å; I224-L229 WeakPolarHBondContact O-CD1 3.25Å; L229-L232 PolarHBondContact O-N 3.14Å; L229-G233 PolarHBondContact O-N 3.38Å
230	T	49.5	Very low	50.3	Low	70 Å²	70	64.8 Å²	64.8	43%	0.429	35%	0.351	S	S	.	.	H	α-helix	trans	-67.1	-39.9	178.3	-51.6	0	0	0	0	112	G226 R227 Q228 R234	G226-T230 PolarHBondContact O-N 3.21Å; G226-T230 VanDerWaalsContact O-N 3.13Å; G226-T230 PolarHBondContact O-OG1 3.43Å; R227-T230 WeakPolarHBondContact O-CB 3.42Å; R227-T230 PolarHBondContact O-N 2.8Å; Q228-T230 PolarHBondContact O-N 3.15Å; T230-R234 VanDerWaalsContact O-CG 3.31Å; T230-R234 WeakPolarHBondContact O-CG 3.36Å; T230-R234 PolarHBondContact O-N 3.11Å; T230-R234 VanDerWaalsContact O-N 3.07Å
231	V	49.5	Very low	50.5	Low	31 Å²	31	61.1 Å²	61.1	19%	0.188	32%	0.32	C	S	.	.	H	α-helix	trans	-69	-44.2	176.7	-175.8	0	0	0	0	110	D166 I168 R227 Q228 G233 R234 T235	D166-V231 HydrophobicContact CB-CG1 4.36Å; I168-V231 HydrophobicContact CD1-CG1 3.97Å; I168-V231 HydrophobicContact CG1-CG1 4.15Å; R227-V231 PolarHBondContact O-N 3.06Å; Q228-V231 PolarHBondContact O-N 2.62Å; Q228-V231 VanDerWaalsContact O-N 3.13Å; V231-G233 PolarHBondContact O-N 3.05Å; V231-R234 PolarHBondContact O-N 3.2Å; V231-T235 PolarHBondContact O-N 2.91Å; V231-T235 PolarHBondContact O-OG1 2.9Å; V231-T235 VanDerWaalsContact O-OG1 3.08Å
232	L	50.6	Low	51.1	Low	6 Å²	6	54.9 Å²	54.9	3%	0.031	29%	0.292	C	S	.	.	H	α-helix	trans	-56.3	-48.9	173.1	-115.1	140.8	0	0	0	112.3	I168 L170 C215 F218 I219 Q228 L229 R234 T235 M236	I168-L232 HydrophobicContact CB-CD1 4.44Å; I168-L232 HydrophobicContact CB-CG 4.3Å; I168-L232 VanDerWaalsContact CD1-CA 3.49Å; I168-L232 HydrophobicContact CD1-CB 4.21Å; I168-L232 HydrophobicContact CD1-CG 3.83Å; I168-L232 HydrophobicContact CG1-CB 4.41Å; I168-L232 HydrophobicContact CG1-CD1 4.15Å; I168-L232 HydrophobicContact CG1-CG 3.82Å; I168-L232 HydrophobicContact CG2-CD1 3.44Å; I168-L232 VanDerWaalsContact CG2-CD1 3.44Å; I168-L232 HydrophobicContact CG2-CD2 4.32Å; I168-L232 HydrophobicContact CG2-CG 3.65Å; L170-L232 HydrophobicContact CD1-CD2 4.14Å; L170-L232 HydrophobicContact CD2-CD1 4.02Å; L170-L232 HydrophobicContact CD2-CD2 4.29Å; C215-L232 HydrophobicContact CB-CD2 4.3Å; F218-L232 HydrophobicContact CD1-CD1 3.85Å; F218-L232 HydrophobicContact CD1-CD2 4.43Å; F218-L232 HydrophobicContact CE1-CD1 3.61Å; I219-L232 HydrophobicContact CD1-CD2 4.01Å; I219-L232 HydrophobicContact CG1-CD2 4.04Å; Q228-L232 PolarHBondContact O-N 2.9Å; L229-L232 PolarHBondContact O-N 3.14Å; L232-R234 VanDerWaalsContact C-N 3.3Å; L232-R234 PolarHBondContact O-N 2.96Å; L232-T235 PolarHBondContact O-N 2.94Å; L232-M236 WeakPolarHBondContact O-CB 3.28Å; L232-M236 PolarHBondContact O-N 3.1Å
233	G	52.4	Low	51.9	Low	26 Å²	26	56.5 Å²	56.5	27%	0.268	29%	0.294	S	S	.	.	H	α-helix	trans	-61.3	-36.9	178	0	0	0	0	0	112.9	L229 V231 S237	L229-G233 PolarHBondContact O-N 3.38Å; V231-G233 PolarHBondContact O-N 3.05Å; G233-S237 WeakPolarHBondContact O-CB 3.44Å; G233-S237 PolarHBondContact O-N 3.16Å; G233-S237 PolarHBondContact O-OG 3.07Å
234	R	53.5	Low	52.8	Low	106 Å²	106	52.3 Å²	52.3	40%	0.4	27%	0.267	S	S	.	.	H	α-helix	trans	-69.7	-47.2	175.4	-75	176.2	-175.4	176.1	4.3	111.9	T230 V231 L232 M236 S237 R238 T277	T230-R234 VanDerWaalsContact O-CG 3.31Å; T230-R234 WeakPolarHBondContact O-CG 3.36Å; T230-R234 PolarHBondContact O-N 3.11Å; T230-R234 VanDerWaalsContact O-N 3.07Å; V231-R234 PolarHBondContact O-N 3.2Å; L232-R234 VanDerWaalsContact C-N 3.3Å; L232-R234 PolarHBondContact O-N 2.96Å; R234-M236 VanDerWaalsContact C-N 3.33Å; R234-M236 PolarHBondContact O-N 2.7Å; R234-S237 PolarHBondContact O-N 3.45Å; R234-R238 WeakPolarHBondContact O-CG 2.89Å; R234-R238 PolarHBondContact O-N 2.95Å; R234-T277 HydrophobicContact CG-CG2 4.19Å
235	T	53	Low	53.4	Low	13 Å²	13	50.7 Å²	50.7	8%	0.08	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-41.7	177.2	-55.4	0	0	0	0	110.9	I168 V183 V231 L232 S237 R238 I239	I168-T235 HydrophobicContact CD1-CG2 4.33Å; I168-T235 WeakPolarHBondContact CD1-OG1 3.28Å; V183-T235 HydrophobicContact CG1-CG2 4.29Å; V231-T235 PolarHBondContact O-N 2.91Å; V231-T235 PolarHBondContact O-OG1 2.9Å; V231-T235 VanDerWaalsContact O-OG1 3.08Å; L232-T235 PolarHBondContact O-N 2.94Å; T235-S237 PolarHBondContact O-N 3.43Å; T235-R238 WeakPolarHBondContact O-CB 3.27Å; T235-R238 PolarHBondContact O-N 3.09Å; T235-R238 VanDerWaalsContact O-N 3.16Å; T235-I239 HydrophobicContact CG2-CD1 3.99Å; T235-I239 WeakPolarHBondContact O-CG1 3.44Å; T235-I239 PolarHBondContact O-N 2.99Å
236	M	56.1	Low	54.3	Low	28 Å²	28	44.1 Å²	44.1	14%	0.138	22%	0.224	C	C	.	.	H	α-helix	trans	-65.4	-38.6	176.3	-168.4	158.5	75.5	0	0	112	C215 Q216 I219 L232 R234 R238 I239 L240	C215-M236 HydrophobicContact CB-CG 4.32Å; C215-M236 HydrophobicContact CB-SD 3.34Å; C215-M236 WeakPolarHBondContact CB-SD 3Å; Q216-M236 HydrophobicContact CG-CE 4.12Å; Q216-M236 HydrophobicContact CG-SD 3.93Å; I219-M236 HydrophobicContact CD1-CE 3.42Å; I219-M236 VanDerWaalsContact CD1-CE 3.42Å; I219-M236 HydrophobicContact CD1-SD 4.06Å; L232-M236 WeakPolarHBondContact O-CB 3.28Å; L232-M236 PolarHBondContact O-N 3.1Å; R234-M236 VanDerWaalsContact C-N 3.33Å; R234-M236 PolarHBondContact O-N 2.7Å; M236-R238 VanDerWaalsContact C-N 3.29Å; M236-R238 PolarHBondContact O-N 3.19Å; M236-I239 PolarHBondContact O-N 3.44Å; M236-L240 HydrophobicContact CG-CD1 4.2Å; M236-L240 WeakPolarHBondContact O-CB 3.19Å; M236-L240 VanDerWaalsContact O-CG 3.32Å; M236-L240 WeakPolarHBondContact O-CG 3.32Å; M236-L240 PolarHBondContact O-N 2.96Å
237	S	55.9	Low	55.2	Low	30 Å²	30	45 Å²	45	21%	0.21	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-37.6	173.3	-62	0	0	0	0	112	G233 R234 T235 A241 T277	G233-S237 WeakPolarHBondContact O-CB 3.44Å; G233-S237 PolarHBondContact O-N 3.16Å; G233-S237 PolarHBondContact O-OG 3.07Å; R234-S237 PolarHBondContact O-N 3.45Å; T235-S237 PolarHBondContact O-N 3.43Å; S237-A241 WeakPolarHBondContact O-CB 3.3Å; S237-A241 PolarHBondContact O-N 2.86Å; S237-T277 WeakPolarHBondContact CB-O 3.4Å
238	R	55.2	Low	56.3	Low	29 Å²	29	35.1 Å²	35.1	11%	0.109	19%	0.185	C	C	.	.	H	α-helix	trans	-69.9	-44.4	175.6	-70	176.1	179.9	-176.4	0.9	112.6	R234 T235 M236 L240 A241 A242 V276	R234-R238 WeakPolarHBondContact O-CG 2.89Å; R234-R238 PolarHBondContact O-N 2.95Å; T235-R238 WeakPolarHBondContact O-CB 3.27Å; T235-R238 PolarHBondContact O-N 3.09Å; T235-R238 VanDerWaalsContact O-N 3.16Å; M236-R238 VanDerWaalsContact C-N 3.29Å; M236-R238 PolarHBondContact O-N 3.19Å; R238-L240 PolarHBondContact O-N 3.02Å; R238-A241 WeakPolarHBondContact O-CB 3.33Å; R238-A241 PolarHBondContact O-N 3.26Å; R238-A242 WeakPolarHBondContact O-CB 3.5Å; R238-A242 PolarHBondContact O-N 2.79Å; R238-V276 PolarHBondContact NE-O 3.42Å
239	I	56	Low	57.2	Low	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.1	-48	175.2	-77.4	165.9	0	0	0	110.6	V182 V183 F186 L208 T211 T212 T235 M236 A241 A242 K243	V182-I239 HydrophobicContact CG1-CD1 4.39Å; V182-I239 HydrophobicContact CG1-CG1 4.34Å; V183-I239 HydrophobicContact CG2-CD1 4.08Å; F186-I239 HydrophobicContact CB-CG1 4.21Å; F186-I239 HydrophobicContact CD2-CG1 4.41Å; F186-I239 HydrophobicContact CG-CG1 4.34Å; L208-I239 HydrophobicContact CD2-CB 4.27Å; L208-I239 HydrophobicContact CD2-CG1 4.26Å; L208-I239 HydrophobicContact CD2-CG2 3.69Å; T211-I239 HydrophobicContact CG2-CD1 3.97Å; T212-I239 WeakPolarHBondContact OG1-CG2 3.37Å; T235-I239 HydrophobicContact CG2-CD1 3.99Å; T235-I239 WeakPolarHBondContact O-CG1 3.44Å; T235-I239 PolarHBondContact O-N 2.99Å; M236-I239 PolarHBondContact O-N 3.44Å; I239-A241 VanDerWaalsContact C-N 3.34Å; I239-A241 PolarHBondContact O-N 2.9Å; I239-A242 PolarHBondContact O-N 3.17Å; I239-K243 VanDerWaalsContact O-CB 3.31Å; I239-K243 WeakPolarHBondContact O-CB 3.2Å; I239-K243 PolarHBondContact O-N 2.98Å
240	L	59.8	Low	58.1	Low	59 Å²	59	33.3 Å²	33.3	31%	0.309	18%	0.176	S	C	.	.	H	α-helix	trans	-62.3	-41.6	177.5	-79	169.8	0	0	0	112.2	T212 M236 R238 K244	T212-L240 HydrophobicContact CG2-CD2 3.59Å; T212-L240 HydrophobicContact CG2-CG 4.04Å; M236-L240 HydrophobicContact CG-CD1 4.2Å; M236-L240 WeakPolarHBondContact O-CB 3.19Å; M236-L240 VanDerWaalsContact O-CG 3.32Å; M236-L240 WeakPolarHBondContact O-CG 3.32Å; M236-L240 PolarHBondContact O-N 2.96Å; R238-L240 PolarHBondContact O-N 3.02Å; L240-K244 WeakPolarHBondContact O-CG 3Å; L240-K244 PolarHBondContact O-N 3.45Å
241	A	58	Low	59.1	Low	9 Å²	9	36.1 Å²	36.1	7%	0.074	18%	0.182	C	C	.	.	H	α-helix	trans	-64.4	-46.7	177.4	0	0	0	0	0	111.9	S237 R238 I239 K244 L245 I279	S237-A241 WeakPolarHBondContact O-CB 3.3Å; S237-A241 PolarHBondContact O-N 2.86Å; R238-A241 WeakPolarHBondContact O-CB 3.33Å; R238-A241 PolarHBondContact O-N 3.26Å; I239-A241 VanDerWaalsContact C-N 3.34Å; I239-A241 PolarHBondContact O-N 2.9Å; A241-K244 PolarHBondContact O-N 3.49Å; A241-L245 WeakPolarHBondContact O-CB 3.43Å; A241-L245 PolarHBondContact O-N 3.38Å; A241-I279 HydrophobicContact CB-CB 3.78Å; A241-I279 HydrophobicContact CB-CD1 3.61Å; A241-I279 HydrophobicContact CB-CG1 3.64Å
242	A	59.5	Low	60	Low	1 Å²	1	36.3 Å²	36.3	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-63.2	-42.5	175.8	0	0	0	0	0	111.9	F186 R238 I239 K244 L245 M246 L263	F186-A242 HydrophobicContact CD1-CB 4.04Å; F186-A242 HydrophobicContact CE1-CB 3.17Å; F186-A242 HydrophobicContact CE2-CB 4.47Å; F186-A242 HydrophobicContact CZ-CB 3.45Å; F186-A242 VanDerWaalsContact CZ-CB 3.45Å; R238-A242 WeakPolarHBondContact O-CB 3.5Å; R238-A242 PolarHBondContact O-N 2.79Å; I239-A242 PolarHBondContact O-N 3.17Å; A242-K244 PolarHBondContact O-N 3.01Å; A242-L245 WeakPolarHBondContact O-CB 3.25Å; A242-L245 PolarHBondContact O-N 3.41Å; A242-M246 HydrophobicContact CB-CE 4.47Å; A242-M246 WeakPolarHBondContact O-CB 3.46Å; A242-M246 VanDerWaalsContact O-CG 3.26Å; A242-M246 WeakPolarHBondContact O-CG 3.43Å; A242-M246 PolarHBondContact O-N 2.68Å; A242-L263 HydrophobicContact CB-CD2 3.84Å
243	K	62.1	Low	60.9	Low	58 Å²	58	40.3 Å²	40.3	25%	0.252	21%	0.209	S	C	.	.	H	α-helix	trans	-56.4	-52.2	173.8	178	179.2	162.2	174.9	0	110.8	V205 L208 S209 I239 L245 M246 T247	V205-K243 HydrophobicContact CG1-CG 4.31Å; L208-K243 HydrophobicContact CB-CB 4.1Å; L208-K243 HydrophobicContact CB-CD 4.44Å; L208-K243 HydrophobicContact CB-CG 4.35Å; L208-K243 HydrophobicContact CD1-CB 4.13Å; S209-K243 WeakPolarHBondContact OG-CE 3.29Å; S209-K243 PolarHBondContact OG-NZ 3.35Å; I239-K243 VanDerWaalsContact O-CB 3.31Å; I239-K243 WeakPolarHBondContact O-CB 3.2Å; I239-K243 PolarHBondContact O-N 2.98Å; K243-L245 VanDerWaalsContact C-N 3.3Å; K243-L245 PolarHBondContact O-N 3.16Å; K243-M246 PolarHBondContact O-N 2.91Å; K243-T247 WeakPolarHBondContact O-CB 3.32Å; K243-T247 PolarHBondContact O-N 3.43Å; K243-T247 PolarHBondContact O-OG1 2.79Å
244	K	63.6	Low	61.6	Low	89 Å²	89	39.4 Å²	39.4	39%	0.387	20%	0.197	S	C	.	.	H	α-helix	trans	-59.3	-41.8	178.7	-74.5	-179.9	-179.3	-175.4	0	112	L240 A241 A242 T247 C248 S281 L284	L240-K244 WeakPolarHBondContact O-CG 3Å; L240-K244 PolarHBondContact O-N 3.45Å; A241-K244 PolarHBondContact O-N 3.49Å; A242-K244 PolarHBondContact O-N 3.01Å; K244-T247 PolarHBondContact O-N 2.82Å; K244-C248 WeakPolarHBondContact O-CB 3.47Å; K244-C248 PolarHBondContact O-N 3.43Å; K244-S281 PolarHBondContact NZ-OG 3.15Å; K244-S281 VanDerWaalsContact NZ-OG 3.15Å; K244-L284 HydrophobicContact CB-CD1 3.46Å; K244-L284 VanDerWaalsContact CB-CD1 3.46Å; K244-L284 HydrophobicContact CD-CD1 4.46Å
245	L	62.5	Low	62.2	Low	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.5	-48.4	177.3	-172.1	79.6	0	0	0	111	A241 A242 K243 T247 C248 V249 L259 I262 L263 L284 L303 V307	A241-L245 WeakPolarHBondContact O-CB 3.43Å; A241-L245 PolarHBondContact O-N 3.38Å; A242-L245 WeakPolarHBondContact O-CB 3.25Å; A242-L245 PolarHBondContact O-N 3.41Å; K243-L245 VanDerWaalsContact C-N 3.3Å; K243-L245 PolarHBondContact O-N 3.16Å; L245-T247 PolarHBondContact O-N 3.1Å; L245-C248 WeakPolarHBondContact O-CB 3.39Å; L245-C248 PolarHBondContact O-N 3.4Å; L245-V249 WeakPolarHBondContact O-CG2 3.39Å; L245-V249 PolarHBondContact O-N 3.27Å; L245-L259 HydrophobicContact CB-CD2 4.38Å; L245-L259 HydrophobicContact CD2-CD2 3.43Å; L245-L259 VanDerWaalsContact CD2-CD2 3.43Å; L245-L259 HydrophobicContact CG-CD2 3.57Å; L245-I262 HydrophobicContact CD1-CD1 4.17Å; L245-I262 HydrophobicContact CD1-CG2 4.13Å; L245-I262 HydrophobicContact CD2-CB 4.04Å; L245-I262 HydrophobicContact CD2-CG2 3.49Å; L245-I262 VanDerWaalsContact CD2-CG2 3.49Å; L245-I262 HydrophobicContact CG-CG2 4.48Å; L245-L263 HydrophobicContact CD2-CD2 4.29Å; L245-L263 HydrophobicContact CD2-CG 4.18Å; L245-L284 HydrophobicContact CB-CD1 4.41Å; L245-L284 HydrophobicContact CB-CD2 4.47Å; L245-L284 HydrophobicContact CD1-CD2 3.55Å; L245-L303 HydrophobicContact CD1-CD1 4.26Å; L245-L303 HydrophobicContact CD1-CD2 3.91Å; L245-L303 HydrophobicContact CD1-CG 4.23Å; L245-V307 HydrophobicContact CD1-CG2 4.27Å
246	M	62.6	Low	62.8	Low	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.7	-42.5	177.2	-70.6	179.2	-166.9	0	0	112	F186 F195 L201 L204 V205 L208 A242 K243 C248 V249 I250 L259 L263	F186-M246 HydrophobicContact CZ-CE 3.79Å; F195-M246 HydrophobicContact CE1-CE 3.57Å; F195-M246 HydrophobicContact CZ-CE 3.67Å; L201-M246 HydrophobicContact CD2-CB 3.7Å; L201-M246 HydrophobicContact CD2-CG 3.95Å; L201-M246 HydrophobicContact CG-CG 4.43Å; L204-M246 HydrophobicContact CB-SD 4.22Å; V205-M246 HydrophobicContact CG2-CB 3.46Å; V205-M246 VanDerWaalsContact CG2-CB 3.46Å; V205-M246 HydrophobicContact CG2-SD 4.37Å; L208-M246 HydrophobicContact CD1-CE 3.95Å; L208-M246 HydrophobicContact CD1-SD 3.49Å; L208-M246 WeakPolarHBondContact CD1-SD 3.33Å; A242-M246 HydrophobicContact CB-CE 4.47Å; A242-M246 WeakPolarHBondContact O-CB 3.46Å; A242-M246 VanDerWaalsContact O-CG 3.26Å; A242-M246 WeakPolarHBondContact O-CG 3.43Å; A242-M246 PolarHBondContact O-N 2.68Å; K243-M246 PolarHBondContact O-N 2.91Å; M246-C248 VanDerWaalsContact C-N 3.3Å; M246-C248 PolarHBondContact O-N 3.4Å; M246-V249 PolarHBondContact O-N 2.89Å; M246-I250 VanDerWaalsContact O-CG1 3.31Å; M246-I250 WeakPolarHBondContact O-CG1 3.38Å; M246-I250 PolarHBondContact O-N 3.39Å; M246-L259 HydrophobicContact CG-CD1 4.39Å; M246-L259 HydrophobicContact CG-CD2 4.2Å; M246-L263 HydrophobicContact CE-CD1 4.15Å
247	T	64.9	Low	63	Low	61 Å²	61	44.9 Å²	44.9	37%	0.374	24%	0.237	S	C	.	.	H	α-helix	trans	-60.9	-40.3	174.6	-54.1	0	0	0	0	111.3	K243 K244 L245 K251	K243-T247 WeakPolarHBondContact O-CB 3.32Å; K243-T247 PolarHBondContact O-N 3.43Å; K243-T247 PolarHBondContact O-OG1 2.79Å; K244-T247 PolarHBondContact O-N 2.82Å; L245-T247 PolarHBondContact O-N 3.1Å; T247-K251 WeakPolarHBondContact O-CB 3.31Å; T247-K251 PolarHBondContact O-N 3.04Å
248	C	65.2	Low	63.2	Low	8 Å²	8	43.6 Å²	43.6	5%	0.054	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-44.3	175	-172.3	0	0	0	0	111.5	K244 L245 M246 K251 Y252	K244-C248 WeakPolarHBondContact O-CB 3.47Å; K244-C248 PolarHBondContact O-N 3.43Å; L245-C248 WeakPolarHBondContact O-CB 3.39Å; L245-C248 PolarHBondContact O-N 3.4Å; M246-C248 VanDerWaalsContact C-N 3.3Å; M246-C248 PolarHBondContact O-N 3.4Å; C248-K251 PolarHBondContact O-N 3.11Å; C248-Y252 VanDerWaalsContact O-CD2 3.23Å; C248-Y252 WeakPolarHBondContact O-CD2 3.34Å; C248-Y252 PolarHBondContact O-N 3.17Å; C248-Y252 VanDerWaalsContact O-N 3.11Å; C248-Y252 VanDerWaalsContact SG-CD2 3.58Å
249	V	63.9	Low	63.4	Low	3 Å²	3	42.3 Å²	42.3	2%	0.018	22%	0.223	C	C	.	.	H	α-helix	trans	-62.8	-44.9	178.3	167.6	0	0	0	0	111.8	L201 L245 M246 S253 I254 L259 L303	L201-V249 HydrophobicContact CD2-CB 4.35Å; L201-V249 HydrophobicContact CD2-CG1 4.17Å; L245-V249 WeakPolarHBondContact O-CG2 3.39Å; L245-V249 PolarHBondContact O-N 3.27Å; M246-V249 PolarHBondContact O-N 2.89Å; V249-S253 WeakPolarHBondContact O-CA 3.28Å; V249-S253 PolarHBondContact O-N 3.45Å; V249-I254 HydrophobicContact CB-CB 4.25Å; V249-I254 HydrophobicContact CG1-CB 4.05Å; V249-I254 WeakPolarHBondContact CG1-O 3.49Å; V249-I254 HydrophobicContact CG2-CB 4.07Å; V249-I254 HydrophobicContact CG2-CD1 4.46Å; V249-I254 HydrophobicContact CG2-CG2 4.27Å; V249-I254 PolarHBondContact O-N 3.25Å; V249-L259 HydrophobicContact CB-CD1 4.07Å; V249-L259 HydrophobicContact CB-CD2 4.33Å; V249-L259 HydrophobicContact CB-CG 4.34Å; V249-L259 HydrophobicContact CG1-CD1 3.8Å; V249-L259 HydrophobicContact CG1-CG 4.31Å; V249-L259 HydrophobicContact CG2-CD1 4.11Å; V249-L259 HydrophobicContact CG2-CD2 3.66Å; V249-L259 HydrophobicContact CG2-CG 3.82Å; V249-L303 HydrophobicContact CG2-CD2 4.08Å
250	I	66.2	Low	63.4	Low	72 Å²	72	44.7 Å²	44.7	37%	0.369	24%	0.243	S	C	.	.	H	α-helix	trans	-62.7	-50	175.7	-66	164.6	0	0	0	110.6	L201 V205 M246 Y252 S253	L201-I250 HydrophobicContact CB-CD1 4.05Å; L201-I250 HydrophobicContact CB-CG1 4.01Å; L201-I250 HydrophobicContact CD2-CD1 3.92Å; L201-I250 HydrophobicContact CD2-CG1 3.61Å; L201-I250 HydrophobicContact CG-CD1 4.49Å; L201-I250 HydrophobicContact CG-CG1 4.43Å; V205-I250 HydrophobicContact CB-CD1 4.44Å; V205-I250 HydrophobicContact CG2-CD1 3.71Å; M246-I250 VanDerWaalsContact O-CG1 3.31Å; M246-I250 WeakPolarHBondContact O-CG1 3.38Å; M246-I250 PolarHBondContact O-N 3.39Å; I250-Y252 PolarHBondContact O-N 2.88Å; I250-S253 PolarHBondContact O-N 2.63Å
251	K	71.1	Confident	63.2	Low	129 Å²	129	44.4 Å²	44.4	56%	0.561	25%	0.246	S	C	*	.	H	α-helix	trans	-59.7	-34.5	-174.4	-175.4	-177.8	176.5	-162.9	0	112.4	T247 C248	T247-K251 WeakPolarHBondContact O-CB 3.31Å; T247-K251 PolarHBondContact O-N 3.04Å; C248-K251 PolarHBondContact O-N 3.11Å
252	Y	67.4	Low	63.3	Low	35 Å²	35	44 Å²	44	14%	0.137	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	13.6	-174.6	-57	-56.4	0	0	0	113.7	C248 I250 I254 L286 N288 V291	C248-Y252 VanDerWaalsContact O-CD2 3.23Å; C248-Y252 WeakPolarHBondContact O-CD2 3.34Å; C248-Y252 PolarHBondContact O-N 3.17Å; C248-Y252 VanDerWaalsContact O-N 3.11Å; C248-Y252 VanDerWaalsContact SG-CD2 3.58Å; I250-Y252 PolarHBondContact O-N 2.88Å; Y252-I254 PolarHBondContact O-N 3.43Å; Y252-I254 VanDerWaalsContact O-N 3.14Å; Y252-L286 PolarHBondContact OH-O 3.23Å; Y252-N288 PolarHBondContact OH-OD1 2.99Å; Y252-V291 HydrophobicContact CD1-CB 3.97Å; Y252-V291 HydrophobicContact CD1-CG1 3.15Å; Y252-V291 HydrophobicContact CD1-CG2 3.89Å; Y252-V291 HydrophobicContact CD2-CG2 4.38Å; Y252-V291 HydrophobicContact CE1-CB 3.92Å; Y252-V291 HydrophobicContact CE1-CG1 3.63Å; Y252-V291 HydrophobicContact CE1-CG2 3.61Å; Y252-V291 HydrophobicContact CE2-CG2 4.18Å; Y252-V291 HydrophobicContact CG-CG1 3.69Å; Y252-V291 HydrophobicContact CG-CG2 4.24Å
253	S	70.5	Confident	63.1	Low	90 Å²	90	44.1 Å²	44.1	63%	0.629	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.1	40.6	178.9	-54.3	0	0	0	0	113.5	V249 I250 P296	V249-S253 WeakPolarHBondContact O-CA 3.28Å; V249-S253 PolarHBondContact O-N 3.45Å; I250-S253 PolarHBondContact O-N 2.63Å; S253-P296 WeakPolarHBondContact O-CB 3.24Å
254	I	67.3	Low	62.9	Low	7 Å²	7	45 Å²	45	4%	0.036	25%	0.251	C	S	.	.			trans	-73.5	150.2	179.7	-56.1	-179.9	0	0	0	108.7	V249 Y252 E256 L299 T300 L303	V249-I254 HydrophobicContact CB-CB 4.25Å; V249-I254 HydrophobicContact CG1-CB 4.05Å; V249-I254 WeakPolarHBondContact CG1-O 3.49Å; V249-I254 HydrophobicContact CG2-CB 4.07Å; V249-I254 HydrophobicContact CG2-CD1 4.46Å; V249-I254 HydrophobicContact CG2-CG2 4.27Å; V249-I254 PolarHBondContact O-N 3.25Å; Y252-I254 PolarHBondContact O-N 3.43Å; Y252-I254 VanDerWaalsContact O-N 3.14Å; I254-E256 PolarHBondContact O-N 2.88Å; I254-L299 HydrophobicContact CD1-CB 4.06Å; I254-L299 HydrophobicContact CG1-CB 3.9Å; I254-L299 HydrophobicContact CG1-CD1 4.42Å; I254-T300 WeakPolarHBondContact CG2-OG1 3.34Å; I254-L303 HydrophobicContact CD1-CD2 4.14Å
255	D	66.5	Low	62.5	Low	84 Å²	84	42.2 Å²	42.2	45%	0.449	24%	0.239	S	C	.	.			trans	-62.9	122.8	177.6	-178.9	0.6	0	0	0	111	S257 C258 T300	D255-S257 PolarHBondContact O-N 3.29Å; D255-S257 VanDerWaalsContact O-N 3.12Å; D255-S257 WeakPolarHBondContact OD1-CB 3.32Å; D255-S257 PolarHBondContact OD1-N 2.81Å; D255-S257 PolarHBondContact OD1-OG 3.24Å; D255-S257 PolarHBondContact OD2-OG 2.82Å; D255-C258 WeakPolarHBondContact O-CB 3.42Å; D255-C258 PolarHBondContact O-N 3.38Å; D255-C258 VanDerWaalsContact O-N 3.09Å; D255-C258 PolarHBondContact O-SG 2.69Å; D255-T300 PolarHBondContact N-OG1 3.21Å
256	E	63.9	Low	62	Low	108 Å²	108	43 Å²	43	51%	0.505	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-22.8	-179.7	-58.8	-172.7	163.5	0	0	112.7	L201 I254 C258 L259	L201-E256 HydrophobicContact CD1-CB 4.37Å; L201-E256 HydrophobicContact CD1-CG 3.98Å; I254-E256 PolarHBondContact O-N 2.88Å; E256-C258 PolarHBondContact O-N 2.84Å; E256-C258 VanDerWaalsContact O-N 3.15Å; E256-L259 VanDerWaalsContact O-CB 3.32Å; E256-L259 WeakPolarHBondContact O-CB 3.48Å; E256-L259 PolarHBondContact O-N 3.45Å
257	S	62	Low	61.5	Low	71 Å²	71	44.5 Å²	44.5	50%	0.497	25%	0.251	S	S	.	.	H	α-helix	trans	-57.4	-29.1	175.5	76.4	0	0	0	0	112.7	D255 L259	D255-S257 PolarHBondContact O-N 3.29Å; D255-S257 VanDerWaalsContact O-N 3.12Å; D255-S257 WeakPolarHBondContact OD1-CB 3.32Å; D255-S257 PolarHBondContact OD1-N 2.81Å; D255-S257 PolarHBondContact OD1-OG 3.24Å; D255-S257 PolarHBondContact OD2-OG 2.82Å; S257-L259 VanDerWaalsContact C-N 3.3Å; S257-L259 PolarHBondContact O-N 2.86Å
258	C	60	Low	60.8	Low	3 Å²	3	46.7 Å²	46.7	2%	0.02	25%	0.253	C	S	.	.	H	α-helix	trans	-67	-31	176.8	83.1	0	0	0	0	112.6	D255 E256 A260 S261 I262 T300	D255-C258 WeakPolarHBondContact O-CB 3.42Å; D255-C258 PolarHBondContact O-N 3.38Å; D255-C258 VanDerWaalsContact O-N 3.09Å; D255-C258 PolarHBondContact O-SG 2.69Å; E256-C258 PolarHBondContact O-N 2.84Å; E256-C258 VanDerWaalsContact O-N 3.15Å; C258-A260 PolarHBondContact O-N 2.96Å; C258-S261 PolarHBondContact O-N 2.97Å; C258-I262 WeakPolarHBondContact O-CB 3.27Å; C258-I262 VanDerWaalsContact O-CG1 3.3Å; C258-I262 WeakPolarHBondContact O-CG1 3.38Å; C258-I262 PolarHBondContact O-N 3.48Å; C258-T300 HydrophobicContact CB-CG2 3.48Å; C258-T300 VanDerWaalsContact CB-CG2 3.48Å
259	L	58.2	Low	60	Low	1 Å²	1	51.5 Å²	51.5	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-65.6	-42.6	-178.8	-72.3	165.9	0	0	0	111.1	F195 L201 L245 M246 V249 E256 S257 S261 I262 L263	F195-L259 HydrophobicContact CE2-CB 4.3Å; F195-L259 HydrophobicContact CZ-CB 4Å; L201-L259 HydrophobicContact CD1-CD1 3.41Å; L201-L259 VanDerWaalsContact CD1-CD1 3.41Å; L201-L259 HydrophobicContact CD2-CD1 3.52Å; L201-L259 HydrophobicContact CG-CD1 4.03Å; L245-L259 HydrophobicContact CB-CD2 4.38Å; L245-L259 HydrophobicContact CD2-CD2 3.43Å; L245-L259 VanDerWaalsContact CD2-CD2 3.43Å; L245-L259 HydrophobicContact CG-CD2 3.57Å; M246-L259 HydrophobicContact CG-CD1 4.39Å; M246-L259 HydrophobicContact CG-CD2 4.2Å; V249-L259 HydrophobicContact CB-CD1 4.07Å; V249-L259 HydrophobicContact CB-CD2 4.33Å; V249-L259 HydrophobicContact CB-CG 4.34Å; V249-L259 HydrophobicContact CG1-CD1 3.8Å; V249-L259 HydrophobicContact CG1-CG 4.31Å; V249-L259 HydrophobicContact CG2-CD1 4.11Å; V249-L259 HydrophobicContact CG2-CD2 3.66Å; V249-L259 HydrophobicContact CG2-CG 3.82Å; E256-L259 VanDerWaalsContact O-CB 3.32Å; E256-L259 WeakPolarHBondContact O-CB 3.48Å; E256-L259 PolarHBondContact O-N 3.45Å; S257-L259 VanDerWaalsContact C-N 3.3Å; S257-L259 PolarHBondContact O-N 2.86Å; L259-S261 VanDerWaalsContact C-N 3.3Å; L259-S261 PolarHBondContact O-N 3.37Å; L259-I262 PolarHBondContact O-N 2.94Å; L259-L263 HydrophobicContact CB-CD1 4.37Å; L259-L263 WeakPolarHBondContact O-CB 3.36Å; L259-L263 WeakPolarHBondContact O-CD1 3.44Å; L259-L263 WeakPolarHBondContact O-CG 3.27Å; L259-L263 PolarHBondContact O-N 2.92Å
260	A	55.6	Low	59.1	Low	51 Å²	51	51.9 Å²	51.9	42%	0.421	28%	0.275	S	S	.	.	H	α-helix	trans	-60.7	-43.3	177.9	0	0	0	0	0	111	C258 D264	C258-A260 PolarHBondContact O-N 2.96Å; A260-D264 VanDerWaalsContact O-CB 3.25Å; A260-D264 WeakPolarHBondContact O-CB 3.42Å; A260-D264 PolarHBondContact O-N 3.18Å
261	S	57.1	Low	57.9	Low	53 Å²	53	60.2 Å²	60.2	37%	0.371	30%	0.302	S	S	.	.	H	α-helix	trans	-64.2	-51.1	177.3	-179.2	0	0	0	0	112.1	C258 L259 L263 D264 Q265 Q304	C258-S261 PolarHBondContact O-N 2.97Å; L259-S261 VanDerWaalsContact C-N 3.3Å; L259-S261 PolarHBondContact O-N 3.37Å; S261-L263 PolarHBondContact O-N 3.19Å; S261-D264 PolarHBondContact O-N 3.06Å; S261-Q265 WeakPolarHBondContact O-CG 3.39Å; S261-Q265 PolarHBondContact O-N 2.88Å; S261-Q304 PolarHBondContact OG-NE2 3.43Å; S261-Q304 VanDerWaalsContact OG-NE2 3.08Å; S261-Q304 PolarHBondContact OG-OE1 3.33Å
262	I	58.5	Low	56.4	Low	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-63	-42.8	-179.4	-69.4	167.9	0	0	0	111.1	L245 C258 L259 Q265 L266 L303 V307	L245-I262 HydrophobicContact CD1-CD1 4.17Å; L245-I262 HydrophobicContact CD1-CG2 4.13Å; L245-I262 HydrophobicContact CD2-CB 4.04Å; L245-I262 HydrophobicContact CD2-CG2 3.49Å; L245-I262 VanDerWaalsContact CD2-CG2 3.49Å; L245-I262 HydrophobicContact CG-CG2 4.48Å; C258-I262 WeakPolarHBondContact O-CB 3.27Å; C258-I262 VanDerWaalsContact O-CG1 3.3Å; C258-I262 WeakPolarHBondContact O-CG1 3.38Å; C258-I262 PolarHBondContact O-N 3.48Å; L259-I262 PolarHBondContact O-N 2.94Å; I262-Q265 PolarHBondContact O-N 3.09Å; I262-L266 HydrophobicContact CG2-CD1 3.81Å; I262-L266 WeakPolarHBondContact O-CD1 3.32Å; I262-L266 VanDerWaalsContact O-CG 3.27Å; I262-L266 WeakPolarHBondContact O-CG 3.17Å; I262-L266 PolarHBondContact O-N 3.38Å; I262-L303 HydrophobicContact CD1-CD2 3.97Å; I262-L303 HydrophobicContact CD1-CG 3.97Å; I262-V307 HydrophobicContact CD1-CG2 4.34Å; I262-V307 HydrophobicContact CG2-CB 4.22Å; I262-V307 HydrophobicContact CG2-CG1 3.66Å; I262-V307 HydrophobicContact CG2-CG2 4.18Å
263	L	56.8	Low	55.3	Low	4 Å²	4	59.4 Å²	59.4	2%	0.021	31%	0.312	C	S	.	.	H	α-helix	trans	-73	-34	-179.9	-68.5	167.3	0	0	0	112.5	F186 L194 F195 A242 L245 M246 L259 S261 Q265 L266 N267	F186-L263 HydrophobicContact CE1-CD2 3.93Å; L194-L263 HydrophobicContact CD1-CB 3.5Å; L194-L263 HydrophobicContact CD2-CB 4.33Å; L194-L263 HydrophobicContact CD2-CD1 4.29Å; L194-L263 HydrophobicContact CG-CB 4.48Å; F195-L263 HydrophobicContact CE2-CD1 3.49Å; F195-L263 VanDerWaalsContact CE2-CD1 3.49Å; F195-L263 HydrophobicContact CZ-CD1 3.36Å; A242-L263 HydrophobicContact CB-CD2 3.84Å; L245-L263 HydrophobicContact CD2-CD2 4.29Å; L245-L263 HydrophobicContact CD2-CG 4.18Å; M246-L263 HydrophobicContact CE-CD1 4.15Å; L259-L263 HydrophobicContact CB-CD1 4.37Å; L259-L263 WeakPolarHBondContact O-CB 3.36Å; L259-L263 WeakPolarHBondContact O-CD1 3.44Å; L259-L263 WeakPolarHBondContact O-CG 3.27Å; L259-L263 PolarHBondContact O-N 2.92Å; S261-L263 PolarHBondContact O-N 3.19Å; L263-Q265 VanDerWaalsContact C-N 3.34Å; L263-L266 HydrophobicContact CD2-CD1 3.91Å; L263-L266 PolarHBondContact O-N 3.12Å; L263-N267 WeakPolarHBondContact O-CB 3.3Å; L263-N267 PolarHBondContact O-N 3.03Å
264	D	57	Low	54.1	Low	76 Å²	76	62.2 Å²	62.2	41%	0.406	31%	0.313	S	S	.	.	H	α-helix	trans	-59.6	-47	169	-173.9	59.1	0	0	0	110.4	A260 S261 L266 N267 R268	A260-D264 VanDerWaalsContact O-CB 3.25Å; A260-D264 WeakPolarHBondContact O-CB 3.42Å; A260-D264 PolarHBondContact O-N 3.18Å; S261-D264 PolarHBondContact O-N 3.06Å; D264-L266 VanDerWaalsContact C-N 3.32Å; D264-L266 PolarHBondContact O-N 3.11Å; D264-N267 CarbonylContact O-C 3.57Å; D264-N267 PolarHBondContact O-N 2.67Å; D264-N267 VanDerWaalsContact O-N 3.09Å; D264-R268 WeakPolarHBondContact O-CG 3.19Å; D264-R268 PolarHBondContact O-N 3.18Å; D264-R268 IonicContact OD2-CZ 3.18Å; D264-R268 IonicContact OD2-NE 3.38Å; D264-R268 PolarHBondContact OD2-NE 3.33Å; D264-R268 IonicContact OD2-NH2 3.63Å; D264-R268 PolarHBondContact OD2-NH2 3Å
265	Q	54.7	Low	53	Low	30 Å²	30	61.9 Å²	61.9	14%	0.14	31%	0.312	C	S	.	.	H	α-helix	trans	-60.8	-38.8	176.8	-72	179.2	-35.4	0	0	112.9	S261 I262 L263 N267 R268 N308 L311	S261-Q265 WeakPolarHBondContact O-CG 3.39Å; S261-Q265 PolarHBondContact O-N 2.88Å; I262-Q265 PolarHBondContact O-N 3.09Å; L263-Q265 VanDerWaalsContact C-N 3.34Å; Q265-N267 VanDerWaalsContact C-N 3.33Å; Q265-R268 PolarHBondContact O-N 2.89Å; Q265-N308 PolarHBondContact NE2-OD1 3.36Å; Q265-N308 PolarHBondContact OE1-OD1 2.84Å; Q265-L311 HydrophobicContact CB-CD1 3.67Å
266	L	53.7	Low	52	Low	17 Å²	17	58.4 Å²	58.4	9%	0.089	29%	0.293	C	S	.	.	H	α-helix	trans	-67	-33.2	174.6	-73.1	158.8	0	0	0	112.8	I262 L263 D264 V276 I279 L311	I262-L266 HydrophobicContact CG2-CD1 3.81Å; I262-L266 WeakPolarHBondContact O-CD1 3.32Å; I262-L266 VanDerWaalsContact O-CG 3.27Å; I262-L266 WeakPolarHBondContact O-CG 3.17Å; I262-L266 PolarHBondContact O-N 3.38Å; L263-L266 HydrophobicContact CD2-CD1 3.91Å; L263-L266 PolarHBondContact O-N 3.12Å; D264-L266 VanDerWaalsContact C-N 3.32Å; D264-L266 PolarHBondContact O-N 3.11Å; L266-V276 HydrophobicContact CD2-CB 3.94Å; L266-V276 HydrophobicContact CD2-CG1 3.67Å; L266-I279 HydrophobicContact CD1-CD1 3.45Å; L266-I279 VanDerWaalsContact CD1-CD1 3.45Å; L266-I279 HydrophobicContact CD1-CG1 4.33Å; L266-I279 HydrophobicContact CD2-CD1 3.66Å; L266-I279 HydrophobicContact CD2-CG1 3.59Å; L266-I279 HydrophobicContact CG-CD1 4.21Å; L266-L311 HydrophobicContact CD2-CD2 3.37Å; L266-L311 HydrophobicContact CG-CD2 4.01Å
267	N	50.6	Low	51.1	Low	32 Å²	32	55.1 Å²	55.1	17%	0.171	28%	0.28	C	S	.	.	H	α-helix	trans	-82.4	-17.9	179.6	-85.2	-13.5	0	0	0	113.7	L194 L263 D264 Q265 K269	L194-N267 VanDerWaalsContact CD1-ND2 3.34Å; L194-N267 WeakPolarHBondContact CD1-ND2 3.31Å; L263-N267 WeakPolarHBondContact O-CB 3.3Å; L263-N267 PolarHBondContact O-N 3.03Å; D264-N267 CarbonylContact O-C 3.57Å; D264-N267 PolarHBondContact O-N 2.67Å; D264-N267 VanDerWaalsContact O-N 3.09Å; Q265-N267 VanDerWaalsContact C-N 3.33Å; N267-K269 PolarHBondContact O-N 3.31Å
268	R	50.6	Low	50.4	Low	107 Å²	107	60.1 Å²	60.1	40%	0.404	29%	0.289	S	S	.	.			trans	-60	110.6	174.6	-78.1	175.9	-169.8	-174.7	3.8	110.3	D264 Q265 C270 E321	D264-R268 WeakPolarHBondContact O-CG 3.19Å; D264-R268 PolarHBondContact O-N 3.18Å; D264-R268 IonicContact OD2-CZ 3.18Å; D264-R268 IonicContact OD2-NE 3.38Å; D264-R268 PolarHBondContact OD2-NE 3.33Å; D264-R268 IonicContact OD2-NH2 3.63Å; D264-R268 PolarHBondContact OD2-NH2 3Å; Q265-R268 PolarHBondContact O-N 2.89Å; R268-C270 PolarHBondContact O-N 2.97Å; R268-C270 VanDerWaalsContact O-N 3.14Å; R268-E321 IonicContact NH1-OE1 2.89Å; R268-E321 PolarHBondContact NH1-OE1 3.48Å
269	K	48.1	Very low	49.9	Very low	109 Å²	109	60.9 Å²	60.9	47%	0.474	29%	0.292	S	S	.	.			trans	-71.4	102.4	170.8	-76.7	-177.9	170.3	170.1	0	108.8	S188 N267	S188-K269 WeakPolarHBondContact O-CE 3.49Å; S188-K269 PolarHBondContact O-NZ 2.96Å; S188-K269 WeakPolarHBondContact OG-CE 3.34Å; S188-K269 PolarHBondContact OG-NZ 3.41Å; N267-K269 PolarHBondContact O-N 3.31Å
270	C	44.5	Very low	49.4	Very low	10 Å²	10	62.4 Å²	62.4	7%	0.068	30%	0.302	C	S	.	.			trans	-70.4	138.4	159.9	110.5	0	0	0	0	109	R268 V272 C273 K274 C316	R268-C270 PolarHBondContact O-N 2.97Å; R268-C270 VanDerWaalsContact O-N 3.14Å; C270-V272 PolarHBondContact O-N 3.38Å; C270-C273 WeakPolarHBondContact CB-SG 3.25Å; C270-C273 VanDerWaalsContact SG-CA 3.59Å; C270-C273 WeakPolarHBondContact SG-CB 3.34Å; C270-C273 PolarHBondContact SG-N 3.27Å; C270-C273 CovalentContact SG-SG 2.05Å; C270-C273 PolarHBondContact SG-SG 3.38Å; C270-K274 PolarHBondContact O-N 2.92Å; C270-C316 HydrophobicContact CB-CB 3.87Å; C270-C316 WeakPolarHBondContact SG-CB 3.41Å; C270-C316 PolarHBondContact SG-SG 3.48Å
271	R	42.9	Very low	48.8	Very low	247 Å²	247	62.6 Å²	62.6	93%	0.932	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-29.4	-176.2	-87.3	-178.3	171.9	179.7	-2.6	113.3
272	V	39	Very low	48.4	Very low	119 Å²	119	65.4 Å²	65.4	72%	0.721	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-43.6	-172.3	-174.1	0	0	0	0	112.5	C270	C270-V272 PolarHBondContact O-N 3.38Å
273	C	43	Very low	47.9	Very low	29 Å²	29	65.6 Å²	65.6	20%	0.196	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-7.1	-173.1	61	0	0	0	0	114.7	C270 G275 N315 C316	C270-C273 WeakPolarHBondContact CB-SG 3.25Å; C270-C273 VanDerWaalsContact SG-CA 3.59Å; C270-C273 WeakPolarHBondContact SG-CB 3.34Å; C270-C273 PolarHBondContact SG-N 3.27Å; C270-C273 CovalentContact SG-SG 2.05Å; C270-C273 PolarHBondContact SG-SG 3.38Å; C273-G275 PolarHBondContact O-N 2.83Å; C273-G275 VanDerWaalsContact O-N 3.16Å; C273-N315 HydrophobicContact CB-CB 4.07Å; C273-C316 HydrophobicContact CB-CB 3.63Å; C273-C316 WeakPolarHBondContact SG-CB 3.21Å
274	K	46.6	Very low	47.7	Very low	148 Å²	148	66.2 Å²	66.2	64%	0.643	32%	0.316	S	S	*	.			trans	57.9	22.9	-175.3	-57.1	-175.6	178	-178.4	0	114	C270	C270-K274 PolarHBondContact O-N 2.92Å
275	G	43.5	Very low	47.4	Very low	1 Å²	1	68.5 Å²	68.5	1%	0.01	33%	0.327	C	S	.	.	S	Bend	trans	92.2	173.1	177.6	0	0	0	0	0	114.3	C273 T277 N315	C273-G275 PolarHBondContact O-N 2.83Å; C273-G275 VanDerWaalsContact O-N 3.16Å; G275-T277 PolarHBondContact O-N 3.19Å; G275-N315 PolarHBondContact O-ND2 3.29Å
276	V	46.7	Very low	47.5	Very low	10 Å²	10	67.8 Å²	67.8	6%	0.061	33%	0.325	C	S	.	.			trans	-76.9	119.2	-180	179.7	0	0	0	0	108.4	R238 L266 L311 N315	R238-V276 PolarHBondContact NE-O 3.42Å; L266-V276 HydrophobicContact CD2-CB 3.94Å; L266-V276 HydrophobicContact CD2-CG1 3.67Å; V276-L311 HydrophobicContact CB-CD2 3.91Å; V276-L311 HydrophobicContact CG1-CD2 3.69Å; V276-L311 HydrophobicContact CG2-CB 4.48Å; V276-L311 HydrophobicContact CG2-CD2 3.35Å; V276-L311 HydrophobicContact CG2-CG 4.45Å; V276-N315 WeakPolarHBondContact CA-ND2 3.38Å; V276-N315 HydrophobicContact CG2-CB 4.12Å
277	T	44.5	Very low	47.5	Very low	39 Å²	39	69.1 Å²	69.1	24%	0.239	33%	0.334	C	S	.	.			trans	-97.3	-20.3	-174.4	46.4	0	0	0	0	112.9	R234 S237 G275 N315	R234-T277 HydrophobicContact CG-CG2 4.19Å; S237-T277 WeakPolarHBondContact CB-O 3.4Å; G275-T277 PolarHBondContact O-N 3.19Å; T277-N315 PolarHBondContact N-ND2 2.8Å; T277-N315 VanDerWaalsContact N-ND2 3.18Å; T277-N315 PolarHBondContact OG1-ND2 2.81Å
278	R	46.1	Very low	47.7	Very low	177 Å²	177	72.3 Å²	72.3	67%	0.668	35%	0.351	S	S	*	.			trans	-148.1	129	179.6	-70.8	-176.4	174.8	171.1	-2.4	109.8
279	I	50.2	Low	47.9	Very low	19 Å²	19	70.7 Å²	70.7	10%	0.097	36%	0.357	C	S	.	.			trans	-87.8	121	156.3	-58.3	-178.7	0	0	0	105.8	A241 L266 S281 A283 L284	A241-I279 HydrophobicContact CB-CB 3.78Å; A241-I279 HydrophobicContact CB-CD1 3.61Å; A241-I279 HydrophobicContact CB-CG1 3.64Å; L266-I279 HydrophobicContact CD1-CD1 3.45Å; L266-I279 VanDerWaalsContact CD1-CD1 3.45Å; L266-I279 HydrophobicContact CD1-CG1 4.33Å; L266-I279 HydrophobicContact CD2-CD1 3.66Å; L266-I279 HydrophobicContact CD2-CG1 3.59Å; L266-I279 HydrophobicContact CG-CD1 4.21Å; I279-S281 PolarHBondContact O-N 3.04Å; I279-A283 HydrophobicContact CG2-CB 4.02Å; I279-L284 HydrophobicContact CG2-CD1 3.95Å; I279-L284 HydrophobicContact CG2-CG 4.05Å
280	P	47.2	Very low	48.4	Very low	32 Å²	32	66.4 Å²	66.4	21%	0.208	34%	0.338	C	S	.	.			trans	-57.8	130.1	177	-28.5	40.2	0	0	0	109.9	N282 A283 Y310 D314	P280-N282 PolarHBondContact O-N 3.21Å; P280-A283 WeakPolarHBondContact O-CB 3.24Å; P280-A283 PolarHBondContact O-N 3.01Å; P280-Y310 HydrophobicContact CB-CD1 4.03Å; P280-Y310 HydrophobicContact CB-CE1 3.77Å; P280-Y310 HydrophobicContact CG-CD1 3.45Å; P280-Y310 VanDerWaalsContact CG-CD1 3.45Å; P280-Y310 HydrophobicContact CG-CE1 3.67Å; P280-Y310 HydrophobicContact CG-CG 4.4Å; P280-D314 WeakPolarHBondContact CG-OD2 3.43Å
281	S	44.5	Very low	49.1	Very low	56 Å²	56	66.9 Å²	66.9	39%	0.392	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-47	-34.4	178.3	-51.3	0	0	0	0	112.9	K244 I279 A283 L284	K244-S281 PolarHBondContact NZ-OG 3.15Å; K244-S281 VanDerWaalsContact NZ-OG 3.15Å; I279-S281 PolarHBondContact O-N 3.04Å; S281-A283 VanDerWaalsContact C-N 3.29Å; S281-A283 PolarHBondContact O-N 2.95Å; S281-L284 PolarHBondContact O-N 3.27Å
282	N	47.7	Very low	49.8	Very low	112 Å²	112	61.3 Å²	61.3	60%	0.599	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-74.8	-19.9	-175.2	-48.9	4.8	0	0	0	112.1	P280 L284	P280-N282 PolarHBondContact O-N 3.21Å; N282-L284 VanDerWaalsContact C-N 3.27Å; N282-L284 PolarHBondContact O-N 2.97Å
283	A	48.5	Very low	51.1	Low	3 Å²	3	63.7 Å²	63.7	3%	0.025	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-69.3	-26	177.5	0	0	0	0	0	113.1	I279 P280 S281 I306 Y310	I279-A283 HydrophobicContact CG2-CB 4.02Å; P280-A283 WeakPolarHBondContact O-CB 3.24Å; P280-A283 PolarHBondContact O-N 3.01Å; S281-A283 VanDerWaalsContact C-N 3.29Å; S281-A283 PolarHBondContact O-N 2.95Å; A283-I306 HydrophobicContact CB-CG2 4.44Å; A283-I306 WeakPolarHBondContact O-CG2 3.14Å; A283-Y310 HydrophobicContact CB-CD1 4.14Å; A283-Y310 HydrophobicContact CB-CD2 3.2Å; A283-Y310 HydrophobicContact CB-CE1 4.07Å; A283-Y310 HydrophobicContact CB-CE2 3.17Å; A283-Y310 HydrophobicContact CB-CG 3.7Å
284	L	52	Low	52.3	Low	17 Å²	17	65.5 Å²	65.5	9%	0.089	34%	0.336	C	S	.	.	S	Bend	trans	-105.6	-0.9	-174.3	-61	173.4	0	0	0	112.5	K244 L245 I279 S281 N282 L286 L303 V307	K244-L284 HydrophobicContact CB-CD1 3.46Å; K244-L284 VanDerWaalsContact CB-CD1 3.46Å; K244-L284 HydrophobicContact CD-CD1 4.46Å; L245-L284 HydrophobicContact CB-CD1 4.41Å; L245-L284 HydrophobicContact CB-CD2 4.47Å; L245-L284 HydrophobicContact CD1-CD2 3.55Å; I279-L284 HydrophobicContact CG2-CD1 3.95Å; I279-L284 HydrophobicContact CG2-CG 4.05Å; S281-L284 PolarHBondContact O-N 3.27Å; N282-L284 VanDerWaalsContact C-N 3.27Å; N282-L284 PolarHBondContact O-N 2.97Å; L284-L286 PolarHBondContact O-N 2.64Å; L284-L303 HydrophobicContact CD2-CD1 4.13Å; L284-V307 HydrophobicContact CD2-CG2 4.49Å
285	L	51	Low	53.4	Low	124 Å²	124	61.6 Å²	61.6	65%	0.649	33%	0.325	S	S	*	.			trans	-88.2	86	170	-81	159	0	0	0	107.7	P287	L285-P287 VanDerWaalsContact O-CD 3.3Å; L285-P287 WeakPolarHBondContact O-CD 3.17Å
286	L	56.3	Low	54.5	Low	16 Å²	16	64.6 Å²	64.6	8%	0.084	35%	0.345	C	S	.	.			trans	-77.5	115.5	165.8	-67.9	168.9	0	0	0	107.5	Y252 L284 V291 I306	Y252-L286 PolarHBondContact OH-O 3.23Å; L284-L286 PolarHBondContact O-N 2.64Å; L286-V291 HydrophobicContact CB-CG2 4.14Å; L286-I306 HydrophobicContact CD2-CD1 3.53Å
287	P	55	Low	55.4	Low	45 Å²	45	67.8 Å²	67.8	29%	0.292	37%	0.367	S	S	.	.			trans	-53.5	144	174.5	-19.5	26	0	0	0	110.5	L285 S289 F290	L285-P287 VanDerWaalsContact O-CD 3.3Å; L285-P287 WeakPolarHBondContact O-CD 3.17Å; P287-S289 PolarHBondContact O-N 3.04Å; P287-S289 VanDerWaalsContact O-N 3.08Å; P287-F290 HydrophobicContact CB-CD2 3.84Å; P287-F290 HydrophobicContact CB-CE2 4.46Å; P287-F290 HydrophobicContact CG-CD2 3.53Å; P287-F290 HydrophobicContact CG-CE2 3.84Å; P287-F290 WeakPolarHBondContact O-CA 3.34Å; P287-F290 WeakPolarHBondContact O-CB 3.4Å; P287-F290 PolarHBondContact O-N 2.74Å
288	N	53.2	Low	56.5	Low	98 Å²	98	69.4 Å²	69.4	52%	0.524	37%	0.372	S	S	.	.	H	α-helix	trans	-56.5	-33.1	-176.3	-70.6	-20.1	0	0	0	112.9	Y252 F290 V291 E292	Y252-N288 PolarHBondContact OH-OD1 2.99Å; N288-F290 PolarHBondContact O-N 3.45Å; N288-F290 VanDerWaalsContact O-N 3.12Å; N288-V291 PolarHBondContact O-N 3.02Å; N288-E292 PolarHBondContact O-N 2.86Å; N288-E292 VanDerWaalsContact O-N 3.1Å
289	S	55	Low	57.5	Low	74 Å²	74	61.3 Å²	61.3	52%	0.517	34%	0.342	S	S	.	.	H	α-helix	trans	-61.4	-17	173.3	64.1	0	0	0	0	114.6	P287	P287-S289 PolarHBondContact O-N 3.04Å; P287-S289 VanDerWaalsContact O-N 3.08Å
290	F	59	Low	58.4	Low	18 Å²	18	61.4 Å²	61.4	8%	0.079	34%	0.343	C	S	.	.	H	α-helix	trans	-78.1	-28.5	171.6	-91.3	-83.3	0	0	0	113.2	P287 N288 R294 D421 K423 A424 H427	P287-F290 HydrophobicContact CB-CD2 3.84Å; P287-F290 HydrophobicContact CB-CE2 4.46Å; P287-F290 HydrophobicContact CG-CD2 3.53Å; P287-F290 HydrophobicContact CG-CE2 3.84Å; P287-F290 WeakPolarHBondContact O-CA 3.34Å; P287-F290 WeakPolarHBondContact O-CB 3.4Å; P287-F290 PolarHBondContact O-N 2.74Å; N288-F290 PolarHBondContact O-N 3.45Å; N288-F290 VanDerWaalsContact O-N 3.12Å; F290-R294 WeakPolarHBondContact O-CG 3.38Å; F290-D421 WeakPolarHBondContact CD1-OD2 3.47Å; F290-D421 WeakPolarHBondContact CE1-OD2 3.25Å; F290-K423 HydrophobicContact CE1-CB 4.09Å; F290-K423 HydrophobicContact CZ-CB 3.83Å; F290-A424 HydrophobicContact CD1-CB 4.15Å; F290-A424 HydrophobicContact CE1-CB 3.31Å; F290-A424 HydrophobicContact CZ-CB 3.96Å; F290-H427 HydrophobicContact CE2-CB 4.36Å; F290-H427 HydrophobicContact CZ-CB 4.27Å
291	V	58.6	Low	59.3	Low	20 Å²	20	62.7 Å²	62.7	12%	0.121	35%	0.353	C	S	.	.	H	α-helix	trans	-97.3	-32.1	-168.2	-172.4	0	0	0	0	110.8	Y252 L286 N288 N293 R294 L299	Y252-V291 HydrophobicContact CD1-CB 3.97Å; Y252-V291 HydrophobicContact CD1-CG1 3.15Å; Y252-V291 HydrophobicContact CD1-CG2 3.89Å; Y252-V291 HydrophobicContact CD2-CG2 4.38Å; Y252-V291 HydrophobicContact CE1-CB 3.92Å; Y252-V291 HydrophobicContact CE1-CG1 3.63Å; Y252-V291 HydrophobicContact CE1-CG2 3.61Å; Y252-V291 HydrophobicContact CE2-CG2 4.18Å; Y252-V291 HydrophobicContact CG-CG1 3.69Å; Y252-V291 HydrophobicContact CG-CG2 4.24Å; L286-V291 HydrophobicContact CB-CG2 4.14Å; N288-V291 PolarHBondContact O-N 3.02Å; V291-N293 PolarHBondContact O-N 2.74Å; V291-R294 PolarHBondContact O-N 2.79Å; V291-L299 HydrophobicContact CB-CD2 4.46Å; V291-L299 HydrophobicContact CG1-CD1 3.92Å; V291-L299 HydrophobicContact CG1-CD2 4.17Å; V291-L299 HydrophobicContact CG2-CD2 4.41Å
292	E	58.9	Low	60.4	Low	131 Å²	131	60.1 Å²	60.1	61%	0.612	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	128.1	175.7	-75.1	170.2	-174.2	0	0	111.4	N288 R294	N288-E292 PolarHBondContact O-N 2.86Å; N288-E292 VanDerWaalsContact O-N 3.1Å; E292-R294 VanDerWaalsContact C-N 3.29Å; E292-R294 PolarHBondContact O-N 2.85Å
293	N	65.3	Low	61.4	Low	169 Å²	169	54.8 Å²	54.8	90%	0.904	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	17.4	179.2	-50.4	-39.2	0	0	0	116.3	V291	V291-N293 PolarHBondContact O-N 2.74Å
294	R	68.9	Low	62.4	Low	66 Å²	66	56 Å²	56	25%	0.249	31%	0.312	C	S	.	.			trans	-94.2	144.4	173.6	-63.8	-72.1	-171.9	174.5	-11.7	111.7	F290 V291 E292 L299 M302 D421	F290-R294 WeakPolarHBondContact O-CG 3.38Å; V291-R294 PolarHBondContact O-N 2.79Å; E292-R294 VanDerWaalsContact C-N 3.29Å; E292-R294 PolarHBondContact O-N 2.85Å; R294-L299 HydrophobicContact CB-CD1 4.13Å; R294-L299 HydrophobicContact CB-CD2 3.84Å; R294-L299 HydrophobicContact CB-CG 3.71Å; R294-L299 HydrophobicContact CG-CD2 4.06Å; R294-L299 HydrophobicContact CG-CG 4.45Å; R294-M302 VanDerWaalsContact CD-CE 3.49Å; R294-M302 HydrophobicContact CG-CE 3.99Å; R294-D421 IonicContact CZ-OD2 3.97Å; R294-D421 IonicContact NE-OD2 3.38Å; R294-D421 IonicContact NH2-OD1 2.58Å; R294-D421 IonicContact NH2-OD2 3.44Å; R294-D421 PolarHBondContact NH2-OD2 2.86Å
295	T	70.4	Confident	63.1	Low	66 Å²	66	56 Å²	56	41%	0.405	31%	0.312	S	S	.	.			trans	-77.4	153.4	168.4	60.4	0	0	0	0	111	S297 E298 L299	T295-S297 PolarHBondContact O-N 2.84Å; T295-S297 VanDerWaalsContact O-N 3.17Å; T295-S297 PolarHBondContact OG1-OG 3.28Å; T295-E298 PolarHBondContact N-OE2 3.34Å; T295-E298 PolarHBondContact O-N 3.46Å; T295-E298 VanDerWaalsContact O-N 3.12Å; T295-E298 VanDerWaalsContact OG1-CG 3.25Å; T295-E298 WeakPolarHBondContact OG1-CG 3.37Å; T295-E298 PolarHBondContact OG1-OE2 3.38Å; T295-E298 VanDerWaalsContact OG1-OE2 3.07Å; T295-L299 PolarHBondContact O-N 2.97Å; T295-L299 VanDerWaalsContact O-N 3.09Å
296	P	66.4	Low	63.7	Low	65 Å²	65	50.5 Å²	50.5	42%	0.422	28%	0.283	S	S	.	.	H	α-helix	trans	-52.4	-36.1	175.5	-31.3	37.5	0	0	0	114.2	S253 L299 T300	S253-P296 WeakPolarHBondContact O-CB 3.24Å; P296-L299 PolarHBondContact O-N 3.03Å; P296-T300 WeakPolarHBondContact O-CB 3.15Å; P296-T300 PolarHBondContact O-N 3.26Å; P296-T300 PolarHBondContact O-OG1 2.89Å; P296-T300 VanDerWaalsContact O-OG1 3.08Å
297	S	65.1	Low	64.2	Low	76 Å²	76	49.8 Å²	49.8	53%	0.531	28%	0.279	S	S	.	.	H	α-helix	trans	-70.6	-35.7	-180	66.6	0	0	0	0	113	T295 S301	T295-S297 PolarHBondContact O-N 2.84Å; T295-S297 VanDerWaalsContact O-N 3.17Å; T295-S297 PolarHBondContact OG1-OG 3.28Å; S297-S301 WeakPolarHBondContact O-CB 3.1Å; S297-S301 PolarHBondContact O-N 2.94Å; S297-S301 PolarHBondContact O-OG 3.49Å
298	E	67.9	Low	64.6	Low	73 Å²	73	49.7 Å²	49.7	34%	0.341	28%	0.276	S	S	.	.	H	α-helix	trans	-67.9	-42.2	173.8	-71.6	172.1	139.8	0	0	110.9	T295 S301 M302	T295-E298 PolarHBondContact N-OE2 3.34Å; T295-E298 PolarHBondContact O-N 3.46Å; T295-E298 VanDerWaalsContact O-N 3.12Å; T295-E298 VanDerWaalsContact OG1-CG 3.25Å; T295-E298 WeakPolarHBondContact OG1-CG 3.37Å; T295-E298 PolarHBondContact OG1-OE2 3.38Å; T295-E298 VanDerWaalsContact OG1-OE2 3.07Å; E298-S301 PolarHBondContact O-N 2.96Å; E298-M302 HydrophobicContact CB-CE 4.14Å; E298-M302 WeakPolarHBondContact O-CB 3.27Å; E298-M302 WeakPolarHBondContact O-CE 3.43Å; E298-M302 WeakPolarHBondContact O-CG 3.47Å; E298-M302 PolarHBondContact O-N 2.84Å
299	L	67.1	Low	65.1	Low	7 Å²	7	45.2 Å²	45.2	4%	0.037	25%	0.252	C	S	.	.	H	α-helix	trans	-63	-43.4	175.4	-69.2	170.6	0	0	0	111.6	I254 V291 R294 T295 P296 S301 M302 L303	I254-L299 HydrophobicContact CD1-CB 4.06Å; I254-L299 HydrophobicContact CG1-CB 3.9Å; I254-L299 HydrophobicContact CG1-CD1 4.42Å; V291-L299 HydrophobicContact CB-CD2 4.46Å; V291-L299 HydrophobicContact CG1-CD1 3.92Å; V291-L299 HydrophobicContact CG1-CD2 4.17Å; V291-L299 HydrophobicContact CG2-CD2 4.41Å; R294-L299 HydrophobicContact CB-CD1 4.13Å; R294-L299 HydrophobicContact CB-CD2 3.84Å; R294-L299 HydrophobicContact CB-CG 3.71Å; R294-L299 HydrophobicContact CG-CD2 4.06Å; R294-L299 HydrophobicContact CG-CG 4.45Å; T295-L299 PolarHBondContact O-N 2.97Å; T295-L299 VanDerWaalsContact O-N 3.09Å; P296-L299 PolarHBondContact O-N 3.03Å; L299-S301 PolarHBondContact O-N 3.35Å; L299-M302 HydrophobicContact CD2-CE 4.18Å; L299-M302 PolarHBondContact O-N 3.26Å; L299-L303 VanDerWaalsContact O-CB 3.29Å; L299-L303 WeakPolarHBondContact O-CB 3.24Å; L299-L303 PolarHBondContact O-N 3.48Å
300	T	67.5	Low	65.3	Low	21 Å²	21	42.4 Å²	42.4	13%	0.129	23%	0.23	C	C	.	.	H	α-helix	trans	-54.5	-51.1	172	-71.5	0	0	0	0	111.3	I254 D255 C258 P296 M302 L303 Q304	I254-T300 WeakPolarHBondContact CG2-OG1 3.34Å; D255-T300 PolarHBondContact N-OG1 3.21Å; C258-T300 HydrophobicContact CB-CG2 3.48Å; C258-T300 VanDerWaalsContact CB-CG2 3.48Å; P296-T300 WeakPolarHBondContact O-CB 3.15Å; P296-T300 PolarHBondContact O-N 3.26Å; P296-T300 PolarHBondContact O-OG1 2.89Å; P296-T300 VanDerWaalsContact O-OG1 3.08Å; T300-M302 PolarHBondContact O-N 2.97Å; T300-L303 PolarHBondContact O-N 3.34Å; T300-Q304 WeakPolarHBondContact O-CB 3.43Å; T300-Q304 PolarHBondContact O-N 3.03Å
301	S	66.5	Low	65.1	Low	59 Å²	59	42.5 Å²	42.5	41%	0.413	23%	0.231	S	C	.	.	H	α-helix	trans	-64.6	-42.1	-177	-59.4	0	0	0	0	112	S297 E298 L299 L305	S297-S301 WeakPolarHBondContact O-CB 3.1Å; S297-S301 PolarHBondContact O-N 2.94Å; S297-S301 PolarHBondContact O-OG 3.49Å; E298-S301 PolarHBondContact O-N 2.96Å; L299-S301 PolarHBondContact O-N 3.35Å; S301-L305 WeakPolarHBondContact O-CG 3.39Å; S301-L305 PolarHBondContact O-N 2.99Å
302	M	68.2	Low	65	Low	3 Å²	3	42.7 Å²	42.7	2%	0.015	23%	0.232	C	C	.	.	H	α-helix	trans	-65.8	-44.6	176.2	-77	-173.3	-81.3	0	0	111.9	R294 E298 L299 T300 Q304 L305 I306 L417 V420 D421	R294-M302 VanDerWaalsContact CD-CE 3.49Å; R294-M302 HydrophobicContact CG-CE 3.99Å; E298-M302 HydrophobicContact CB-CE 4.14Å; E298-M302 WeakPolarHBondContact O-CB 3.27Å; E298-M302 WeakPolarHBondContact O-CE 3.43Å; E298-M302 WeakPolarHBondContact O-CG 3.47Å; E298-M302 PolarHBondContact O-N 2.84Å; L299-M302 HydrophobicContact CD2-CE 4.18Å; L299-M302 PolarHBondContact O-N 3.26Å; T300-M302 PolarHBondContact O-N 2.97Å; M302-Q304 VanDerWaalsContact C-N 3.32Å; M302-Q304 PolarHBondContact O-N 3.43Å; M302-L305 PolarHBondContact O-N 2.91Å; M302-I306 WeakPolarHBondContact O-CB 3.21Å; M302-I306 WeakPolarHBondContact O-CD1 3.49Å; M302-I306 WeakPolarHBondContact O-CG1 3.31Å; M302-I306 PolarHBondContact O-N 2.91Å; M302-L417 HydrophobicContact CG-CD1 4.36Å; M302-V420 HydrophobicContact CG-CG1 3.82Å; M302-V420 HydrophobicContact SD-CG1 4.39Å; M302-D421 HydrophobicContact SD-CB 3.84Å
303	L	69.4	Low	64.8	Low	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-43.2	177.8	-172.3	69	0	0	0	110.9	L245 V249 I254 I262 L284 L299 T300 L305 I306 V307	L245-L303 HydrophobicContact CD1-CD1 4.26Å; L245-L303 HydrophobicContact CD1-CD2 3.91Å; L245-L303 HydrophobicContact CD1-CG 4.23Å; V249-L303 HydrophobicContact CG2-CD2 4.08Å; I254-L303 HydrophobicContact CD1-CD2 4.14Å; I262-L303 HydrophobicContact CD1-CD2 3.97Å; I262-L303 HydrophobicContact CD1-CG 3.97Å; L284-L303 HydrophobicContact CD2-CD1 4.13Å; L299-L303 VanDerWaalsContact O-CB 3.29Å; L299-L303 WeakPolarHBondContact O-CB 3.24Å; L299-L303 PolarHBondContact O-N 3.48Å; T300-L303 PolarHBondContact O-N 3.34Å; L303-L305 PolarHBondContact O-N 2.83Å; L303-I306 PolarHBondContact O-N 2.98Å; L303-V307 WeakPolarHBondContact O-CB 3.37Å; L303-V307 VanDerWaalsContact O-CG2 3.3Å; L303-V307 WeakPolarHBondContact O-CG2 3.44Å; L303-V307 PolarHBondContact O-N 2.85Å
304	Q	67.8	Low	64	Low	29 Å²	29	33.3 Å²	33.3	14%	0.136	18%	0.183	C	C	.	.	H	α-helix	trans	-61.3	-44.5	175.8	-163.8	82.7	45.3	0	0	111.6	S261 T300 M302 V307 N308	S261-Q304 PolarHBondContact OG-NE2 3.43Å; S261-Q304 VanDerWaalsContact OG-NE2 3.08Å; S261-Q304 PolarHBondContact OG-OE1 3.33Å; T300-Q304 WeakPolarHBondContact O-CB 3.43Å; T300-Q304 PolarHBondContact O-N 3.03Å; M302-Q304 VanDerWaalsContact C-N 3.32Å; M302-Q304 PolarHBondContact O-N 3.43Å; Q304-V307 PolarHBondContact O-N 2.87Å; Q304-N308 VanDerWaalsContact O-CB 3.25Å; Q304-N308 WeakPolarHBondContact O-CB 3.35Å; Q304-N308 PolarHBondContact O-N 3.28Å; Q304-N308 PolarHBondContact O-ND2 2.86Å
305	L	66.9	Low	62.9	Low	17 Å²	17	31.9 Å²	31.9	9%	0.089	18%	0.18	C	C	.	.	H	α-helix	trans	-62.5	-45.4	177.3	-83.2	161.6	0	0	0	112.1	S301 M302 L303 N308 L309 Q416 L417 V420	S301-L305 WeakPolarHBondContact O-CG 3.39Å; S301-L305 PolarHBondContact O-N 2.99Å; M302-L305 PolarHBondContact O-N 2.91Å; L303-L305 PolarHBondContact O-N 2.83Å; L305-N308 PolarHBondContact O-N 3.35Å; L305-L309 WeakPolarHBondContact O-CB 3.14Å; L305-L309 WeakPolarHBondContact O-CG 3.49Å; L305-L309 PolarHBondContact O-N 3.45Å; L305-Q416 HydrophobicContact CD2-CB 3.73Å; L305-L417 HydrophobicContact CB-CD1 4.29Å; L305-L417 HydrophobicContact CD1-CD1 4.32Å; L305-V420 HydrophobicContact CD1-CG2 4.33Å
306	I	65.1	Low	61.7	Low	7 Å²	7	30.8 Å²	30.8	4%	0.036	18%	0.175	C	C	.	.	H	α-helix	trans	-62	-49.6	177.7	-68.8	163	0	0	0	109.9	A283 L286 M302 L303 L309 Y310 L428	A283-I306 HydrophobicContact CB-CG2 4.44Å; A283-I306 WeakPolarHBondContact O-CG2 3.14Å; L286-I306 HydrophobicContact CD2-CD1 3.53Å; M302-I306 WeakPolarHBondContact O-CB 3.21Å; M302-I306 WeakPolarHBondContact O-CD1 3.49Å; M302-I306 WeakPolarHBondContact O-CG1 3.31Å; M302-I306 PolarHBondContact O-N 2.91Å; L303-I306 PolarHBondContact O-N 2.98Å; I306-L309 WeakPolarHBondContact O-CB 3.3Å; I306-L309 PolarHBondContact O-N 2.7Å; I306-Y310 HydrophobicContact CG2-CD2 3.81Å; I306-Y310 HydrophobicContact CG2-CE2 3.86Å; I306-Y310 VanDerWaalsContact O-CD2 3.25Å; I306-Y310 WeakPolarHBondContact O-CD2 3.49Å; I306-Y310 PolarHBondContact O-N 3.08Å; I306-L428 HydrophobicContact CB-CD1 4.37Å; I306-L428 HydrophobicContact CG1-CD1 3.62Å; I306-L428 HydrophobicContact CG2-CD1 4.45Å; I306-L428 HydrophobicContact CG2-CD2 4.34Å
307	V	64.8	Low	60.8	Low	1 Å²	1	28.6 Å²	28.6	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-64.2	-46.1	-179.4	177.4	0	0	0	0	110.3	L245 I262 L284 L303 Q304 L309 Y310 L311	L245-V307 HydrophobicContact CD1-CG2 4.27Å; I262-V307 HydrophobicContact CD1-CG2 4.34Å; I262-V307 HydrophobicContact CG2-CB 4.22Å; I262-V307 HydrophobicContact CG2-CG1 3.66Å; I262-V307 HydrophobicContact CG2-CG2 4.18Å; L284-V307 HydrophobicContact CD2-CG2 4.49Å; L303-V307 WeakPolarHBondContact O-CB 3.37Å; L303-V307 VanDerWaalsContact O-CG2 3.3Å; L303-V307 WeakPolarHBondContact O-CG2 3.44Å; L303-V307 PolarHBondContact O-N 2.85Å; Q304-V307 PolarHBondContact O-N 2.87Å; V307-L309 VanDerWaalsContact C-N 3.27Å; V307-L309 PolarHBondContact O-N 2.75Å; V307-Y310 CarbonylContact O-C 3.56Å; V307-Y310 WeakPolarHBondContact O-CA 3.42Å; V307-Y310 PolarHBondContact O-N 2.91Å; V307-L311 HydrophobicContact CG1-CD1 3.97Å; V307-L311 HydrophobicContact CG1-CD2 4.33Å; V307-L311 HydrophobicContact CG1-CG 3.94Å; V307-L311 VanDerWaalsContact O-CG 3.28Å; V307-L311 WeakPolarHBondContact O-CG 3.43Å; V307-L311 PolarHBondContact O-N 3.47Å
308	N	64.1	Low	59.7	Low	44 Å²	44	26.6 Å²	26.6	24%	0.235	15%	0.145	C	C	.	.	H	α-helix	trans	-51.7	-46.4	173.3	-78.4	-22.6	0	0	0	111.9	Q265 Q304 L305 Y310 L311 L312	Q265-N308 PolarHBondContact NE2-OD1 3.36Å; Q265-N308 PolarHBondContact OE1-OD1 2.84Å; Q304-N308 VanDerWaalsContact O-CB 3.25Å; Q304-N308 WeakPolarHBondContact O-CB 3.35Å; Q304-N308 PolarHBondContact O-N 3.28Å; Q304-N308 PolarHBondContact O-ND2 2.86Å; L305-N308 PolarHBondContact O-N 3.35Å; N308-Y310 VanDerWaalsContact C-N 3.31Å; N308-Y310 PolarHBondContact O-N 3.45Å; N308-L311 PolarHBondContact O-N 3.44Å; N308-L312 VanDerWaalsContact O-CB 3.32Å; N308-L312 WeakPolarHBondContact O-CB 3.26Å; N308-L312 WeakPolarHBondContact O-CD1 3.46Å; N308-L312 WeakPolarHBondContact O-CG 3.49Å; N308-L312 PolarHBondContact O-N 3.31Å
309	L	63	Low	58.1	Low	4 Å²	4	28 Å²	28	2%	0.021	16%	0.155	C	C	.	.	H	α-helix	trans	-58.1	-41.8	176	-83.5	161.6	0	0	0	112.8	L305 I306 V307 R313 A410 A413 L414 L417 L428	L305-L309 WeakPolarHBondContact O-CB 3.14Å; L305-L309 WeakPolarHBondContact O-CG 3.49Å; L305-L309 PolarHBondContact O-N 3.45Å; I306-L309 WeakPolarHBondContact O-CB 3.3Å; I306-L309 PolarHBondContact O-N 2.7Å; V307-L309 VanDerWaalsContact C-N 3.27Å; V307-L309 PolarHBondContact O-N 2.75Å; L309-R313 VanDerWaalsContact O-CB 3.27Å; L309-R313 WeakPolarHBondContact O-CB 3.49Å; L309-R313 PolarHBondContact O-N 3.5Å; L309-A410 HydrophobicContact CD2-CB 4.36Å; L309-A410 VanDerWaalsContact CD2-O 3.31Å; L309-A410 WeakPolarHBondContact CD2-O 3.41Å; L309-A413 HydrophobicContact CD1-CB 4.32Å; L309-A413 HydrophobicContact CD2-CB 3.63Å; L309-A413 HydrophobicContact CG-CB 3.64Å; L309-L414 HydrophobicContact CD1-CD2 3.77Å; L309-L414 HydrophobicContact CD1-CG 4.21Å; L309-L414 HydrophobicContact CD2-CD2 4.09Å; L309-L414 HydrophobicContact CD2-CG 3.71Å; L309-L417 HydrophobicContact CD1-CD2 4.24Å; L309-L428 HydrophobicContact CD1-CD1 3.82Å
310	Y	59.3	Low	56.7	Low	15 Å²	15	37.9 Å²	37.9	6%	0.059	19%	0.191	C	C	.	.	H	α-helix	trans	-73.2	-37	177.9	-84.1	-76	0	0	0	113.2	P280 A283 I306 V307 N308 L312 R313 D314 L428	P280-Y310 HydrophobicContact CB-CD1 4.03Å; P280-Y310 HydrophobicContact CB-CE1 3.77Å; P280-Y310 HydrophobicContact CG-CD1 3.45Å; P280-Y310 VanDerWaalsContact CG-CD1 3.45Å; P280-Y310 HydrophobicContact CG-CE1 3.67Å; P280-Y310 HydrophobicContact CG-CG 4.4Å; A283-Y310 HydrophobicContact CB-CD1 4.14Å; A283-Y310 HydrophobicContact CB-CD2 3.2Å; A283-Y310 HydrophobicContact CB-CE1 4.07Å; A283-Y310 HydrophobicContact CB-CE2 3.17Å; A283-Y310 HydrophobicContact CB-CG 3.7Å; I306-Y310 HydrophobicContact CG2-CD2 3.81Å; I306-Y310 HydrophobicContact CG2-CE2 3.86Å; I306-Y310 VanDerWaalsContact O-CD2 3.25Å; I306-Y310 WeakPolarHBondContact O-CD2 3.49Å; I306-Y310 PolarHBondContact O-N 3.08Å; V307-Y310 CarbonylContact O-C 3.56Å; V307-Y310 WeakPolarHBondContact O-CA 3.42Å; V307-Y310 PolarHBondContact O-N 2.91Å; N308-Y310 VanDerWaalsContact C-N 3.31Å; N308-Y310 PolarHBondContact O-N 3.45Å; Y310-L312 VanDerWaalsContact C-N 3.34Å; Y310-R313 WeakPolarHBondContact O-CB 3.28Å; Y310-R313 PolarHBondContact O-N 2.67Å; Y310-D314 PolarHBondContact O-N 2.73Å; Y310-L428 HydrophobicContact CE2-CD2 3.68Å
311	L	56.4	Low	55.4	Low	19 Å²	19	40.7 Å²	40.7	10%	0.099	20%	0.203	C	C	.	.	H	α-helix	trans	-60.7	-47.4	172.4	-61.2	175.3	0	0	0	110.3	Q265 L266 V276 V307 N308 R313 N315	Q265-L311 HydrophobicContact CB-CD1 3.67Å; L266-L311 HydrophobicContact CD2-CD2 3.37Å; L266-L311 HydrophobicContact CG-CD2 4.01Å; V276-L311 HydrophobicContact CB-CD2 3.91Å; V276-L311 HydrophobicContact CG1-CD2 3.69Å; V276-L311 HydrophobicContact CG2-CB 4.48Å; V276-L311 HydrophobicContact CG2-CD2 3.35Å; V276-L311 HydrophobicContact CG2-CG 4.45Å; V307-L311 HydrophobicContact CG1-CD1 3.97Å; V307-L311 HydrophobicContact CG1-CD2 4.33Å; V307-L311 HydrophobicContact CG1-CG 3.94Å; V307-L311 VanDerWaalsContact O-CG 3.28Å; V307-L311 WeakPolarHBondContact O-CG 3.43Å; V307-L311 PolarHBondContact O-N 3.47Å; N308-L311 PolarHBondContact O-N 3.44Å; L311-R313 VanDerWaalsContact C-N 3.3Å; L311-R313 PolarHBondContact O-N 2.87Å; L311-N315 CarbonylContact O-C 3.52Å; L311-N315 PolarHBondContact O-N 2.81Å
312	L	55.4	Low	54.1	Low	24 Å²	24	38.6 Å²	38.6	13%	0.126	19%	0.187	C	C	.	.	H	α-helix	trans	-63.1	-35.8	175.9	-68.5	168.7	0	0	0	111.8	N308 Y310 I317 K406 A409 A413	N308-L312 VanDerWaalsContact O-CB 3.32Å; N308-L312 WeakPolarHBondContact O-CB 3.26Å; N308-L312 WeakPolarHBondContact O-CD1 3.46Å; N308-L312 WeakPolarHBondContact O-CG 3.49Å; N308-L312 PolarHBondContact O-N 3.31Å; Y310-L312 VanDerWaalsContact C-N 3.34Å; L312-I317 HydrophobicContact CD2-CB 4.21Å; L312-I317 HydrophobicContact CD2-CG1 3.78Å; L312-I317 HydrophobicContact CD2-CG2 3.88Å; L312-K406 WeakPolarHBondContact O-CE 3.09Å; L312-K406 WeakPolarHBondContact O-CG 3.43Å; L312-A409 HydrophobicContact CD1-CB 3.91Å; L312-A409 HydrophobicContact CD2-CB 3.8Å; L312-A409 HydrophobicContact CG-CB 4.46Å; L312-A413 HydrophobicContact CD1-CB 4.46Å
313	R	54.9	Low	52.5	Low	41 Å²	41	43.6 Å²	43.6	16%	0.155	21%	0.214	C	C	.	.	H	α-helix	trans	-67.7	-50	178.2	-174.8	-174.7	-180	166	7	112.3	L309 Y310 L311 K406 A431 F432	L309-R313 VanDerWaalsContact O-CB 3.27Å; L309-R313 WeakPolarHBondContact O-CB 3.49Å; L309-R313 PolarHBondContact O-N 3.5Å; Y310-R313 WeakPolarHBondContact O-CB 3.28Å; Y310-R313 PolarHBondContact O-N 2.67Å; L311-R313 VanDerWaalsContact C-N 3.3Å; L311-R313 PolarHBondContact O-N 2.87Å; R313-K406 WeakPolarHBondContact O-CE 3.37Å; R313-K406 PolarHBondContact O-NZ 2.77Å; R313-A431 PolarHBondContact NH1-O 3.31Å; R313-A431 PolarHBondContact NH2-O 2.79Å; R313-F432 HydrophobicContact CB-CE2 3.82Å; R313-F432 HydrophobicContact CB-CZ 4.17Å; R313-F432 HydrophobicContact CG-CD2 4.5Å; R313-F432 HydrophobicContact CG-CE2 3.82Å; R313-F432 HydrophobicContact CG-CZ 4.05Å
314	D	49.6	Very low	50.9	Low	63 Å²	63	50 Å²	50	34%	0.337	25%	0.248	S	C	.	.	H	α-helix	trans	-94.4	-41.5	-166.5	-74.1	-21.7	0	0	0	112.8	P280 Y310	P280-D314 WeakPolarHBondContact CG-OD2 3.43Å; Y310-D314 PolarHBondContact O-N 2.73Å
315	N	44.5	Very low	49.5	Very low	36 Å²	36	52 Å²	52	19%	0.193	26%	0.259	C	S	.	.	S	Bend	trans	-148	94.4	-171.7	-78	-23.4	0	0	0	112.6	C273 G275 V276 T277 L311	C273-N315 HydrophobicContact CB-CB 4.07Å; G275-N315 PolarHBondContact O-ND2 3.29Å; V276-N315 WeakPolarHBondContact CA-ND2 3.38Å; V276-N315 HydrophobicContact CG2-CB 4.12Å; T277-N315 PolarHBondContact N-ND2 2.8Å; T277-N315 VanDerWaalsContact N-ND2 3.18Å; T277-N315 PolarHBondContact OG1-ND2 2.81Å; L311-N315 CarbonylContact O-C 3.52Å; L311-N315 PolarHBondContact O-N 2.81Å
316	C	45.5	Very low	48.1	Very low	43 Å²	43	54.9 Å²	54.9	29%	0.291	28%	0.281	S	S	.	.			trans	50	126.2	160.1	-152.6	0	0	0	0	118.7	C270 C273 C318	C270-C316 HydrophobicContact CB-CB 3.87Å; C270-C316 WeakPolarHBondContact SG-CB 3.41Å; C270-C316 PolarHBondContact SG-SG 3.48Å; C273-C316 HydrophobicContact CB-CB 3.63Å; C273-C316 WeakPolarHBondContact SG-CB 3.21Å; C316-C318 PolarHBondContact O-N 3.2Å
317	I	46.9	Very low	46.4	Very low	19 Å²	19	56.5 Å²	56.5	10%	0.097	30%	0.295	C	S	.	.			trans	-66.1	124.6	162.5	-34.1	171.5	0	0	0	107	L312 D319 M322 P405 K406 A409	L312-I317 HydrophobicContact CD2-CB 4.21Å; L312-I317 HydrophobicContact CD2-CG1 3.78Å; L312-I317 HydrophobicContact CD2-CG2 3.88Å; I317-D319 PolarHBondContact O-N 3.11Å; I317-M322 HydrophobicContact CB-CG 4.07Å; I317-M322 HydrophobicContact CD1-CE 3.74Å; I317-M322 HydrophobicContact CD1-CG 4.27Å; I317-M322 HydrophobicContact CD1-SD 4.22Å; I317-M322 HydrophobicContact CG2-CG 3.35Å; I317-M322 HydrophobicContact CG2-SD 3.68Å; I317-P405 HydrophobicContact CD1-CB 3.87Å; I317-P405 VanDerWaalsContact CD1-O 3.27Å; I317-P405 WeakPolarHBondContact CD1-O 3.25Å; I317-K406 HydrophobicContact CD1-CB 4.07Å; I317-K406 VanDerWaalsContact CD1-N 3.33Å; I317-K406 HydrophobicContact CG1-CB 4.45Å; I317-A409 HydrophobicContact CD1-CB 4.18Å
318	C	42.7	Very low	44.9	Very low	34 Å²	34	60.4 Å²	60.4	23%	0.23	34%	0.336	C	S	.	.			trans	-65.9	119.7	172.1	-74.4	0	0	0	0	107.8	C316 R320 E321	C316-C318 PolarHBondContact O-N 3.2Å; C318-R320 PolarHBondContact O-N 3.39Å; C318-E321 PolarHBondContact O-N 3.46Å
319	D	34.4	Very low	43.1	Very low	102 Å²	102	67.1 Å²	67.1	55%	0.545	36%	0.363	S	S	.	.	H	α-helix	trans	-47.5	-30.4	-176.6	-61.5	-41.6	0	0	0	113.2	I317 E321 M322 D323	I317-D319 PolarHBondContact O-N 3.11Å; D319-E321 PolarHBondContact O-N 3.07Å; D319-M322 PolarHBondContact O-N 3.46Å; D319-M322 VanDerWaalsContact O-N 3.15Å; D319-D323 PolarHBondContact O-N 2.85Å
320	R	37.9	Very low	41.3	Very low	214 Å²	214	71.6 Å²	71.6	81%	0.808	39%	0.394	S	S	*	.	H	α-helix	trans	-62	-36.1	176	-90.3	-173.1	175.6	178.1	-1.7	115.5	C318 M322	C318-R320 PolarHBondContact O-N 3.39Å; R320-M322 VanDerWaalsContact C-N 3.31Å
321	E	40.3	Very low	39.7	Very low	81 Å²	81	83.7 Å²	83.7	38%	0.379	44%	0.44	S	S	.	.	H	α-helix	trans	-77.4	-23.9	176.5	-78.9	178.4	-173.1	0	0	111.2	R268 C318 D319 L325	R268-E321 IonicContact NH1-OE1 2.89Å; R268-E321 PolarHBondContact NH1-OE1 3.48Å; C318-E321 PolarHBondContact O-N 3.46Å; D319-E321 PolarHBondContact O-N 3.07Å; E321-L325 WeakPolarHBondContact O-CB 3.3Å; E321-L325 VanDerWaalsContact O-CD1 3.31Å; E321-L325 WeakPolarHBondContact O-CD1 3.19Å; E321-L325 WeakPolarHBondContact O-CG 3.45Å; E321-L325 PolarHBondContact O-N 3.46Å
322	M	39.6	Very low	38.1	Very low	15 Å²	15	87.7 Å²	87.7	7%	0.074	47%	0.47	C	S	.	.	H	α-helix	trans	-81.4	-33.1	176.2	-64.2	-58.4	-93.7	0	0	112.6	I317 D319 R320 D324 L325 S326 F352 P405	I317-M322 HydrophobicContact CB-CG 4.07Å; I317-M322 HydrophobicContact CD1-CE 3.74Å; I317-M322 HydrophobicContact CD1-CG 4.27Å; I317-M322 HydrophobicContact CD1-SD 4.22Å; I317-M322 HydrophobicContact CG2-CG 3.35Å; I317-M322 HydrophobicContact CG2-SD 3.68Å; D319-M322 PolarHBondContact O-N 3.46Å; D319-M322 VanDerWaalsContact O-N 3.15Å; R320-M322 VanDerWaalsContact C-N 3.31Å; M322-D324 PolarHBondContact O-N 3.45Å; M322-L325 PolarHBondContact O-N 3.39Å; M322-L325 VanDerWaalsContact O-N 3.14Å; M322-L325 HydrophobicContact SD-CD1 3.82Å; M322-S326 VanDerWaalsContact O-CB 3.24Å; M322-S326 WeakPolarHBondContact O-CB 3.15Å; M322-S326 PolarHBondContact O-N 2.99Å; M322-S326 PolarHBondContact O-OG 3.12Å; M322-F352 HydrophobicContact CE-CD1 4.34Å; M322-F352 HydrophobicContact CE-CD2 4.28Å; M322-F352 HydrophobicContact CE-CE1 3.54Å; M322-F352 HydrophobicContact CE-CE2 3.52Å; M322-F352 HydrophobicContact CE-CZ 3.09Å; M322-F352 HydrophobicContact SD-CZ 4.17Å; M322-P405 HydrophobicContact CE-CB 3.3Å; M322-P405 WeakPolarHBondContact CE-O 3.49Å
323	D	34.2	Very low	36.7	Very low	108 Å²	108	98.3 Å²	98.3	58%	0.578	51%	0.508	S	S	*	.	H	α-helix	trans	-60.3	-37.3	171.3	-73.1	-28	0	0	0	111	D319 A327	D319-D323 PolarHBondContact O-N 2.85Å; D323-A327 VanDerWaalsContact O-CB 3.25Å; D323-A327 WeakPolarHBondContact O-CB 3.44Å; D323-A327 PolarHBondContact O-N 2.88Å; D323-A327 VanDerWaalsContact O-N 3.09Å
324	D	36.3	Very low	35.1	Very low	133 Å²	133	108.1 Å²	108.1	71%	0.711	55%	0.545	S	S	*	.	H	α-helix	trans	-74.7	-24.6	175.4	-75.2	-18.7	0	0	0	113.7	M322	M322-D324 PolarHBondContact O-N 3.45Å
325	L	37.4	Very low	34	Very low	73 Å²	73	111.1 Å²	111.1	38%	0.382	57%	0.571	S	S	.	*	H	α-helix	trans	-89.7	-28.2	178	-73.6	165.8	0	0	0	113.3	E321 M322 I354	E321-L325 WeakPolarHBondContact O-CB 3.3Å; E321-L325 VanDerWaalsContact O-CD1 3.31Å; E321-L325 WeakPolarHBondContact O-CD1 3.19Å; E321-L325 WeakPolarHBondContact O-CG 3.45Å; E321-L325 PolarHBondContact O-N 3.46Å; M322-L325 PolarHBondContact O-N 3.39Å; M322-L325 VanDerWaalsContact O-N 3.14Å; M322-L325 HydrophobicContact SD-CD1 3.82Å; L325-I354 HydrophobicContact CB-CD1 4.39Å; L325-I354 HydrophobicContact CD1-CD1 3.78Å; L325-I354 HydrophobicContact CD2-CD1 3.86Å; L325-I354 HydrophobicContact CD2-CG1 4.21Å; L325-I354 HydrophobicContact CG-CD1 4.22Å
326	S	37.3	Very low	33	Very low	76 Å²	76	112.7 Å²	112.7	53%	0.531	60%	0.595	S	S	.	*	H	α-helix	trans	-87.3	-35.3	-179.2	-45.8	0	0	0	0	111.4	M322	M322-S326 VanDerWaalsContact O-CB 3.24Å; M322-S326 WeakPolarHBondContact O-CB 3.15Å; M322-S326 PolarHBondContact O-N 2.99Å; M322-S326 PolarHBondContact O-OG 3.12Å
327	A	29.8	Very low	32	Very low	42 Å²	42	116.1 Å²	116.1	35%	0.347	62%	0.62	S	S	.	*	S	Bend	trans	-86.1	110.4	169.3	0	0	0	0	0	108.1	D323 K329	D323-A327 VanDerWaalsContact O-CB 3.25Å; D323-A327 WeakPolarHBondContact O-CB 3.44Å; D323-A327 PolarHBondContact O-N 2.88Å; D323-A327 VanDerWaalsContact O-N 3.09Å; A327-K329 HydrophobicContact CB-CG 4.39Å; A327-K329 PolarHBondContact O-N 3.35Å
328	G	34	Very low	31	Very low	83 Å²	83	119.7 Å²	119.7	86%	0.856	65%	0.653	S	S	*	*			trans	-63.8	40.8	172	0	0	0	0	0	114.5	S330	G328-S330 PolarHBondContact O-N 3.16Å
329	K	26.2	Very low	30.2	Very low	184 Å²	184	124.6 Å²	124.6	80%	0.8	68%	0.682	S	S	*	*			trans	-85.1	93.5	178.8	-74.2	-175.2	178	178.6	0	108.8	A327	A327-K329 HydrophobicContact CB-CG 4.39Å; A327-K329 PolarHBondContact O-N 3.35Å
330	S	25.6	Very low	29.9	Very low	98 Å²	98	127.4 Å²	127.4	69%	0.685	70%	0.697	S	S	*	*			trans	-36.9	137.2	157.1	56.3	0	0	0	0	111.3	G328 S332	G328-S330 PolarHBondContact O-N 3.16Å; S330-S332 PolarHBondContact O-N 2.87Å
331	W	24.3	Very low	29.4	Very low	269 Å²	269	126.4 Å²	126.4	100%	1.019	70%	0.701	S	S	*	*	S	Bend	trans	-47.5	96.2	167.4	-68.5	-21.6	0	0	0	111.8
332	S	24	Very low	28.5	Very low	103 Å²	103	127.9 Å²	127.9	72%	0.72	72%	0.72	S	S	*	*			trans	-143.7	118.3	151.6	89.3	0	0	0	0	108.7	S330 R334	S330-S332 PolarHBondContact O-N 2.87Å; S332-R334 PolarHBondContact O-N 3.31Å
333	R	24.6	Very low	27.8	Very low	248 Å²	248	130.2 Å²	130.2	94%	0.936	75%	0.748	S	S	*	*			trans	-68.4	114.3	171.6	-81	177.3	171.4	-177.1	-2.2	108.3
334	R	22.5	Very low	27.3	Very low	247 Å²	247	134.3 Å²	134.3	93%	0.932	76%	0.764	S	S	*	*			trans	-165.7	132.3	137.1	-111.8	173.3	-163.6	-153.8	3.3	112.1	S332	S332-R334 PolarHBondContact O-N 3.31Å
335	S	26.9	Very low	26.8	Very low	126 Å²	126	133.6 Å²	133.6	88%	0.881	77%	0.769	S	S	*	*			trans	-34.3	143.8	168.3	158	0	0	0	0	116
336	G	22.7	Very low	26.1	Very low	68 Å²	68	135.5 Å²	135.5	70%	0.701	79%	0.787	S	S	*	*			trans	155.3	110	149.1	0	0	0	0	0	117.2
337	S	23.7	Very low	25.6	Very low	116 Å²	116	138.3 Å²	138.3	81%	0.811	81%	0.807	S	S	*	*			trans	67.9	118.5	148.5	-155.4	0	0	0	0	121.2
338	A	27.7	Very low	25.9	Very low	94 Å²	94	139.8 Å²	139.8	78%	0.777	82%	0.815	S	S	*	*			trans	-78.1	135.4	162.5	0	0	0	0	0	110.4
339	T	25.6	Very low	26.3	Very low	137 Å²	137	140.7 Å²	140.7	84%	0.84	81%	0.814	S	S	*	*			trans	-137.1	126.6	157.1	32.9	0	0	0	0	109.8
340	N	27.3	Very low	27.8	Very low	161 Å²	161	138.5 Å²	138.5	86%	0.861	81%	0.811	S	S	*	*			trans	-66.7	132.4	171.4	-71	-31.8	0	0	0	109.9
341	Q	26.7	Very low	29.9	Very low	193 Å²	193	136.7 Å²	136.7	90%	0.902	80%	0.797	S	S	*	*			trans	-143.3	133.7	144	-74.2	-163.2	-6.7	0	0	112.1
342	S	22.6	Very low	32.3	Very low	111 Å²	111	125.2 Å²	125.2	78%	0.776	75%	0.754	S	S	*	*			trans	-30.4	143.7	172.3	49.6	0	0	0	0	120.3
343	G	24.6	Very low	34.9	Very low	65 Å²	65	123.6 Å²	123.6	67%	0.67	74%	0.74	S	S	*	*				75.8	101.3	113.8	0	0	0	0	0	118.6
344	H	23.7	Very low	37.4	Very low	194 Å²	194	112.1 Å²	112.1	90%	0.898	70%	0.697	S	S	*	*				-172.5	124.7	120.8	-91.2	-39.7	0	0	0	110.8	C346	H344-C346 PolarHBondContact O-N 3.47Å
345	S	25.2	Very low	40.1	Very low	117 Å²	117	106 Å²	106	82%	0.818	68%	0.677	S	S	*	*			trans	-73.5	109.9	168.7	48	0	0	0	0	110.2
346	C	23.9	Very low	42.6	Very low	114 Å²	114	104.5 Å²	104.5	77%	0.77	66%	0.655	S	S	*	*			trans	-126.2	100.8	158	-104	0	0	0	0	108.3	H344 S348	H344-C346 PolarHBondContact O-N 3.47Å; C346-S348 PolarHBondContact O-N 2.81Å
347	S	27.1	Very low	45.2	Very low	134 Å²	134	103.8 Å²	103.8	94%	0.937	64%	0.639	S	S	*	*			trans	-75.7	70.4	169.5	61.7	0	0	0	0	109.9
348	S	35	Very low	47.8	Very low	74 Å²	74	99.2 Å²	99.2	52%	0.517	61%	0.605	S	S	.	*	S	Bend	trans	-128.7	114.3	152.5	59.5	0	0	0	0	104.6	C346 N350	C346-S348 PolarHBondContact O-N 2.81Å; S348-N350 VanDerWaalsContact C-N 3.35Å; S348-N350 PolarHBondContact O-N 2.91Å
349	A	42.9	Very low	50.3	Low	101 Å²	101	102.2 Å²	102.2	84%	0.835	60%	0.597	S	S	*	*			trans	-59.8	98.4	-176.8	0	0	0	0	0	109.1
350	N	56.6	Low	53	Low	138 Å²	138	99 Å²	99	74%	0.738	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-60.6	129	176.9	-79.4	-20.1	0	0	0	107.7	S348 F352	S348-N350 VanDerWaalsContact C-N 3.35Å; S348-N350 PolarHBondContact O-N 2.91Å; N350-F352 PolarHBondContact O-N 3.38Å
351	P	70	Confident	55.5	Low	61 Å²	61	96.1 Å²	96.1	40%	0.396	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-61.5	133.2	-178.9	25.7	-33.3	0	0	0	109.4	T401 S402	P351-T401 HydrophobicContact CB-CG2 3.71Å; P351-T401 HydrophobicContact CG-CG2 4.15Å; P351-S402 CarbonylContact C-O 3.31Å; P351-S402 WeakPolarHBondContact CA-O 3.23Å
352	F	76.1	Confident	58.1	Low	27 Å²	27	88.4 Å²	88.4	12%	0.118	53%	0.534	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	129	179.7	172.7	-97.2	0	0	0	109.5	M322 N350 I354 T401 S402 P405	M322-F352 HydrophobicContact CE-CD1 4.34Å; M322-F352 HydrophobicContact CE-CD2 4.28Å; M322-F352 HydrophobicContact CE-CE1 3.54Å; M322-F352 HydrophobicContact CE-CE2 3.52Å; M322-F352 HydrophobicContact CE-CZ 3.09Å; M322-F352 HydrophobicContact SD-CZ 4.17Å; N350-F352 PolarHBondContact O-N 3.38Å; F352-I354 HydrophobicContact CE1-CB 3.76Å; F352-I354 HydrophobicContact CE1-CG2 4.33Å; F352-I354 HydrophobicContact CZ-CB 4.09Å; F352-T401 CarbonylContact O-C 3.57Å; F352-T401 WeakPolarHBondContact O-CA 3.47Å; F352-S402 PolarHBondContact N-O 3.41Å; F352-S402 PolarHBondContact O-N 3Å; F352-P405 HydrophobicContact CB-CB 4.49Å; F352-P405 HydrophobicContact CB-CG 4.21Å; F352-P405 HydrophobicContact CD1-CB 4.3Å; F352-P405 HydrophobicContact CD2-CB 4.05Å; F352-P405 HydrophobicContact CD2-CG 4.13Å; F352-P405 HydrophobicContact CE2-CB 4.39Å; F352-P405 HydrophobicContact CG-CB 4.01Å; F352-P405 HydrophobicContact CG-CG 4.16Å
353	T	77	Confident	60.8	Low	70 Å²	70	83.6 Å²	83.6	43%	0.429	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	125.7	177.4	-53	0	0	0	0	110.4	C399 I400 T401	T353-C399 HydrophobicContact CG2-CB 4.49Å; T353-I400 CarbonylContact C-O 3.58Å; T353-I400 VanDerWaalsContact CA-O 3.32Å; T353-I400 WeakPolarHBondContact CA-O 3.4Å; T353-T401 PolarHBondContact OG1-OG1 3.48Å
354	I	78.3	Confident	63.3	Low	6 Å²	6	82.1 Å²	82.1	3%	0.031	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	138.9	171.9	-168.9	169.4	0	0	0	109.9	L325 F352 C399 I400 C412	L325-I354 HydrophobicContact CB-CD1 4.39Å; L325-I354 HydrophobicContact CD1-CD1 3.78Å; L325-I354 HydrophobicContact CD2-CD1 3.86Å; L325-I354 HydrophobicContact CD2-CG1 4.21Å; L325-I354 HydrophobicContact CG-CD1 4.22Å; F352-I354 HydrophobicContact CE1-CB 3.76Å; F352-I354 HydrophobicContact CE1-CG2 4.33Å; F352-I354 HydrophobicContact CZ-CB 4.09Å; I354-C399 CarbonylContact O-C 3.5Å; I354-C399 WeakPolarHBondContact O-CA 3.44Å; I354-I400 HydrophobicContact CG2-CB 3.77Å; I354-I400 HydrophobicContact CG2-CG1 4.5Å; I354-I400 PolarHBondContact N-O 3.36Å; I354-I400 PolarHBondContact O-N 3.29Å; I354-C412 HydrophobicContact CD1-CB 4.06Å; I354-C412 HydrophobicContact CG2-CB 4.1Å
355	K	78	Confident	66	Low	119 Å²	119	77.3 Å²	77.3	52%	0.517	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	126.6	-177.8	-173.4	174	-178.9	-169.2	0	110.3	D397	K355-D397 HydrophobicContact CD-CB 4.45Å; K355-D397 WeakPolarHBondContact CE-OD2 3.27Å; K355-D397 HydrophobicContact CG-CB 4.2Å; K355-D397 IonicContact NZ-OD2 3.74Å; K355-D397 PolarHBondContact NZ-OD2 3.42Å
356	K	80	Confident	68.5	Low	95 Å²	95	72 Å²	72	41%	0.413	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	121.9	179	-167.2	70.9	176.4	-176.3	0	111.4	I358 V398	K356-I358 HydrophobicContact CG-CG1 4.48Å; K356-V398 PolarHBondContact N-O 3.46Å; K356-V398 PolarHBondContact O-N 2.96Å
357	S	78	Confident	71.2	Confident	52 Å²	52	67.9 Å²	67.9	36%	0.364	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	132.3	172.8	-50.3	0	0	0	0	111.2	C396 D397	S357-C396 CarbonylContact C-O 3.58Å; S357-C396 WeakPolarHBondContact CA-O 3.34Å; S357-D397 WeakPolarHBondContact CA-OD1 3.36Å; S357-D397 VanDerWaalsContact CB-OD1 3.28Å; S357-D397 WeakPolarHBondContact CB-OD1 3.47Å; S357-D397 PolarHBondContact OG-OD1 3.35Å
358	I	77.9	Confident	73.6	Confident	20 Å²	20	67.4 Å²	67.4	10%	0.103	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	142.7	-177.6	-48.2	-171.8	0	0	0	108.7	K356 F395 C396 V398 I419	K356-I358 HydrophobicContact CG-CG1 4.48Å; I358-F395 WeakPolarHBondContact O-CA 3.1Å; I358-C396 PolarHBondContact N-O 3.36Å; I358-C396 PolarHBondContact O-N 3.48Å; I358-V398 HydrophobicContact CD1-CB 4.01Å; I358-V398 HydrophobicContact CD1-CG2 3.43Å; I358-V398 VanDerWaalsContact CD1-CG2 3.43Å; I358-V398 HydrophobicContact CG1-CG2 3.97Å; I358-I419 HydrophobicContact CD1-CD1 3.48Å; I358-I419 VanDerWaalsContact CD1-CD1 3.48Å; I358-I419 HydrophobicContact CG2-CD1 3.82Å
359	R	80.3	Confident	75.4	Confident	158 Å²	158	70.6 Å²	70.6	60%	0.596	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.6	139.4	174	-74.2	-175.8	177.9	170	-0.5	110.6	S361 S362 L363 N394 F395	R359-S361 PolarHBondContact O-N 3.4Å; R359-S362 WeakPolarHBondContact O-CA 3.45Å; R359-S362 WeakPolarHBondContact O-CB 3.26Å; R359-S362 PolarHBondContact O-N 3.47Å; R359-L363 PolarHBondContact O-N 2.87Å; R359-N394 CarbonylContact C-O 3.56Å; R359-N394 VanDerWaalsContact CA-O 3.29Å; R359-N394 WeakPolarHBondContact CA-O 3.32Å; R359-F395 HydrophobicContact CG-CD1 4.06Å; R359-F395 HydrophobicContact CG-CE1 3.5Å; R359-F395 HydrophobicContact CG-CE2 4.5Å; R359-F395 HydrophobicContact CG-CZ 3.76Å
360	I	81.1	Confident	76.9	Confident	69 Å²	69	67.7 Å²	67.7	35%	0.354	36%	0.36	S	S	.	.	H	α-helix	trans	-55.7	-38.9	177.8	-65.5	176.2	0	0	0	111.1	S362 L363 N394	I360-S362 PolarHBondContact O-N 2.88Å; I360-S362 VanDerWaalsContact O-N 3.13Å; I360-L363 VanDerWaalsContact O-CB 3.3Å; I360-L363 WeakPolarHBondContact O-CB 2.75Å; I360-L363 PolarHBondContact O-N 3.39Å; I360-N394 PolarHBondContact N-O 2.92Å
361	S	80.4	Confident	78	Confident	100 Å²	100	61.6 Å²	61.6	70%	0.699	33%	0.329	S	S	*	.	H	α-helix	trans	-59	-26.9	176.2	60	0	0	0	0	113.9	R359	R359-S361 PolarHBondContact O-N 3.4Å
362	S	80.9	Confident	78.5	Confident	32 Å²	32	65.6 Å²	65.6	22%	0.224	34%	0.336	C	S	.	.	H	α-helix	trans	-92.4	-24.2	177.3	-60.3	0	0	0	0	112.6	R359 I360 G364 K365	R359-S362 WeakPolarHBondContact O-CA 3.45Å; R359-S362 WeakPolarHBondContact O-CB 3.26Å; R359-S362 PolarHBondContact O-N 3.47Å; I360-S362 PolarHBondContact O-N 2.88Å; I360-S362 VanDerWaalsContact O-N 3.13Å; S362-G364 PolarHBondContact O-N 3.49Å; S362-K365 WeakPolarHBondContact O-CB 3.48Å; S362-K365 PolarHBondContact O-N 3.22Å
363	L	79.5	Confident	78.8	Confident	9 Å²	9	64.5 Å²	64.5	5%	0.047	33%	0.332	C	S	.	.	H	α-helix	trans	-58.9	-37.5	176.8	-175.4	68.2	0	0	0	111.8	R359 I360 K365 L366 V367 I387 C396 V398	R359-L363 PolarHBondContact O-N 2.87Å; I360-L363 VanDerWaalsContact O-CB 3.3Å; I360-L363 WeakPolarHBondContact O-CB 2.75Å; I360-L363 PolarHBondContact O-N 3.39Å; L363-K365 PolarHBondContact O-N 3.44Å; L363-K365 VanDerWaalsContact O-N 3.09Å; L363-L366 WeakPolarHBondContact O-CB 3.28Å; L363-L366 PolarHBondContact O-N 2.94Å; L363-V367 HydrophobicContact CD1-CG2 4.02Å; L363-V367 HydrophobicContact CG-CG2 4Å; L363-V367 PolarHBondContact O-N 3.19Å; L363-V367 VanDerWaalsContact O-N 3.1Å; L363-I387 HydrophobicContact CD1-CD1 3.83Å; L363-I387 HydrophobicContact CD1-CG1 4.1Å; L363-I387 HydrophobicContact CD1-CG2 3.91Å; L363-I387 HydrophobicContact CD2-CG2 3.89Å; L363-C396 HydrophobicContact CD2-CB 4.06Å; L363-V398 HydrophobicContact CD1-CG2 4.31Å
364	G	78.4	Confident	79.2	Confident	34 Å²	34	61.8 Å²	61.8	35%	0.351	32%	0.315	S	S	.	.	H	α-helix	trans	-53.6	-31.8	175.5	0	0	0	0	0	112.4	S362 K368	S362-G364 PolarHBondContact O-N 3.49Å; G364-K368 WeakPolarHBondContact O-CB 3.2Å; G364-K368 VanDerWaalsContact O-CD 3.27Å; G364-K368 WeakPolarHBondContact O-CD 3.29Å; G364-K368 WeakPolarHBondContact O-CG 3.46Å; G364-K368 PolarHBondContact O-N 3.5Å; G364-K368 VanDerWaalsContact O-N 3.07Å
365	K	80.3	Confident	79.4	Confident	94 Å²	94	69.5 Å²	69.5	41%	0.409	34%	0.344	S	S	.	.	H	α-helix	trans	-68.5	-35.7	175.5	-61.8	-176.5	-179.6	-177	0	112.8	S362 L363 I373 I419	S362-K365 WeakPolarHBondContact O-CB 3.48Å; S362-K365 PolarHBondContact O-N 3.22Å; L363-K365 PolarHBondContact O-N 3.44Å; L363-K365 VanDerWaalsContact O-N 3.09Å; K365-I373 WeakPolarHBondContact O-CD1 3.26Å; K365-I419 WeakPolarHBondContact CD-O 3.2Å; K365-I419 PolarHBondContact NZ-O 2.88Å; K365-I419 VanDerWaalsContact NZ-O 3.09Å
366	L	77.5	Confident	79.6	Confident	4 Å²	4	65.6 Å²	65.6	2%	0.021	33%	0.33	C	S	.	.	H	α-helix	trans	-75.8	-38.7	-178.7	-147	93.9	0	0	0	112.4	L363 I373 V374 A415 A418 I419	L363-L366 WeakPolarHBondContact O-CB 3.28Å; L363-L366 PolarHBondContact O-N 2.94Å; L366-I373 HydrophobicContact CG-CG2 4.48Å; L366-V374 HydrophobicContact CD2-CG2 3.85Å; L366-V374 HydrophobicContact CG-CG2 4.15Å; L366-A415 HydrophobicContact CD1-CB 4.11Å; L366-A415 WeakPolarHBondContact CD1-O 3.34Å; L366-A418 HydrophobicContact CD1-CB 4.34Å; L366-I419 HydrophobicContact CD1-CD1 3.96Å; L366-I419 HydrophobicContact CD1-CG1 3.7Å
367	V	80.5	Confident	79.8	Confident	29 Å²	29	61.2 Å²	61.2	18%	0.176	31%	0.311	C	S	.	.	H	α-helix	trans	-95.3	-7.7	-173.1	-165.7	0	0	0	0	112.7	L363 G371 I387 T460	L363-V367 HydrophobicContact CD1-CG2 4.02Å; L363-V367 HydrophobicContact CG-CG2 4Å; L363-V367 PolarHBondContact O-N 3.19Å; L363-V367 VanDerWaalsContact O-N 3.1Å; V367-G371 PolarHBondContact O-N 2.91Å; V367-I387 HydrophobicContact CG2-CD1 3.35Å; V367-T460 HydrophobicContact CG1-CG2 4.49Å
368	K	77.8	Confident	80.1	Confident	123 Å²	123	61.5 Å²	61.5	54%	0.535	31%	0.307	S	S	.	.	H	α-helix	trans	-51.3	153.1	177.3	-103.2	166.2	-157.1	-167.4	0	112.7	G364 G370 G371	G364-K368 WeakPolarHBondContact O-CB 3.2Å; G364-K368 VanDerWaalsContact O-CD 3.27Å; G364-K368 WeakPolarHBondContact O-CD 3.29Å; G364-K368 WeakPolarHBondContact O-CG 3.46Å; G364-K368 PolarHBondContact O-N 3.5Å; G364-K368 VanDerWaalsContact O-N 3.07Å; K368-G370 PolarHBondContact O-N 3.38Å; K368-G371 PolarHBondContact O-N 3.46Å
369	K	73	Confident	80.3	Confident	142 Å²	142	67.4 Å²	67.4	62%	0.617	34%	0.337	S	S	*	.	H	α-helix	trans	54.5	46.9	178.1	-55.8	172.4	-172.3	158.8	0	112.7	G371 R372 E422	K369-G371 VanDerWaalsContact C-N 3.33Å; K369-G371 PolarHBondContact O-N 2.84Å; K369-R372 PolarHBondContact O-N 2.91Å; K369-E422 IonicContact NZ-OE1 3.43Å; K369-E422 PolarHBondContact NZ-OE1 3.36Å; K369-E422 IonicContact NZ-OE2 2.89Å; K369-E422 PolarHBondContact NZ-OE2 3Å
370	G	73.7	Confident	80.1	Confident	40 Å²	40	60.5 Å²	60.5	41%	0.412	31%	0.313	S	S	.	.	H	α-helix	trans	69.6	25.5	177.5	0	0	0	0	0	114.7	K368 R375	K368-G370 PolarHBondContact O-N 3.38Å; G370-R375 PolarHBondContact O-NH2 3.1Å
371	G	79.3	Confident	79.8	Confident	10 Å²	10	57.4 Å²	57.4	10%	0.103	30%	0.297	C	S	.	.	H	α-helix	trans	74.8	26	-178.4	0	0	0	0	0	114	V367 K368 K369 I373 V374 R375	V367-G371 PolarHBondContact O-N 2.91Å; K368-G371 PolarHBondContact O-N 3.46Å; K369-G371 VanDerWaalsContact C-N 3.33Å; K369-G371 PolarHBondContact O-N 2.84Å; G371-I373 VanDerWaalsContact C-N 3.28Å; G371-I373 PolarHBondContact O-N 3.21Å; G371-V374 WeakPolarHBondContact O-CB 3.49Å; G371-V374 PolarHBondContact O-N 3.41Å; G371-V374 VanDerWaalsContact O-N 3.11Å; G371-R375 WeakPolarHBondContact O-CG 3.37Å; G371-R375 PolarHBondContact O-N 2.95Å
372	R	80.7	Confident	79.8	Confident	145 Å²	145	54.9 Å²	54.9	55%	0.547	28%	0.276	S	S	.	.	H	α-helix	trans	-54	-43.9	-179.2	-176.9	178.2	177.3	174.4	-0.8	112.5	K369 R375 V376 Y426	K369-R372 PolarHBondContact O-N 2.91Å; R372-R375 PolarHBondContact O-N 3.02Å; R372-V376 WeakPolarHBondContact O-CG2 3.27Å; R372-V376 PolarHBondContact O-N 3.43Å; R372-Y426 WeakPolarHBondContact CD-OH 3.43Å
373	I	82.6	Confident	80	Confident	3 Å²	3	53.9 Å²	53.9	2%	0.015	27%	0.269	C	S	.	.	H	α-helix	trans	-60.9	-47.6	178.3	-70	176.1	0	0	0	110.3	K365 L366 G371 R375 V376 L377 A418 E422 F425	K365-I373 WeakPolarHBondContact O-CD1 3.26Å; L366-I373 HydrophobicContact CG-CG2 4.48Å; G371-I373 VanDerWaalsContact C-N 3.28Å; G371-I373 PolarHBondContact O-N 3.21Å; I373-R375 PolarHBondContact O-N 3.21Å; I373-V376 PolarHBondContact O-N 3.4Å; I373-L377 VanDerWaalsContact O-CB 3.28Å; I373-L377 WeakPolarHBondContact O-CB 3.36Å; I373-L377 PolarHBondContact O-N 2.8Å; I373-A418 HydrophobicContact CD1-CB 4.34Å; I373-A418 HydrophobicContact CG2-CB 3.49Å; I373-A418 VanDerWaalsContact CG2-CB 3.49Å; I373-E422 HydrophobicContact CD1-CB 4.42Å; I373-E422 HydrophobicContact CD1-CG 3.92Å; I373-F425 HydrophobicContact CB-CE1 4.18Å; I373-F425 HydrophobicContact CG1-CD1 4.32Å; I373-F425 HydrophobicContact CG1-CE1 4.13Å; I373-F425 HydrophobicContact CG2-CD1 4.23Å; I373-F425 HydrophobicContact CG2-CE1 3.84Å; I373-F425 HydrophobicContact CG2-CE2 4.32Å; I373-F425 HydrophobicContact CG2-CZ 3.89Å; I373-F425 WeakPolarHBondContact O-CZ 3.28Å
374	V	85	Confident	80.3	Confident	13 Å²	13	56 Å²	56	8%	0.079	28%	0.284	C	S	.	.	H	α-helix	trans	-57.6	-49.9	177.6	174.8	0	0	0	0	110.7	L366 G371 V376 L377 E378 V385	L366-V374 HydrophobicContact CD2-CG2 3.85Å; L366-V374 HydrophobicContact CG-CG2 4.15Å; G371-V374 WeakPolarHBondContact O-CB 3.49Å; G371-V374 PolarHBondContact O-N 3.41Å; G371-V374 VanDerWaalsContact O-N 3.11Å; V374-V376 VanDerWaalsContact C-N 3.34Å; V374-V376 PolarHBondContact O-N 3.27Å; V374-L377 WeakPolarHBondContact O-CB 3.44Å; V374-L377 PolarHBondContact O-N 2.78Å; V374-L377 VanDerWaalsContact O-N 3.12Å; V374-E378 HydrophobicContact CG1-CG 4.16Å; V374-E378 WeakPolarHBondContact O-CB 3.45Å; V374-E378 VanDerWaalsContact O-CG 3.29Å; V374-E378 WeakPolarHBondContact O-CG 3.39Å; V374-E378 PolarHBondContact O-N 3.04Å; V374-V385 HydrophobicContact CG1-CB 3.76Å; V374-V385 HydrophobicContact CG1-CG1 4.22Å; V374-V385 HydrophobicContact CG1-CG2 4.15Å
375	R	82.8	Confident	80.7	Confident	168 Å²	168	54.9 Å²	54.9	63%	0.634	27%	0.271	S	S	*	.	H	α-helix	trans	-60.7	-41.4	179.9	-64.9	179.1	-159.6	176.7	4.5	112.8	G370 G371 R372 I373 L377 L379	G370-R375 PolarHBondContact O-NH2 3.1Å; G371-R375 WeakPolarHBondContact O-CG 3.37Å; G371-R375 PolarHBondContact O-N 2.95Å; R372-R375 PolarHBondContact O-N 3.02Å; I373-R375 PolarHBondContact O-N 3.21Å; R375-L377 VanDerWaalsContact C-N 3.34Å; R375-L379 VanDerWaalsContact O-CB 3.26Å; R375-L379 WeakPolarHBondContact O-CB 3.44Å; R375-L379 PolarHBondContact O-N 3.04Å
376	V	82	Confident	80.9	Confident	37 Å²	37	53.3 Å²	53.3	22%	0.224	27%	0.271	C	S	.	.	H	α-helix	trans	-66.1	-41	176.8	171.4	0	0	0	0	110.6	R372 I373 V374 L379 V380 F425 Y426 C429	R372-V376 WeakPolarHBondContact O-CG2 3.27Å; R372-V376 PolarHBondContact O-N 3.43Å; I373-V376 PolarHBondContact O-N 3.4Å; V374-V376 VanDerWaalsContact C-N 3.34Å; V374-V376 PolarHBondContact O-N 3.27Å; V376-L379 PolarHBondContact O-N 3.49Å; V376-V380 HydrophobicContact CG1-CG2 4.16Å; V376-V380 WeakPolarHBondContact O-CB 3.49Å; V376-V380 WeakPolarHBondContact O-CG2 3.21Å; V376-V380 PolarHBondContact O-N 3.06Å; V376-F425 HydrophobicContact CB-CE1 4.2Å; V376-F425 HydrophobicContact CB-CZ 4.04Å; V376-F425 HydrophobicContact CG1-CE1 4.01Å; V376-F425 HydrophobicContact CG1-CZ 3.84Å; V376-Y426 HydrophobicContact CG1-CE1 4.49Å; V376-Y426 HydrophobicContact CG2-CE1 4.23Å; V376-C429 HydrophobicContact CG1-CB 4.12Å
377	L	84.1	Confident	81.3	Confident	3 Å²	3	55.4 Å²	55.4	2%	0.016	28%	0.281	C	S	.	.	H	α-helix	trans	-63.7	-47.8	178.3	-173.1	142.1	0	0	0	111.6	I373 V374 R375 L379 V380 T381 V385 A411 L414 A415 F425	I373-L377 VanDerWaalsContact O-CB 3.28Å; I373-L377 WeakPolarHBondContact O-CB 3.36Å; I373-L377 PolarHBondContact O-N 2.8Å; V374-L377 WeakPolarHBondContact O-CB 3.44Å; V374-L377 PolarHBondContact O-N 2.78Å; V374-L377 VanDerWaalsContact O-N 3.12Å; R375-L377 VanDerWaalsContact C-N 3.34Å; L377-L379 VanDerWaalsContact C-N 3.33Å; L377-L379 PolarHBondContact O-N 2.96Å; L377-V380 PolarHBondContact O-N 3.21Å; L377-T381 WeakPolarHBondContact O-CB 3.46Å; L377-T381 PolarHBondContact O-N 3.25Å; L377-T381 PolarHBondContact O-OG1 2.78Å; L377-V385 HydrophobicContact CD2-CG2 3.52Å; L377-A411 WeakPolarHBondContact CD1-O 3.47Å; L377-A411 HydrophobicContact CD2-CB 3.96Å; L377-L414 HydrophobicContact CD1-CB 3.7Å; L377-L414 HydrophobicContact CG-CB 4.35Å; L377-A415 HydrophobicContact CD1-CB 3.68Å; L377-A415 VanDerWaalsContact CD1-N 3.28Å; L377-F425 HydrophobicContact CB-CE2 4.07Å; L377-F425 HydrophobicContact CB-CZ 4.08Å; L377-F425 HydrophobicContact CD1-CE2 3.98Å; L377-F425 HydrophobicContact CG-CE2 4.46Å
378	E	84.9	Confident	81.3	Confident	59 Å²	59	58 Å²	58	28%	0.276	29%	0.294	S	S	.	.	H	α-helix	trans	-57.2	-46.1	175.1	-71	-179	145.5	0	0	111.3	V374 N382 S383 V385	V374-E378 HydrophobicContact CG1-CG 4.16Å; V374-E378 WeakPolarHBondContact O-CB 3.45Å; V374-E378 VanDerWaalsContact O-CG 3.29Å; V374-E378 WeakPolarHBondContact O-CG 3.39Å; V374-E378 PolarHBondContact O-N 3.04Å; E378-N382 WeakPolarHBondContact O-CA 3.48Å; E378-N382 PolarHBondContact O-N 2.87Å; E378-S383 WeakPolarHBondContact CA-O 3.39Å; E378-S383 WeakPolarHBondContact CB-O 3.38Å; E378-S383 VanDerWaalsContact CG-O 3.24Å; E378-S383 WeakPolarHBondContact CG-O 3.46Å; E378-S383 PolarHBondContact O-N 3.43Å; E378-V385 HydrophobicContact CG-CB 4.29Å; E378-V385 HydrophobicContact CG-CG2 3.8Å; E378-V385 PolarHBondContact OE1-N 3.15Å
379	L	82	Confident	81.3	Confident	143 Å²	143	59.1 Å²	59.1	75%	0.749	31%	0.306	S	S	*	.	H	α-helix	trans	-63.4	-46.4	179.2	-174.3	73.3	0	0	0	112.5	R375 V376 L377	R375-L379 VanDerWaalsContact O-CB 3.26Å; R375-L379 WeakPolarHBondContact O-CB 3.44Å; R375-L379 PolarHBondContact O-N 3.04Å; V376-L379 PolarHBondContact O-N 3.49Å; L377-L379 VanDerWaalsContact C-N 3.33Å; L377-L379 PolarHBondContact O-N 2.96Å
380	V	76.4	Confident	81.4	Confident	14 Å²	14	54 Å²	54	9%	0.085	29%	0.287	C	S	.	.	H	α-helix	trans	-73.5	-31.1	-174.3	170.9	0	0	0	0	112.1	V376 L377 L414 C429 F432 A433	V376-V380 HydrophobicContact CG1-CG2 4.16Å; V376-V380 WeakPolarHBondContact O-CB 3.49Å; V376-V380 WeakPolarHBondContact O-CG2 3.21Å; V376-V380 PolarHBondContact O-N 3.06Å; L377-V380 PolarHBondContact O-N 3.21Å; V380-L414 HydrophobicContact CG1-CD1 4.47Å; V380-C429 HydrophobicContact CG2-CB 4.1Å; V380-F432 HydrophobicContact CG1-CB 3.73Å; V380-F432 HydrophobicContact CG1-CD1 3.91Å; V380-F432 HydrophobicContact CG1-CG 4.17Å; V380-A433 HydrophobicContact CG2-CB 4.42Å
381	T	74.9	Confident	81.4	Confident	4 Å²	4	61 Å²	61	3%	0.025	31%	0.314	C	S	.	.	H	α-helix	trans	-107.5	3.4	-174.5	62.3	0	0	0	0	114	L377 S383 E407 A411 L414	L377-T381 WeakPolarHBondContact O-CB 3.46Å; L377-T381 PolarHBondContact O-N 3.25Å; L377-T381 PolarHBondContact O-OG1 2.78Å; T381-S383 PolarHBondContact O-N 3.29Å; T381-S383 PolarHBondContact O-OG 3.12Å; T381-S383 WeakPolarHBondContact OG1-CB 3.35Å; T381-S383 PolarHBondContact OG1-OG 2.82Å; T381-E407 WeakPolarHBondContact O-CB 3.44Å; T381-A411 HydrophobicContact CG2-CB 3.97Å; T381-A411 WeakPolarHBondContact OG1-CB 3.43Å; T381-L414 HydrophobicContact CG2-CD1 3.69Å
382	N	80.5	Confident	81.1	Confident	47 Å²	47	68.8 Å²	68.8	25%	0.251	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.7	40.8	-174.3	-170	21.3	0	0	0	112.4	E378 P403 P441	E378-N382 WeakPolarHBondContact O-CA 3.48Å; E378-N382 PolarHBondContact O-N 2.87Å; N382-P403 WeakPolarHBondContact O-CD 3.31Å; N382-P441 WeakPolarHBondContact OD1-CG 2.95Å
383	S	84	Confident	80.9	Confident	11 Å²	11	67.6 Å²	67.6	8%	0.077	35%	0.349	C	S	.	.			trans	-119.9	160.3	-175.6	-58.3	0	0	0	0	109.8	E378 T381 T401 S402	E378-S383 WeakPolarHBondContact CA-O 3.39Å; E378-S383 WeakPolarHBondContact CB-O 3.38Å; E378-S383 VanDerWaalsContact CG-O 3.24Å; E378-S383 WeakPolarHBondContact CG-O 3.46Å; E378-S383 PolarHBondContact O-N 3.43Å; T381-S383 PolarHBondContact O-N 3.29Å; T381-S383 PolarHBondContact O-OG 3.12Å; T381-S383 WeakPolarHBondContact OG1-CB 3.35Å; T381-S383 PolarHBondContact OG1-OG 2.82Å; S383-T401 CarbonylContact C-O 3.6Å; S383-T401 VanDerWaalsContact CA-O 3.24Å; S383-T401 WeakPolarHBondContact CA-O 3.3Å; S383-T401 WeakPolarHBondContact CB-O 3.46Å; S383-S402 VanDerWaalsContact CB-OG 3.25Å; S383-S402 WeakPolarHBondContact CB-OG 3.18Å; S383-S402 WeakPolarHBondContact OG-CB 3.45Å; S383-S402 PolarHBondContact OG-OG 2.98Å
384	S	86.4	Confident	80.7	Confident	52 Å²	52	72.7 Å²	72.7	36%	0.364	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.6	169.9	67.5	0	0	0	0	110.3	I400 T401	S384-I400 CarbonylContact O-C 3.43Å; S384-I400 WeakPolarHBondContact O-CA 3.48Å; S384-T401 PolarHBondContact N-O 3.31Å; S384-T401 PolarHBondContact O-N 2.99Å; S384-T401 WeakPolarHBondContact OG-CB 3.29Å
385	V	86	Confident	80.6	Confident	11 Å²	11	75.4 Å²	75.4	7%	0.067	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	126.6	-179.5	-176.4	0	0	0	0	109.5	V374 L377 E378 V398 C399 I400	V374-V385 HydrophobicContact CG1-CB 3.76Å; V374-V385 HydrophobicContact CG1-CG1 4.22Å; V374-V385 HydrophobicContact CG1-CG2 4.15Å; L377-V385 HydrophobicContact CD2-CG2 3.52Å; E378-V385 HydrophobicContact CG-CB 4.29Å; E378-V385 HydrophobicContact CG-CG2 3.8Å; E378-V385 PolarHBondContact OE1-N 3.15Å; V385-V398 HydrophobicContact CG1-CG1 3.66Å; V385-C399 CarbonylContact C-O 3.59Å; V385-C399 WeakPolarHBondContact CA-O 3.44Å; V385-I400 HydrophobicContact CG1-CG1 4.44Å; V385-I400 HydrophobicContact CG2-CG1 4.25Å
386	C	85.5	Confident	80.6	Confident	62 Å²	62	67.5 Å²	67.5	42%	0.419	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	137.4	173.7	-59.1	0	0	0	0	109.6	C399	C386-C399 HydrophobicContact CB-CB 4.41Å; C386-C399 PolarHBondContact N-O 3.11Å; C386-C399 PolarHBondContact O-N 3.38Å
387	I	84.5	Confident	80.6	Confident	47 Å²	47	66.4 Å²	66.4	24%	0.241	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	117.7	176.2	-61.3	158	0	0	0	107.1	L363 V367 C396 V398	L363-I387 HydrophobicContact CD1-CD1 3.83Å; L363-I387 HydrophobicContact CD1-CG1 4.1Å; L363-I387 HydrophobicContact CD1-CG2 3.91Å; L363-I387 HydrophobicContact CD2-CG2 3.89Å; V367-I387 HydrophobicContact CG2-CD1 3.35Å; I387-C396 HydrophobicContact CG2-CB 4.09Å; I387-V398 HydrophobicContact CG1-CG2 4.37Å
388	L	81	Confident	80.5	Confident	85 Å²	85	66.5 Å²	66.5	45%	0.445	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	132.6	178.7	-59.4	179.4	0	0	0	109.6	D397 C399	L388-D397 HydrophobicContact CB-CB 4.36Å; L388-D397 PolarHBondContact N-O 3.09Å; L388-D397 PolarHBondContact O-N 3.46Å; L388-C399 WeakPolarHBondContact CD1-SG 3.5Å
389	N	77.2	Confident	80.6	Confident	145 Å²	145	64.3 Å²	64.3	78%	0.775	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	142.1	167.2	-85.4	-11.2	0	0	0	109.9	C396	N389-C396 PolarHBondContact OD1-SG 2.96Å
390	T	76.8	Confident	80.7	Confident	35 Å²	35	57.7 Å²	57.7	22%	0.215	31%	0.307	C	S	.	.			trans	-114.6	160.2	180	85.7	0	0	0	0	109.9	R392 F395 D397	T390-R392 PolarHBondContact O-N 3.12Å; T390-R392 WeakPolarHBondContact OG1-CB 3.44Å; T390-R392 PolarHBondContact OG1-N 2.57Å; T390-R392 PolarHBondContact OG1-O 3.47Å; T390-F395 PolarHBondContact OG1-O 3.03Å; T390-D397 HydrophobicContact CG2-CB 3.75Å; T390-D397 VanDerWaalsContact CG2-N 3.32Å; T390-D397 WeakPolarHBondContact CG2-OD2 3.48Å
391	L	73.4	Confident	81.1	Confident	187 Å²	187	58.6 Å²	58.6	98%	0.979	31%	0.313	S	S	*	.	S	Bend	trans	-69.6	-9.8	170.5	-65	168.9	0	0	0	112.6
392	R	72.8	Confident	81.4	Confident	173 Å²	173	58.4 Å²	58.4	65%	0.653	31%	0.311	S	S	*	.	S	Bend	trans	-83.3	121.5	-179.7	-65.3	-178.6	176.5	177.8	-0.8	110.1	T390 N394 F395	T390-R392 PolarHBondContact O-N 3.12Å; T390-R392 WeakPolarHBondContact OG1-CB 3.44Å; T390-R392 PolarHBondContact OG1-N 2.57Å; T390-R392 PolarHBondContact OG1-O 3.47Å; R392-N394 PolarHBondContact O-N 3.17Å; R392-F395 HydrophobicContact CB-CB 4.16Å; R392-F395 HydrophobicContact CB-CD2 4.41Å; R392-F395 PolarHBondContact O-N 3.21Å; R392-F395 VanDerWaalsContact O-N 3.13Å
393	V	75.5	Confident	81.1	Confident	121 Å²	121	58.2 Å²	58.2	73%	0.733	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	129.2	175.6	-173.1	0	0	0	0	109.7	F395	V393-F395 VanDerWaalsContact C-N 3.33Å; V393-F395 WeakPolarHBondContact O-CD2 3.28Å; V393-F395 PolarHBondContact O-N 3.39Å
394	N	79.9	Confident	80.6	Confident	110 Å²	110	60.3 Å²	60.3	59%	0.588	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	14	-180	-57.2	-33.2	0	0	0	116.9	R359 I360 R392	R359-N394 CarbonylContact C-O 3.56Å; R359-N394 VanDerWaalsContact CA-O 3.29Å; R359-N394 WeakPolarHBondContact CA-O 3.32Å; I360-N394 PolarHBondContact N-O 2.92Å; R392-N394 PolarHBondContact O-N 3.17Å
395	F	81.7	Confident	79.7	Confident	69 Å²	69	60.8 Å²	60.8	30%	0.303	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	140.2	175.4	-69.5	-93.6	0	0	0	113.5	I358 R359 T390 R392 V393	I358-F395 WeakPolarHBondContact O-CA 3.1Å; R359-F395 HydrophobicContact CG-CD1 4.06Å; R359-F395 HydrophobicContact CG-CE1 3.5Å; R359-F395 HydrophobicContact CG-CE2 4.5Å; R359-F395 HydrophobicContact CG-CZ 3.76Å; T390-F395 PolarHBondContact OG1-O 3.03Å; R392-F395 HydrophobicContact CB-CB 4.16Å; R392-F395 HydrophobicContact CB-CD2 4.41Å; R392-F395 PolarHBondContact O-N 3.21Å; R392-F395 VanDerWaalsContact O-N 3.13Å; V393-F395 VanDerWaalsContact C-N 3.33Å; V393-F395 WeakPolarHBondContact O-CD2 3.28Å; V393-F395 PolarHBondContact O-N 3.39Å
396	C	83.1	Confident	78.9	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.014	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	149.6	167.3	-69	0	0	0	0	109.5	S357 I358 L363 I387 N389	S357-C396 CarbonylContact C-O 3.58Å; S357-C396 WeakPolarHBondContact CA-O 3.34Å; I358-C396 PolarHBondContact N-O 3.36Å; I358-C396 PolarHBondContact O-N 3.48Å; L363-C396 HydrophobicContact CD2-CB 4.06Å; I387-C396 HydrophobicContact CG2-CB 4.09Å; N389-C396 PolarHBondContact OD1-SG 2.96Å
397	D	81.5	Confident	78.3	Confident	15 Å²	15	64.5 Å²	64.5	8%	0.08	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	122.8	173.5	-73.6	-32.2	0	0	0	109.6	K355 S357 L388 T390	K355-D397 HydrophobicContact CD-CB 4.45Å; K355-D397 WeakPolarHBondContact CE-OD2 3.27Å; K355-D397 HydrophobicContact CG-CB 4.2Å; K355-D397 IonicContact NZ-OD2 3.74Å; K355-D397 PolarHBondContact NZ-OD2 3.42Å; S357-D397 WeakPolarHBondContact CA-OD1 3.36Å; S357-D397 VanDerWaalsContact CB-OD1 3.28Å; S357-D397 WeakPolarHBondContact CB-OD1 3.47Å; S357-D397 PolarHBondContact OG-OD1 3.35Å; L388-D397 HydrophobicContact CB-CB 4.36Å; L388-D397 PolarHBondContact N-O 3.09Å; L388-D397 PolarHBondContact O-N 3.46Å; T390-D397 HydrophobicContact CG2-CB 3.75Å; T390-D397 VanDerWaalsContact CG2-N 3.32Å; T390-D397 WeakPolarHBondContact CG2-OD2 3.48Å
398	V	83.1	Confident	77.8	Confident	4 Å²	4	62.2 Å²	62.2	2%	0.024	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	114.2	170.2	-176.7	0	0	0	0	107.9	K356 I358 L363 V385 I387 I400	K356-V398 PolarHBondContact N-O 3.46Å; K356-V398 PolarHBondContact O-N 2.96Å; I358-V398 HydrophobicContact CD1-CB 4.01Å; I358-V398 HydrophobicContact CD1-CG2 3.43Å; I358-V398 VanDerWaalsContact CD1-CG2 3.43Å; I358-V398 HydrophobicContact CG1-CG2 3.97Å; L363-V398 HydrophobicContact CD1-CG2 4.31Å; V385-V398 HydrophobicContact CG1-CG1 3.66Å; I387-V398 HydrophobicContact CG1-CG2 4.37Å; V398-I400 HydrophobicContact CG1-CG1 4.14Å
399	C	85.4	Confident	77.2	Confident	13 Å²	13	58.6 Å²	58.6	9%	0.088	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	125.6	175.6	-65.6	0	0	0	0	108.9	T353 I354 V385 C386 L388	T353-C399 HydrophobicContact CG2-CB 4.49Å; I354-C399 CarbonylContact O-C 3.5Å; I354-C399 WeakPolarHBondContact O-CA 3.44Å; V385-C399 CarbonylContact C-O 3.59Å; V385-C399 WeakPolarHBondContact CA-O 3.44Å; C386-C399 HydrophobicContact CB-CB 4.41Å; C386-C399 PolarHBondContact N-O 3.11Å; C386-C399 PolarHBondContact O-N 3.38Å; L388-C399 WeakPolarHBondContact CD1-SG 3.5Å
400	I	85	Confident	77	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.021	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	120.9	177.7	-54.5	177.5	0	0	0	107.7	T353 I354 S384 V385 V398 A411 C412 A415	T353-I400 CarbonylContact C-O 3.58Å; T353-I400 VanDerWaalsContact CA-O 3.32Å; T353-I400 WeakPolarHBondContact CA-O 3.4Å; I354-I400 HydrophobicContact CG2-CB 3.77Å; I354-I400 HydrophobicContact CG2-CG1 4.5Å; I354-I400 PolarHBondContact N-O 3.36Å; I354-I400 PolarHBondContact O-N 3.29Å; S384-I400 CarbonylContact O-C 3.43Å; S384-I400 WeakPolarHBondContact O-CA 3.48Å; V385-I400 HydrophobicContact CG1-CG1 4.44Å; V385-I400 HydrophobicContact CG2-CG1 4.25Å; V398-I400 HydrophobicContact CG1-CG1 4.14Å; I400-A411 HydrophobicContact CD1-CB 4.3Å; I400-A411 HydrophobicContact CG2-CB 3.6Å; I400-C412 VanDerWaalsContact CD1-CA 3.49Å; I400-C412 HydrophobicContact CD1-CB 4.04Å; I400-A415 HydrophobicContact CD1-CB 4.25Å
401	T	85.3	Confident	77.1	Confident	33 Å²	33	50.2 Å²	50.2	20%	0.202	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	131.3	-178.8	-49.5	0	0	0	0	109.2	P351 F352 T353 S383 S384	P351-T401 HydrophobicContact CB-CG2 3.71Å; P351-T401 HydrophobicContact CG-CG2 4.15Å; F352-T401 CarbonylContact O-C 3.57Å; F352-T401 WeakPolarHBondContact O-CA 3.47Å; T353-T401 PolarHBondContact OG1-OG1 3.48Å; S383-T401 CarbonylContact C-O 3.6Å; S383-T401 VanDerWaalsContact CA-O 3.24Å; S383-T401 WeakPolarHBondContact CA-O 3.3Å; S383-T401 WeakPolarHBondContact CB-O 3.46Å; S384-T401 PolarHBondContact N-O 3.31Å; S384-T401 PolarHBondContact O-N 2.99Å; S384-T401 WeakPolarHBondContact OG-CB 3.29Å
402	S	80.7	Confident	77.5	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	151.9	-169.9	-52.4	0	0	0	0	111.5	P351 F352 S383 T404 G408	P351-S402 CarbonylContact C-O 3.31Å; P351-S402 WeakPolarHBondContact CA-O 3.23Å; F352-S402 PolarHBondContact N-O 3.41Å; F352-S402 PolarHBondContact O-N 3Å; S383-S402 VanDerWaalsContact CB-OG 3.25Å; S383-S402 WeakPolarHBondContact CB-OG 3.18Å; S383-S402 WeakPolarHBondContact OG-CB 3.45Å; S383-S402 PolarHBondContact OG-OG 2.98Å; S402-T404 WeakPolarHBondContact CB-O 3.47Å; S402-T404 PolarHBondContact O-N 3.23Å; S402-G408 VanDerWaalsContact CB-N 3.34Å; S402-G408 WeakPolarHBondContact OG-CA 3.42Å; S402-G408 PolarHBondContact OG-N 3.46Å
403	P	74.9	Confident	77.4	Confident	43 Å²	43	34 Å²	34	28%	0.279	19%	0.19	S	C	.	.	S	Bend	trans	-60.3	-36.9	176.1	-13.7	19.7	0	0	0	112	N382 E407 W443	N382-P403 WeakPolarHBondContact O-CD 3.31Å; P403-E407 WeakPolarHBondContact CB-OE2 3.38Å; P403-E407 VanDerWaalsContact CD-OE2 3.28Å; P403-E407 WeakPolarHBondContact CD-OE2 3.5Å; P403-E407 VanDerWaalsContact CG-OE2 3.28Å; P403-E407 WeakPolarHBondContact CG-OE2 3.44Å; P403-W443 HydrophobicContact CG-CH2 4.48Å; P403-W443 HydrophobicContact CG-CZ2 4.02Å
404	T	72.5	Confident	77.6	Confident	56 Å²	56	28.2 Å²	28.2	34%	0.344	16%	0.155	S	C	.	.	S	Bend	trans	-125.1	152.3	178.5	66.1	0	0	0	0	112.5	S402 K406 E407 G408	S402-T404 WeakPolarHBondContact CB-O 3.47Å; S402-T404 PolarHBondContact O-N 3.23Å; T404-K406 PolarHBondContact O-N 3.16Å; T404-K406 VanDerWaalsContact O-N 3.14Å; T404-E407 PolarHBondContact N-OE2 2.87Å; T404-E407 PolarHBondContact O-N 3.21Å; T404-E407 WeakPolarHBondContact OG1-CB 3.42Å; T404-E407 VanDerWaalsContact OG1-CD 3.25Å; T404-E407 VanDerWaalsContact OG1-CG 3.3Å; T404-E407 WeakPolarHBondContact OG1-CG 3.44Å; T404-E407 PolarHBondContact OG1-N 3.41Å; T404-E407 PolarHBondContact OG1-OE2 3.3Å; T404-G408 PolarHBondContact O-N 3.31Å; T404-G408 VanDerWaalsContact O-N 3.11Å
405	P	68.6	Low	77.8	Confident	62 Å²	62	23.2 Å²	23.2	40%	0.403	13%	0.129	S	C	.	.	H	α-helix	trans	-55.4	-31	172	-22.1	31.1	0	0	0	112.9	I317 M322 F352 G408 A409	I317-P405 HydrophobicContact CD1-CB 3.87Å; I317-P405 VanDerWaalsContact CD1-O 3.27Å; I317-P405 WeakPolarHBondContact CD1-O 3.25Å; M322-P405 HydrophobicContact CE-CB 3.3Å; M322-P405 WeakPolarHBondContact CE-O 3.49Å; F352-P405 HydrophobicContact CB-CB 4.49Å; F352-P405 HydrophobicContact CB-CG 4.21Å; F352-P405 HydrophobicContact CD1-CB 4.3Å; F352-P405 HydrophobicContact CD2-CB 4.05Å; F352-P405 HydrophobicContact CD2-CG 4.13Å; F352-P405 HydrophobicContact CE2-CB 4.39Å; F352-P405 HydrophobicContact CG-CB 4.01Å; F352-P405 HydrophobicContact CG-CG 4.16Å; P405-G408 PolarHBondContact O-N 2.75Å; P405-A409 WeakPolarHBondContact O-CB 3.37Å; P405-A409 PolarHBondContact O-N 3.06Å
406	K	67.6	Low	77.7	Confident	92 Å²	92	22.8 Å²	22.8	40%	0.4	13%	0.128	S	C	.	.	H	α-helix	trans	-68.9	-46.2	-178.7	-170.4	-174.5	-177.3	-173.4	0	111.8	L312 R313 I317 T404 G408 A410	L312-K406 WeakPolarHBondContact O-CE 3.09Å; L312-K406 WeakPolarHBondContact O-CG 3.43Å; R313-K406 WeakPolarHBondContact O-CE 3.37Å; R313-K406 PolarHBondContact O-NZ 2.77Å; I317-K406 HydrophobicContact CD1-CB 4.07Å; I317-K406 VanDerWaalsContact CD1-N 3.33Å; I317-K406 HydrophobicContact CG1-CB 4.45Å; T404-K406 PolarHBondContact O-N 3.16Å; T404-K406 VanDerWaalsContact O-N 3.14Å; K406-G408 VanDerWaalsContact C-N 3.34Å; K406-A410 WeakPolarHBondContact O-CB 3.48Å; K406-A410 PolarHBondContact O-N 3.49Å
407	E	73.2	Confident	77.4	Confident	58 Å²	58	22.7 Å²	22.7	27%	0.271	13%	0.128	S	C	.	.	H	α-helix	trans	-63.3	-42.2	175	-74.6	161.5	155.5	0	0	110.9	T381 P403 T404 A410 A411	T381-E407 WeakPolarHBondContact O-CB 3.44Å; P403-E407 WeakPolarHBondContact CB-OE2 3.38Å; P403-E407 VanDerWaalsContact CD-OE2 3.28Å; P403-E407 WeakPolarHBondContact CD-OE2 3.5Å; P403-E407 VanDerWaalsContact CG-OE2 3.28Å; P403-E407 WeakPolarHBondContact CG-OE2 3.44Å; T404-E407 PolarHBondContact N-OE2 2.87Å; T404-E407 PolarHBondContact O-N 3.21Å; T404-E407 WeakPolarHBondContact OG1-CB 3.42Å; T404-E407 VanDerWaalsContact OG1-CD 3.25Å; T404-E407 VanDerWaalsContact OG1-CG 3.3Å; T404-E407 WeakPolarHBondContact OG1-CG 3.44Å; T404-E407 PolarHBondContact OG1-N 3.41Å; T404-E407 PolarHBondContact OG1-OE2 3.3Å; E407-A410 PolarHBondContact O-N 3.11Å; E407-A411 WeakPolarHBondContact O-CB 3.33Å; E407-A411 PolarHBondContact O-N 3.2Å
408	G	73.7	Confident	77.4	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.3	-41.9	178.4	0	0	0	0	0	113.9	S402 T404 P405 K406 A411 C412	S402-G408 VanDerWaalsContact CB-N 3.34Å; S402-G408 WeakPolarHBondContact OG-CA 3.42Å; S402-G408 PolarHBondContact OG-N 3.46Å; T404-G408 PolarHBondContact O-N 3.31Å; T404-G408 VanDerWaalsContact O-N 3.11Å; P405-G408 PolarHBondContact O-N 2.75Å; K406-G408 VanDerWaalsContact C-N 3.34Å; G408-A411 PolarHBondContact O-N 3.22Å; G408-C412 WeakPolarHBondContact O-CB 3.11Å; G408-C412 PolarHBondContact O-N 2.91Å
409	A	69.5	Low	77.3	Confident	9 Å²	9	23 Å²	23	7%	0.074	13%	0.129	C	C	.	.	H	α-helix	trans	-65.2	-42.7	174.8	0	0	0	0	0	111.8	L312 I317 P405 C412 A413	L312-A409 HydrophobicContact CD1-CB 3.91Å; L312-A409 HydrophobicContact CD2-CB 3.8Å; L312-A409 HydrophobicContact CG-CB 4.46Å; I317-A409 HydrophobicContact CD1-CB 4.18Å; P405-A409 WeakPolarHBondContact O-CB 3.37Å; P405-A409 PolarHBondContact O-N 3.06Å; A409-C412 PolarHBondContact O-N 3.47Å; A409-A413 PolarHBondContact O-N 3.26Å
410	A	72.8	Confident	76.9	Confident	3 Å²	3	24.9 Å²	24.9	3%	0.025	14%	0.14	C	C	.	.	H	α-helix	trans	-63.6	-43.3	176.5	0	0	0	0	0	111.8	L309 K406 E407 A413 L414 F432	L309-A410 HydrophobicContact CD2-CB 4.36Å; L309-A410 VanDerWaalsContact CD2-O 3.31Å; L309-A410 WeakPolarHBondContact CD2-O 3.41Å; K406-A410 WeakPolarHBondContact O-CB 3.48Å; K406-A410 PolarHBondContact O-N 3.49Å; E407-A410 PolarHBondContact O-N 3.11Å; A410-A413 PolarHBondContact O-N 3.4Å; A410-L414 PolarHBondContact O-N 2.89Å; A410-F432 HydrophobicContact CB-CZ 4Å
411	A	79.4	Confident	76.3	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.9	-44.6	174.8	0	0	0	0	0	111.7	L377 T381 I400 E407 G408 A413 L414 A415	L377-A411 WeakPolarHBondContact CD1-O 3.47Å; L377-A411 HydrophobicContact CD2-CB 3.96Å; T381-A411 HydrophobicContact CG2-CB 3.97Å; T381-A411 WeakPolarHBondContact OG1-CB 3.43Å; I400-A411 HydrophobicContact CD1-CB 4.3Å; I400-A411 HydrophobicContact CG2-CB 3.6Å; E407-A411 WeakPolarHBondContact O-CB 3.33Å; E407-A411 PolarHBondContact O-N 3.2Å; G408-A411 PolarHBondContact O-N 3.22Å; A411-A413 VanDerWaalsContact C-N 3.34Å; A411-A413 PolarHBondContact O-N 3.25Å; A411-L414 PolarHBondContact O-N 2.86Å; A411-A415 WeakPolarHBondContact O-CB 3.46Å; A411-A415 PolarHBondContact O-N 3.03Å
412	C	80.6	Confident	76.1	Confident	11 Å²	11	26.6 Å²	26.6	7%	0.074	15%	0.146	C	C	.	.	H	α-helix	trans	-61.3	-41.7	175.4	-175.8	0	0	0	0	112.4	I354 I400 G408 A409 A415 Q416	I354-C412 HydrophobicContact CD1-CB 4.06Å; I354-C412 HydrophobicContact CG2-CB 4.1Å; I400-C412 VanDerWaalsContact CD1-CA 3.49Å; I400-C412 HydrophobicContact CD1-CB 4.04Å; G408-C412 WeakPolarHBondContact O-CB 3.11Å; G408-C412 PolarHBondContact O-N 2.91Å; A409-C412 PolarHBondContact O-N 3.47Å; C412-A415 PolarHBondContact O-N 3.3Å; C412-Q416 WeakPolarHBondContact O-CG 3.38Å; C412-Q416 PolarHBondContact O-N 3Å
413	A	72.5	Confident	75.7	Confident	8 Å²	8	33.6 Å²	33.6	7%	0.066	18%	0.176	C	C	.	.	H	α-helix	trans	-70.2	-38.5	178.9	0	0	0	0	0	112.3	L309 L312 A409 A410 A411 A415 Q416 L417	L309-A413 HydrophobicContact CD1-CB 4.32Å; L309-A413 HydrophobicContact CD2-CB 3.63Å; L309-A413 HydrophobicContact CG-CB 3.64Å; L312-A413 HydrophobicContact CD1-CB 4.46Å; A409-A413 PolarHBondContact O-N 3.26Å; A410-A413 PolarHBondContact O-N 3.4Å; A411-A413 VanDerWaalsContact C-N 3.34Å; A411-A413 PolarHBondContact O-N 3.25Å; A413-A415 VanDerWaalsContact C-N 3.32Å; A413-A415 PolarHBondContact O-N 2.91Å; A413-Q416 PolarHBondContact O-N 3.41Å; A413-L417 WeakPolarHBondContact O-CB 3.36Å; A413-L417 PolarHBondContact O-N 3.36Å
414	L	78.9	Confident	75.4	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.9	-37.4	172.1	-77.2	174.4	0	0	0	111.9	L309 L377 V380 T381 A410 A411 L417 A418 F425 L428	L309-L414 HydrophobicContact CD1-CD2 3.77Å; L309-L414 HydrophobicContact CD1-CG 4.21Å; L309-L414 HydrophobicContact CD2-CD2 4.09Å; L309-L414 HydrophobicContact CD2-CG 3.71Å; L377-L414 HydrophobicContact CD1-CB 3.7Å; L377-L414 HydrophobicContact CG-CB 4.35Å; V380-L414 HydrophobicContact CG1-CD1 4.47Å; T381-L414 HydrophobicContact CG2-CD1 3.69Å; A410-L414 PolarHBondContact O-N 2.89Å; A411-L414 PolarHBondContact O-N 2.86Å; L414-L417 PolarHBondContact O-N 3.47Å; L414-A418 WeakPolarHBondContact O-CB 3.18Å; L414-A418 PolarHBondContact O-N 2.89Å; L414-F425 HydrophobicContact CB-CD2 4.21Å; L414-F425 HydrophobicContact CB-CE2 4.17Å; L414-F425 HydrophobicContact CD2-CD2 4.31Å; L414-F425 WeakPolarHBondContact O-CD2 3.37Å; L414-L428 HydrophobicContact CD2-CB 4.19Å
415	A	83.1	Confident	75.7	Confident	5 Å²	5	29.1 Å²	29.1	4%	0.041	15%	0.148	C	C	.	.	H	α-helix	trans	-65.9	-43.4	177.8	0	0	0	0	0	111	L366 L377 I400 A411 C412 A413 L417 A418 I419	L366-A415 HydrophobicContact CD1-CB 4.11Å; L366-A415 WeakPolarHBondContact CD1-O 3.34Å; L377-A415 HydrophobicContact CD1-CB 3.68Å; L377-A415 VanDerWaalsContact CD1-N 3.28Å; I400-A415 HydrophobicContact CD1-CB 4.25Å; A411-A415 WeakPolarHBondContact O-CB 3.46Å; A411-A415 PolarHBondContact O-N 3.03Å; C412-A415 PolarHBondContact O-N 3.3Å; A413-A415 VanDerWaalsContact C-N 3.32Å; A413-A415 PolarHBondContact O-N 2.91Å; A415-L417 VanDerWaalsContact C-N 3.33Å; A415-A418 PolarHBondContact O-N 3.38Å; A415-I419 WeakPolarHBondContact O-CG1 3.47Å; A415-I419 PolarHBondContact O-N 3.24Å
416	Q	80.6	Confident	76.1	Confident	61 Å²	61	28.4 Å²	28.4	29%	0.285	14%	0.138	S	C	.	.	H	α-helix	trans	-62.3	-42.2	173.7	-72.5	174.1	12.1	0	0	111.5	L305 C412 A413 A418 I419 V420	L305-Q416 HydrophobicContact CD2-CB 3.73Å; C412-Q416 WeakPolarHBondContact O-CG 3.38Å; C412-Q416 PolarHBondContact O-N 3Å; A413-Q416 PolarHBondContact O-N 3.41Å; Q416-A418 VanDerWaalsContact C-N 3.33Å; Q416-A418 PolarHBondContact O-N 3.25Å; Q416-I419 WeakPolarHBondContact O-CB 3.33Å; Q416-I419 PolarHBondContact O-N 3.28Å; Q416-V420 WeakPolarHBondContact O-CG2 3.31Å; Q416-V420 PolarHBondContact O-N 3.01Å
417	L	75.9	Confident	76.2	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61	-43.3	175.6	-175.3	67.5	0	0	0	111.6	M302 L305 L309 A413 L414 A415 I419 V420 D421 A424 L428	M302-L417 HydrophobicContact CG-CD1 4.36Å; L305-L417 HydrophobicContact CB-CD1 4.29Å; L305-L417 HydrophobicContact CD1-CD1 4.32Å; L309-L417 HydrophobicContact CD1-CD2 4.24Å; A413-L417 WeakPolarHBondContact O-CB 3.36Å; A413-L417 PolarHBondContact O-N 3.36Å; L414-L417 PolarHBondContact O-N 3.47Å; A415-L417 VanDerWaalsContact C-N 3.33Å; L417-I419 PolarHBondContact O-N 3.45Å; L417-V420 PolarHBondContact O-N 2.85Å; L417-D421 CarbonylContact O-C 3.54Å; L417-D421 PolarHBondContact O-N 2.81Å; L417-D421 VanDerWaalsContact O-O 3.14Å; L417-A424 HydrophobicContact CD1-CB 3.71Å; L417-A424 HydrophobicContact CD2-CB 3.87Å; L417-A424 HydrophobicContact CG-CB 3.82Å; L417-L428 HydrophobicContact CD2-CB 4.46Å; L417-L428 HydrophobicContact CD2-CD1 3.19Å; L417-L428 HydrophobicContact CD2-CG 4.25Å
418	A	81.7	Confident	75.9	Confident	2 Å²	2	26.4 Å²	26.4	2%	0.017	13%	0.13	C	C	.	.	H	α-helix	trans	-62.2	-30.1	178.8	0	0	0	0	0	113.3	L366 I373 L414 A415 Q416 F425	L366-A418 HydrophobicContact CD1-CB 4.34Å; I373-A418 HydrophobicContact CD1-CB 4.34Å; I373-A418 HydrophobicContact CG2-CB 3.49Å; I373-A418 VanDerWaalsContact CG2-CB 3.49Å; L414-A418 WeakPolarHBondContact O-CB 3.18Å; L414-A418 PolarHBondContact O-N 2.89Å; A415-A418 PolarHBondContact O-N 3.38Å; Q416-A418 VanDerWaalsContact C-N 3.33Å; Q416-A418 PolarHBondContact O-N 3.25Å; A418-F425 HydrophobicContact CB-CB 3.86Å; A418-F425 HydrophobicContact CB-CD1 4.31Å; A418-F425 HydrophobicContact CB-CD2 3.79Å; A418-F425 HydrophobicContact CB-CE2 4.44Å; A418-F425 HydrophobicContact CB-CG 3.7Å
419	I	80.9	Confident	75.8	Confident	22 Å²	22	26.4 Å²	26.4	11%	0.113	13%	0.131	C	C	.	.	H	α-helix	trans	-70.5	-36.2	174.9	-69.1	162.7	0	0	0	111.4	I358 K365 L366 A415 Q416 L417	I358-I419 HydrophobicContact CD1-CD1 3.48Å; I358-I419 VanDerWaalsContact CD1-CD1 3.48Å; I358-I419 HydrophobicContact CG2-CD1 3.82Å; K365-I419 WeakPolarHBondContact CD-O 3.2Å; K365-I419 PolarHBondContact NZ-O 2.88Å; K365-I419 VanDerWaalsContact NZ-O 3.09Å; L366-I419 HydrophobicContact CD1-CD1 3.96Å; L366-I419 HydrophobicContact CD1-CG1 3.7Å; A415-I419 WeakPolarHBondContact O-CG1 3.47Å; A415-I419 PolarHBondContact O-N 3.24Å; Q416-I419 WeakPolarHBondContact O-CB 3.33Å; Q416-I419 PolarHBondContact O-N 3.28Å; L417-I419 PolarHBondContact O-N 3.45Å
420	V	76.6	Confident	75.7	Confident	53 Å²	53	31.6 Å²	31.6	32%	0.321	16%	0.157	S	C	.	.	H	α-helix	trans	-80.7	-44.1	179.9	179.5	0	0	0	0	110.7	M302 L305 Q416 L417	M302-V420 HydrophobicContact CG-CG1 3.82Å; M302-V420 HydrophobicContact SD-CG1 4.39Å; L305-V420 HydrophobicContact CD1-CG2 4.33Å; Q416-V420 WeakPolarHBondContact O-CG2 3.31Å; Q416-V420 PolarHBondContact O-N 3.01Å; L417-V420 PolarHBondContact O-N 2.85Å
421	D	73.9	Confident	75.1	Confident	11 Å²	11	32.8 Å²	32.8	6%	0.059	17%	0.167	C	C	.	.			trans	-154.3	108.8	-174.8	-172.9	-17.9	0	0	0	112.4	F290 R294 M302 L417 K423 A424 F425	F290-D421 WeakPolarHBondContact CD1-OD2 3.47Å; F290-D421 WeakPolarHBondContact CE1-OD2 3.25Å; R294-D421 IonicContact CZ-OD2 3.97Å; R294-D421 IonicContact NE-OD2 3.38Å; R294-D421 IonicContact NH2-OD1 2.58Å; R294-D421 IonicContact NH2-OD2 3.44Å; R294-D421 PolarHBondContact NH2-OD2 2.86Å; M302-D421 HydrophobicContact SD-CB 3.84Å; L417-D421 CarbonylContact O-C 3.54Å; L417-D421 PolarHBondContact O-N 2.81Å; L417-D421 VanDerWaalsContact O-O 3.14Å; D421-K423 VanDerWaalsContact C-N 3.35Å; D421-K423 PolarHBondContact O-N 2.7Å; D421-K423 WeakPolarHBondContact OD1-CA 3.34Å; D421-K423 WeakPolarHBondContact OD1-CB 3.41Å; D421-K423 PolarHBondContact OD1-N 3.32Å; D421-A424 HydrophobicContact CB-CB 3.71Å; D421-A424 PolarHBondContact O-N 3.33Å; D421-A424 PolarHBondContact OD1-N 3.5Å; D421-F425 PolarHBondContact O-N 2.92Å; D421-F425 VanDerWaalsContact O-N 3.16Å
422	E	79.7	Confident	74.2	Confident	62 Å²	62	34.4 Å²	34.4	29%	0.29	17%	0.174	S	C	.	.	H	α-helix	trans	-63.1	-36.7	175.3	179	178.5	178.6	0	0	112.3	K369 I373 F425 Y426	K369-E422 IonicContact NZ-OE1 3.43Å; K369-E422 PolarHBondContact NZ-OE1 3.36Å; K369-E422 IonicContact NZ-OE2 2.89Å; K369-E422 PolarHBondContact NZ-OE2 3Å; I373-E422 HydrophobicContact CD1-CB 4.42Å; I373-E422 HydrophobicContact CD1-CG 3.92Å; E422-F425 WeakPolarHBondContact O-CB 3.12Å; E422-Y426 HydrophobicContact CG-CD2 3.96Å; E422-Y426 HydrophobicContact CG-CE2 3.44Å; E422-Y426 VanDerWaalsContact CG-CE2 3.44Å; E422-Y426 WeakPolarHBondContact O-CD2 3.02Å; E422-Y426 PolarHBondContact O-N 3.42Å; E422-Y426 WeakPolarHBondContact OE1-CE2 3.25Å
423	K	74	Confident	73.1	Confident	148 Å²	148	36.2 Å²	36.2	64%	0.643	19%	0.189	S	C	*	.	H	α-helix	trans	-67.6	-42	178.3	-65.7	-177.4	-179.7	178.4	0	110.1	F290 D421 F425 Y426 H427	F290-K423 HydrophobicContact CE1-CB 4.09Å; F290-K423 HydrophobicContact CZ-CB 3.83Å; D421-K423 VanDerWaalsContact C-N 3.35Å; D421-K423 PolarHBondContact O-N 2.7Å; D421-K423 WeakPolarHBondContact OD1-CA 3.34Å; D421-K423 WeakPolarHBondContact OD1-CB 3.41Å; D421-K423 PolarHBondContact OD1-N 3.32Å; K423-F425 VanDerWaalsContact C-N 3.27Å; K423-F425 PolarHBondContact O-N 3.45Å; K423-Y426 PolarHBondContact O-N 2.98Å; K423-H427 PolarHBondContact O-N 2.89Å
424	A	68	Low	71.8	Confident	4 Å²	4	40.1 Å²	40.1	3%	0.033	22%	0.216	C	C	.	.	H	α-helix	trans	-60.8	-44.4	-179	0	0	0	0	0	110.2	F290 L417 D421 H427 L428	F290-A424 HydrophobicContact CD1-CB 4.15Å; F290-A424 HydrophobicContact CE1-CB 3.31Å; F290-A424 HydrophobicContact CZ-CB 3.96Å; L417-A424 HydrophobicContact CD1-CB 3.71Å; L417-A424 HydrophobicContact CD2-CB 3.87Å; L417-A424 HydrophobicContact CG-CB 3.82Å; D421-A424 HydrophobicContact CB-CB 3.71Å; D421-A424 PolarHBondContact O-N 3.33Å; D421-A424 PolarHBondContact OD1-N 3.5Å; A424-H427 PolarHBondContact O-N 3.03Å; A424-L428 PolarHBondContact O-N 2.78Å
425	F	78.4	Confident	70.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-54.8	-51.9	175.6	165.7	-100.4	0	0	0	112	I373 V376 L377 L414 A418 D421 E422 K423 H427 L428 C429	I373-F425 HydrophobicContact CB-CE1 4.18Å; I373-F425 HydrophobicContact CG1-CD1 4.32Å; I373-F425 HydrophobicContact CG1-CE1 4.13Å; I373-F425 HydrophobicContact CG2-CD1 4.23Å; I373-F425 HydrophobicContact CG2-CE1 3.84Å; I373-F425 HydrophobicContact CG2-CE2 4.32Å; I373-F425 HydrophobicContact CG2-CZ 3.89Å; I373-F425 WeakPolarHBondContact O-CZ 3.28Å; V376-F425 HydrophobicContact CB-CE1 4.2Å; V376-F425 HydrophobicContact CB-CZ 4.04Å; V376-F425 HydrophobicContact CG1-CE1 4.01Å; V376-F425 HydrophobicContact CG1-CZ 3.84Å; L377-F425 HydrophobicContact CB-CE2 4.07Å; L377-F425 HydrophobicContact CB-CZ 4.08Å; L377-F425 HydrophobicContact CD1-CE2 3.98Å; L377-F425 HydrophobicContact CG-CE2 4.46Å; L414-F425 HydrophobicContact CB-CD2 4.21Å; L414-F425 HydrophobicContact CB-CE2 4.17Å; L414-F425 HydrophobicContact CD2-CD2 4.31Å; L414-F425 WeakPolarHBondContact O-CD2 3.37Å; A418-F425 HydrophobicContact CB-CB 3.86Å; A418-F425 HydrophobicContact CB-CD1 4.31Å; A418-F425 HydrophobicContact CB-CD2 3.79Å; A418-F425 HydrophobicContact CB-CE2 4.44Å; A418-F425 HydrophobicContact CB-CG 3.7Å; D421-F425 PolarHBondContact O-N 2.92Å; D421-F425 VanDerWaalsContact O-N 3.16Å; E422-F425 WeakPolarHBondContact O-CB 3.12Å; K423-F425 VanDerWaalsContact C-N 3.27Å; K423-F425 PolarHBondContact O-N 3.45Å; F425-H427 PolarHBondContact O-N 3.36Å; F425-L428 PolarHBondContact O-N 3.48Å; F425-C429 WeakPolarHBondContact CE2-SG 3.3Å; F425-C429 WeakPolarHBondContact CZ-SG 3.46Å; F425-C429 WeakPolarHBondContact O-CB 3.43Å; F425-C429 PolarHBondContact O-N 2.93Å; F425-C429 PolarHBondContact O-SG 2.79Å
426	Y	76.2	Confident	67.8	Low	48 Å²	48	51.1 Å²	51.1	19%	0.188	27%	0.269	C	S	.	.	H	α-helix	trans	-66	-39.5	-179.7	-72	-60.5	0	0	0	112.9	R372 V376 E422 K423 L428 C429 N430	R372-Y426 WeakPolarHBondContact CD-OH 3.43Å; V376-Y426 HydrophobicContact CG1-CE1 4.49Å; V376-Y426 HydrophobicContact CG2-CE1 4.23Å; E422-Y426 HydrophobicContact CG-CD2 3.96Å; E422-Y426 HydrophobicContact CG-CE2 3.44Å; E422-Y426 VanDerWaalsContact CG-CE2 3.44Å; E422-Y426 WeakPolarHBondContact O-CD2 3.02Å; E422-Y426 PolarHBondContact O-N 3.42Å; E422-Y426 WeakPolarHBondContact OE1-CE2 3.25Å; K423-Y426 PolarHBondContact O-N 2.98Å; Y426-L428 VanDerWaalsContact C-N 3.35Å; Y426-L428 PolarHBondContact O-N 3.3Å; Y426-C429 PolarHBondContact O-N 3.42Å; Y426-N430 PolarHBondContact O-N 3.12Å
427	H	70	Confident	65.4	Low	92 Å²	92	53.2 Å²	53.2	43%	0.426	29%	0.288	S	S	.	.	H	α-helix	trans	-60.7	-45.9	178	-172.7	57.2	0	0	0	111.5	F290 K423 A424 F425 N430 A431	F290-H427 HydrophobicContact CE2-CB 4.36Å; F290-H427 HydrophobicContact CZ-CB 4.27Å; K423-H427 PolarHBondContact O-N 2.89Å; A424-H427 PolarHBondContact O-N 3.03Å; F425-H427 PolarHBondContact O-N 3.36Å; H427-N430 PolarHBondContact O-N 3.08Å; H427-A431 PolarHBondContact O-N 2.97Å
428	L	68	Low	63.3	Low	15 Å²	15	63.5 Å²	63.5	8%	0.079	33%	0.333	C	S	.	.	H	α-helix	trans	-70.9	-36.7	177.5	-76.6	176.5	0	0	0	113.1	I306 L309 Y310 L414 L417 A424 F425 Y426 N430 A431 F432	I306-L428 HydrophobicContact CB-CD1 4.37Å; I306-L428 HydrophobicContact CG1-CD1 3.62Å; I306-L428 HydrophobicContact CG2-CD1 4.45Å; I306-L428 HydrophobicContact CG2-CD2 4.34Å; L309-L428 HydrophobicContact CD1-CD1 3.82Å; Y310-L428 HydrophobicContact CE2-CD2 3.68Å; L414-L428 HydrophobicContact CD2-CB 4.19Å; L417-L428 HydrophobicContact CD2-CB 4.46Å; L417-L428 HydrophobicContact CD2-CD1 3.19Å; L417-L428 HydrophobicContact CD2-CG 4.25Å; A424-L428 PolarHBondContact O-N 2.78Å; F425-L428 PolarHBondContact O-N 3.48Å; Y426-L428 VanDerWaalsContact C-N 3.35Å; Y426-L428 PolarHBondContact O-N 3.3Å; L428-N430 VanDerWaalsContact C-N 3.28Å; L428-N430 PolarHBondContact O-N 3.5Å; L428-A431 CarbonylContact O-C 3.59Å; L428-A431 WeakPolarHBondContact O-CB 3.46Å; L428-A431 PolarHBondContact O-N 3.48Å; L428-A431 VanDerWaalsContact O-N 3.11Å; L428-F432 WeakPolarHBondContact O-CB 3.42Å; L428-F432 PolarHBondContact O-N 3.42Å
429	C	72.2	Confident	60.9	Low	1 Å²	1	72.1 Å²	72.1	1%	0.007	37%	0.369	C	S	.	.	H	α-helix	trans	-58.2	-42.7	174.9	-76.8	0	0	0	0	111.5	V376 V380 F425 Y426 A431 F432 A433	V376-C429 HydrophobicContact CG1-CB 4.12Å; V380-C429 HydrophobicContact CG2-CB 4.1Å; F425-C429 WeakPolarHBondContact CE2-SG 3.3Å; F425-C429 WeakPolarHBondContact CZ-SG 3.46Å; F425-C429 WeakPolarHBondContact O-CB 3.43Å; F425-C429 PolarHBondContact O-N 2.93Å; F425-C429 PolarHBondContact O-SG 2.79Å; Y426-C429 PolarHBondContact O-N 3.42Å; C429-A431 VanDerWaalsContact C-N 3.34Å; C429-A431 PolarHBondContact O-N 2.78Å; C429-F432 PolarHBondContact O-N 3.07Å; C429-A433 VanDerWaalsContact O-CB 3.28Å; C429-A433 WeakPolarHBondContact O-CB 3.29Å; C429-A433 PolarHBondContact O-N 2.58Å
430	N	66.9	Low	58.5	Low	118 Å²	118	77.4 Å²	77.4	63%	0.631	40%	0.403	S	S	*	.	H	α-helix	trans	-62.7	-41.7	174.6	-72.3	-13.4	0	0	0	111.7	Y426 H427 L428 F432 S434	Y426-N430 PolarHBondContact O-N 3.12Å; H427-N430 PolarHBondContact O-N 3.08Å; L428-N430 VanDerWaalsContact C-N 3.28Å; L428-N430 PolarHBondContact O-N 3.5Å; N430-F432 VanDerWaalsContact C-N 3.29Å; N430-F432 PolarHBondContact O-N 3.1Å; N430-S434 PolarHBondContact O-N 3.49Å
431	A	58.8	Low	56.5	Low	28 Å²	28	78 Å²	78	23%	0.231	41%	0.407	C	S	.	.	H	α-helix	trans	-66	-30.9	175.5	0	0	0	0	0	113	R313 H427 L428 C429 S434	R313-A431 PolarHBondContact NH1-O 3.31Å; R313-A431 PolarHBondContact NH2-O 2.79Å; H427-A431 PolarHBondContact O-N 2.97Å; L428-A431 CarbonylContact O-C 3.59Å; L428-A431 WeakPolarHBondContact O-CB 3.46Å; L428-A431 PolarHBondContact O-N 3.48Å; L428-A431 VanDerWaalsContact O-N 3.11Å; C429-A431 VanDerWaalsContact C-N 3.34Å; C429-A431 PolarHBondContact O-N 2.78Å; A431-S434 PolarHBondContact O-OG 3.09Å
432	F	60.7	Low	54.2	Low	34 Å²	34	89.1 Å²	89.1	15%	0.149	45%	0.448	C	S	.	.	H	α-helix	trans	-78.2	-45.7	178.6	-141	-90.1	0	0	0	111.5	R313 V380 A410 L428 C429 N430 S434 K435	R313-F432 HydrophobicContact CB-CE2 3.82Å; R313-F432 HydrophobicContact CB-CZ 4.17Å; R313-F432 HydrophobicContact CG-CD2 4.5Å; R313-F432 HydrophobicContact CG-CE2 3.82Å; R313-F432 HydrophobicContact CG-CZ 4.05Å; V380-F432 HydrophobicContact CG1-CB 3.73Å; V380-F432 HydrophobicContact CG1-CD1 3.91Å; V380-F432 HydrophobicContact CG1-CG 4.17Å; A410-F432 HydrophobicContact CB-CZ 4Å; L428-F432 WeakPolarHBondContact O-CB 3.42Å; L428-F432 PolarHBondContact O-N 3.42Å; C429-F432 PolarHBondContact O-N 3.07Å; N430-F432 VanDerWaalsContact C-N 3.29Å; N430-F432 PolarHBondContact O-N 3.1Å; F432-S434 VanDerWaalsContact C-N 3.28Å; F432-S434 PolarHBondContact O-N 2.89Å; F432-K435 PolarHBondContact O-N 3.03Å
433	A	57.7	Low	51.8	Low	48 Å²	48	92.4 Å²	92.4	40%	0.397	46%	0.458	S	S	.	.	H	α-helix	trans	-62.3	-29.7	-177.9	0	0	0	0	0	113.7	V380 C429 K435 V436	V380-A433 HydrophobicContact CG2-CB 4.42Å; C429-A433 VanDerWaalsContact O-CB 3.28Å; C429-A433 WeakPolarHBondContact O-CB 3.29Å; C429-A433 PolarHBondContact O-N 2.58Å; A433-K435 PolarHBondContact O-N 3.22Å; A433-V436 PolarHBondContact O-N 3.32Å
434	S	45.9	Very low	49.6	Very low	91 Å²	91	89.3 Å²	89.3	64%	0.636	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-10.8	-179.9	65	0	0	0	0	115.7	N430 A431 F432	N430-S434 PolarHBondContact O-N 3.49Å; A431-S434 PolarHBondContact O-OG 3.09Å; F432-S434 VanDerWaalsContact C-N 3.28Å; F432-S434 PolarHBondContact O-N 2.89Å
435	K	42.7	Very low	47.9	Very low	168 Å²	168	97.8 Å²	97.8	73%	0.73	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.6	5.6	179.5	-67.7	-164.9	176.4	-174.9	0	115.3	F432 A433	F432-K435 PolarHBondContact O-N 3.03Å; A433-K435 PolarHBondContact O-N 3.22Å
436	V	34.7	Very low	45.5	Very low	68 Å²	68	101.9 Å²	101.9	41%	0.412	52%	0.521	S	S	.	.	S	Bend	trans	-80.9	123.8	174.4	-176.4	0	0	0	0	107.7	A433 K438	A433-V436 PolarHBondContact O-N 3.32Å; V436-K438 PolarHBondContact O-N 3.33Å
437	P	30.1	Very low	43.5	Very low	105 Å²	105	104.8 Å²	104.8	68%	0.682	54%	0.543	S	S	*	.			trans	-57.2	127.6	175.3	-14.2	25.4	0	0	0	108.2	K439	P437-K439 PolarHBondContact O-N 3.09Å
438	K	32.8	Very low	41.6	Very low	216 Å²	216	109.2 Å²	109.2	94%	0.939	56%	0.557	S	S	*	*			trans	-65.4	71.1	173.1	-67.8	-178.9	-179.7	178.6	0	110	V436	V436-K438 PolarHBondContact O-N 3.33Å
439	K	31	Very low	39.7	Very low	182 Å²	182	112.5 Å²	112.5	79%	0.791	58%	0.582	S	S	*	*			trans	-113.3	101.2	163.2	-76.7	-169.6	176.6	-176.8	0	106.1	P437 P441	P437-K439 PolarHBondContact O-N 3.09Å; K439-P441 WeakPolarHBondContact O-CD 3.27Å
440	V	29.7	Very low	37.6	Very low	134 Å²	134	119.9 Å²	119.9	81%	0.812	62%	0.621	S	S	*	*			trans	-53.3	118.8	168.8	-177.7	0	0	0	0	106.8	R442	V440-R442 PolarHBondContact O-N 3.42Å; V440-R442 VanDerWaalsContact O-N 3.1Å
441	P	34.1	Very low	35.6	Very low	64 Å²	64	122.3 Å²	122.3	42%	0.416	63%	0.631	S	S	.	*			trans	-73.8	109.4	178.9	6.5	6.5	0	0	0	107.6	N382 K439 W443	N382-P441 WeakPolarHBondContact OD1-CG 2.95Å; K439-P441 WeakPolarHBondContact O-CD 3.27Å; P441-W443 VanDerWaalsContact C-N 3.35Å; P441-W443 PolarHBondContact O-N 3.09Å; P441-W443 VanDerWaalsContact O-N 3.16Å
442	R	27.5	Very low	34.2	Very low	245 Å²	245	127.6 Å²	127.6	93%	0.925	66%	0.661	S	S	*	*			trans	-74	94.4	159.4	-76.8	-174.9	178.3	179.6	-0.4	106.8	V440	V440-R442 PolarHBondContact O-N 3.42Å; V440-R442 VanDerWaalsContact O-N 3.1Å
443	W	28.1	Very low	32.6	Very low	132 Å²	132	136.1 Å²	136.1	50%	0.5	69%	0.692	S	S	.	*			trans	-70.6	146.4	167.8	-77.3	85.5	0	0	0	109.9	P403 P441 Q445	P403-W443 HydrophobicContact CG-CH2 4.48Å; P403-W443 HydrophobicContact CG-CZ2 4.02Å; P441-W443 VanDerWaalsContact C-N 3.35Å; P441-W443 PolarHBondContact O-N 3.09Å; P441-W443 VanDerWaalsContact O-N 3.16Å; W443-Q445 PolarHBondContact O-N 3.08Å
444	P	28.4	Very low	31.2	Very low	82 Å²	82	138.3 Å²	138.3	53%	0.532	70%	0.702	S	S	.	*			trans	-64.1	133.5	174	-11.6	26.4	0	0	0	109.2	S446	P444-S446 PolarHBondContact O-N 3.14Å
445	Q	31.5	Very low	30.5	Very low	182 Å²	182	139.3 Å²	139.3	85%	0.85	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-57.1	-5.5	177.3	-81.3	169.2	-38.6	0	0	114.3	W443 V447 Y448	W443-Q445 PolarHBondContact O-N 3.08Å; Q445-V447 PolarHBondContact O-N 3.12Å; Q445-Y448 PolarHBondContact O-N 3.17Å
446	S	29.5	Very low	30	Very low	86 Å²	86	133.6 Å²	133.6	60%	0.601	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-77.6	-9.7	-175.5	63.2	0	0	0	0	115.6	P444 S449	P444-S446 PolarHBondContact O-N 3.14Å; S446-S449 PolarHBondContact O-OG 3.05Å
447	V	33.1	Very low	29.8	Very low	109 Å²	109	134.3 Å²	134.3	66%	0.661	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-87.3	-13.7	174.7	-171.6	0	0	0	0	111.9	Q445	Q445-V447 PolarHBondContact O-N 3.12Å
448	Y	30.8	Very low	29.8	Very low	185 Å²	185	132 Å²	132	73%	0.725	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-6.2	179.4	-86.9	-81.5	0	0	0	114.6	Q445	Q445-Y448 PolarHBondContact O-N 3.17Å
449	S	27.1	Very low	29.7	Very low	84 Å²	84	125.1 Å²	125.1	59%	0.587	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-0.7	-165.1	62.8	0	0	0	0	116.4	S446	S446-S449 PolarHBondContact O-OG 3.05Å
450	N	27.8	Very low	29.9	Very low	157 Å²	157	119.1 Å²	119.1	84%	0.84	64%	0.639	S	S	*	*	S	Bend	trans	-154.5	11.4	-179.9	-98.1	-22.2	0	0	0	119.3
451	M	26.6	Very low	29.9	Very low	169 Å²	169	116.5 Å²	116.5	83%	0.833	62%	0.623	S	S	*	*	S	Bend	trans	-137.8	114.2	167.1	-72.5	-157.3	-175.2	0	0	111.5
452	T	27.5	Very low	29.7	Very low	139 Å²	139	120 Å²	120	85%	0.853	63%	0.633	S	S	*	*			trans	29.7	93	155.9	36.1	0	0	0	0	117.3
453	R	27.6	Very low	29.8	Very low	212 Å²	212	111.7 Å²	111.7	80%	0.8	61%	0.612	S	S	*	*			trans	26.4	122.9	139.7	-141.2	174.8	-168.3	179.7	3	117.2	L455	R453-L455 PolarHBondContact O-N 3.07Å
454	P	29.8	Very low	30	Very low	95 Å²	95	109.6 Å²	109.6	62%	0.617	61%	0.61	S	S	*	*	S	Bend	trans	-58.2	141.5	166.6	27.3	-32.3	0	0	0	109	S456	P454-S456 PolarHBondContact O-N 3.13Å
455	L	30.5	Very low	30.1	Very low	111 Å²	111	111.4 Å²	111.4	58%	0.581	61%	0.611	S	S	*	*			trans	-40	97	178.9	-78.5	155.1	0	0	0	110.6	R453 T459	R453-L455 PolarHBondContact O-N 3.07Å; L455-T459 HydrophobicContact CD2-CG2 4.04Å
456	S	31.2	Very low	30.1	Very low	48 Å²	48	106.2 Å²	106.2	34%	0.336	60%	0.599	S	S	.	*			trans	-71.1	151.5	167.4	73	0	0	0	0	107	P454 A458 T459	P454-S456 PolarHBondContact O-N 3.13Å; S456-A458 PolarHBondContact O-N 3.22Å; S456-T459 PolarHBondContact O-N 3.29Å; S456-T459 PolarHBondContact O-OG1 2.9Å
457	A	31.4	Very low	30.2	Very low	83 Å²	83	106.2 Å²	106.2	69%	0.686	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.6	-19.4	-180	0	0	0	0	0	114.2	T459 T460	A457-T459 PolarHBondContact O-N 3.13Å; A457-T460 PolarHBondContact O-N 3.41Å; A457-T460 PolarHBondContact O-OG1 3.44Å
458	A	29.8	Very low	30	Very low	56 Å²	56	107.2 Å²	107.2	46%	0.463	60%	0.597	S	S	.	*	H	α-helix	trans	-67.9	-22.9	176.4	0	0	0	0	0	115.5	S456 T461	S456-A458 PolarHBondContact O-N 3.22Å; A458-T461 VanDerWaalsContact C-OG1 3.24Å; A458-T461 VanDerWaalsContact CA-OG1 3.31Å; A458-T461 WeakPolarHBondContact CA-OG1 3.18Å; A458-T461 PolarHBondContact O-N 2.88Å; A458-T461 PolarHBondContact O-OG1 2.74Å
459	T	31.6	Very low	29.9	Very low	73 Å²	73	102.8 Å²	102.8	45%	0.448	59%	0.593	S	S	.	*	H	α-helix	trans	-82.6	-18.9	177.4	-21.8	0	0	0	0	112.4	L455 S456 A457 T461	L455-T459 HydrophobicContact CD2-CG2 4.04Å; S456-T459 PolarHBondContact O-N 3.29Å; S456-T459 PolarHBondContact O-OG1 2.9Å; A457-T459 PolarHBondContact O-N 3.13Å; T459-T461 VanDerWaalsContact C-N 3.3Å
460	T	34.1	Very low	30.1	Very low	56 Å²	56	106.5 Å²	106.5	34%	0.344	61%	0.606	S	S	.	*	H	α-helix	trans	-71.2	-25.2	169.6	-1.1	0	0	0	0	112.5	V367 A457 I464	V367-T460 HydrophobicContact CG1-CG2 4.49Å; A457-T460 PolarHBondContact O-N 3.41Å; A457-T460 PolarHBondContact O-OG1 3.44Å; T460-I464 WeakPolarHBondContact O-CD1 3.46Å; T460-I464 WeakPolarHBondContact O-CG1 3.44Å
461	T	30.9	Very low	30	Very low	79 Å²	79	103.5 Å²	103.5	49%	0.485	60%	0.597	S	S	.	*	H	α-helix	trans	-79.8	-33.9	179.8	22.4	0	0	0	0	113.4	A458 T459 C463 I464 E465	A458-T461 VanDerWaalsContact C-OG1 3.24Å; A458-T461 VanDerWaalsContact CA-OG1 3.31Å; A458-T461 WeakPolarHBondContact CA-OG1 3.18Å; A458-T461 PolarHBondContact O-N 2.88Å; A458-T461 PolarHBondContact O-OG1 2.74Å; T459-T461 VanDerWaalsContact C-N 3.3Å; T461-C463 VanDerWaalsContact C-N 3.34Å; T461-C463 PolarHBondContact O-N 3.29Å; T461-I464 PolarHBondContact O-N 3.37Å; T461-I464 VanDerWaalsContact O-N 3.14Å; T461-E465 PolarHBondContact O-N 3.1Å
462	H	29	Very low	30	Very low	137 Å²	137	105 Å²	105	63%	0.634	60%	0.599	S	S	*	*	H	α-helix	trans	-76.5	-13.2	179.3	-88	-51.8	0	0	0	115.3	E465	H462-E465 IonicContact CE1-OE2 2.87Å; H462-E465 PolarHBondContact CE1-OE2 3.18Å; H462-E465 IonicContact ND1-OE2 2.73Å; H462-E465 PolarHBondContact ND1-OE2 3.34Å
463	C	29.7	Very low	30.1	Very low	71 Å²	71	108 Å²	108	48%	0.48	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.1	-10.7	168.5	-68.3	0	0	0	0	113.2	T461 S467	T461-C463 VanDerWaalsContact C-N 3.34Å; T461-C463 PolarHBondContact O-N 3.29Å; C463-S467 PolarHBondContact O-OG 3.14Å; C463-S467 VanDerWaalsContact O-OG 3.06Å
464	I	32.8	Very low	30	Very low	88 Å²	88	107.6 Å²	107.6	45%	0.451	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.2	-35.3	175.5	-64.7	170.4	0	0	0	109.9	T460 T461 A466 S467 E468	T460-I464 WeakPolarHBondContact O-CD1 3.46Å; T460-I464 WeakPolarHBondContact O-CG1 3.44Å; T461-I464 PolarHBondContact O-N 3.37Å; T461-I464 VanDerWaalsContact O-N 3.14Å; I464-A466 VanDerWaalsContact C-N 3.33Å; I464-A466 PolarHBondContact O-N 2.94Å; I464-S467 WeakPolarHBondContact O-CB 3.41Å; I464-S467 PolarHBondContact O-N 3.44Å; I464-E468 PolarHBondContact O-N 3.06Å
465	E	30	Very low	30	Very low	120 Å²	120	108.5 Å²	108.5	56%	0.561	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-24.2	178.1	-70.7	175.3	156.9	0	0	114.5	T461 H462 S467	T461-E465 PolarHBondContact O-N 3.1Å; H462-E465 IonicContact CE1-OE2 2.87Å; H462-E465 PolarHBondContact CE1-OE2 3.18Å; H462-E465 IonicContact ND1-OE2 2.73Å; H462-E465 PolarHBondContact ND1-OE2 3.34Å; E465-S467 VanDerWaalsContact C-N 3.26Å; E465-S467 PolarHBondContact O-N 3.07Å
466	A	30.7	Very low	29.8	Very low	72 Å²	72	113 Å²	113	60%	0.595	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-3.8	172.6	0	0	0	0	0	113.5	I464	I464-A466 VanDerWaalsContact C-N 3.33Å; I464-A466 PolarHBondContact O-N 2.94Å
467	S	31.2	Very low	29.4	Very low	86 Å²	86	117.4 Å²	117.4	60%	0.601	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	-19.6	179.4	-48.5	0	0	0	0	112.7	C463 I464 E465	C463-S467 PolarHBondContact O-OG 3.14Å; C463-S467 VanDerWaalsContact O-OG 3.06Å; I464-S467 WeakPolarHBondContact O-CB 3.41Å; I464-S467 PolarHBondContact O-N 3.44Å; E465-S467 VanDerWaalsContact C-N 3.26Å; E465-S467 PolarHBondContact O-N 3.07Å
468	E	29.2	Very low	29.3	Very low	131 Å²	131	119.8 Å²	119.8	61%	0.612	66%	0.661	S	S	*	*	S	Bend	trans	-92.7	-2.9	-179.3	-73	-178.4	164.6	0	0	114	I464 N470	I464-E468 PolarHBondContact O-N 3.06Å; E468-N470 VanDerWaalsContact C-N 3.3Å; E468-N470 PolarHBondContact O-N 3.38Å
469	S	30.4	Very low	29.1	Very low	92 Å²	92	123.4 Å²	123.4	64%	0.643	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	8.1	176.4	46	0	0	0	0	114.9
470	N	30	Very low	28.8	Very low	162 Å²	162	126.4 Å²	126.4	87%	0.866	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.7	17.4	175.3	-90.8	-16.9	0	0	0	114.9	E468	E468-N470 VanDerWaalsContact C-N 3.3Å; E468-N470 PolarHBondContact O-N 3.38Å
471	S	26.4	Very low	28.6	Very low	93 Å²	93	131.2 Å²	131.2	65%	0.65	71%	0.709	S	S	*	*			trans	-138.4	70.1	172.7	63.2	0	0	0	0	112
472	K	27	Very low	28.4	Very low	200 Å²	200	130.9 Å²	130.9	87%	0.87	72%	0.721	S	S	*	*			trans	-133	82	159.7	-88.6	-174.3	178.5	175.6	0	109.1
473	K	28.3	Very low	28.4	Very low	202 Å²	202	132.1 Å²	132.1	88%	0.878	73%	0.733	S	S	*	*			trans	178.6	86.4	146.7	-104.7	179.5	180	-177.2	0	108
474	E	25	Very low	28	Very low	204 Å²	204	137 Å²	137	95%	0.953	75%	0.749	S	S	*	*			trans	-173.6	78.6	149	-105.8	169.6	-160.6	0	0	107.1
475	S	30.7	Very low	27.8	Very low	114 Å²	114	139.7 Å²	139.7	80%	0.797	76%	0.763	S	S	*	*			trans	-101	116.5	168	53.4	0	0	0	0	108.8
476	K	27.4	Very low	27.7	Very low	205 Å²	205	138.3 Å²	138.3	89%	0.891	77%	0.767	S	S	*	*			trans	50.1	104.7	151.1	-89.5	178.3	168.4	179.3	0	118.3
477	V	22.8	Very low	27.5	Very low	141 Å²	141	141.8 Å²	141.8	86%	0.855	78%	0.775	S	S	*	*			trans	-78.1	116.2	148.6	173.5	0	0	0	0	108.9
478	V	28.8	Very low	27.1	Very low	134 Å²	134	144.4 Å²	144.4	81%	0.812	78%	0.778	S	S	*	*			trans	-176.5	124.6	150	173.8	0	0	0	0	104.1
479	N	24.4	Very low	27	Very low	131 Å²	131	146.3 Å²	146.3	70%	0.701	78%	0.784	S	S	*	*			cis	-169.2	164.6	-9.7	-146.9	3.5	0	0	0	107.2
480	L	25.9	Very low	26.8	Very low	137 Å²	137	148 Å²	148	72%	0.717	79%	0.79	S	S	*	*			trans	82	115.7	151	-63.9	154.1	0	0	0	121.1
481	N	29.3	Very low	26.5	Very low	157 Å²	157	147.5 Å²	147.5	84%	0.84	79%	0.787	S	S	*	*			trans	96.6	114.5	150.3	-61.3	-7	0	0	0	119.8
482	G	27.1	Very low	26.5	Very low	72 Å²	72	147.7 Å²	147.7	74%	0.742	79%	0.788	S	S	*	*				109.6	97.2	127.3	0	0	0	0	0	118.2
483	D	28.4	Very low	26.7	Very low	163 Å²	163	147 Å²	147	87%	0.872	79%	0.785	S	S	*	*			trans	62.1	107.3	142.1	-59	-15.3	0	0	0	122.9
484	E	23.1	Very low	26.5	Very low	174 Å²	174	144 Å²	144	81%	0.813	78%	0.775	S	S	*	*				14.3	141.9	126.8	-91.5	-174.1	179.1	0	0	124.5
485	L	28.4	Very low	26.8	Very low	143 Å²	143	140.1 Å²	140.1	75%	0.749	77%	0.77	S	S	*	*			trans	105.9	102.7	142.8	-71.2	156	0	0	0	121.8
486	S	27.1	Very low	26.6	Very low	92 Å²	92	141.3 Å²	141.3	64%	0.643	77%	0.767	S	S	*	*				67.7	130.2	121	69.5	0	0	0	0	125.2
487	N	26	Very low	27	Very low	145 Å²	145	141.7 Å²	141.7	78%	0.775	77%	0.769	S	S	*	*			trans	88	122.7	135	-73.2	-4.3	0	0	0	125
488	E	24.2	Very low	27.1	Very low	140 Å²	140	142.9 Å²	142.9	65%	0.654	77%	0.77	S	S	*	*			trans	65.4	116.9	132.8	-77	-160.9	126.7	0	0	124.2
489	K	26	Very low	26.9	Very low	172 Å²	172	140 Å²	140	75%	0.748	77%	0.767	S	S	*	*				82	139.9	122.2	-84.3	-178.2	175.9	145	0	123.3
490	V	26.7	Very low	27	Very low	127 Å²	127	141.9 Å²	141.9	77%	0.77	77%	0.774	S	S	*	*			trans	111.5	131.5	143.8	-163.2	0	0	0	0	118.3
491	L	24.2	Very low	26.9	Very low	152 Å²	152	141.7 Å²	141.7	80%	0.796	77%	0.774	S	S	*	*			trans	-51.1	164.9	171.2	-59	107.8	0	0	0	113.8
492	S	26.8	Very low	26.9	Very low	97 Å²	97	139.3 Å²	139.3	68%	0.678	77%	0.77	S	S	*	*				-179.8	164.8	51.2	-41.6	0	0	0	0	112.6
493	K	29.5	Very low	26.7	Very low	185 Å²	185	144 Å²	144	80%	0.804	78%	0.777	S	S	*	*			trans	78.4	148.6	149.4	-72.9	-172.6	170.7	-172.8	0	119.5
494	E	24.6	Very low	26.6	Very low	140 Å²	140	139.5 Å²	139.5	65%	0.654	77%	0.77	S	S	*	*			cis	171.4	136.9	-13.9	-169.3	160.7	-149	0	0	104.4
495	S	32.4	Very low	26.7	Very low	122 Å²	122	138.3 Å²	138.3	85%	0.853	77%	0.769	S	S	*	*			trans	172.9	129.4	136.8	38.7	0	0	0	0	113.3
496	D	26.7	Very low	26.6	Very low	138 Å²	138	138.5 Å²	138.5	74%	0.738	77%	0.771	S	S	*	*			trans	-67.6	160.5	179.4	-66.1	-65.5	0	0	0	115.5
497	K	33.9	Very low	26.7	Very low	214 Å²	214	140.5 Å²	140.5	93%	0.93	78%	0.784	S	S	*	*				-159.9	112.1	127.1	-106	171.7	-172.6	-179.9	0	111.3
498	N	26	Very low	26.6	Very low	165 Å²	165	139.6 Å²	139.6	88%	0.882	79%	0.788	S	S	*	*			trans	-85.2	153.8	163.3	-86.6	-34.6	0	0	0	110.8
499	G	24.6	Very low	26.9	Very low	73 Å²	73	136.8 Å²	136.8	75%	0.753	80%	0.797	S	S	*	*			trans	156.3	88.2	155.4	0	0	0	0	0	119.2
500	M	25.8	Very low	26.9	Very low	171 Å²	171	140.4 Å²	140.4	84%	0.842	81%	0.806	S	S	*	*			trans	57.8	125.4	133.7	-74.4	174.4	114.1	0	0	125.1
501	N	23.9	Very low	26.7	Very low	133 Å²	133	139.9 Å²	139.9	71%	0.711	81%	0.807	S	S	*	*				72.8	120.1	128.1	-74.8	5.8	0	0	0	124.9
502	S	28.9	Very low	26.9	Very low	108 Å²	108	139.2 Å²	139.2	76%	0.755	81%	0.81	S	S	*	*				122.6	126.3	115.1	67.2	0	0	0	0	119.4
503	N	24.5	Very low	26.8	Very low	169 Å²	169	141.9 Å²	141.9	90%	0.904	82%	0.816	S	S	*	*			trans	42	136.9	145.3	-71.6	-3.6	0	0	0	123.4
504	G	25.8	Very low	26.7	Very low	69 Å²	69	138.9 Å²	138.9	71%	0.711	82%	0.818	S	S	*	*			trans	131.9	105.5	133	0	0	0	0	0	117.9
505	D	25.6	Very low	26.7	Very low	150 Å²	150	140 Å²	140	80%	0.802	83%	0.828	S	S	*	*			trans	63.9	123.1	137.7	-67.4	-22.3	0	0	0	124.6
506	N	24.7	Very low	26.5	Very low	147 Å²	147	137.8 Å²	137.8	79%	0.786	82%	0.824	S	S	*	*			trans	42.5	117.3	131	-69.8	-26.2	0	0	0	120.1
507	C	29.2	Very low	26.3	Very low	134 Å²	134	137.8 Å²	137.8	91%	0.905	83%	0.83	S	S	*	*			trans	-138.7	106.2	144.2	-88.2	0	0	0	0	111
508	S	24.8	Very low	26.1	Very low	125 Å²	125	132.9 Å²	132.9	87%	0.874	82%	0.822	S	S	*	*			trans	-64	125	155.4	51.6	0	0	0	0	110.2
509	G	30	Very low	26.1	Very low	82 Å²	82	131.4 Å²	131.4	85%	0.845	82%	0.819	S	S	*	*			trans	-120.3	126.4	173.7	0	0	0	0	0	111
510	R	26.1	Very low	26.1	Very low	247 Å²	247	132.4 Å²	132.4	93%	0.932	82%	0.82	S	S	*	*			trans	-90.4	154.5	-160.8	-156.8	176.4	-170	174.3	0.9	111.7
511	C	22.8	Very low	26.1	Very low	117 Å²	117	133.5 Å²	133.5	79%	0.791	82%	0.823	S	S	*	*			trans	-53.5	144.7	176.7	-49.2	0	0	0	0	114.5
512	T	29.5	Very low	26.3	Very low	138 Å²	138	130.6 Å²	130.6	85%	0.847	83%	0.825	S	S	*	*			trans	-132	121.4	147.8	51.9	0	0	0	0	109.5
513	N	23.7	Very low	26.1	Very low	153 Å²	153	133.7 Å²	133.7	82%	0.818	83%	0.831	S	S	*	*			trans	-66.8	141.6	171.6	-68.9	-31.7	0	0	0	110.8
514	S	27.7	Very low	26.2	Very low	121 Å²	121	130.5 Å²	130.5	85%	0.846	82%	0.822	S	S	*	*			trans	-124.5	108.5	149.9	32.1	0	0	0	0	109
515	L	24.9	Very low	26.1	Very low	163 Å²	163	133.2 Å²	133.2	85%	0.853	83%	0.825	S	S	*	*			trans	-57.1	129.4	161.8	-111.4	76.6	0	0	0	108.7
516	G	27.6	Very low	26.2	Very low	76 Å²	76	133.9 Å²	133.9	78%	0.784	83%	0.827	S	S	*	*			trans	-153.4	77.2	171.6	0	0	0	0	0	108.9	S518	G516-S518 PolarHBondContact O-N 2.89Å
517	T	23.1	Very low	26.2	Very low	138 Å²	138	134.7 Å²	134.7	85%	0.847	83%	0.826	S	S	*	*			trans	-65.7	114.4	165.9	42.1	0	0	0	0	109.2
518	S	28.2	Very low	26.1	Very low	112 Å²	112	133.9 Å²	133.9	78%	0.783	82%	0.821	S	S	*	*			trans	-144.4	130.7	147.8	73.6	0	0	0	0	112.1	G516	G516-S518 PolarHBondContact O-N 2.89Å
519	T	27.7	Very low	26.2	Very low	133 Å²	133	133.8 Å²	133.8	82%	0.816	82%	0.816	S	S	*	*			trans	-40.7	151.3	177.6	38.1	0	0	0	0	117.9
520	A	24.4	Very low	26.2	Very low	94 Å²	94	135.1 Å²	135.1	78%	0.777	81%	0.812	S	S	*	*			trans	-53.3	128.5	171.8	0	0	0	0	0	114
521	H	26.2	Very low	26.4	Very low	194 Å²	194	135.5 Å²	135.5	90%	0.898	83%	0.831	S	S	*	*			trans	-142.7	127.6	159.3	-94.4	-1.5	0	0	0	111.7
522	G	26.4	Very low	26.5	Very low	72 Å²	72	136.4 Å²	136.4	74%	0.742	83%	0.833	S	S	*	*			trans	89.8	76.6	142.6	0	0	0	0	0	117.4	S524	G522-S524 PolarHBondContact O-N 3.33Å
523	I	24.4	Very low	26.4	Very low	173 Å²	173	136.3 Å²	136.3	89%	0.887	83%	0.833	S	S	*	*			trans	-71.4	98	148.8	-58.8	171.2	0	0	0	106.1	T525	I523-T525 PolarHBondContact O-N 3.48Å
524	S	26.6	Very low	26.5	Very low	102 Å²	102	135.4 Å²	135.4	71%	0.713	83%	0.833	S	S	*	*			trans	-86.4	105	167	53	0	0	0	0	109.2	G522 I526	G522-S524 PolarHBondContact O-N 3.33Å; S524-I526 PolarHBondContact O-N 3.29Å
525	T	23.6	Very low	26.5	Very low	126 Å²	126	136.2 Å²	136.2	77%	0.773	83%	0.833	S	S	*	*			trans	-46.1	113.3	155.1	25.7	0	0	0	0	110.2	I523 Q527	I523-T525 PolarHBondContact O-N 3.48Å; T525-Q527 PolarHBondContact O-N 3.03Å
526	I	28.8	Very low	26.6	Very low	164 Å²	164	134.6 Å²	134.6	84%	0.841	83%	0.831	S	S	*	*			trans	-81.7	106.1	162.8	-64.2	177.6	0	0	0	107	S524	S524-I526 PolarHBondContact O-N 3.29Å
527	Q	25.5	Very low	26.5	Very low	165 Å²	165	138.5 Å²	138.5	77%	0.771	84%	0.835	S	S	*	*			trans	-57.8	137.7	166.4	-77.7	173.7	-36	0	0	110.4	T525 T529	T525-Q527 PolarHBondContact O-N 3.03Å; Q527-T529 PolarHBondContact O-N 3.42Å
528	S	26.6	Very low	26.7	Very low	116 Å²	116	138.5 Å²	138.5	81%	0.811	83%	0.834	S	S	*	*			trans	-57	122.2	162.1	43.2	0	0	0	0	111.7
529	T	27.3	Very low	26.6	Very low	124 Å²	124	140.5 Å²	140.5	76%	0.761	84%	0.838	S	S	*	*			trans	-141.2	127.9	156.4	45.6	0	0	0	0	111.2	Q527	Q527-T529 PolarHBondContact O-N 3.42Å
530	S	29.4	Very low	26.5	Very low	109 Å²	109	141.2 Å²	141.2	76%	0.762	84%	0.839	S	S	*	*			trans	65.3	107.2	155.5	62.9	0	0	0	0	120.6
531	L	29.2	Very low	26.7	Very low	255 Å²	255	145.5 Å²	145.5	100%	1.335	85%	0.845	S	S	*	*			trans	52.1	0	138.8	-72.6	160.1	0	0	0	119.9

Retrieved 531 of 531 residues in 426.5 ms (Link to these results)

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