A0A3Q0KSW0_SCHMA Loading...

Peroxisomal membrane protein PEX16

AlphaFold DB , UniProt , Accession A0A3Q0KSW0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 335 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	38.2	Very low	41.3	Very low	196 Å²	196	120.5 Å²	120.5	97%	0.966	60%	0.596	S	S	*	*				0	110.4	0	-163.1	174.2	-177.8	0	0	103.5	D3	M1-D3 PolarHBondContact O-N 3.38Å
2	D	35.9	Very low	42.1	Very low	112 Å²	112	117.9 Å²	117.9	60%	0.599	59%	0.586	S	S	*	*			trans	-46.9	123.7	-167	-84.5	-40	0	0	0	112.8	N4 K5	D2-N4 HydrophobicContact CB-CB 4.32Å; D2-N4 PolarHBondContact O-N 3.14Å; D2-N4 VanDerWaalsContact O-N 3.1Å; D2-K5 HydrophobicContact CB-CG 4.39Å; D2-K5 PolarHBondContact O-N 3.47Å
3	D	34	Very low	42.3	Very low	139 Å²	139	111.8 Å²	111.8	74%	0.743	56%	0.557	S	S	*	*	H	α-helix	trans	-53.1	-29.5	171.1	-72.3	-34.2	0	0	0	111.2	M1 K5 L6 E7	M1-D3 PolarHBondContact O-N 3.38Å; D3-K5 VanDerWaalsContact C-N 3.3Å; D3-K5 PolarHBondContact O-N 2.8Å; D3-L6 PolarHBondContact O-N 3.27Å; D3-E7 PolarHBondContact O-N 3.46Å
4	N	43.3	Very low	42.4	Very low	117 Å²	117	110.4 Å²	110.4	63%	0.626	55%	0.552	S	S	*	*	H	α-helix	trans	-60.2	-29.2	173.1	-74.3	-13	0	0	0	114.5	D2 M8	D2-N4 HydrophobicContact CB-CB 4.32Å; D2-N4 PolarHBondContact O-N 3.14Å; D2-N4 VanDerWaalsContact O-N 3.1Å; N4-M8 VanDerWaalsContact O-CB 3.3Å; N4-M8 WeakPolarHBondContact O-CB 3.26Å; N4-M8 PolarHBondContact O-N 2.95Å
5	K	40.7	Very low	43.3	Very low	118 Å²	118	106.9 Å²	106.9	51%	0.513	55%	0.547	S	S	.	.	H	α-helix	trans	-75.9	-31.8	178.2	-79.3	-173.9	178	-179.7	0	112.3	D2 D3 M8 H9	D2-K5 HydrophobicContact CB-CG 4.39Å; D2-K5 PolarHBondContact O-N 3.47Å; D3-K5 VanDerWaalsContact C-N 3.3Å; D3-K5 PolarHBondContact O-N 2.8Å; K5-M8 HydrophobicContact CG-CE 4.36Å; K5-H9 WeakPolarHBondContact O-CB 3.42Å; K5-H9 PolarHBondContact O-CD2 3.42Å; K5-H9 VanDerWaalsContact O-CD2 3.29Å; K5-H9 PolarHBondContact O-N 3.27Å
6	L	38.1	Very low	43.4	Very low	76 Å²	76	109.8 Å²	109.8	40%	0.398	55%	0.549	S	S	.	.	H	α-helix	trans	-73.4	-44.1	178.3	-176.6	63.1	0	0	0	110.6	D3 H9 I10	D3-L6 PolarHBondContact O-N 3.27Å; L6-H9 PolarHBondContact O-N 3.06Å; L6-I10 HydrophobicContact CG-CD1 4.17Å; L6-I10 WeakPolarHBondContact O-CG1 3.21Å; L6-I10 PolarHBondContact O-N 3.16Å
7	E	41.5	Very low	43.3	Very low	122 Å²	122	108.6 Å²	108.6	57%	0.57	54%	0.538	S	S	*	.	H	α-helix	trans	-61.6	-45.7	177.5	-167.2	164.6	-156.9	0	0	111.7	D3 H9 I10 E11	D3-E7 PolarHBondContact O-N 3.46Å; E7-H9 VanDerWaalsContact C-N 3.32Å; E7-H9 PolarHBondContact O-N 2.86Å; E7-I10 WeakPolarHBondContact O-CB 3.22Å; E7-I10 PolarHBondContact O-N 3.17Å; E7-I10 VanDerWaalsContact O-N 3.09Å; E7-E11 PolarHBondContact O-N 3.24Å
8	M	47.1	Very low	43.7	Very low	117 Å²	117	113.8 Å²	113.8	58%	0.576	55%	0.55	S	S	*	.	H	α-helix	trans	-61.4	-36.8	174.8	-175.6	178.2	42.9	0	0	112.9	N4 K5 L12	N4-M8 VanDerWaalsContact O-CB 3.3Å; N4-M8 WeakPolarHBondContact O-CB 3.26Å; N4-M8 PolarHBondContact O-N 2.95Å; K5-M8 HydrophobicContact CG-CE 4.36Å; M8-L12 WeakPolarHBondContact O-CB 3.47Å; M8-L12 PolarHBondContact O-N 3.21Å
9	H	43.9	Very low	44.3	Very low	117 Å²	117	114.6 Å²	114.6	54%	0.542	55%	0.553	S	S	.	*	H	α-helix	trans	-68.4	-34	174.5	-93.1	-53.2	0	0	0	112.9	K5 L6 E7 N13	K5-H9 WeakPolarHBondContact O-CB 3.42Å; K5-H9 PolarHBondContact O-CD2 3.42Å; K5-H9 VanDerWaalsContact O-CD2 3.29Å; K5-H9 PolarHBondContact O-N 3.27Å; L6-H9 PolarHBondContact O-N 3.06Å; E7-H9 VanDerWaalsContact C-N 3.32Å; E7-H9 PolarHBondContact O-N 2.86Å; H9-N13 WeakPolarHBondContact O-CB 3.3Å; H9-N13 PolarHBondContact O-N 3.27Å; H9-N13 PolarHBondContact O-ND2 3.21Å
10	I	41.2	Very low	44.3	Very low	80 Å²	80	110.9 Å²	110.9	41%	0.41	54%	0.542	S	S	.	.	H	α-helix	trans	-69.1	-45.4	175.8	-69.2	166.8	0	0	0	110.2	L6 E7 N13 N14	L6-I10 HydrophobicContact CG-CD1 4.17Å; L6-I10 WeakPolarHBondContact O-CG1 3.21Å; L6-I10 PolarHBondContact O-N 3.16Å; E7-I10 WeakPolarHBondContact O-CB 3.22Å; E7-I10 PolarHBondContact O-N 3.17Å; E7-I10 VanDerWaalsContact O-N 3.09Å; I10-N13 PolarHBondContact O-N 3.32Å; I10-N14 WeakPolarHBondContact O-CB 3.48Å; I10-N14 PolarHBondContact O-N 3.25Å
11	E	50.7	Low	44.2	Very low	131 Å²	131	112.6 Å²	112.6	61%	0.612	54%	0.543	S	S	*	.	H	α-helix	trans	-62.1	-44.8	177.1	-73	-163.4	148	0	0	112.7	E7 N13 N14 A15	E7-E11 PolarHBondContact O-N 3.24Å; E11-N13 VanDerWaalsContact C-N 3.31Å; E11-N13 PolarHBondContact O-N 3.36Å; E11-N14 PolarHBondContact O-N 3.41Å; E11-A15 PolarHBondContact O-N 3.23Å
12	L	51	Low	45.1	Very low	90 Å²	90	108 Å²	108	47%	0.471	52%	0.519	S	S	.	.	H	α-helix	trans	-63.1	-37.9	178.9	-160	85.8	0	0	0	111.9	M8 R16	M8-L12 WeakPolarHBondContact O-CB 3.47Å; M8-L12 PolarHBondContact O-N 3.21Å; L12-R16 WeakPolarHBondContact O-CG 3.15Å; L12-R16 PolarHBondContact O-N 3.47Å
13	N	43.7	Very low	45.9	Very low	39 Å²	39	107 Å²	107	21%	0.209	51%	0.514	C	S	.	.	H	α-helix	trans	-69.6	-40.8	175.2	-79.8	-24.8	0	0	0	111.8	H9 I10 E11 A15 R16 Y17	H9-N13 WeakPolarHBondContact O-CB 3.3Å; H9-N13 PolarHBondContact O-N 3.27Å; H9-N13 PolarHBondContact O-ND2 3.21Å; I10-N13 PolarHBondContact O-N 3.32Å; E11-N13 VanDerWaalsContact C-N 3.31Å; E11-N13 PolarHBondContact O-N 3.36Å; N13-A15 VanDerWaalsContact C-N 3.32Å; N13-A15 PolarHBondContact O-N 3.1Å; N13-R16 PolarHBondContact O-N 3.13Å; N13-Y17 WeakPolarHBondContact O-CD2 3.1Å; N13-Y17 PolarHBondContact O-N 3.3Å
14	N	45	Very low	46.5	Very low	91 Å²	91	103.7 Å²	103.7	49%	0.487	50%	0.496	S	S	.	.	H	α-helix	trans	-61.3	-39.1	175.7	-77.9	-20.5	0	0	0	112.4	I10 E11 Y17 R18	I10-N14 WeakPolarHBondContact O-CB 3.48Å; I10-N14 PolarHBondContact O-N 3.25Å; E11-N14 PolarHBondContact O-N 3.41Å; N14-Y17 PolarHBondContact O-N 2.88Å; N14-R18 PolarHBondContact O-N 3.21Å
15	A	54.9	Low	46.9	Very low	59 Å²	59	102.7 Å²	102.7	49%	0.488	49%	0.486	S	S	.	.	H	α-helix	trans	-62.4	-44	174.6	0	0	0	0	0	112	E11 N13 Y17 R18 Q19	E11-A15 PolarHBondContact O-N 3.23Å; N13-A15 VanDerWaalsContact C-N 3.32Å; N13-A15 PolarHBondContact O-N 3.1Å; A15-Y17 PolarHBondContact O-N 3.31Å; A15-R18 PolarHBondContact O-N 3.41Å; A15-Q19 PolarHBondContact O-N 3.37Å
16	R	45.7	Very low	47.6	Very low	152 Å²	152	99.3 Å²	99.3	57%	0.574	48%	0.48	S	S	*	.	H	α-helix	trans	-62.9	-40.5	176.3	-72.2	173.4	174.4	-176.6	-2.9	112.4	L12 N13 Q19 A20	L12-R16 WeakPolarHBondContact O-CG 3.15Å; L12-R16 PolarHBondContact O-N 3.47Å; N13-R16 PolarHBondContact O-N 3.13Å; R16-Q19 PolarHBondContact O-N 2.68Å; R16-A20 WeakPolarHBondContact O-CB 3.43Å; R16-A20 PolarHBondContact O-N 3.5Å
17	Y	42	Very low	48	Very low	91 Å²	91	101 Å²	101	36%	0.357	49%	0.489	S	S	.	.	H	α-helix	trans	-66.2	-41.1	176.2	-79.8	-64	0	0	0	112.9	N13 N14 A15 A20 Y21 Q64	N13-Y17 WeakPolarHBondContact O-CD2 3.1Å; N13-Y17 PolarHBondContact O-N 3.3Å; N14-Y17 PolarHBondContact O-N 2.88Å; A15-Y17 PolarHBondContact O-N 3.31Å; Y17-A20 PolarHBondContact O-N 3.37Å; Y17-Y21 WeakPolarHBondContact O-CB 3.22Å; Y17-Y21 PolarHBondContact O-N 3.36Å; Y17-Q64 PolarHBondContact OH-OE1 3.43Å; Y17-Q64 VanDerWaalsContact OH-OE1 3.07Å
18	R	49.2	Very low	48.1	Very low	201 Å²	201	101.4 Å²	101.4	76%	0.758	49%	0.489	S	S	*	.	H	α-helix	trans	-60.3	-45.1	173.6	-82.2	-174.1	-172.5	171.6	4.2	111.7	N14 A15 A20 Y21 E22	N14-R18 PolarHBondContact O-N 3.21Å; A15-R18 PolarHBondContact O-N 3.41Å; R18-A20 PolarHBondContact O-N 3.25Å; R18-Y21 PolarHBondContact O-N 3.04Å; R18-E22 PolarHBondContact O-N 3.29Å
19	Q	54.9	Low	47.9	Very low	130 Å²	130	102 Å²	102	61%	0.607	49%	0.49	S	S	*	.	H	α-helix	trans	-62.9	-43.2	178.7	-169.4	177.9	9.4	0	0	111.9	A15 R16 Y21 E22 N23	A15-Q19 PolarHBondContact O-N 3.37Å; R16-Q19 PolarHBondContact O-N 2.68Å; Q19-Y21 PolarHBondContact O-N 3.38Å; Q19-E22 PolarHBondContact O-N 2.62Å; Q19-N23 WeakPolarHBondContact O-CB 3.35Å; Q19-N23 PolarHBondContact O-N 2.99Å; Q19-N23 PolarHBondContact O-ND2 3.12Å
20	A	44.2	Very low	47.6	Very low	40 Å²	40	105.8 Å²	105.8	33%	0.331	50%	0.501	S	S	.	.	H	α-helix	trans	-62.9	-40.7	175.4	0	0	0	0	0	112.3	R16 Y17 R18 N23 I24	R16-A20 WeakPolarHBondContact O-CB 3.43Å; R16-A20 PolarHBondContact O-N 3.5Å; Y17-A20 PolarHBondContact O-N 3.37Å; R18-A20 PolarHBondContact O-N 3.25Å; A20-N23 PolarHBondContact O-N 2.67Å; A20-I24 WeakPolarHBondContact O-CD1 3.29Å; A20-I24 VanDerWaalsContact O-CG1 3.25Å; A20-I24 WeakPolarHBondContact O-CG1 3.47Å; A20-I24 PolarHBondContact O-N 3.22Å
21	Y	43.6	Very low	47.6	Very low	147 Å²	147	107.5 Å²	107.5	58%	0.576	52%	0.515	S	S	*	.	H	α-helix	trans	-62.7	-46.6	176.5	179.3	-98.3	0	0	0	112.5	Y17 R18 Q19 N23 I24 K25	Y17-Y21 WeakPolarHBondContact O-CB 3.22Å; Y17-Y21 PolarHBondContact O-N 3.36Å; R18-Y21 PolarHBondContact O-N 3.04Å; Q19-Y21 PolarHBondContact O-N 3.38Å; Y21-N23 PolarHBondContact O-N 3.08Å; Y21-I24 PolarHBondContact O-N 2.82Å; Y21-K25 HydrophobicContact CE1-CD 4.43Å; Y21-K25 WeakPolarHBondContact O-CB 2.98Å; Y21-K25 PolarHBondContact O-N 3.39Å
22	E	56.6	Low	47	Very low	98 Å²	98	108.3 Å²	108.3	46%	0.458	52%	0.519	S	S	.	.	H	α-helix	trans	-65.1	-37.7	177.2	-69.1	-57	142.6	0	0	112	R18 Q19 I24 K25 A26	R18-E22 PolarHBondContact O-N 3.29Å; Q19-E22 PolarHBondContact O-N 2.62Å; E22-I24 PolarHBondContact O-N 3.12Å; E22-K25 PolarHBondContact O-N 2.69Å; E22-A26 WeakPolarHBondContact O-CB 3.39Å; E22-A26 PolarHBondContact O-N 2.79Å
23	N	53.5	Low	46.3	Very low	91 Å²	91	108 Å²	108	49%	0.487	52%	0.524	S	S	.	.	H	α-helix	trans	-62.4	-40.9	174	-71.4	-14.2	0	0	0	112.2	Q19 A20 Y21 A26 L27	Q19-N23 WeakPolarHBondContact O-CB 3.35Å; Q19-N23 PolarHBondContact O-N 2.99Å; Q19-N23 PolarHBondContact O-ND2 3.12Å; A20-N23 PolarHBondContact O-N 2.67Å; Y21-N23 PolarHBondContact O-N 3.08Å; N23-A26 PolarHBondContact O-N 3.4Å; N23-L27 PolarHBondContact O-N 2.72Å
24	I	45.5	Very low	45.6	Very low	70 Å²	70	111.2 Å²	111.2	36%	0.359	55%	0.55	S	S	.	.	H	α-helix	trans	-66.5	-40.3	176.4	-68.8	163.8	0	0	0	110.8	A20 Y21 E22 L27 K28 M57	A20-I24 WeakPolarHBondContact O-CD1 3.29Å; A20-I24 VanDerWaalsContact O-CG1 3.25Å; A20-I24 WeakPolarHBondContact O-CG1 3.47Å; A20-I24 PolarHBondContact O-N 3.22Å; Y21-I24 PolarHBondContact O-N 2.82Å; E22-I24 PolarHBondContact O-N 3.12Å; I24-L27 PolarHBondContact O-N 3.07Å; I24-K28 PolarHBondContact O-N 3.47Å; I24-M57 HydrophobicContact CD1-CE 4.01Å
25	K	51.3	Low	44.8	Very low	97 Å²	97	112.2 Å²	112.2	42%	0.422	56%	0.564	S	S	.	*	H	α-helix	trans	-63.6	-41.4	176.9	-167.3	179.6	176.6	-171.7	0	111.6	Y21 E22 K28 Q29	Y21-K25 HydrophobicContact CE1-CD 4.43Å; Y21-K25 WeakPolarHBondContact O-CB 2.98Å; Y21-K25 PolarHBondContact O-N 3.39Å; E22-K25 PolarHBondContact O-N 2.69Å; K25-K28 PolarHBondContact O-N 2.92Å; K25-Q29 PolarHBondContact O-N 3.18Å; K25-Q29 VanDerWaalsContact O-N 3.08Å
26	A	55.7	Low	43.7	Very low	46 Å²	46	120.1 Å²	120.1	38%	0.38	58%	0.581	S	S	.	*	H	α-helix	trans	-64.3	-41.1	174.4	0	0	0	0	0	112.5	E22 N23 K28 Q29 Y30	E22-A26 WeakPolarHBondContact O-CB 3.39Å; E22-A26 PolarHBondContact O-N 2.79Å; N23-A26 PolarHBondContact O-N 3.4Å; A26-K28 VanDerWaalsContact C-N 3.31Å; A26-K28 PolarHBondContact O-N 2.97Å; A26-Q29 PolarHBondContact O-N 3.21Å; A26-Y30 PolarHBondContact O-N 3.39Å
27	L	46.6	Very low	42.9	Very low	113 Å²	113	117.6 Å²	117.6	59%	0.592	59%	0.587	S	S	*	*	H	α-helix	trans	-62.9	-36	174.6	-84.7	158.8	0	0	0	112.8	N23 I24 Y30 T31	N23-L27 PolarHBondContact O-N 2.72Å; I24-L27 PolarHBondContact O-N 3.07Å; L27-Y30 PolarHBondContact O-N 2.95Å; L27-T31 PolarHBondContact O-N 2.94Å; L27-T31 PolarHBondContact O-OG1 3.01Å
28	K	43.6	Very low	42.3	Very low	130 Å²	130	120.7 Å²	120.7	57%	0.565	61%	0.608	S	S	*	*	H	α-helix	trans	-71.7	-37.2	178.1	-148.2	-177.8	-179.1	-166.8	0	112.3	I24 K25 A26 Y30 T31 E32	I24-K28 PolarHBondContact O-N 3.47Å; K25-K28 PolarHBondContact O-N 2.92Å; A26-K28 VanDerWaalsContact C-N 3.31Å; A26-K28 PolarHBondContact O-N 2.97Å; K28-Y30 VanDerWaalsContact C-N 3.27Å; K28-Y30 PolarHBondContact O-N 3.35Å; K28-T31 WeakPolarHBondContact CA-OG1 2.84Å; K28-T31 PolarHBondContact O-N 3.09Å; K28-T31 PolarHBondContact O-OG1 3.35Å; K28-E32 PolarHBondContact O-N 3.22Å
29	Q	43.9	Very low	41.3	Very low	129 Å²	129	119.1 Å²	119.1	60%	0.603	61%	0.609	S	S	*	*	H	α-helix	trans	-65.6	-29.5	173	-74.8	-179.9	-21.8	0	0	112.6	K25 A26 S33	K25-Q29 PolarHBondContact O-N 3.18Å; K25-Q29 VanDerWaalsContact O-N 3.08Å; A26-Q29 PolarHBondContact O-N 3.21Å; Q29-S33 PolarHBondContact O-OG 3.11Å; Q29-S33 VanDerWaalsContact O-OG 3.13Å
30	Y	37.1	Very low	40.1	Very low	196 Å²	196	118.7 Å²	118.7	77%	0.769	62%	0.615	S	S	*	*	H	α-helix	trans	-75.2	-21	173.7	-102.1	-87.4	0	0	0	114.5	A26 L27 K28	A26-Y30 PolarHBondContact O-N 3.39Å; L27-Y30 PolarHBondContact O-N 2.95Å; K28-Y30 VanDerWaalsContact C-N 3.27Å; K28-Y30 PolarHBondContact O-N 3.35Å
31	T	41.7	Very low	39.4	Very low	116 Å²	116	122.8 Å²	122.8	71%	0.712	64%	0.637	S	S	*	*	H	α-helix	trans	-94.2	-16	-180	23.9	0	0	0	0	113.5	L27 K28	L27-T31 PolarHBondContact O-N 2.94Å; L27-T31 PolarHBondContact O-OG1 3.01Å; K28-T31 WeakPolarHBondContact CA-OG1 2.84Å; K28-T31 PolarHBondContact O-N 3.09Å; K28-T31 PolarHBondContact O-OG1 3.35Å
32	E	37.9	Very low	39.1	Very low	149 Å²	149	120.4 Å²	120.4	70%	0.696	64%	0.638	S	S	*	*	S	Bend	trans	-95.2	-1.8	177	-71	174	-175.7	0	0	113.1	K28	K28-E32 PolarHBondContact O-N 3.22Å
33	S	34.6	Very low	38.1	Very low	82 Å²	82	122.3 Å²	122.3	57%	0.573	65%	0.651	S	S	*	*	S	Bend	trans	-117.9	66	-179.9	63.1	0	0	0	0	113.3	Q29	Q29-S33 PolarHBondContact O-OG 3.11Å; Q29-S33 VanDerWaalsContact O-OG 3.13Å
34	S	30.6	Very low	37.4	Very low	108 Å²	108	123.2 Å²	123.2	76%	0.755	66%	0.659	S	S	*	*			trans	-170.1	84.2	155.9	-175.4	0	0	0	0	110.9	R36	S34-R36 PolarHBondContact O-N 3.15Å
35	S	28.3	Very low	37	Very low	112 Å²	112	124.5 Å²	124.5	78%	0.783	67%	0.667	S	S	*	*			trans	-79.1	99.2	160.8	49.7	0	0	0	0	108.9
36	R	31.3	Very low	36.4	Very low	225 Å²	225	129.3 Å²	129.3	85%	0.849	68%	0.682	S	S	*	*			trans	-179.2	111.5	149.7	-101.1	160.3	-165.3	-166.7	5	112.2	S34	S34-R36 PolarHBondContact O-N 3.15Å
37	S	27.9	Very low	35.7	Very low	98 Å²	98	135.1 Å²	135.1	69%	0.685	70%	0.699	S	S	*	*			trans	58.3	128.7	136.4	73.2	0	0	0	0	121
38	I	30.7	Very low	35.4	Very low	156 Å²	156	133.7 Å²	133.7	80%	0.8	69%	0.692	S	S	*	*			trans	122.9	123.5	141.1	-60.9	157.8	0	0	0	114.7
39	Q	28.1	Very low	35.4	Very low	169 Å²	169	133 Å²	133	79%	0.79	70%	0.695	S	S	*	*			trans	-42	134.5	170.2	-61.4	159.2	-36.4	0	0	113.4
40	T	30.3	Very low	35.2	Very low	120 Å²	120	130.6 Å²	130.6	74%	0.736	68%	0.684	S	S	*	*				159	131.4	103.9	44	0	0	0	0	110
41	T	28.7	Very low	35.4	Very low	127 Å²	127	125.8 Å²	125.8	78%	0.779	67%	0.669	S	S	*	*	S	Bend	trans	60.3	126.7	156.4	49.3	0	0	0	0	119.3
42	T	36.6	Very low	35.4	Very low	97 Å²	97	123 Å²	123	60%	0.595	65%	0.654	S	S	*	*			trans	85.5	32.8	164.2	73.6	0	0	0	0	121.6	V44 D45	T42-V44 PolarHBondContact O-N 3Å; T42-D45 PolarHBondContact O-N 2.9Å
43	D	37.1	Very low	35.7	Very low	138 Å²	138	120.7 Å²	120.7	74%	0.738	64%	0.642	S	S	*	*	H	α-helix	trans	-68.6	-10.5	164.5	-97.5	-27.8	0	0	0	114.6
44	V	37.8	Very low	35.9	Very low	109 Å²	109	121.2 Å²	121.2	66%	0.661	64%	0.637	S	S	*	*	H	α-helix	trans	-78.2	-29.4	178.9	-177.5	0	0	0	0	111.9	T42 N48	T42-V44 PolarHBondContact O-N 3Å; V44-N48 PolarHBondContact O-N 3.31Å
45	D	38.1	Very low	36.4	Very low	97 Å²	97	119.1 Å²	119.1	52%	0.519	61%	0.614	S	S	.	*	H	α-helix	trans	-79.4	-37.6	-177.5	-73.4	-34.3	0	0	0	112.6	T42 K47 N48 D49	T42-D45 PolarHBondContact O-N 2.9Å; D45-K47 PolarHBondContact O-N 3.41Å; D45-N48 PolarHBondContact O-N 3Å; D45-D49 PolarHBondContact O-N 3.08Å; D45-D49 VanDerWaalsContact O-N 3.12Å
46	R	38.3	Very low	36.9	Very low	198 Å²	198	119.9 Å²	119.9	75%	0.747	61%	0.606	S	S	*	*	H	α-helix	trans	-69.5	-29.5	177.8	-74	-178.3	175.5	166	-0.2	113.8	M50	R46-M50 PolarHBondContact O-N 3.21Å
47	K	39.5	Very low	37.4	Very low	168 Å²	168	112.1 Å²	112.1	73%	0.73	58%	0.58	S	S	*	*	H	α-helix	trans	-72.6	-35.7	175	-122.2	177.1	-177.6	173.7	0	111.8	D45 E51	D45-K47 PolarHBondContact O-N 3.41Å; K47-E51 WeakPolarHBondContact O-CB 3.5Å; K47-E51 PolarHBondContact O-N 3.22Å; K47-E51 VanDerWaalsContact O-N 3.16Å
48	N	41.5	Very low	37.9	Very low	83 Å²	83	113 Å²	113	44%	0.444	58%	0.575	S	S	.	*	H	α-helix	trans	-68.6	-34.6	174.8	-84.3	-20.5	0	0	0	112.5	V44 D45 S52	V44-N48 PolarHBondContact O-N 3.31Å; D45-N48 PolarHBondContact O-N 3Å; N48-S52 VanDerWaalsContact O-CB 3.23Å; N48-S52 WeakPolarHBondContact O-CB 3.34Å; N48-S52 PolarHBondContact O-N 3.04Å; N48-S52 PolarHBondContact O-OG 3.19Å
49	D	43	Very low	38.2	Very low	117 Å²	117	109.1 Å²	109.1	63%	0.626	56%	0.556	S	S	*	*	H	α-helix	trans	-67.7	-43.9	176.2	-84.4	-14.5	0	0	0	112.6	D45 S52 F53	D45-D49 PolarHBondContact O-N 3.08Å; D45-D49 VanDerWaalsContact O-N 3.12Å; D49-S52 PolarHBondContact O-N 3.05Å; D49-F53 VanDerWaalsContact O-CB 3.28Å; D49-F53 WeakPolarHBondContact O-CB 3.49Å; D49-F53 PolarHBondContact O-N 3.32Å
50	M	40.6	Very low	38.8	Very low	78 Å²	78	106.2 Å²	106.2	38%	0.384	54%	0.542	S	S	.	.	H	α-helix	trans	-67.3	-39.3	178	-132.4	-58.5	151.7	0	0	111.7	R46 F53 M54	R46-M50 PolarHBondContact O-N 3.21Å; M50-F53 HydrophobicContact CE-CD1 3.85Å; M50-F53 HydrophobicContact CE-CE1 4.37Å; M50-F53 PolarHBondContact O-N 3.15Å; M50-F53 HydrophobicContact SD-CD1 4.47Å; M50-M54 WeakPolarHBondContact O-CB 3.45Å; M50-M54 WeakPolarHBondContact O-CG 3.08Å; M50-M54 PolarHBondContact O-N 3.36Å; M50-M54 HydrophobicContact SD-CE 4Å; M50-M54 HydrophobicContact SD-CG 3.87Å; M50-M54 HydrophobicContact SD-SD 4.26Å
51	E	41.4	Very low	39.4	Very low	94 Å²	94	104.2 Å²	104.2	44%	0.439	53%	0.525	S	S	.	.	H	α-helix	trans	-66.2	-39	175.4	-159.6	-174.2	142.4	0	0	111.9	K47 K55	K47-E51 WeakPolarHBondContact O-CB 3.5Å; K47-E51 PolarHBondContact O-N 3.22Å; K47-E51 VanDerWaalsContact O-N 3.16Å; E51-K55 WeakPolarHBondContact O-CB 3.22Å; E51-K55 VanDerWaalsContact O-CG 3.23Å; E51-K55 WeakPolarHBondContact O-CG 3.48Å; E51-K55 PolarHBondContact O-N 3.47Å; E51-K55 VanDerWaalsContact OE1-CE 3.3Å; E51-K55 WeakPolarHBondContact OE1-CE 3.49Å; E51-K55 IonicContact OE1-NZ 2.71Å; E51-K55 PolarHBondContact OE1-NZ 3.43Å
52	S	42	Very low	39.9	Very low	58 Å²	58	101.1 Å²	101.1	41%	0.406	50%	0.5	S	S	.	.	H	α-helix	trans	-67.9	-40	175.1	-61.1	0	0	0	0	112	N48 D49 K55 M56	N48-S52 VanDerWaalsContact O-CB 3.23Å; N48-S52 WeakPolarHBondContact O-CB 3.34Å; N48-S52 PolarHBondContact O-N 3.04Å; N48-S52 PolarHBondContact O-OG 3.19Å; D49-S52 PolarHBondContact O-N 3.05Å; S52-K55 WeakPolarHBondContact O-CB 3.5Å; S52-K55 PolarHBondContact O-N 3.28Å; S52-M56 WeakPolarHBondContact O-CB 3.38Å; S52-M56 PolarHBondContact O-N 3.29Å
53	F	42.2	Very low	40.1	Very low	101 Å²	101	102 Å²	102	44%	0.443	50%	0.498	S	S	.	.	H	α-helix	trans	-63.9	-45.7	174.3	-176.9	-101.6	0	0	0	111.8	D49 M50 K55 M56 M57	D49-F53 VanDerWaalsContact O-CB 3.28Å; D49-F53 WeakPolarHBondContact O-CB 3.49Å; D49-F53 PolarHBondContact O-N 3.32Å; M50-F53 HydrophobicContact CE-CD1 3.85Å; M50-F53 HydrophobicContact CE-CE1 4.37Å; M50-F53 PolarHBondContact O-N 3.15Å; M50-F53 HydrophobicContact SD-CD1 4.47Å; F53-K55 VanDerWaalsContact C-N 3.35Å; F53-K55 PolarHBondContact O-N 3.15Å; F53-M56 WeakPolarHBondContact O-CB 3.48Å; F53-M56 PolarHBondContact O-N 3.25Å; F53-M57 HydrophobicContact CD1-CE 4.41Å; F53-M57 HydrophobicContact CD1-CG 4.35Å; F53-M57 HydrophobicContact CD1-SD 4.37Å; F53-M57 HydrophobicContact CE1-CE 4Å; F53-M57 HydrophobicContact CE1-CG 3.99Å; F53-M57 HydrophobicContact CE1-SD 3.59Å; F53-M57 VanDerWaalsContact CE1-SD 3.59Å; F53-M57 HydrophobicContact CZ-CG 4.12Å; F53-M57 HydrophobicContact CZ-SD 3.89Å; F53-M57 WeakPolarHBondContact O-CG 3.34Å; F53-M57 PolarHBondContact O-N 3.31Å
54	M	40	Very low	40.4	Very low	93 Å²	93	98.7 Å²	98.7	46%	0.458	48%	0.478	S	S	.	.	H	α-helix	trans	-61.2	-41.8	173.4	-77	-172.5	-73.8	0	0	112	M50 M56 M57 M58	M50-M54 WeakPolarHBondContact O-CB 3.45Å; M50-M54 WeakPolarHBondContact O-CG 3.08Å; M50-M54 PolarHBondContact O-N 3.36Å; M50-M54 HydrophobicContact SD-CE 4Å; M50-M54 HydrophobicContact SD-CG 3.87Å; M50-M54 HydrophobicContact SD-SD 4.26Å; M54-M56 VanDerWaalsContact C-N 3.32Å; M54-M56 PolarHBondContact O-N 3.02Å; M54-M57 PolarHBondContact O-N 2.8Å; M54-M58 WeakPolarHBondContact O-CB 3.02Å; M54-M58 VanDerWaalsContact O-CG 3.31Å; M54-M58 WeakPolarHBondContact O-CG 3.24Å; M54-M58 PolarHBondContact O-N 3.25Å
55	K	41	Very low	40.5	Very low	64 Å²	64	96.5 Å²	96.5	28%	0.278	46%	0.46	S	S	.	.	H	α-helix	trans	-60.4	-41.8	173.9	-77.2	167.8	-174.9	161.2	0	111.8	E51 S52 F53 M58 L59 P139	E51-K55 WeakPolarHBondContact O-CB 3.22Å; E51-K55 VanDerWaalsContact O-CG 3.23Å; E51-K55 WeakPolarHBondContact O-CG 3.48Å; E51-K55 PolarHBondContact O-N 3.47Å; E51-K55 VanDerWaalsContact OE1-CE 3.3Å; E51-K55 WeakPolarHBondContact OE1-CE 3.49Å; E51-K55 IonicContact OE1-NZ 2.71Å; E51-K55 PolarHBondContact OE1-NZ 3.43Å; S52-K55 WeakPolarHBondContact O-CB 3.5Å; S52-K55 PolarHBondContact O-N 3.28Å; F53-K55 VanDerWaalsContact C-N 3.35Å; F53-K55 PolarHBondContact O-N 3.15Å; K55-M58 HydrophobicContact CG-CE 4.41Å; K55-M58 PolarHBondContact O-N 2.82Å; K55-L59 WeakPolarHBondContact O-CB 3.41Å; K55-L59 PolarHBondContact O-N 3.16Å; K55-P139 HydrophobicContact CD-CG 4.5Å
56	M	39.2	Very low	40.7	Very low	127 Å²	127	94 Å²	94	63%	0.626	45%	0.447	S	S	*	.	H	α-helix	trans	-65.9	-45.5	178.5	-154.1	-176.9	-57.1	0	0	111.5	S52 F53 M54 M58 L59 Q60	S52-M56 WeakPolarHBondContact O-CB 3.38Å; S52-M56 PolarHBondContact O-N 3.29Å; F53-M56 WeakPolarHBondContact O-CB 3.48Å; F53-M56 PolarHBondContact O-N 3.25Å; M54-M56 VanDerWaalsContact C-N 3.32Å; M54-M56 PolarHBondContact O-N 3.02Å; M56-M58 PolarHBondContact O-N 2.73Å; M56-L59 PolarHBondContact O-N 3.37Å; M56-Q60 WeakPolarHBondContact O-CB 3.38Å; M56-Q60 PolarHBondContact O-N 2.76Å
57	M	40.8	Very low	40.9	Very low	62 Å²	62	90.2 Å²	90.2	31%	0.305	44%	0.441	S	S	.	.	H	α-helix	trans	-61.7	-42.1	174.4	-70	-153.3	-51.5	0	0	112.3	I24 F53 M54 Q60 Q61	I24-M57 HydrophobicContact CD1-CE 4.01Å; F53-M57 HydrophobicContact CD1-CE 4.41Å; F53-M57 HydrophobicContact CD1-CG 4.35Å; F53-M57 HydrophobicContact CD1-SD 4.37Å; F53-M57 HydrophobicContact CE1-CE 4Å; F53-M57 HydrophobicContact CE1-CG 3.99Å; F53-M57 HydrophobicContact CE1-SD 3.59Å; F53-M57 VanDerWaalsContact CE1-SD 3.59Å; F53-M57 HydrophobicContact CZ-CG 4.12Å; F53-M57 HydrophobicContact CZ-SD 3.89Å; F53-M57 WeakPolarHBondContact O-CG 3.34Å; F53-M57 PolarHBondContact O-N 3.31Å; M54-M57 PolarHBondContact O-N 2.8Å; M57-Q60 PolarHBondContact O-N 3.43Å; M57-Q61 VanDerWaalsContact O-CB 3.3Å; M57-Q61 WeakPolarHBondContact O-CB 3.43Å; M57-Q61 PolarHBondContact O-N 3.49Å
58	M	38.3	Very low	41	Very low	117 Å²	117	86 Å²	86	58%	0.576	43%	0.426	S	S	*	.	H	α-helix	trans	-64.4	-39.8	175.7	-74.7	-165.6	-54.1	0	0	112.3	M54 K55 M56 Q61 F62	M54-M58 WeakPolarHBondContact O-CB 3.02Å; M54-M58 VanDerWaalsContact O-CG 3.31Å; M54-M58 WeakPolarHBondContact O-CG 3.24Å; M54-M58 PolarHBondContact O-N 3.25Å; K55-M58 HydrophobicContact CG-CE 4.41Å; K55-M58 PolarHBondContact O-N 2.82Å; M56-M58 PolarHBondContact O-N 2.73Å; M58-Q61 PolarHBondContact O-N 2.97Å; M58-F62 VanDerWaalsContact O-CB 3.32Å; M58-F62 WeakPolarHBondContact O-CB 3.31Å; M58-F62 PolarHBondContact O-N 2.81Å
59	L	38.6	Very low	41	Very low	74 Å²	74	87.2 Å²	87.2	39%	0.387	43%	0.425	S	S	.	.	H	α-helix	trans	-63.3	-43.2	175	-111.4	145.4	0	0	0	111.7	K55 M56 F62 Q63	K55-L59 WeakPolarHBondContact O-CB 3.41Å; K55-L59 PolarHBondContact O-N 3.16Å; M56-L59 PolarHBondContact O-N 3.37Å; L59-F62 PolarHBondContact O-N 3.03Å; L59-Q63 WeakPolarHBondContact O-CG 3.42Å; L59-Q63 PolarHBondContact O-N 2.48Å
60	Q	40.1	Very low	40.9	Very low	108 Å²	108	84.1 Å²	84.1	51%	0.505	41%	0.407	S	S	.	.	H	α-helix	trans	-67.5	-41.3	178.1	-164.5	175.8	7.5	0	0	111.6	M56 M57 Q63 Q64	M56-Q60 WeakPolarHBondContact O-CB 3.38Å; M56-Q60 PolarHBondContact O-N 2.76Å; M57-Q60 PolarHBondContact O-N 3.43Å; Q60-Q63 PolarHBondContact O-N 2.95Å; Q60-Q64 WeakPolarHBondContact O-CG 3.38Å; Q60-Q64 PolarHBondContact O-N 3.2Å
61	Q	41.6	Very low	41	Very low	79 Å²	79	82.7 Å²	82.7	37%	0.369	41%	0.405	S	S	.	.	H	α-helix	trans	-64.3	-39.9	173.9	-173.7	167	15.7	0	0	111.6	M57 M58 Q64 Q65	M57-Q61 VanDerWaalsContact O-CB 3.3Å; M57-Q61 WeakPolarHBondContact O-CB 3.43Å; M57-Q61 PolarHBondContact O-N 3.49Å; M58-Q61 PolarHBondContact O-N 2.97Å; Q61-Q64 PolarHBondContact O-N 3.07Å; Q61-Q65 WeakPolarHBondContact O-CB 3.16Å; Q61-Q65 WeakPolarHBondContact O-CG 3.39Å; Q61-Q65 PolarHBondContact O-N 2.94Å
62	F	39.7	Very low	41	Very low	61 Å²	61	80.8 Å²	80.8	27%	0.268	41%	0.405	S	S	.	.	H	α-helix	trans	-62.2	-44.6	172.9	-173.4	-77.4	0	0	0	111.4	M58 L59 Q65 N66 K133	M58-F62 VanDerWaalsContact O-CB 3.32Å; M58-F62 WeakPolarHBondContact O-CB 3.31Å; M58-F62 PolarHBondContact O-N 2.81Å; L59-F62 PolarHBondContact O-N 3.03Å; F62-Q65 PolarHBondContact O-N 3.07Å; F62-N66 HydrophobicContact CE1-CB 4.36Å; F62-N66 WeakPolarHBondContact O-CB 3.39Å; F62-N66 PolarHBondContact O-N 2.75Å; F62-K133 HydrophobicContact CD1-CD 4.28Å; F62-K133 HydrophobicContact CD2-CD 4.39Å; F62-K133 HydrophobicContact CE1-CD 3.69Å; F62-K133 HydrophobicContact CE2-CD 3.75Å; F62-K133 HydrophobicContact CE2-CG 3.99Å; F62-K133 HydrophobicContact CZ-CD 3.37Å; F62-K133 VanDerWaalsContact CZ-CE 3.44Å; F62-K133 HydrophobicContact CZ-CG 4.11Å
63	Q	40.7	Very low	40.8	Very low	116 Å²	116	79.6 Å²	79.6	54%	0.542	39%	0.394	S	S	.	.	H	α-helix	trans	-62.4	-42.9	177.4	-76.6	174.5	-24.8	0	0	112	L59 Q60 N66 L67	L59-Q63 WeakPolarHBondContact O-CG 3.42Å; L59-Q63 PolarHBondContact O-N 2.48Å; Q60-Q63 PolarHBondContact O-N 2.95Å; Q63-N66 PolarHBondContact O-N 2.95Å; Q63-L67 PolarHBondContact O-N 2.92Å
64	Q	43.2	Very low	40.8	Very low	69 Å²	69	76.2 Å²	76.2	32%	0.322	38%	0.38	S	S	.	.	H	α-helix	trans	-64.1	-42.7	176.6	-75.4	178.4	-19.2	0	0	112.4	Y17 Q60 Q61 L67 L68	Y17-Q64 PolarHBondContact OH-OE1 3.43Å; Y17-Q64 VanDerWaalsContact OH-OE1 3.07Å; Q60-Q64 WeakPolarHBondContact O-CG 3.38Å; Q60-Q64 PolarHBondContact O-N 3.2Å; Q61-Q64 PolarHBondContact O-N 3.07Å; Q64-L67 PolarHBondContact O-N 3.17Å; Q64-L68 PolarHBondContact O-N 3.18Å
65	Q	41.2	Very low	41	Very low	62 Å²	62	75.2 Å²	75.2	29%	0.29	38%	0.377	S	S	.	.	H	α-helix	trans	-64.5	-41.4	174.8	-75.4	-177.9	-7.7	0	0	111.5	Q61 F62 L67 L68 Y69	Q61-Q65 WeakPolarHBondContact O-CB 3.16Å; Q61-Q65 WeakPolarHBondContact O-CG 3.39Å; Q61-Q65 PolarHBondContact O-N 2.94Å; F62-Q65 PolarHBondContact O-N 3.07Å; Q65-L67 VanDerWaalsContact C-N 3.31Å; Q65-L67 PolarHBondContact O-N 2.69Å; Q65-L68 PolarHBondContact O-N 3.23Å; Q65-Y69 HydrophobicContact CB-CD2 4.4Å; Q65-Y69 HydrophobicContact CB-CE2 4.07Å; Q65-Y69 WeakPolarHBondContact O-CD2 3.17Å; Q65-Y69 PolarHBondContact O-N 3.33Å
66	N	41.4	Very low	41	Very low	44 Å²	44	77.4 Å²	77.4	24%	0.235	40%	0.395	C	S	.	.	H	α-helix	trans	-61.8	-39	176.6	-146.8	16.3	0	0	0	111.7	F62 Q63 Y69 Q70	F62-N66 HydrophobicContact CE1-CB 4.36Å; F62-N66 WeakPolarHBondContact O-CB 3.39Å; F62-N66 PolarHBondContact O-N 2.75Å; Q63-N66 PolarHBondContact O-N 2.95Å; N66-Y69 PolarHBondContact O-N 3.08Å; N66-Q70 WeakPolarHBondContact O-CB 3.45Å; N66-Q70 VanDerWaalsContact O-CG 3.25Å; N66-Q70 WeakPolarHBondContact O-CG 3.27Å; N66-Q70 PolarHBondContact O-N 3.46Å
67	L	42.5	Very low	40.9	Very low	119 Å²	119	72.1 Å²	72.1	62%	0.623	37%	0.37	S	S	*	.	H	α-helix	trans	-65.2	-40.5	173.6	-114	113.4	0	0	0	112.7	Q63 Q64 Q65 Q70 S71	Q63-L67 PolarHBondContact O-N 2.92Å; Q64-L67 PolarHBondContact O-N 3.17Å; Q65-L67 VanDerWaalsContact C-N 3.31Å; Q65-L67 PolarHBondContact O-N 2.69Å; L67-Q70 PolarHBondContact O-N 3.16Å; L67-S71 VanDerWaalsContact O-CB 3.31Å; L67-S71 WeakPolarHBondContact O-CB 2.95Å; L67-S71 PolarHBondContact O-N 3.39Å
68	L	41.9	Very low	41.1	Very low	81 Å²	81	72 Å²	72	42%	0.424	37%	0.373	S	S	.	.	H	α-helix	trans	-64.5	-42	175	-79.8	160.7	0	0	0	111.6	Q64 Q65 S71 A72	Q64-L68 PolarHBondContact O-N 3.18Å; Q65-L68 PolarHBondContact O-N 3.23Å; L68-S71 PolarHBondContact O-N 3.28Å; L68-A72 WeakPolarHBondContact O-CB 3.29Å; L68-A72 PolarHBondContact O-N 3.18Å
69	Y	41.7	Very low	41.6	Very low	108 Å²	108	73.7 Å²	73.7	42%	0.424	38%	0.377	S	S	.	.	H	α-helix	trans	-65	-42.3	174.7	-71.2	-58.2	0	0	0	111.8	Q65 N66 S71 A72 L73	Q65-Y69 HydrophobicContact CB-CD2 4.4Å; Q65-Y69 HydrophobicContact CB-CE2 4.07Å; Q65-Y69 WeakPolarHBondContact O-CD2 3.17Å; Q65-Y69 PolarHBondContact O-N 3.33Å; N66-Y69 PolarHBondContact O-N 3.08Å; Y69-S71 VanDerWaalsContact C-N 3.34Å; Y69-A72 PolarHBondContact O-N 3.04Å; Y69-L73 WeakPolarHBondContact O-CB 3.42Å; Y69-L73 PolarHBondContact O-N 3.34Å
70	Q	40.9	Very low	41.9	Very low	52 Å²	52	74.3 Å²	74.3	24%	0.243	38%	0.378	C	S	.	.	H	α-helix	trans	-61.4	-42.3	173.6	-74.6	175.5	-1.2	0	0	111.5	N66 L67 L73 L74	N66-Q70 WeakPolarHBondContact O-CB 3.45Å; N66-Q70 VanDerWaalsContact O-CG 3.25Å; N66-Q70 WeakPolarHBondContact O-CG 3.27Å; N66-Q70 PolarHBondContact O-N 3.46Å; L67-Q70 PolarHBondContact O-N 3.16Å; Q70-L73 PolarHBondContact O-N 3.22Å; Q70-L74 VanDerWaalsContact O-CB 3.23Å; Q70-L74 WeakPolarHBondContact O-CB 3.37Å; Q70-L74 VanDerWaalsContact O-CD1 3.31Å; Q70-L74 WeakPolarHBondContact O-CD1 3.39Å; Q70-L74 WeakPolarHBondContact O-CG 3.33Å; Q70-L74 PolarHBondContact O-N 3.15Å
71	S	42.9	Very low	42.1	Very low	48 Å²	48	70.4 Å²	70.4	34%	0.336	36%	0.36	S	S	.	.	H	α-helix	trans	-65.5	-45.2	177.1	-177.2	0	0	0	0	112.6	L67 L68 Y69 L74 N75	L67-S71 VanDerWaalsContact O-CB 3.31Å; L67-S71 WeakPolarHBondContact O-CB 2.95Å; L67-S71 PolarHBondContact O-N 3.39Å; L68-S71 PolarHBondContact O-N 3.28Å; Y69-S71 VanDerWaalsContact C-N 3.34Å; S71-L74 PolarHBondContact O-N 3.11Å; S71-N75 WeakPolarHBondContact O-CB 3.25Å; S71-N75 VanDerWaalsContact O-CG 3.26Å; S71-N75 PolarHBondContact O-N 3.07Å; S71-N75 PolarHBondContact O-ND2 3.03Å; S71-N75 VanDerWaalsContact O-ND2 3.15Å
72	A	40.6	Very low	42.4	Very low	54 Å²	54	70 Å²	70	45%	0.446	36%	0.355	S	S	.	.	H	α-helix	trans	-63.6	-41.7	175.6	0	0	0	0	0	111.5	L68 Y69 N75 T76	L68-A72 WeakPolarHBondContact O-CB 3.29Å; L68-A72 PolarHBondContact O-N 3.18Å; Y69-A72 PolarHBondContact O-N 3.04Å; A72-N75 PolarHBondContact O-N 3.17Å; A72-T76 WeakPolarHBondContact O-CG2 3.32Å; A72-T76 PolarHBondContact O-N 3.08Å; A72-T76 VanDerWaalsContact O-N 3.12Å
73	L	39.4	Very low	42.8	Very low	33 Å²	33	68.4 Å²	68.4	17%	0.173	35%	0.353	C	S	.	.	H	α-helix	trans	-62.4	-49.5	173.7	-133.3	89.9	0	0	0	110.9	Y69 Q70 N75 T76 L77 F122	Y69-L73 WeakPolarHBondContact O-CB 3.42Å; Y69-L73 PolarHBondContact O-N 3.34Å; Q70-L73 PolarHBondContact O-N 3.22Å; L73-N75 PolarHBondContact O-N 2.98Å; L73-T76 WeakPolarHBondContact O-CA 3.44Å; L73-T76 PolarHBondContact O-N 2.95Å; L73-T76 PolarHBondContact O-OG1 3.47Å; L73-L77 WeakPolarHBondContact O-CG 3.28Å; L73-L77 PolarHBondContact O-N 3.34Å; L73-F122 HydrophobicContact CD1-CD1 3.73Å; L73-F122 HydrophobicContact CD1-CD2 4.33Å; L73-F122 HydrophobicContact CD1-CE1 3.45Å; L73-F122 VanDerWaalsContact CD1-CE1 3.45Å; L73-F122 HydrophobicContact CD1-CE2 4.09Å; L73-F122 HydrophobicContact CD1-CG 4.18Å; L73-F122 HydrophobicContact CD1-CZ 3.65Å; L73-F122 HydrophobicContact CD2-CD2 4.36Å; L73-F122 HydrophobicContact CD2-CG 4.33Å
74	L	41.7	Very low	43.1	Very low	30 Å²	30	69.3 Å²	69.3	16%	0.157	36%	0.357	C	S	.	.	H	α-helix	trans	-55.2	-33	175.3	-80.4	159.9	0	0	0	111.5	Q70 S71 L77 R82 Y85 I86	Q70-L74 VanDerWaalsContact O-CB 3.23Å; Q70-L74 WeakPolarHBondContact O-CB 3.37Å; Q70-L74 VanDerWaalsContact O-CD1 3.31Å; Q70-L74 WeakPolarHBondContact O-CD1 3.39Å; Q70-L74 WeakPolarHBondContact O-CG 3.33Å; Q70-L74 PolarHBondContact O-N 3.15Å; S71-L74 PolarHBondContact O-N 3.11Å; L74-L77 HydrophobicContact CD2-CD1 4.49Å; L74-L77 PolarHBondContact O-N 3.38Å; L74-R82 HydrophobicContact CB-CG 4.26Å; L74-R82 HydrophobicContact CD2-CB 3.89Å; L74-R82 HydrophobicContact CD2-CG 3.69Å; L74-R82 WeakPolarHBondContact O-CD 3.11Å; L74-R82 WeakPolarHBondContact O-CG 3.38Å; L74-R82 PolarHBondContact O-NE 3.34Å; L74-R82 PolarHBondContact O-NH1 2.89Å; L74-Y85 HydrophobicContact CD2-CD1 3.98Å; L74-Y85 HydrophobicContact CG-CD1 4.43Å; L74-I86 HydrophobicContact CD2-CD1 4.35Å; L74-I86 HydrophobicContact CD2-CG1 4.26Å
75	N	44	Very low	43	Very low	72 Å²	72	68.1 Å²	68.1	39%	0.385	35%	0.35	S	S	.	.	H	α-helix	trans	-78.4	-20.9	176.6	-72.1	-31.7	0	0	0	114.2	S71 A72 L73 R82	S71-N75 WeakPolarHBondContact O-CB 3.25Å; S71-N75 VanDerWaalsContact O-CG 3.26Å; S71-N75 PolarHBondContact O-N 3.07Å; S71-N75 PolarHBondContact O-ND2 3.03Å; S71-N75 VanDerWaalsContact O-ND2 3.15Å; A72-N75 PolarHBondContact O-N 3.17Å; L73-N75 PolarHBondContact O-N 2.98Å; N75-R82 PolarHBondContact OD1-NH1 3.11Å; N75-R82 VanDerWaalsContact OD1-NH1 3.11Å
76	T	39.8	Very low	43.2	Very low	109 Å²	109	69.4 Å²	69.4	67%	0.669	36%	0.357	S	S	*	.	H	α-helix	trans	-85.6	-13.9	170.4	60.5	0	0	0	0	113.9	A72 L73	A72-T76 WeakPolarHBondContact O-CG2 3.32Å; A72-T76 PolarHBondContact O-N 3.08Å; A72-T76 VanDerWaalsContact O-N 3.12Å; L73-T76 WeakPolarHBondContact O-CA 3.44Å; L73-T76 PolarHBondContact O-N 2.95Å; L73-T76 PolarHBondContact O-OG1 3.47Å
77	L	37.3	Very low	43.3	Very low	17 Å²	17	72 Å²	72	9%	0.089	38%	0.375	C	S	.	.	S	Bend	trans	-80.7	140.4	174.9	-68.2	178	0	0	0	110.2	L73 L74 E81 R82 Y85 L119	L73-L77 WeakPolarHBondContact O-CG 3.28Å; L73-L77 PolarHBondContact O-N 3.34Å; L74-L77 HydrophobicContact CD2-CD1 4.49Å; L74-L77 PolarHBondContact O-N 3.38Å; L77-E81 VanDerWaalsContact CA-OE2 3.22Å; L77-E81 WeakPolarHBondContact CA-OE2 3.42Å; L77-E81 HydrophobicContact CB-CB 3.62Å; L77-E81 HydrophobicContact CD1-CB 4.35Å; L77-E81 HydrophobicContact CD2-CB 3.85Å; L77-E81 HydrophobicContact CD2-CG 4.48Å; L77-E81 WeakPolarHBondContact CD2-OE2 3.21Å; L77-E81 HydrophobicContact CG-CB 4.09Å; L77-R82 HydrophobicContact CB-CG 3.85Å; L77-R82 PolarHBondContact O-NE 3.47Å; L77-R82 PolarHBondContact O-NH2 3.47Å; L77-Y85 HydrophobicContact CD1-CG 4.42Å; L77-L119 HydrophobicContact CD2-CD1 4.3Å; L77-L119 HydrophobicContact CD2-CG 4.5Å
78	T	46.4	Very low	43.3	Very low	59 Å²	59	73.6 Å²	73.6	36%	0.362	38%	0.379	S	S	.	.			trans	-57.6	161.2	165.6	79.2	0	0	0	0	109.3	E80 E81 R82	T78-E80 WeakPolarHBondContact CB-OE2 2.82Å; T78-E80 PolarHBondContact O-N 2.88Å; T78-E80 PolarHBondContact OG1-OE2 3.33Å; T78-E81 PolarHBondContact N-OE2 2.83Å; T78-E81 PolarHBondContact O-N 3.32Å; T78-E81 VanDerWaalsContact O-N 3.08Å; T78-E81 WeakPolarHBondContact OG1-CG 3.48Å; T78-E81 PolarHBondContact OG1-N 3.23Å; T78-R82 PolarHBondContact O-N 3.23Å
79	K	47.4	Very low	43.2	Very low	153 Å²	153	77.6 Å²	77.6	67%	0.665	39%	0.39	S	S	*	.	H	α-helix	trans	-57.3	-36	-179.5	-77.5	-178.3	175.5	179.3	0	111.2	R82 A83	K79-R82 PolarHBondContact O-N 3.04Å; K79-A83 PolarHBondContact O-N 3.44Å
80	E	46	Very low	42.9	Very low	86 Å²	86	77 Å²	77	40%	0.402	39%	0.389	S	S	.	.	H	α-helix	trans	-65.2	-38.7	177.2	-58	77	-156.9	0	0	112.4	T78 A83 Q84 L107	T78-E80 WeakPolarHBondContact CB-OE2 2.82Å; T78-E80 PolarHBondContact O-N 2.88Å; T78-E80 PolarHBondContact OG1-OE2 3.33Å; E80-A83 PolarHBondContact O-N 3.36Å; E80-Q84 WeakPolarHBondContact O-CG 3.33Å; E80-Q84 PolarHBondContact O-N 3.49Å; E80-Q84 VanDerWaalsContact O-N 3.14Å; E80-L107 HydrophobicContact CB-CD2 4.3Å; E80-L107 HydrophobicContact CG-CD2 3.37Å
81	E	44.6	Very low	42.4	Very low	27 Å²	27	79.8 Å²	79.8	13%	0.126	41%	0.412	C	S	.	.	H	α-helix	trans	-73.8	-34.1	179.9	-72.9	171.5	165	0	0	112.7	L77 T78 A83 Q84 Y85 N115	L77-E81 VanDerWaalsContact CA-OE2 3.22Å; L77-E81 WeakPolarHBondContact CA-OE2 3.42Å; L77-E81 HydrophobicContact CB-CB 3.62Å; L77-E81 HydrophobicContact CD1-CB 4.35Å; L77-E81 HydrophobicContact CD2-CB 3.85Å; L77-E81 HydrophobicContact CD2-CG 4.48Å; L77-E81 WeakPolarHBondContact CD2-OE2 3.21Å; L77-E81 HydrophobicContact CG-CB 4.09Å; T78-E81 PolarHBondContact N-OE2 2.83Å; T78-E81 PolarHBondContact O-N 3.32Å; T78-E81 VanDerWaalsContact O-N 3.08Å; T78-E81 WeakPolarHBondContact OG1-CG 3.48Å; T78-E81 PolarHBondContact OG1-N 3.23Å; E81-A83 VanDerWaalsContact C-N 3.33Å; E81-Q84 PolarHBondContact O-N 3.22Å; E81-Y85 WeakPolarHBondContact O-CB 3.31Å; E81-Y85 PolarHBondContact O-N 3.39Å; E81-N115 WeakPolarHBondContact OE1-CB 3.38Å; E81-N115 PolarHBondContact OE1-ND2 2.93Å
82	R	48.2	Very low	41.9	Very low	71 Å²	71	87 Å²	87	27%	0.268	43%	0.433	S	S	.	.	H	α-helix	trans	-60.9	-44.6	170.1	-70.7	-178.2	-120.3	-140.6	-14.1	111.1	L74 N75 L77 T78 K79 Q84 Y85 I86	L74-R82 HydrophobicContact CB-CG 4.26Å; L74-R82 HydrophobicContact CD2-CB 3.89Å; L74-R82 HydrophobicContact CD2-CG 3.69Å; L74-R82 WeakPolarHBondContact O-CD 3.11Å; L74-R82 WeakPolarHBondContact O-CG 3.38Å; L74-R82 PolarHBondContact O-NE 3.34Å; L74-R82 PolarHBondContact O-NH1 2.89Å; N75-R82 PolarHBondContact OD1-NH1 3.11Å; N75-R82 VanDerWaalsContact OD1-NH1 3.11Å; L77-R82 HydrophobicContact CB-CG 3.85Å; L77-R82 PolarHBondContact O-NE 3.47Å; L77-R82 PolarHBondContact O-NH2 3.47Å; T78-R82 PolarHBondContact O-N 3.23Å; K79-R82 PolarHBondContact O-N 3.04Å; R82-Q84 VanDerWaalsContact C-N 3.34Å; R82-Q84 PolarHBondContact O-N 3.23Å; R82-Y85 PolarHBondContact O-N 2.98Å; R82-I86 WeakPolarHBondContact O-CB 3.16Å; R82-I86 WeakPolarHBondContact O-CD1 3.38Å; R82-I86 WeakPolarHBondContact O-CG1 3.43Å; R82-I86 PolarHBondContact O-N 2.83Å
83	A	48	Very low	41.3	Very low	27 Å²	27	87.5 Å²	87.5	22%	0.223	44%	0.444	C	S	.	.	H	α-helix	trans	-61.8	-41.8	178.5	0	0	0	0	0	111.4	K79 E80 E81 T87	K79-A83 PolarHBondContact O-N 3.44Å; E80-A83 PolarHBondContact O-N 3.36Å; E81-A83 VanDerWaalsContact C-N 3.33Å; A83-T87 WeakPolarHBondContact O-CB 3.36Å; A83-T87 PolarHBondContact O-N 3.02Å; A83-T87 PolarHBondContact O-OG1 3.06Å
84	Q	46	Very low	41	Very low	135 Å²	135	92.8 Å²	92.8	63%	0.631	47%	0.472	S	S	*	.	H	α-helix	trans	-66.9	-41.2	177.2	-70.3	178.1	11.9	0	0	112.9	E80 E81 R82 T87 H88	E80-Q84 WeakPolarHBondContact O-CG 3.33Å; E80-Q84 PolarHBondContact O-N 3.49Å; E80-Q84 VanDerWaalsContact O-N 3.14Å; E81-Q84 PolarHBondContact O-N 3.22Å; R82-Q84 VanDerWaalsContact C-N 3.34Å; R82-Q84 PolarHBondContact O-N 3.23Å; Q84-T87 PolarHBondContact O-N 3.42Å; Q84-H88 PolarHBondContact O-N 2.86Å; Q84-H88 VanDerWaalsContact O-N 3.11Å
85	Y	42.2	Very low	40.5	Very low	44 Å²	44	98.5 Å²	98.5	17%	0.173	50%	0.501	C	S	.	.	H	α-helix	trans	-64.9	-45.7	177.4	-176.9	-92.1	0	0	0	112.2	L74 L77 E81 R82 T87 H88 Y89 L119	L74-Y85 HydrophobicContact CD2-CD1 3.98Å; L74-Y85 HydrophobicContact CG-CD1 4.43Å; L77-Y85 HydrophobicContact CD1-CG 4.42Å; E81-Y85 WeakPolarHBondContact O-CB 3.31Å; E81-Y85 PolarHBondContact O-N 3.39Å; R82-Y85 PolarHBondContact O-N 2.98Å; Y85-T87 PolarHBondContact O-N 3.31Å; Y85-H88 PolarHBondContact O-N 3.36Å; Y85-Y89 HydrophobicContact CD2-CD2 4.39Å; Y85-Y89 PolarHBondContact O-N 3.18Å; Y85-L119 HydrophobicContact CD2-CD2 4.28Å
86	I	44	Very low	40.1	Very low	88 Å²	88	100.8 Å²	100.8	45%	0.451	51%	0.511	S	S	.	.	H	α-helix	trans	-61.3	-35.7	176	-68	165.1	0	0	0	110.8	L74 R82 F90	L74-I86 HydrophobicContact CD2-CD1 4.35Å; L74-I86 HydrophobicContact CD2-CG1 4.26Å; R82-I86 WeakPolarHBondContact O-CB 3.16Å; R82-I86 WeakPolarHBondContact O-CD1 3.38Å; R82-I86 WeakPolarHBondContact O-CG1 3.43Å; R82-I86 PolarHBondContact O-N 2.83Å; I86-F90 WeakPolarHBondContact O-CB 3.23Å
87	T	43.8	Very low	40.1	Very low	98 Å²	98	104.1 Å²	104.1	60%	0.601	52%	0.516	S	S	*	.	H	α-helix	trans	-75	-31.7	-179.6	-47.8	0	0	0	0	113.4	A83 Q84 Y85	A83-T87 WeakPolarHBondContact O-CB 3.36Å; A83-T87 PolarHBondContact O-N 3.02Å; A83-T87 PolarHBondContact O-OG1 3.06Å; Q84-T87 PolarHBondContact O-N 3.42Å; Y85-T87 PolarHBondContact O-N 3.31Å
88	H	42.4	Very low	40.4	Very low	153 Å²	153	107.8 Å²	107.8	71%	0.708	54%	0.543	S	S	*	.	H	α-helix	trans	-98.3	-25	-175	-99.3	63.5	0	0	0	115	Q84 Y85	Q84-H88 PolarHBondContact O-N 2.86Å; Q84-H88 VanDerWaalsContact O-N 3.11Å; Y85-H88 PolarHBondContact O-N 3.36Å
89	Y	39.2	Very low	40.2	Very low	166 Å²	166	109.3 Å²	109.3	65%	0.651	55%	0.549	S	S	*	.	H	α-helix	trans	-131.9	5.3	-165.1	-71.8	-79.2	0	0	0	115	Y85 P91	Y85-Y89 HydrophobicContact CD2-CD2 4.39Å; Y85-Y89 PolarHBondContact O-N 3.18Å; Y89-P91 WeakPolarHBondContact O-CD 3.18Å
90	F	36.6	Very low	39.9	Very low	95 Å²	95	104.7 Å²	104.7	42%	0.417	53%	0.534	S	S	.	.			trans	-99.7	98.7	171.5	-113	-90.3	0	0	0	110.9	I86 Y92	I86-F90 WeakPolarHBondContact O-CB 3.23Å; F90-Y92 PolarHBondContact O-N 2.98Å
91	P	30	Very low	39.7	Very low	110 Å²	110	106.8 Å²	106.8	71%	0.714	54%	0.544	S	S	*	.			trans	-81.7	63.2	169.9	36	-34.4	0	0	0	109.3	Y89	Y89-P91 WeakPolarHBondContact O-CD 3.18Å
92	Y	32	Very low	39.6	Very low	199 Å²	199	115.2 Å²	115.2	78%	0.78	57%	0.574	S	S	*	*			trans	-147.1	99.9	164.5	-78.3	-75.7	0	0	0	108.1	F90	F90-Y92 PolarHBondContact O-N 2.98Å
93	G	28.9	Very low	39.1	Very low	65 Å²	65	115.8 Å²	115.8	67%	0.67	58%	0.58	S	S	*	*			trans	-65.7	157.8	179.6	0	0	0	0	0	112.8
94	D	32.9	Very low	38.8	Very low	145 Å²	145	121 Å²	121	78%	0.775	60%	0.598	S	S	*	*	S	Bend	trans	102.1	2.2	156.5	-60.5	-31.1	0	0	0	122
95	I	30.9	Very low	38.6	Very low	150 Å²	150	123.1 Å²	123.1	77%	0.769	61%	0.605	S	S	*	*	S	Bend	trans	-102.6	-18.3	-175.1	-63.3	165	0	0	0	117.5
96	M	35.9	Very low	38.4	Very low	119 Å²	119	127.8 Å²	127.8	59%	0.586	63%	0.632	S	S	*	*			trans	-141.2	41.1	-167.8	-72.7	-81.3	155	0	0	116.6	S98 V100	M96-S98 VanDerWaalsContact C-N 3.33Å; M96-S98 PolarHBondContact O-N 3.46Å; M96-V100 WeakPolarHBondContact O-CG2 3.12Å
97	K	40.3	Very low	38	Very low	179 Å²	179	127.8 Å²	127.8	78%	0.778	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-22.4	-177.5	-82.3	-179.9	179.7	167.6	0	115.5
98	S	42.2	Very low	37.6	Very low	94 Å²	94	127.3 Å²	127.3	66%	0.657	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-27.8	-172.8	55.7	0	0	0	0	115.1	M96	M96-S98 VanDerWaalsContact C-N 3.33Å; M96-S98 PolarHBondContact O-N 3.46Å
99	D	42.2	Very low	37.2	Very low	92 Å²	92	126.6 Å²	126.6	49%	0.492	64%	0.639	S	S	.	*	H	α-helix	trans	-87.5	-25.9	-175.8	-70.9	-21.2	0	0	0	112.8	E101 R102 E103	D99-E101 VanDerWaalsContact C-N 3.33Å; D99-E101 PolarHBondContact O-N 3.39Å; D99-R102 PolarHBondContact O-N 3.14Å; D99-E103 PolarHBondContact O-N 3.4Å
100	V	40.8	Very low	36.8	Very low	56 Å²	56	127 Å²	127	34%	0.339	65%	0.647	S	S	.	*	H	α-helix	trans	-65.3	-32.1	-178.3	174.7	0	0	0	0	112.9	M96 K104	M96-V100 WeakPolarHBondContact O-CG2 3.12Å; V100-K104 HydrophobicContact CG1-CD 4.5Å; V100-K104 VanDerWaalsContact O-CG 3.25Å; V100-K104 WeakPolarHBondContact O-CG 3.44Å; V100-K104 PolarHBondContact O-N 2.63Å
101	E	43.8	Very low	36.6	Very low	130 Å²	130	130.3 Å²	130.3	61%	0.607	67%	0.669	S	S	*	*	H	α-helix	trans	-75.2	-34.7	178.7	-89.4	-93.4	137	0	0	112.6	D99	D99-E101 VanDerWaalsContact C-N 3.33Å; D99-E101 PolarHBondContact O-N 3.39Å
102	R	41.3	Very low	36.8	Very low	204 Å²	204	134.4 Å²	134.4	77%	0.77	68%	0.676	S	S	*	*	H	α-helix	trans	-76.3	-36.5	-177.5	-158.6	178	-173.1	-170.6	1.7	111.7	D99	D99-R102 PolarHBondContact O-N 3.14Å
103	E	37.5	Very low	37.2	Very low	82 Å²	82	130.6 Å²	130.6	38%	0.383	67%	0.668	S	S	.	*	H	α-helix	trans	-70.6	-36.8	174.3	-88.1	-176.8	154.4	0	0	112.6	D99 K105 L106 L107	D99-E103 PolarHBondContact O-N 3.4Å; E103-K105 PolarHBondContact O-N 2.94Å; E103-K105 VanDerWaalsContact O-N 3.15Å; E103-L106 PolarHBondContact O-N 3.06Å; E103-L106 VanDerWaalsContact O-N 3.15Å; E103-L107 HydrophobicContact CB-CD1 4.25Å; E103-L107 VanDerWaalsContact O-CD1 3.31Å; E103-L107 WeakPolarHBondContact O-CD1 3.39Å; E103-L107 VanDerWaalsContact O-CG 3.24Å; E103-L107 WeakPolarHBondContact O-CG 3.31Å; E103-L107 PolarHBondContact O-N 3.31Å
104	K	41.9	Very low	37.5	Very low	138 Å²	138	135.6 Å²	135.6	60%	0.6	68%	0.675	S	S	*	*	H	α-helix	trans	-56.7	-31.3	177.3	-84.9	177.1	-176.9	179.2	0	114.1	V100	V100-K104 HydrophobicContact CG1-CD 4.5Å; V100-K104 VanDerWaalsContact O-CG 3.25Å; V100-K104 WeakPolarHBondContact O-CG 3.44Å; V100-K104 PolarHBondContact O-N 2.63Å
105	K	42.6	Very low	37.6	Very low	179 Å²	179	131.5 Å²	131.5	78%	0.778	65%	0.653	S	S	*	*	H	α-helix	trans	-80.4	-23.9	-179.7	-89.4	-178.5	175.4	174.7	0	114.3	E103	E103-K105 PolarHBondContact O-N 2.94Å; E103-K105 VanDerWaalsContact O-N 3.15Å
106	L	37.7	Very low	37.6	Very low	141 Å²	141	126.7 Å²	126.7	74%	0.738	64%	0.635	S	S	*	*	H	α-helix	trans	-88	-20.2	179.1	-80.3	155.9	0	0	0	112.6	E103	E103-L106 PolarHBondContact O-N 3.06Å; E103-L106 VanDerWaalsContact O-N 3.15Å
107	L	34.5	Very low	37.4	Very low	89 Å²	89	123.5 Å²	123.5	47%	0.466	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.2	6.1	-173.1	-69.2	166.9	0	0	0	115.5	E80 E103 L109	E80-L107 HydrophobicContact CB-CD2 4.3Å; E80-L107 HydrophobicContact CG-CD2 3.37Å; E103-L107 HydrophobicContact CB-CD1 4.25Å; E103-L107 VanDerWaalsContact O-CD1 3.31Å; E103-L107 WeakPolarHBondContact O-CD1 3.39Å; E103-L107 VanDerWaalsContact O-CG 3.24Å; E103-L107 WeakPolarHBondContact O-CG 3.31Å; E103-L107 PolarHBondContact O-N 3.31Å; L107-L109 PolarHBondContact O-N 3.36Å
108	A	36.4	Very low	37.1	Very low	88 Å²	88	121.1 Å²	121.1	73%	0.727	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-2.2	-179	0	0	0	0	0	114.1
109	L	33.9	Very low	36.5	Very low	137 Å²	137	119.6 Å²	119.6	72%	0.717	60%	0.598	S	S	*	*	S	Bend	trans	-126.3	118.9	-174.9	-74.7	148.8	0	0	0	109.2	L107	L107-L109 PolarHBondContact O-N 3.36Å
110	E	29.7	Very low	36	Very low	176 Å²	176	120.5 Å²	120.5	82%	0.822	60%	0.595	S	S	*	*	S	Bend	trans	89.4	116.3	156.3	-57.3	176.5	172.2	0	0	120.2
111	N	33.6	Very low	35.6	Very low	163 Å²	163	121.6 Å²	121.6	87%	0.872	60%	0.598	S	S	*	*			trans	73.9	92.7	151.3	-64.3	-27	0	0	0	121.3
112	K	34.6	Very low	35.1	Very low	197 Å²	197	120 Å²	120	86%	0.857	59%	0.589	S	S	*	*			trans	-104.2	123.3	170.4	-65	169.8	176.4	174	0	109.6
113	D	39.8	Very low	34.6	Very low	118 Å²	118	112.2 Å²	112.2	63%	0.631	57%	0.572	S	S	*	*	S	Bend	trans	168.9	-10.5	137.1	-96.8	-21.4	0	0	0	117.5	K177	D113-K177 IonicContact OD1-NZ 3.99Å; D113-K177 IonicContact OD2-NZ 2.62Å; D113-K177 PolarHBondContact OD2-NZ 2.6Å
114	E	36.1	Very low	34.6	Very low	171 Å²	171	111.1 Å²	111.1	80%	0.799	57%	0.565	S	S	*	*	S	Bend	trans	-92.9	-19.4	-166.4	-124.6	175.9	175.6	0	0	116.6
115	N	34.8	Very low	34.4	Very low	59 Å²	59	108.7 Å²	108.7	32%	0.316	56%	0.557	S	S	.	*	S	Bend	trans	-104.7	-12.9	-167.1	-69.7	-30.4	0	0	0	116	E81 S117 K118	E81-N115 WeakPolarHBondContact OE1-CB 3.38Å; E81-N115 PolarHBondContact OE1-ND2 2.93Å; N115-S117 PolarHBondContact O-N 3.44Å; N115-K118 PolarHBondContact O-N 3.16Å
116	A	30.9	Very low	34.1	Very low	48 Å²	48	104.9 Å²	104.9	40%	0.397	54%	0.542	S	S	.	.	H	α-helix	trans	-70.7	-15.2	179	0	0	0	0	0	114.1	R120	A116-R120 WeakPolarHBondContact O-CG 3.46Å; A116-R120 PolarHBondContact O-NE 3.21Å
117	S	31.9	Very low	34.1	Very low	52 Å²	52	101.1 Å²	101.1	36%	0.364	52%	0.523	S	S	.	.	H	α-helix	trans	-81.6	-27.7	178.2	-62.7	0	0	0	0	112.6	N115	N115-S117 PolarHBondContact O-N 3.44Å
118	K	32.8	Very low	34.5	Very low	130 Å²	130	100 Å²	100	57%	0.565	51%	0.514	S	S	*	.	H	α-helix	trans	-76.7	-42.6	-179.7	-65.5	172.3	-174.4	162.5	0	111.3	N115 R120 I121 F122	N115-K118 PolarHBondContact O-N 3.16Å; K118-R120 PolarHBondContact O-N 3.4Å; K118-I121 PolarHBondContact O-N 2.82Å; K118-F122 WeakPolarHBondContact O-CD2 3.37Å
119	L	29.4	Very low	34.7	Very low	61 Å²	61	97.9 Å²	97.9	32%	0.319	50%	0.497	S	S	.	.	H	α-helix	trans	-58.8	-28.2	175	-89.2	149.7	0	0	0	114.3	L77 Y85 F122 G123	L77-L119 HydrophobicContact CD2-CD1 4.3Å; L77-L119 HydrophobicContact CD2-CG 4.5Å; Y85-L119 HydrophobicContact CD2-CD2 4.28Å; L119-F122 WeakPolarHBondContact O-CB 3.4Å; L119-F122 PolarHBondContact O-N 3.43Å; L119-G123 PolarHBondContact O-N 2.84Å
120	R	32.5	Very low	35.1	Very low	111 Å²	111	93.9 Å²	93.9	42%	0.419	48%	0.478	S	S	.	.	H	α-helix	trans	-83.6	-28.1	-176.5	-70.7	-173.4	-119.2	-166.9	-2.2	113.7	A116 K118 F122 G123 Y124 P170	A116-R120 WeakPolarHBondContact O-CG 3.46Å; A116-R120 PolarHBondContact O-NE 3.21Å; K118-R120 PolarHBondContact O-N 3.4Å; R120-F122 VanDerWaalsContact C-N 3.26Å; R120-F122 PolarHBondContact O-N 3.17Å; R120-G123 PolarHBondContact O-N 3.09Å; R120-Y124 WeakPolarHBondContact O-CD2 3.35Å; R120-Y124 WeakPolarHBondContact O-CE2 3.17Å; R120-Y124 PolarHBondContact O-N 3.24Å; R120-P170 VanDerWaalsContact NE-CG 3.29Å; R120-P170 VanDerWaalsContact NH1-CD 3.25Å
121	I	32.9	Very low	35.6	Very low	79 Å²	79	88.6 Å²	88.6	41%	0.405	45%	0.454	S	S	.	.	H	α-helix	trans	-63.5	-37.1	167.6	-65.9	172.9	0	0	0	110	K118 Y124 I125	K118-I121 PolarHBondContact O-N 2.82Å; I121-Y124 PolarHBondContact O-N 3.33Å; I121-I125 HydrophobicContact CG2-CD1 3.96Å; I121-I125 WeakPolarHBondContact O-CG1 3.23Å; I121-I125 PolarHBondContact O-N 3.21Å; I121-I125 VanDerWaalsContact O-N 3.16Å
122	F	32	Very low	36	Very low	97 Å²	97	83.2 Å²	83.2	43%	0.425	43%	0.425	S	S	.	.	H	α-helix	trans	-64.9	-36.6	173.8	-72.9	-70	0	0	0	113	L73 K118 L119 R120 Y124 I125 H126	L73-F122 HydrophobicContact CD1-CD1 3.73Å; L73-F122 HydrophobicContact CD1-CD2 4.33Å; L73-F122 HydrophobicContact CD1-CE1 3.45Å; L73-F122 VanDerWaalsContact CD1-CE1 3.45Å; L73-F122 HydrophobicContact CD1-CE2 4.09Å; L73-F122 HydrophobicContact CD1-CG 4.18Å; L73-F122 HydrophobicContact CD1-CZ 3.65Å; L73-F122 HydrophobicContact CD2-CD2 4.36Å; L73-F122 HydrophobicContact CD2-CG 4.33Å; K118-F122 WeakPolarHBondContact O-CD2 3.37Å; L119-F122 WeakPolarHBondContact O-CB 3.4Å; L119-F122 PolarHBondContact O-N 3.43Å; R120-F122 VanDerWaalsContact C-N 3.26Å; R120-F122 PolarHBondContact O-N 3.17Å; F122-Y124 PolarHBondContact O-N 3.05Å; F122-I125 PolarHBondContact O-N 2.87Å; F122-H126 WeakPolarHBondContact O-CB 3.44Å; F122-H126 PolarHBondContact O-N 3.47Å
123	G	31.2	Very low	36.3	Very low	40 Å²	40	76.8 Å²	76.8	41%	0.412	40%	0.397	S	S	.	.	H	α-helix	trans	-61.4	-41.5	175.3	0	0	0	0	0	113.8	L119 R120 H126 L127	L119-G123 PolarHBondContact O-N 2.84Å; R120-G123 PolarHBondContact O-N 3.09Å; G123-H126 PolarHBondContact O-N 3.33Å; G123-L127 WeakPolarHBondContact O-CB 3.25Å; G123-L127 PolarHBondContact O-N 3.01Å
124	Y	37	Very low	36.3	Very low	59 Å²	59	76 Å²	76	23%	0.231	39%	0.39	C	S	.	.	H	α-helix	trans	-71.7	-39.1	176.3	-62.4	-60.2	0	0	0	112.5	R120 I121 F122 H126 L127 F128 K169	R120-Y124 WeakPolarHBondContact O-CD2 3.35Å; R120-Y124 WeakPolarHBondContact O-CE2 3.17Å; R120-Y124 PolarHBondContact O-N 3.24Å; I121-Y124 PolarHBondContact O-N 3.33Å; F122-Y124 PolarHBondContact O-N 3.05Å; Y124-H126 VanDerWaalsContact C-N 3.26Å; Y124-H126 PolarHBondContact O-N 3.45Å; Y124-L127 PolarHBondContact O-N 2.98Å; Y124-F128 WeakPolarHBondContact O-CB 3.45Å; Y124-F128 WeakPolarHBondContact O-CD2 3.19Å; Y124-F128 PolarHBondContact O-N 2.9Å; Y124-K169 HydrophobicContact CE1-CD 4.22Å; Y124-K169 WeakPolarHBondContact OH-CD 3.44Å; Y124-K169 WeakPolarHBondContact OH-CE 3.25Å; Y124-K169 WeakPolarHBondContact OH-CG 3.47Å
125	I	38.2	Very low	36.4	Very low	87 Å²	87	69.9 Å²	69.9	45%	0.446	37%	0.366	S	S	.	.	H	α-helix	trans	-60.4	-41	172.8	-67.2	168	0	0	0	110	I121 F122 A129	I121-I125 HydrophobicContact CG2-CD1 3.96Å; I121-I125 WeakPolarHBondContact O-CG1 3.23Å; I121-I125 PolarHBondContact O-N 3.21Å; I121-I125 VanDerWaalsContact O-N 3.16Å; F122-I125 PolarHBondContact O-N 2.87Å; I125-A129 WeakPolarHBondContact O-CB 3.5Å; I125-A129 PolarHBondContact O-N 3.34Å
126	H	36.5	Very low	36.5	Very low	100 Å²	100	71.7 Å²	71.7	46%	0.463	37%	0.373	S	S	.	.	H	α-helix	trans	-65.7	-41.4	176.8	-154.6	78	0	0	0	112.1	F122 G123 Y124 A129 V130	F122-H126 WeakPolarHBondContact O-CB 3.44Å; F122-H126 PolarHBondContact O-N 3.47Å; G123-H126 PolarHBondContact O-N 3.33Å; Y124-H126 VanDerWaalsContact C-N 3.26Å; Y124-H126 PolarHBondContact O-N 3.45Å; H126-A129 CarbonylContact O-C 3.54Å; H126-A129 PolarHBondContact O-N 2.77Å; H126-V130 WeakPolarHBondContact O-CB 3.49Å; H126-V130 VanDerWaalsContact O-CG2 3.24Å; H126-V130 WeakPolarHBondContact O-CG2 3.44Å; H126-V130 PolarHBondContact O-N 3.31Å
127	L	37.4	Very low	36.9	Very low	62 Å²	62	72.6 Å²	72.6	33%	0.325	37%	0.371	S	S	.	.	H	α-helix	trans	-67.2	-42.7	178.4	-158.7	79.5	0	0	0	112.3	G123 Y124 V130 I131 Y159	G123-L127 WeakPolarHBondContact O-CB 3.25Å; G123-L127 PolarHBondContact O-N 3.01Å; Y124-L127 PolarHBondContact O-N 2.98Å; L127-V130 WeakPolarHBondContact O-CB 3.5Å; L127-V130 PolarHBondContact O-N 3.01Å; L127-I131 WeakPolarHBondContact O-CG1 3.19Å; L127-I131 PolarHBondContact O-N 2.86Å; L127-Y159 HydrophobicContact CD2-CE1 3.67Å
128	F	42.6	Very low	36.9	Very low	66 Å²	66	76 Å²	76	29%	0.289	38%	0.381	S	S	.	.	H	α-helix	trans	-66.7	-38.7	173.3	-88.9	-82.1	0	0	0	111.7	Y124 V130 I131 I132 L160	Y124-F128 WeakPolarHBondContact O-CB 3.45Å; Y124-F128 WeakPolarHBondContact O-CD2 3.19Å; Y124-F128 PolarHBondContact O-N 2.9Å; F128-V130 VanDerWaalsContact C-N 3.3Å; F128-V130 PolarHBondContact O-N 3.4Å; F128-I131 PolarHBondContact O-N 3.4Å; F128-I132 WeakPolarHBondContact O-CB 3.46Å; F128-I132 VanDerWaalsContact O-CG1 3.31Å; F128-I132 WeakPolarHBondContact O-CG1 3.43Å; F128-I132 PolarHBondContact O-N 2.89Å; F128-L160 HydrophobicContact CZ-CD1 4.28Å
129	A	41.4	Very low	37.1	Very low	43 Å²	43	74.1 Å²	74.1	36%	0.355	38%	0.382	S	S	.	.	H	α-helix	trans	-63.4	-35.1	171.5	0	0	0	0	0	111.6	I125 H126 K133	I125-A129 WeakPolarHBondContact O-CB 3.5Å; I125-A129 PolarHBondContact O-N 3.34Å; H126-A129 CarbonylContact O-C 3.54Å; H126-A129 PolarHBondContact O-N 2.77Å; A129-K133 WeakPolarHBondContact O-CA 3.47Å; A129-K133 WeakPolarHBondContact O-CB 3.28Å; A129-K133 PolarHBondContact O-N 2.86Å
130	V	41.8	Very low	37.2	Very low	52 Å²	52	75.1 Å²	75.1	32%	0.315	39%	0.392	S	S	.	.	H	α-helix	trans	-67.2	-41.3	173.3	166.7	0	0	0	0	111.4	H126 L127 F128 K133 Q134	H126-V130 WeakPolarHBondContact O-CB 3.49Å; H126-V130 VanDerWaalsContact O-CG2 3.24Å; H126-V130 WeakPolarHBondContact O-CG2 3.44Å; H126-V130 PolarHBondContact O-N 3.31Å; L127-V130 WeakPolarHBondContact O-CB 3.5Å; L127-V130 PolarHBondContact O-N 3.01Å; F128-V130 VanDerWaalsContact C-N 3.3Å; F128-V130 PolarHBondContact O-N 3.4Å; V130-K133 PolarHBondContact O-N 3.22Å; V130-Q134 HydrophobicContact CG1-CG 4.43Å; V130-Q134 VanDerWaalsContact O-CB 3.29Å; V130-Q134 WeakPolarHBondContact O-CB 3.07Å; V130-Q134 VanDerWaalsContact O-CG 3.27Å; V130-Q134 WeakPolarHBondContact O-CG 3.3Å; V130-Q134 PolarHBondContact O-N 3.27Å
131	I	41.1	Very low	37.2	Very low	65 Å²	65	74 Å²	74	33%	0.333	39%	0.391	S	S	.	.	H	α-helix	trans	-64.7	-44.7	176	-67.9	165.4	0	0	0	110.7	L127 F128 Q134 S135	L127-I131 WeakPolarHBondContact O-CG1 3.19Å; L127-I131 PolarHBondContact O-N 2.86Å; F128-I131 PolarHBondContact O-N 3.4Å; I131-Q134 PolarHBondContact O-N 3Å; I131-S135 WeakPolarHBondContact O-CB 3.41Å; I131-S135 PolarHBondContact O-N 3.33Å
132	I	42	Very low	37.1	Very low	50 Å²	50	79 Å²	79	26%	0.256	41%	0.405	S	S	.	.	H	α-helix	trans	-64.8	-46.5	175.4	-70.5	174.1	0	0	0	110.3	F128 Q134 S135 M136 L236	F128-I132 WeakPolarHBondContact O-CB 3.46Å; F128-I132 VanDerWaalsContact O-CG1 3.31Å; F128-I132 WeakPolarHBondContact O-CG1 3.43Å; F128-I132 PolarHBondContact O-N 2.89Å; I132-Q134 VanDerWaalsContact C-N 3.35Å; I132-Q134 PolarHBondContact O-N 2.95Å; I132-S135 WeakPolarHBondContact CA-OG 3.3Å; I132-S135 CarbonylContact O-C 3.26Å; I132-S135 WeakPolarHBondContact O-CA 3.22Å; I132-S135 WeakPolarHBondContact O-CB 3.28Å; I132-S135 PolarHBondContact O-N 3.39Å; I132-S135 VanDerWaalsContact O-N 3.09Å; I132-S135 PolarHBondContact O-OG 2.7Å; I132-M136 HydrophobicContact CG2-CG 4.28Å; I132-M136 HydrophobicContact CG2-SD 3.42Å; I132-M136 WeakPolarHBondContact CG2-SD 3.35Å; I132-M136 WeakPolarHBondContact O-CB 3.14Å; I132-M136 WeakPolarHBondContact O-CG 3.38Å; I132-M136 PolarHBondContact O-N 3.29Å; I132-L236 HydrophobicContact CD1-CD2 4.25Å
133	K	40.6	Very low	37.1	Very low	63 Å²	63	79.7 Å²	79.7	27%	0.274	41%	0.412	S	S	.	.	H	α-helix	trans	-60.7	-42.5	177.1	-174.3	-168.9	-171.5	-176.4	0	111.6	F62 A129 V130 M136 I137	F62-K133 HydrophobicContact CD1-CD 4.28Å; F62-K133 HydrophobicContact CD2-CD 4.39Å; F62-K133 HydrophobicContact CE1-CD 3.69Å; F62-K133 HydrophobicContact CE2-CD 3.75Å; F62-K133 HydrophobicContact CE2-CG 3.99Å; F62-K133 HydrophobicContact CZ-CD 3.37Å; F62-K133 VanDerWaalsContact CZ-CE 3.44Å; F62-K133 HydrophobicContact CZ-CG 4.11Å; A129-K133 WeakPolarHBondContact O-CA 3.47Å; A129-K133 WeakPolarHBondContact O-CB 3.28Å; A129-K133 PolarHBondContact O-N 2.86Å; V130-K133 PolarHBondContact O-N 3.22Å; K133-M136 PolarHBondContact O-N 3.24Å; K133-I137 HydrophobicContact CD-CD1 4.13Å; K133-I137 HydrophobicContact CG-CD1 3.3Å; K133-I137 HydrophobicContact CG-CG1 4.1Å; K133-I137 VanDerWaalsContact O-CB 3.3Å; K133-I137 WeakPolarHBondContact O-CB 3.49Å; K133-I137 WeakPolarHBondContact O-CG1 3.45Å; K133-I137 PolarHBondContact O-N 3.4Å
134	Q	40	Very low	37.3	Very low	101 Å²	101	81.8 Å²	81.8	47%	0.472	42%	0.42	S	S	.	.	H	α-helix	trans	-59.1	-53.9	172.5	-78.3	178.5	-9.2	0	0	108.2	V130 I131 I132 M136 I137 Q138 F141	V130-Q134 HydrophobicContact CG1-CG 4.43Å; V130-Q134 VanDerWaalsContact O-CB 3.29Å; V130-Q134 WeakPolarHBondContact O-CB 3.07Å; V130-Q134 VanDerWaalsContact O-CG 3.27Å; V130-Q134 WeakPolarHBondContact O-CG 3.3Å; V130-Q134 PolarHBondContact O-N 3.27Å; I131-Q134 PolarHBondContact O-N 3Å; I132-Q134 VanDerWaalsContact C-N 3.35Å; I132-Q134 PolarHBondContact O-N 2.95Å; Q134-M136 PolarHBondContact O-N 3.13Å; Q134-I137 PolarHBondContact O-N 3.24Å; Q134-Q138 PolarHBondContact O-N 3.28Å; Q134-F141 HydrophobicContact CB-CE2 4.46Å; Q134-F141 HydrophobicContact CB-CZ 4.19Å; Q134-F141 VanDerWaalsContact O-CD2 3.24Å; Q134-F141 WeakPolarHBondContact O-CD2 3.4Å; Q134-F141 WeakPolarHBondContact O-CE2 3.41Å; Q134-F141 WeakPolarHBondContact O-CZ 3.36Å
135	S	37.9	Very low	37.1	Very low	42 Å²	42	82.9 Å²	82.9	29%	0.294	43%	0.43	S	S	.	.	H	α-helix	trans	-54.9	-24.6	178.8	82.2	0	0	0	0	116.1	I131 I132 F141	I131-S135 WeakPolarHBondContact O-CB 3.41Å; I131-S135 PolarHBondContact O-N 3.33Å; I132-S135 WeakPolarHBondContact CA-OG 3.3Å; I132-S135 CarbonylContact O-C 3.26Å; I132-S135 WeakPolarHBondContact O-CA 3.22Å; I132-S135 WeakPolarHBondContact O-CB 3.28Å; I132-S135 PolarHBondContact O-N 3.39Å; I132-S135 VanDerWaalsContact O-N 3.09Å; I132-S135 PolarHBondContact O-OG 2.7Å; S135-F141 VanDerWaalsContact CA-CE1 3.47Å; S135-F141 WeakPolarHBondContact O-CG 3.43Å
136	M	36.4	Very low	37.1	Very low	97 Å²	97	84.7 Å²	84.7	48%	0.478	44%	0.437	S	S	.	.	H	α-helix	trans	-99.2	-26.5	-177.2	-66.5	171.3	92.8	0	0	114.2	I132 K133 Q134 I254	I132-M136 HydrophobicContact CG2-CG 4.28Å; I132-M136 HydrophobicContact CG2-SD 3.42Å; I132-M136 WeakPolarHBondContact CG2-SD 3.35Å; I132-M136 WeakPolarHBondContact O-CB 3.14Å; I132-M136 WeakPolarHBondContact O-CG 3.38Å; I132-M136 PolarHBondContact O-N 3.29Å; K133-M136 PolarHBondContact O-N 3.24Å; Q134-M136 PolarHBondContact O-N 3.13Å; M136-I254 HydrophobicContact CE-CD1 3.2Å; M136-I254 HydrophobicContact CE-CG1 3.66Å; M136-I254 HydrophobicContact CE-CG2 4.33Å
137	I	38.5	Very low	37.1	Very low	67 Å²	67	82.7 Å²	82.7	34%	0.344	44%	0.437	S	S	.	.	H	α-helix	trans	-111.4	-20.8	-164.5	-53.4	-176.8	0	0	0	113.8	K133 Q134 P139	K133-I137 HydrophobicContact CD-CD1 4.13Å; K133-I137 HydrophobicContact CG-CD1 3.3Å; K133-I137 HydrophobicContact CG-CG1 4.1Å; K133-I137 VanDerWaalsContact O-CB 3.3Å; K133-I137 WeakPolarHBondContact O-CB 3.49Å; K133-I137 WeakPolarHBondContact O-CG1 3.45Å; K133-I137 PolarHBondContact O-N 3.4Å; Q134-I137 PolarHBondContact O-N 3.24Å; I137-P139 VanDerWaalsContact O-CD 3.29Å; I137-P139 WeakPolarHBondContact O-CD 3.49Å
138	Q	33.2	Very low	37.1	Very low	123 Å²	123	82.2 Å²	82.2	58%	0.575	44%	0.439	S	S	*	.	S	Bend	trans	-80.8	121.8	176.9	-59.1	-159.6	-14.1	0	0	112.4	Q134 P140 F141	Q134-Q138 PolarHBondContact O-N 3.28Å; Q138-P140 CarbonylContact O-C 3.37Å; Q138-P140 WeakPolarHBondContact O-CA 3.5Å; Q138-F141 HydrophobicContact CB-CD2 3.77Å; Q138-F141 HydrophobicContact CB-CE2 3.69Å; Q138-F141 HydrophobicContact CG-CE2 4.05Å; Q138-F141 PolarHBondContact O-N 3.39Å
139	P	36.4	Very low	37	Very low	91 Å²	91	80.4 Å²	80.4	59%	0.591	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	111.3	168	18.2	-0.2	0	0	0	109.2	K55 I137	K55-P139 HydrophobicContact CD-CG 4.5Å; I137-P139 VanDerWaalsContact O-CD 3.29Å; I137-P139 WeakPolarHBondContact O-CD 3.49Å
140	P	31.6	Very low	37	Very low	83 Å²	83	79 Å²	79	54%	0.539	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	cis	-114.4	129.3	-5.1	35.4	-18.9	0	0	0	112	Q138 R142	Q138-P140 CarbonylContact O-C 3.37Å; Q138-P140 WeakPolarHBondContact O-CA 3.5Å; P140-R142 HydrophobicContact CB-CB 3.55Å; P140-R142 HydrophobicContact CB-CG 3.42Å; P140-R142 VanDerWaalsContact CB-CG 3.42Å; P140-R142 HydrophobicContact CG-CB 3.73Å; P140-R142 HydrophobicContact CG-CG 3.74Å; P140-R142 PolarHBondContact O-N 3.24Å
141	F	33.5	Very low	37.2	Very low	88 Å²	88	81.8 Å²	81.8	39%	0.386	43%	0.431	S	S	.	.			trans	-53.9	53.7	130.4	-84.6	-95.1	0	0	0	110.5	Q134 S135 Q138 L143 M152	Q134-F141 HydrophobicContact CB-CE2 4.46Å; Q134-F141 HydrophobicContact CB-CZ 4.19Å; Q134-F141 VanDerWaalsContact O-CD2 3.24Å; Q134-F141 WeakPolarHBondContact O-CD2 3.4Å; Q134-F141 WeakPolarHBondContact O-CE2 3.41Å; Q134-F141 WeakPolarHBondContact O-CZ 3.36Å; S135-F141 VanDerWaalsContact CA-CE1 3.47Å; S135-F141 WeakPolarHBondContact O-CG 3.43Å; Q138-F141 HydrophobicContact CB-CD2 3.77Å; Q138-F141 HydrophobicContact CB-CE2 3.69Å; Q138-F141 HydrophobicContact CG-CE2 4.05Å; Q138-F141 PolarHBondContact O-N 3.39Å; F141-L143 PolarHBondContact O-N 2.99Å; F141-L143 VanDerWaalsContact O-N 3.16Å; F141-M152 HydrophobicContact CE1-CE 4.26Å
142	R	28.9	Very low	37.3	Very low	183 Å²	183	83.1 Å²	83.1	69%	0.691	44%	0.436	S	S	*	.			trans	-76.7	109	168.2	-102.5	170.2	-161.6	-168.6	2	102.4	P140 S144	P140-R142 HydrophobicContact CB-CB 3.55Å; P140-R142 HydrophobicContact CB-CG 3.42Å; P140-R142 VanDerWaalsContact CB-CG 3.42Å; P140-R142 HydrophobicContact CG-CB 3.73Å; P140-R142 HydrophobicContact CG-CG 3.74Å; P140-R142 PolarHBondContact O-N 3.24Å; R142-S144 PolarHBondContact O-N 3.43Å
143	L	33.3	Very low	37.5	Very low	112 Å²	112	81.6 Å²	81.6	59%	0.586	43%	0.429	S	S	*	.			trans	-57.6	56.7	140.6	-53.8	170.3	0	0	0	107.9	F141 N145 F149	F141-L143 PolarHBondContact O-N 2.99Å; F141-L143 VanDerWaalsContact O-N 3.16Å; L143-N145 PolarHBondContact O-N 3.4Å; L143-F149 HydrophobicContact CD1-CD2 4.37Å; L143-F149 HydrophobicContact CD2-CB 3.33Å; L143-F149 HydrophobicContact CD2-CD2 3.01Å; L143-F149 HydrophobicContact CD2-CE2 3.85Å; L143-F149 HydrophobicContact CD2-CG 3.38Å; L143-F149 HydrophobicContact CG-CD2 4.3Å
144	S	34.6	Very low	38	Very low	83 Å²	83	83 Å²	83	58%	0.58	43%	0.432	S	S	*	.			trans	-67.4	-21.2	-176.4	37.7	0	0	0	0	110.3	R142	R142-S144 PolarHBondContact O-N 3.43Å
145	N	33.9	Very low	38.4	Very low	82 Å²	82	85.2 Å²	85.2	44%	0.439	44%	0.437	S	S	.	.	S	Bend	trans	-150.9	161.3	165.1	59.6	49.1	0	0	0	110.4	L143 A147 S148	L143-N145 PolarHBondContact O-N 3.4Å; N145-A147 PolarHBondContact O-N 3.24Å; N145-A147 WeakPolarHBondContact OD1-CB 3.39Å; N145-A147 PolarHBondContact OD1-N 3.36Å; N145-S148 PolarHBondContact O-N 2.96Å; N145-S148 PolarHBondContact OD1-N 3.39Å; N145-S148 PolarHBondContact OD1-OG 3.48Å
146	E	36.8	Very low	38.7	Very low	125 Å²	125	85.6 Å²	85.6	58%	0.584	44%	0.44	S	S	*	.	H	α-helix	trans	-53.1	-30.2	175.6	162.1	167.5	-162.7	0	0	113.7	T150 M308	E146-T150 WeakPolarHBondContact O-CB 3.3Å; E146-T150 PolarHBondContact O-N 2.78Å; E146-T150 PolarHBondContact O-OG1 3.16Å; E146-M308 HydrophobicContact CB-CE 3.62Å; E146-M308 HydrophobicContact CG-CE 3.42Å; E146-M308 VanDerWaalsContact CG-CE 3.42Å; E146-M308 HydrophobicContact CG-CG 4.16Å; E146-M308 WeakPolarHBondContact OE1-CG 3.45Å
147	A	37.5	Very low	39.3	Very low	58 Å²	58	81.6 Å²	81.6	48%	0.479	42%	0.421	S	S	.	.	H	α-helix	trans	-69.9	-46	-178.1	0	0	0	0	0	112.4	N145 F149 T150 I151	N145-A147 PolarHBondContact O-N 3.24Å; N145-A147 WeakPolarHBondContact OD1-CB 3.39Å; N145-A147 PolarHBondContact OD1-N 3.36Å; A147-F149 VanDerWaalsContact C-N 3.33Å; A147-F149 PolarHBondContact O-N 3.11Å; A147-T150 PolarHBondContact O-N 2.97Å; A147-I151 WeakPolarHBondContact O-CG1 3.49Å; A147-I151 PolarHBondContact O-N 3.01Å
148	S	36.9	Very low	39.8	Very low	52 Å²	52	80.7 Å²	80.7	36%	0.364	42%	0.417	S	S	.	.	H	α-helix	trans	-63.5	-38.9	177.9	-64	0	0	0	0	112.1	N145 M152	N145-S148 PolarHBondContact O-N 2.96Å; N145-S148 PolarHBondContact OD1-N 3.39Å; N145-S148 PolarHBondContact OD1-OG 3.48Å; S148-M152 WeakPolarHBondContact O-CB 3.49Å; S148-M152 WeakPolarHBondContact O-CG 3.03Å; S148-M152 PolarHBondContact O-N 3.49Å; S148-M152 VanDerWaalsContact O-N 3.15Å
149	F	41.6	Very low	40.5	Very low	29 Å²	29	79.3 Å²	79.3	13%	0.127	41%	0.407	C	S	.	.	H	α-helix	trans	-60.4	-48.3	173.4	-176.4	-133.6	0	0	0	112.1	L143 A147 I151 M152 L153 L260 I305 M308	L143-F149 HydrophobicContact CD1-CD2 4.37Å; L143-F149 HydrophobicContact CD2-CB 3.33Å; L143-F149 HydrophobicContact CD2-CD2 3.01Å; L143-F149 HydrophobicContact CD2-CE2 3.85Å; L143-F149 HydrophobicContact CD2-CG 3.38Å; L143-F149 HydrophobicContact CG-CD2 4.3Å; A147-F149 VanDerWaalsContact C-N 3.33Å; A147-F149 PolarHBondContact O-N 3.11Å; F149-I151 PolarHBondContact O-N 2.91Å; F149-M152 PolarHBondContact O-N 3.06Å; F149-L153 HydrophobicContact CD1-CD1 3.63Å; F149-L153 HydrophobicContact CD2-CD1 3.71Å; F149-L153 HydrophobicContact CD2-CG 4.24Å; F149-L153 HydrophobicContact CE1-CD1 3.29Å; F149-L153 HydrophobicContact CE2-CD1 3.44Å; F149-L153 VanDerWaalsContact CE2-CD1 3.44Å; F149-L153 HydrophobicContact CE2-CG 4.01Å; F149-L153 HydrophobicContact CG-CD1 3.88Å; F149-L153 HydrophobicContact CZ-CD1 3.22Å; F149-L153 HydrophobicContact CZ-CG 4.2Å; F149-L153 WeakPolarHBondContact O-CB 3.36Å; F149-L153 PolarHBondContact O-N 3.45Å; F149-L260 HydrophobicContact CE2-CD2 4.31Å; F149-L260 HydrophobicContact CZ-CD2 3.86Å; F149-I305 HydrophobicContact CE1-CD1 3.92Å; F149-I305 HydrophobicContact CE1-CG2 4.21Å; F149-I305 HydrophobicContact CZ-CD1 4.39Å; F149-I305 HydrophobicContact CZ-CG2 4.44Å; F149-M308 HydrophobicContact CD1-CE 3.62Å; F149-M308 HydrophobicContact CD1-SD 4.11Å; F149-M308 HydrophobicContact CE1-CE 4.26Å; F149-M308 HydrophobicContact CE1-SD 4.19Å
150	T	41.5	Very low	41.1	Very low	14 Å²	14	76.4 Å²	76.4	9%	0.086	39%	0.386	C	S	.	.	H	α-helix	trans	-61.2	-45.5	-178.3	-64.2	0	0	0	0	111.4	E146 A147 M152 L153 R154 M308	E146-T150 WeakPolarHBondContact O-CB 3.3Å; E146-T150 PolarHBondContact O-N 2.78Å; E146-T150 PolarHBondContact O-OG1 3.16Å; A147-T150 PolarHBondContact O-N 2.97Å; T150-M152 PolarHBondContact O-N 3.25Å; T150-L153 PolarHBondContact O-N 3.44Å; T150-R154 WeakPolarHBondContact O-CB 3.2Å; T150-R154 WeakPolarHBondContact O-CG 3.18Å; T150-R154 PolarHBondContact O-N 3.25Å; T150-M308 WeakPolarHBondContact CG2-O 3.49Å; T150-M308 PolarHBondContact OG1-O 3.39Å
151	I	45.3	Very low	41.9	Very low	110 Å²	110	72.7 Å²	72.7	56%	0.564	36%	0.363	S	S	*	.	H	α-helix	trans	-61.7	-45	178.4	-69.1	167.5	0	0	0	110.8	A147 F149 R154 Y155	A147-I151 WeakPolarHBondContact O-CG1 3.49Å; A147-I151 PolarHBondContact O-N 3.01Å; F149-I151 PolarHBondContact O-N 2.91Å; I151-R154 WeakPolarHBondContact O-CB 3.26Å; I151-R154 PolarHBondContact O-N 2.95Å; I151-Y155 PolarHBondContact O-N 3.45Å
152	M	42.5	Very low	42.8	Very low	93 Å²	93	72.4 Å²	72.4	46%	0.458	37%	0.365	S	S	.	.	H	α-helix	trans	-66.6	-42.8	-178.9	-73.8	-63.2	-69.6	0	0	112.3	F141 S148 F149 T150 R154 Y155 S156	F141-M152 HydrophobicContact CE1-CE 4.26Å; S148-M152 WeakPolarHBondContact O-CB 3.49Å; S148-M152 WeakPolarHBondContact O-CG 3.03Å; S148-M152 PolarHBondContact O-N 3.49Å; S148-M152 VanDerWaalsContact O-N 3.15Å; F149-M152 PolarHBondContact O-N 3.06Å; T150-M152 PolarHBondContact O-N 3.25Å; M152-R154 VanDerWaalsContact C-N 3.29Å; M152-R154 PolarHBondContact O-N 3.27Å; M152-Y155 WeakPolarHBondContact O-CB 3.04Å; M152-Y155 PolarHBondContact O-N 3.49Å; M152-Y155 VanDerWaalsContact O-N 3.07Å; M152-S156 PolarHBondContact O-N 3.07Å; M152-S156 PolarHBondContact O-OG 3.42Å
153	L	46	Very low	43.6	Very low	17 Å²	17	64.8 Å²	64.8	9%	0.089	34%	0.34	C	S	.	.	H	α-helix	trans	-57.3	-44.4	172.5	-89.6	161.4	0	0	0	111.9	F149 T150 Y155 S156 V157 I264 I309	F149-L153 HydrophobicContact CD1-CD1 3.63Å; F149-L153 HydrophobicContact CD2-CD1 3.71Å; F149-L153 HydrophobicContact CD2-CG 4.24Å; F149-L153 HydrophobicContact CE1-CD1 3.29Å; F149-L153 HydrophobicContact CE2-CD1 3.44Å; F149-L153 VanDerWaalsContact CE2-CD1 3.44Å; F149-L153 HydrophobicContact CE2-CG 4.01Å; F149-L153 HydrophobicContact CG-CD1 3.88Å; F149-L153 HydrophobicContact CZ-CD1 3.22Å; F149-L153 HydrophobicContact CZ-CG 4.2Å; F149-L153 WeakPolarHBondContact O-CB 3.36Å; F149-L153 PolarHBondContact O-N 3.45Å; T150-L153 PolarHBondContact O-N 3.44Å; L153-Y155 VanDerWaalsContact C-N 3.32Å; L153-Y155 PolarHBondContact O-N 3.37Å; L153-S156 PolarHBondContact O-N 3.26Å; L153-V157 WeakPolarHBondContact O-CB 3.49Å; L153-V157 WeakPolarHBondContact O-CG2 3.48Å; L153-V157 PolarHBondContact O-N 2.94Å; L153-I264 HydrophobicContact CD2-CD1 3.42Å; L153-I264 VanDerWaalsContact CD2-CD1 3.42Å; L153-I309 HydrophobicContact CB-CG1 4.12Å; L153-I309 HydrophobicContact CD1-CD1 4.26Å; L153-I309 HydrophobicContact CD1-CG1 3.74Å; L153-I309 HydrophobicContact CD2-CD1 4.2Å; L153-I309 HydrophobicContact CD2-CG1 4.37Å; L153-I309 HydrophobicContact CG-CG1 4.33Å
154	R	51.7	Low	44.4	Very low	93 Å²	93	59.9 Å²	59.9	35%	0.351	31%	0.314	S	S	.	.	H	α-helix	trans	-63.5	-37.6	174.4	-68.9	177	-179.2	174.5	8.3	111.8	T150 I151 M152 N158 I309 Y313	T150-R154 WeakPolarHBondContact O-CB 3.2Å; T150-R154 WeakPolarHBondContact O-CG 3.18Å; T150-R154 PolarHBondContact O-N 3.25Å; I151-R154 WeakPolarHBondContact O-CB 3.26Å; I151-R154 PolarHBondContact O-N 2.95Å; M152-R154 VanDerWaalsContact C-N 3.29Å; M152-R154 PolarHBondContact O-N 3.27Å; R154-N158 WeakPolarHBondContact O-CB 3.3Å; R154-N158 PolarHBondContact O-N 2.92Å; R154-N158 PolarHBondContact O-ND2 3.41Å; R154-I309 PolarHBondContact NE-O 3.01Å; R154-I309 PolarHBondContact NH2-O 3.15Å; R154-Y313 WeakPolarHBondContact CA-OH 3.44Å; R154-Y313 HydrophobicContact CB-CD1 4.5Å; R154-Y313 HydrophobicContact CB-CD2 4.2Å; R154-Y313 HydrophobicContact CB-CE1 3.99Å; R154-Y313 HydrophobicContact CB-CE2 3.64Å; R154-Y313 HydrophobicContact CG-CD1 3.74Å; R154-Y313 HydrophobicContact CG-CD2 3.65Å; R154-Y313 HydrophobicContact CG-CE1 3.71Å; R154-Y313 HydrophobicContact CG-CE2 3.62Å; R154-Y313 HydrophobicContact CG-CG 3.73Å; R154-Y313 PolarHBondContact O-OH 3.48Å
155	Y	48	Very low	45	Very low	148 Å²	148	61.5 Å²	61.5	58%	0.58	31%	0.311	S	S	*	.	H	α-helix	trans	-65.2	-48.9	177.3	-173	-95.3	0	0	0	111.6	I151 M152 L153 V157 N158 Y159	I151-Y155 PolarHBondContact O-N 3.45Å; M152-Y155 WeakPolarHBondContact O-CB 3.04Å; M152-Y155 PolarHBondContact O-N 3.49Å; M152-Y155 VanDerWaalsContact O-N 3.07Å; L153-Y155 VanDerWaalsContact C-N 3.32Å; L153-Y155 PolarHBondContact O-N 3.37Å; Y155-V157 VanDerWaalsContact C-N 3.31Å; Y155-V157 PolarHBondContact O-N 2.91Å; Y155-N158 PolarHBondContact O-N 3.19Å; Y155-Y159 WeakPolarHBondContact O-CB 3.33Å; Y155-Y159 PolarHBondContact O-N 3.46Å
156	S	44.2	Very low	45.7	Very low	50 Å²	50	60.9 Å²	60.9	35%	0.35	31%	0.307	S	S	.	.	H	α-helix	trans	-59.8	-41.4	178.3	-58.5	0	0	0	0	112.3	M152 L153 L160	M152-S156 PolarHBondContact O-N 3.07Å; M152-S156 PolarHBondContact O-OG 3.42Å; L153-S156 PolarHBondContact O-N 3.26Å; S156-L160 PolarHBondContact O-N 2.97Å; S156-L160 VanDerWaalsContact O-N 3.15Å
157	V	48.6	Very low	45.9	Very low	12 Å²	12	58.4 Å²	58.4	7%	0.073	30%	0.304	C	S	.	.	H	α-helix	trans	-66.8	-49.8	177.2	171.4	0	0	0	0	110.7	L153 Y155 Y159 L160 A161 Y313 Y317	L153-V157 WeakPolarHBondContact O-CB 3.49Å; L153-V157 WeakPolarHBondContact O-CG2 3.48Å; L153-V157 PolarHBondContact O-N 2.94Å; Y155-V157 VanDerWaalsContact C-N 3.31Å; Y155-V157 PolarHBondContact O-N 2.91Å; V157-Y159 PolarHBondContact O-N 3.33Å; V157-L160 WeakPolarHBondContact O-CB 3.1Å; V157-L160 PolarHBondContact O-N 3.49Å; V157-A161 PolarHBondContact O-N 3.49Å; V157-A161 VanDerWaalsContact O-N 3.16Å; V157-Y313 HydrophobicContact CB-CE1 3.9Å; V157-Y313 HydrophobicContact CG1-CE1 3.67Å; V157-Y317 HydrophobicContact CB-CD2 4.42Å; V157-Y317 HydrophobicContact CB-CE2 4.49Å; V157-Y317 HydrophobicContact CG1-CD1 3.67Å; V157-Y317 HydrophobicContact CG1-CD2 3.09Å; V157-Y317 HydrophobicContact CG1-CE1 3.98Å; V157-Y317 HydrophobicContact CG1-CE2 3.42Å; V157-Y317 VanDerWaalsContact CG1-CE2 3.42Å; V157-Y317 HydrophobicContact CG1-CG 3.2Å; V157-Y317 WeakPolarHBondContact O-CE2 3.3Å
158	N	50.4	Low	46	Very low	48 Å²	48	63.5 Å²	63.5	26%	0.257	32%	0.318	S	S	.	.	H	α-helix	trans	-59.4	-44.4	177.5	-83.6	-38.4	0	0	0	112.7	R154 Y155 L160 A161 D162 Y313 K320	R154-N158 WeakPolarHBondContact O-CB 3.3Å; R154-N158 PolarHBondContact O-N 2.92Å; R154-N158 PolarHBondContact O-ND2 3.41Å; Y155-N158 PolarHBondContact O-N 3.19Å; N158-L160 PolarHBondContact O-N 3.27Å; N158-A161 WeakPolarHBondContact O-CA 3.5Å; N158-A161 WeakPolarHBondContact O-CB 3.42Å; N158-A161 PolarHBondContact O-N 3.39Å; N158-D162 PolarHBondContact O-N 3.41Å; N158-Y313 PolarHBondContact N-OH 3.41Å; N158-Y313 PolarHBondContact ND2-OH 3.43Å; N158-Y313 PolarHBondContact OD1-OH 3.43Å; N158-Y313 VanDerWaalsContact OD1-OH 3.1Å; N158-K320 PolarHBondContact OD1-NZ 3.48Å
159	Y	48.1	Very low	46.4	Very low	94 Å²	94	62.5 Å²	62.5	37%	0.369	31%	0.307	S	S	.	.	H	α-helix	trans	-62.7	-34.3	-179.6	-168.2	-89.1	0	0	0	112.1	L127 Y155 V157 S163	L127-Y159 HydrophobicContact CD2-CE1 3.67Å; Y155-Y159 WeakPolarHBondContact O-CB 3.33Å; Y155-Y159 PolarHBondContact O-N 3.46Å; V157-Y159 PolarHBondContact O-N 3.33Å; Y159-S163 WeakPolarHBondContact CE1-OG 3.33Å; Y159-S163 VanDerWaalsContact O-CB 3.22Å; Y159-S163 WeakPolarHBondContact O-CB 2.94Å; Y159-S163 PolarHBondContact O-N 3.01Å; Y159-S163 PolarHBondContact O-OG 3.41Å
160	L	48.4	Very low	46.5	Very low	31 Å²	31	62.3 Å²	62.3	16%	0.162	31%	0.309	C	S	.	.	H	α-helix	trans	-62.2	-46.1	170.5	-177.3	63.4	0	0	0	111.2	F128 S156 V157 N158 S163 L164 F228 Y317	F128-L160 HydrophobicContact CZ-CD1 4.28Å; S156-L160 PolarHBondContact O-N 2.97Å; S156-L160 VanDerWaalsContact O-N 3.15Å; V157-L160 WeakPolarHBondContact O-CB 3.1Å; V157-L160 PolarHBondContact O-N 3.49Å; N158-L160 PolarHBondContact O-N 3.27Å; L160-S163 PolarHBondContact O-N 2.92Å; L160-L164 VanDerWaalsContact O-CG 3.29Å; L160-L164 WeakPolarHBondContact O-CG 3.48Å; L160-L164 PolarHBondContact O-N 3.01Å; L160-F228 HydrophobicContact CD2-CE1 3.83Å; L160-F228 HydrophobicContact CD2-CZ 4.22Å; L160-Y317 WeakPolarHBondContact CD2-OH 3.41Å; L160-Y317 WeakPolarHBondContact CG-OH 3.29Å
161	A	48.8	Very low	46.8	Very low	5 Å²	5	63 Å²	63	4%	0.041	31%	0.311	C	S	.	.	H	α-helix	trans	-62.5	-43.3	176.5	0	0	0	0	0	112.9	V157 N158 S163 L164 K165 Y317 K320	V157-A161 PolarHBondContact O-N 3.49Å; V157-A161 VanDerWaalsContact O-N 3.16Å; N158-A161 WeakPolarHBondContact O-CA 3.5Å; N158-A161 WeakPolarHBondContact O-CB 3.42Å; N158-A161 PolarHBondContact O-N 3.39Å; A161-S163 VanDerWaalsContact C-N 3.33Å; A161-L164 WeakPolarHBondContact O-CB 3.45Å; A161-L164 PolarHBondContact O-N 3.34Å; A161-K165 PolarHBondContact O-N 2.99Å; A161-Y317 HydrophobicContact CB-CD2 3.91Å; A161-Y317 HydrophobicContact CB-CE2 3.32Å; A161-K320 HydrophobicContact CB-CD 4.44Å
162	D	51.2	Low	47.2	Very low	81 Å²	81	58.5 Å²	58.5	43%	0.433	29%	0.288	S	S	.	.	H	α-helix	trans	-71.5	-33.3	-178.3	-66.6	-28.7	0	0	0	111.1	N158 L164 K165	N158-D162 PolarHBondContact O-N 3.41Å; D162-L164 PolarHBondContact O-N 2.99Å; D162-K165 PolarHBondContact O-N 3.34Å; D162-K165 VanDerWaalsContact O-N 3.14Å; D162-K165 IonicContact OD1-NZ 3.8Å
163	S	47	Very low	48	Very low	23 Å²	23	54.3 Å²	54.3	16%	0.161	27%	0.268	C	S	.	.	H	α-helix	trans	-63.8	-28.3	173.4	-68.1	0	0	0	0	113.7	Y159 L160 A161 K169	Y159-S163 WeakPolarHBondContact CE1-OG 3.33Å; Y159-S163 VanDerWaalsContact O-CB 3.22Å; Y159-S163 WeakPolarHBondContact O-CB 2.94Å; Y159-S163 PolarHBondContact O-N 3.01Å; Y159-S163 PolarHBondContact O-OG 3.41Å; L160-S163 PolarHBondContact O-N 2.92Å; A161-S163 VanDerWaalsContact C-N 3.33Å; S163-K169 PolarHBondContact O-NZ 2.91Å
164	L	48.4	Very low	49.2	Very low	9 Å²	9	56.8 Å²	56.8	5%	0.047	28%	0.28	C	S	.	.	H	α-helix	trans	-74.9	-26.1	175.3	-67.8	168.6	0	0	0	112.9	L160 A161 D162 D166 F172 V227 F228 W324	L160-L164 VanDerWaalsContact O-CG 3.29Å; L160-L164 WeakPolarHBondContact O-CG 3.48Å; L160-L164 PolarHBondContact O-N 3.01Å; A161-L164 WeakPolarHBondContact O-CB 3.45Å; A161-L164 PolarHBondContact O-N 3.34Å; D162-L164 PolarHBondContact O-N 2.99Å; L164-D166 VanDerWaalsContact C-N 3.34Å; L164-F172 HydrophobicContact CD2-CE1 3.85Å; L164-F172 HydrophobicContact CD2-CZ 3.76Å; L164-V227 HydrophobicContact CD2-CG1 3.52Å; L164-F228 HydrophobicContact CD1-CE2 3.58Å; L164-F228 HydrophobicContact CD1-CZ 3.73Å; L164-W324 HydrophobicContact CB-CD2 4.23Å; L164-W324 HydrophobicContact CB-CZ2 4.24Å; L164-W324 HydrophobicContact CD2-CH2 4.08Å; L164-W324 HydrophobicContact CD2-CZ2 4.09Å; L164-W324 PolarHBondContact O-NE1 3.39Å
165	K	48.5	Very low	50.3	Low	118 Å²	118	55.5 Å²	55.5	51%	0.513	28%	0.281	S	S	.	.	H	α-helix	trans	-78.1	-17	-177.6	-72.7	178.6	178.8	173.3	0	114.4	A161 D162 S167	A161-K165 PolarHBondContact O-N 2.99Å; D162-K165 PolarHBondContact O-N 3.34Å; D162-K165 VanDerWaalsContact O-N 3.14Å; D162-K165 IonicContact OD1-NZ 3.8Å; K165-S167 PolarHBondContact O-N 3.36Å
166	D	48	Very low	51.7	Low	68 Å²	68	54.5 Å²	54.5	36%	0.364	28%	0.279	S	S	.	.			trans	-78.8	93.3	-174.2	-173.7	1.2	0	0	0	110.5	L164 E168 K169	L164-D166 VanDerWaalsContact C-N 3.34Å; D166-E168 PolarHBondContact O-N 3.11Å; D166-E168 PolarHBondContact OD1-N 2.75Å; D166-K169 HydrophobicContact CB-CD 3.85Å; D166-K169 HydrophobicContact CB-CG 4.44Å; D166-K169 WeakPolarHBondContact O-CG 3.38Å; D166-K169 PolarHBondContact O-N 2.98Å; D166-K169 WeakPolarHBondContact OD2-CE 3.25Å; D166-K169 IonicContact OD2-NZ 3.59Å; D166-K169 PolarHBondContact OD2-NZ 2.97Å
167	S	40.6	Very low	52.7	Low	73 Å²	73	59.4 Å²	59.4	51%	0.51	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-4.4	-175.2	52.3	0	0	0	0	114.5	K165 K169	K165-S167 PolarHBondContact O-N 3.36Å; S167-K169 VanDerWaalsContact C-N 3.26Å; S167-K169 PolarHBondContact O-N 3.33Å
168	E	39.3	Very low	53.4	Low	166 Å²	166	58.9 Å²	58.9	78%	0.776	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-3.3	177.4	-60	-170.8	171.3	0	0	112.9	D166	D166-E168 PolarHBondContact O-N 3.11Å; D166-E168 PolarHBondContact OD1-N 2.75Å
169	K	47.2	Very low	53.9	Low	31 Å²	31	59.9 Å²	59.9	14%	0.135	30%	0.299	C	S	.	.	S	Bend	trans	-90.1	125.4	-177.6	-63.6	169.3	167.1	166.3	0	110.8	Y124 S163 D166 S167 L171 F172 A173	Y124-K169 HydrophobicContact CE1-CD 4.22Å; Y124-K169 WeakPolarHBondContact OH-CD 3.44Å; Y124-K169 WeakPolarHBondContact OH-CE 3.25Å; Y124-K169 WeakPolarHBondContact OH-CG 3.47Å; S163-K169 PolarHBondContact O-NZ 2.91Å; D166-K169 HydrophobicContact CB-CD 3.85Å; D166-K169 HydrophobicContact CB-CG 4.44Å; D166-K169 WeakPolarHBondContact O-CG 3.38Å; D166-K169 PolarHBondContact O-N 2.98Å; D166-K169 WeakPolarHBondContact OD2-CE 3.25Å; D166-K169 IonicContact OD2-NZ 3.59Å; D166-K169 PolarHBondContact OD2-NZ 2.97Å; S167-K169 VanDerWaalsContact C-N 3.26Å; S167-K169 PolarHBondContact O-N 3.33Å; K169-L171 VanDerWaalsContact C-N 3.25Å; K169-L171 PolarHBondContact O-N 3.15Å; K169-F172 HydrophobicContact CB-CD2 4.27Å; K169-F172 CarbonylContact O-C 3.58Å; K169-F172 VanDerWaalsContact O-C 3.26Å; K169-F172 WeakPolarHBondContact O-CA 3.46Å; K169-F172 PolarHBondContact O-N 2.83Å; K169-A173 WeakPolarHBondContact O-CA 3.37Å; K169-A173 WeakPolarHBondContact O-CB 3.45Å; K169-A173 PolarHBondContact O-N 3.03Å
170	P	43.3	Very low	54.8	Low	25 Å²	25	55.5 Å²	55.5	16%	0.162	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-32.4	-171.1	-24.5	32.8	0	0	0	115.2	R120 F172 A173 S178	R120-P170 VanDerWaalsContact NE-CG 3.29Å; R120-P170 VanDerWaalsContact NH1-CD 3.25Å; P170-F172 VanDerWaalsContact C-N 3.32Å; P170-A173 PolarHBondContact O-N 3.25Å; P170-S178 WeakPolarHBondContact O-CA 3.31Å; P170-S178 WeakPolarHBondContact O-CB 3.34Å
171	L	47.9	Very low	56	Low	27 Å²	27	55.9 Å²	55.9	14%	0.141	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-41.4	177.7	-176.2	68.3	0	0	0	111	K169 T179 I180 I231	K169-L171 VanDerWaalsContact C-N 3.25Å; K169-L171 PolarHBondContact O-N 3.15Å; L171-T179 HydrophobicContact CD1-CG2 4.44Å; L171-I180 WeakPolarHBondContact O-CD1 3.33Å; L171-I180 VanDerWaalsContact O-CG1 3.26Å; L171-I180 WeakPolarHBondContact O-CG1 3.36Å; L171-I231 HydrophobicContact CD2-CD1 3.57Å
172	F	53.3	Low	57	Low	16 Å²	16	57.6 Å²	57.6	7%	0.07	30%	0.296	C	S	.	.	S	Bend	trans	-103.8	13.7	-179.9	-53.5	-72.7	0	0	0	111.9	L164 K169 P170 I174 I180 V227 W324 Y328	L164-F172 HydrophobicContact CD2-CE1 3.85Å; L164-F172 HydrophobicContact CD2-CZ 3.76Å; K169-F172 HydrophobicContact CB-CD2 4.27Å; K169-F172 CarbonylContact O-C 3.58Å; K169-F172 VanDerWaalsContact O-C 3.26Å; K169-F172 WeakPolarHBondContact O-CA 3.46Å; K169-F172 PolarHBondContact O-N 2.83Å; P170-F172 VanDerWaalsContact C-N 3.32Å; F172-I174 PolarHBondContact O-N 3.27Å; F172-I180 HydrophobicContact CD1-CD1 3.96Å; F172-I180 HydrophobicContact CE1-CD1 4.43Å; F172-V227 HydrophobicContact CD1-CG2 4.45Å; F172-V227 HydrophobicContact CE1-CB 4.32Å; F172-V227 HydrophobicContact CE1-CG1 3.82Å; F172-V227 HydrophobicContact CE1-CG2 3.48Å; F172-V227 VanDerWaalsContact CE1-CG2 3.48Å; F172-V227 HydrophobicContact CZ-CG1 3.91Å; F172-V227 HydrophobicContact CZ-CG2 4.15Å; F172-W324 HydrophobicContact CD1-CH2 4.32Å; F172-W324 AromaticContact CD1-CZ2 3.8Å; F172-W324 HydrophobicContact CD1-CZ2 3.8Å; F172-W324 HydrophobicContact CE1-CH2 4.17Å; F172-W324 HydrophobicContact CE1-CZ2 4.01Å; F172-Y328 VanDerWaalsContact C-OH 3.29Å; F172-Y328 WeakPolarHBondContact CA-OH 3.49Å; F172-Y328 HydrophobicContact CB-CE2 4.41Å; F172-Y328 WeakPolarHBondContact O-CE2 3.49Å; F172-Y328 PolarHBondContact O-OH 2.86Å
173	A	59.8	Low	57.9	Low	5 Å²	5	55 Å²	55	4%	0.041	28%	0.281	C	S	.	.			trans	-71.4	134.2	-178.2	0	0	0	0	0	108	K169 P170 N175 S178 Y328	K169-A173 WeakPolarHBondContact O-CA 3.37Å; K169-A173 WeakPolarHBondContact O-CB 3.45Å; K169-A173 PolarHBondContact O-N 3.03Å; P170-A173 PolarHBondContact O-N 3.25Å; A173-N175 VanDerWaalsContact CB-ND2 3.3Å; A173-N175 WeakPolarHBondContact CB-ND2 3.41Å; A173-N175 PolarHBondContact O-N 3.12Å; A173-S178 WeakPolarHBondContact O-CB 3.38Å; A173-S178 PolarHBondContact O-OG 2.93Å; A173-Y328 PolarHBondContact O-OH 3.37Å
174	I	69.5	Low	59.4	Low	69 Å²	69	54.6 Å²	54.6	35%	0.354	28%	0.277	S	S	.	.	S	Bend	trans	-84.9	70.7	174.4	-55.2	168.6	0	0	0	106.5	F172 Y328 A331 L335	F172-I174 PolarHBondContact O-N 3.27Å; I174-Y328 HydrophobicContact CD1-CD2 4.02Å; I174-Y328 HydrophobicContact CD1-CE2 4.22Å; I174-Y328 HydrophobicContact CG1-CD2 3.78Å; I174-Y328 HydrophobicContact CG1-CE2 3.47Å; I174-Y328 VanDerWaalsContact CG1-CE2 3.47Å; I174-A331 HydrophobicContact CD1-CB 3.76Å; I174-A331 HydrophobicContact CG1-CB 4.38Å; I174-A331 HydrophobicContact CG2-CB 3.76Å; I174-L335 HydrophobicContact CG2-CD1 3.92Å; I174-L335 HydrophobicContact CG2-CD2 4.18Å; I174-L335 HydrophobicContact CG2-CG 4.11Å
175	N	75.2	Confident	60.7	Low	66 Å²	66	59.1 Å²	59.1	35%	0.353	30%	0.297	S	S	.	.	S	Bend	trans	-151.5	166.1	174.8	67.2	47.8	0	0	0	111.4	A173 K177 S178 Y181	A173-N175 VanDerWaalsContact CB-ND2 3.3Å; A173-N175 WeakPolarHBondContact CB-ND2 3.41Å; A173-N175 PolarHBondContact O-N 3.12Å; N175-K177 PolarHBondContact O-N 3.22Å; N175-K177 VanDerWaalsContact O-N 3.11Å; N175-K177 WeakPolarHBondContact OD1-CA 3.14Å; N175-K177 WeakPolarHBondContact OD1-CB 3.08Å; N175-K177 PolarHBondContact OD1-N 2.89Å; N175-S178 PolarHBondContact O-N 3.47Å; N175-S178 VanDerWaalsContact O-N 3.15Å; N175-S178 PolarHBondContact O-OG 2.85Å; N175-S178 PolarHBondContact OD1-N 3.1Å; N175-S178 VanDerWaalsContact OD1-N 3.11Å; N175-Y181 WeakPolarHBondContact O-CB 3.31Å
176	K	78.1	Confident	61.8	Low	128 Å²	128	60.7 Å²	60.7	56%	0.557	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-10.4	-176.7	-61.3	-170.8	174.9	-179.8	0	114.7	Y181 L335	K176-Y181 VanDerWaalsContact CA-CD1 3.47Å; K176-Y181 HydrophobicContact CB-CD1 4.05Å; K176-Y181 HydrophobicContact CB-CE1 3.79Å; K176-Y181 HydrophobicContact CD-CE1 4.4Å; K176-Y181 HydrophobicContact CG-CD1 4.37Å; K176-Y181 HydrophobicContact CG-CE1 3.78Å; K176-Y181 HydrophobicContact CG-CE2 4.35Å; K176-Y181 WeakPolarHBondContact O-CD1 3.1Å; K176-L335 VanDerWaalsContact CE-C 3.43Å; K176-L335 WeakPolarHBondContact CE-O 3.42Å; K176-L335 HydrophobicContact CG-CB 4.49Å; K176-L335 PolarHBondContact NZ-O 3.43Å
177	K	65.1	Low	62.9	Low	152 Å²	152	61.6 Å²	61.6	66%	0.661	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-7.6	178.5	-59.5	-174.6	179.2	-178.4	0	112.4	D113 N175	D113-K177 IonicContact OD1-NZ 3.99Å; D113-K177 IonicContact OD2-NZ 2.62Å; D113-K177 PolarHBondContact OD2-NZ 2.6Å; N175-K177 PolarHBondContact O-N 3.22Å; N175-K177 VanDerWaalsContact O-N 3.11Å; N175-K177 WeakPolarHBondContact OD1-CA 3.14Å; N175-K177 WeakPolarHBondContact OD1-CB 3.08Å; N175-K177 PolarHBondContact OD1-N 2.89Å
178	S	63.1	Low	64.4	Low	2 Å²	2	61.4 Å²	61.4	1%	0.014	30%	0.299	C	S	.	.	S	Bend	trans	-73.3	146.6	-178.5	77.5	0	0	0	0	112	P170 A173 N175 I180 Y181 A182	P170-S178 WeakPolarHBondContact O-CA 3.31Å; P170-S178 WeakPolarHBondContact O-CB 3.34Å; A173-S178 WeakPolarHBondContact O-CB 3.38Å; A173-S178 PolarHBondContact O-OG 2.93Å; N175-S178 PolarHBondContact O-N 3.47Å; N175-S178 VanDerWaalsContact O-N 3.15Å; N175-S178 PolarHBondContact O-OG 2.85Å; N175-S178 PolarHBondContact OD1-N 3.1Å; N175-S178 VanDerWaalsContact OD1-N 3.11Å; S178-I180 PolarHBondContact O-N 3.46Å; S178-Y181 PolarHBondContact O-N 3.3Å; S178-Y181 VanDerWaalsContact O-N 3.17Å; S178-Y181 VanDerWaalsContact OG-CB 3.32Å; S178-Y181 WeakPolarHBondContact OG-CB 3.24Å; S178-Y181 PolarHBondContact OG-N 3.07Å; S178-Y181 VanDerWaalsContact OG-N 3.08Å; S178-A182 PolarHBondContact O-N 3.28Å; S178-A182 VanDerWaalsContact O-N 3.08Å
179	T	61.9	Low	65.9	Low	69 Å²	69	58 Å²	58	42%	0.423	29%	0.285	S	S	.	.	H	α-helix	trans	-59.5	-38	175.9	-52.3	0	0	0	0	111	L171 A182 M183	L171-T179 HydrophobicContact CD1-CG2 4.44Å; T179-A182 PolarHBondContact O-N 3.11Å; T179-M183 HydrophobicContact CG2-SD 4.15Å; T179-M183 VanDerWaalsContact O-CG 3.29Å; T179-M183 WeakPolarHBondContact O-CG 3.28Å; T179-M183 PolarHBondContact O-N 2.67Å
180	I	66.3	Low	66.8	Low	2 Å²	2	56.8 Å²	56.8	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-63.9	-44.8	177.3	-64.5	177.1	0	0	0	110.3	L171 F172 S178 A182 M183 L184 I223 L226 V227 Y328 I332	L171-I180 WeakPolarHBondContact O-CD1 3.33Å; L171-I180 VanDerWaalsContact O-CG1 3.26Å; L171-I180 WeakPolarHBondContact O-CG1 3.36Å; F172-I180 HydrophobicContact CD1-CD1 3.96Å; F172-I180 HydrophobicContact CE1-CD1 4.43Å; S178-I180 PolarHBondContact O-N 3.46Å; I180-A182 VanDerWaalsContact C-N 3.31Å; I180-A182 PolarHBondContact O-N 3.44Å; I180-M183 PolarHBondContact O-N 2.87Å; I180-M183 VanDerWaalsContact O-N 3.16Å; I180-L184 HydrophobicContact CG2-CD1 3.71Å; I180-L184 HydrophobicContact CG2-CG 4.17Å; I180-L184 VanDerWaalsContact O-CG 3.29Å; I180-L184 WeakPolarHBondContact O-CG 3.48Å; I180-L184 PolarHBondContact O-N 2.94Å; I180-I223 HydrophobicContact CD1-CG2 4.32Å; I180-I223 HydrophobicContact CG2-CD1 4.2Å; I180-I223 HydrophobicContact CG2-CG1 3.62Å; I180-L226 HydrophobicContact CG1-CD2 3.84Å; I180-V227 HydrophobicContact CD1-CG2 4.49Å; I180-Y328 HydrophobicContact CD1-CE1 3.68Å; I180-Y328 WeakPolarHBondContact CD1-OH 3.47Å; I180-Y328 HydrophobicContact CG2-CE1 4.05Å; I180-I332 HydrophobicContact CB-CD1 3.81Å; I180-I332 HydrophobicContact CG2-CD1 3.48Å; I180-I332 VanDerWaalsContact CG2-CD1 3.48Å
181	Y	72.5	Confident	67.6	Low	39 Å²	39	59.6 Å²	59.6	15%	0.153	30%	0.298	C	S	.	.	H	α-helix	trans	-60.3	-44.2	178.7	-179.2	-97.5	0	0	0	111.2	N175 K176 S178 M183 L184 K185 I332 L335	N175-Y181 WeakPolarHBondContact O-CB 3.31Å; K176-Y181 VanDerWaalsContact CA-CD1 3.47Å; K176-Y181 HydrophobicContact CB-CD1 4.05Å; K176-Y181 HydrophobicContact CB-CE1 3.79Å; K176-Y181 HydrophobicContact CD-CE1 4.4Å; K176-Y181 HydrophobicContact CG-CD1 4.37Å; K176-Y181 HydrophobicContact CG-CE1 3.78Å; K176-Y181 HydrophobicContact CG-CE2 4.35Å; K176-Y181 WeakPolarHBondContact O-CD1 3.1Å; S178-Y181 PolarHBondContact O-N 3.3Å; S178-Y181 VanDerWaalsContact O-N 3.17Å; S178-Y181 VanDerWaalsContact OG-CB 3.32Å; S178-Y181 WeakPolarHBondContact OG-CB 3.24Å; S178-Y181 PolarHBondContact OG-N 3.07Å; S178-Y181 VanDerWaalsContact OG-N 3.08Å; Y181-M183 VanDerWaalsContact C-N 3.29Å; Y181-M183 PolarHBondContact O-N 3.39Å; Y181-L184 CarbonylContact O-C 3.54Å; Y181-L184 PolarHBondContact O-N 3.42Å; Y181-L184 VanDerWaalsContact O-N 3.12Å; Y181-K185 HydrophobicContact CE1-CG 4.48Å; Y181-K185 PolarHBondContact O-N 3.26Å; Y181-I332 HydrophobicContact CD2-CG1 4.08Å; Y181-L335 HydrophobicContact CD2-CB 4.09Å; Y181-L335 HydrophobicContact CD2-CD1 3.85Å; Y181-L335 HydrophobicContact CE2-CB 3.64Å; Y181-L335 HydrophobicContact CE2-CD1 4.25Å; Y181-L335 WeakPolarHBondContact CE2-OXT 3.41Å; Y181-L335 PolarHBondContact OH-OXT 3.35Å; Y181-L335 VanDerWaalsContact OH-OXT 3.04Å
182	A	70.2	Confident	68.2	Low	40 Å²	40	66 Å²	66	33%	0.331	33%	0.325	S	S	.	.	H	α-helix	trans	-59.6	-39	176.9	0	0	0	0	0	112.6	S178 T179 I180 L184 K185 Q188	S178-A182 PolarHBondContact O-N 3.28Å; S178-A182 VanDerWaalsContact O-N 3.08Å; T179-A182 PolarHBondContact O-N 3.11Å; I180-A182 VanDerWaalsContact C-N 3.31Å; I180-A182 PolarHBondContact O-N 3.44Å; A182-L184 VanDerWaalsContact C-N 3.32Å; A182-K185 WeakPolarHBondContact O-CB 3.35Å; A182-K185 PolarHBondContact O-N 2.64Å; A182-Q188 PolarHBondContact O-OE1 2.87Å
183	M	71.6	Confident	68.6	Low	26 Å²	26	71.1 Å²	71.1	13%	0.128	35%	0.353	C	S	.	.	H	α-helix	trans	-69.8	-30	176.4	-71.9	173.7	59.4	0	0	113.3	T179 I180 Y181 K185 Y190 Y194 L226	T179-M183 HydrophobicContact CG2-SD 4.15Å; T179-M183 VanDerWaalsContact O-CG 3.29Å; T179-M183 WeakPolarHBondContact O-CG 3.28Å; T179-M183 PolarHBondContact O-N 2.67Å; I180-M183 PolarHBondContact O-N 2.87Å; I180-M183 VanDerWaalsContact O-N 3.16Å; Y181-M183 VanDerWaalsContact C-N 3.29Å; Y181-M183 PolarHBondContact O-N 3.39Å; M183-K185 VanDerWaalsContact C-N 3.27Å; M183-K185 PolarHBondContact O-N 3.45Å; M183-Y190 HydrophobicContact CE-CE1 4.01Å; M183-Y190 PolarHBondContact O-OH 3.07Å; M183-Y194 HydrophobicContact CE-CE1 4.35Å; M183-Y194 WeakPolarHBondContact CE-OH 3.39Å; M183-L226 HydrophobicContact CE-CB 4.25Å; M183-L226 HydrophobicContact CE-CD1 4Å; M183-L226 HydrophobicContact CE-CD2 3.98Å; M183-L226 HydrophobicContact CE-CG 4.29Å; M183-L226 HydrophobicContact SD-CD1 4.05Å; M183-L226 HydrophobicContact SD-CD2 3.59Å; M183-L226 VanDerWaalsContact SD-CD2 3.59Å; M183-L226 HydrophobicContact SD-CG 4.35Å
184	L	77.6	Confident	68.9	Low	15 Å²	15	73.2 Å²	73.2	8%	0.079	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	12.2	177.9	-61.8	177.2	0	0	0	112.9	I180 Y181 A182 I214 A219 L222 I223 I332	I180-L184 HydrophobicContact CG2-CD1 3.71Å; I180-L184 HydrophobicContact CG2-CG 4.17Å; I180-L184 VanDerWaalsContact O-CG 3.29Å; I180-L184 WeakPolarHBondContact O-CG 3.48Å; I180-L184 PolarHBondContact O-N 2.94Å; Y181-L184 CarbonylContact O-C 3.54Å; Y181-L184 PolarHBondContact O-N 3.42Å; Y181-L184 VanDerWaalsContact O-N 3.12Å; A182-L184 VanDerWaalsContact C-N 3.32Å; L184-I214 HydrophobicContact CB-CG2 4.35Å; L184-I214 HydrophobicContact CD2-CG2 4.14Å; L184-I214 WeakPolarHBondContact O-CD1 3.34Å; L184-A219 HydrophobicContact CD1-CB 4.18Å; L184-A219 HydrophobicContact CD2-CB 4.08Å; L184-L222 HydrophobicContact CD2-CB 3.93Å; L184-L222 HydrophobicContact CD2-CD1 3.56Å; L184-L222 HydrophobicContact CD2-CG 4.39Å; L184-I223 HydrophobicContact CD1-CD1 3.95Å; L184-I223 HydrophobicContact CD1-CG1 4.11Å; L184-I332 HydrophobicContact CD1-CD1 4.39Å; L184-I332 HydrophobicContact CD1-CG1 4.27Å; L184-I332 HydrophobicContact CD1-CG2 3.57Å
185	K	76.1	Confident	68.9	Low	104 Å²	104	70.4 Å²	70.4	45%	0.452	35%	0.345	S	S	.	.	S	Bend	trans	-71.8	139.9	172.5	-75.5	-176	177.7	-179.4	0	110.5	Y181 A182 M183 Q188 I214	Y181-K185 HydrophobicContact CE1-CG 4.48Å; Y181-K185 PolarHBondContact O-N 3.26Å; A182-K185 WeakPolarHBondContact O-CB 3.35Å; A182-K185 PolarHBondContact O-N 2.64Å; M183-K185 VanDerWaalsContact C-N 3.27Å; M183-K185 PolarHBondContact O-N 3.45Å; K185-Q188 WeakPolarHBondContact O-CB 3.2Å; K185-Q188 PolarHBondContact O-N 3.43Å; K185-I214 VanDerWaalsContact C-CD1 3.46Å; K185-I214 VanDerWaalsContact O-CD1 3.22Å; K185-I214 WeakPolarHBondContact O-CD1 3.06Å
186	K	71.2	Confident	68.8	Low	152 Å²	152	67.9 Å²	67.9	66%	0.661	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	143.6	166.2	-167.1	-173.5	170	-175.6	0	108.8	Q188	K186-Q188 PolarHBondContact O-N 3.23Å
187	D	72.2	Confident	68.8	Low	87 Å²	87	65.8 Å²	65.8	47%	0.465	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	13.4	178.7	-48.3	-45.1	0	0	0	114.7	I189 M210	D187-I189 PolarHBondContact O-N 2.92Å; D187-M210 VanDerWaalsContact CA-CG 3.47Å; D187-M210 VanDerWaalsContact CA-SD 3.55Å; D187-M210 HydrophobicContact CB-CG 4.24Å; D187-M210 HydrophobicContact CB-SD 3.61Å
188	Q	71.8	Confident	69.5	Low	69 Å²	69	59.5 Å²	59.5	32%	0.322	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-65.6	125.6	173.1	-179.2	61	39.1	0	0	111.2	A182 K185 K186 Y190 M210 L211	A182-Q188 PolarHBondContact O-OE1 2.87Å; K185-Q188 WeakPolarHBondContact O-CB 3.2Å; K185-Q188 PolarHBondContact O-N 3.43Å; K186-Q188 PolarHBondContact O-N 3.23Å; Q188-Y190 HydrophobicContact CB-CE2 4.17Å; Q188-Y190 HydrophobicContact CG-CD2 4.24Å; Q188-Y190 HydrophobicContact CG-CE2 3.71Å; Q188-M210 WeakPolarHBondContact O-CA 3.38Å; Q188-L211 PolarHBondContact O-N 3.27Å
189	I	69.2	Low	70.3	Confident	93 Å²	93	59.4 Å²	59.4	48%	0.477	30%	0.303	S	S	.	.	B	Isolated β-bridge	trans	-93.2	128.6	175.9	-59.6	169.7	0	0	0	109.4	D187	D187-I189 PolarHBondContact O-N 2.92Å
190	Y	67.5	Low	71.2	Confident	7 Å²	7	60.8 Å²	60.8	3%	0.027	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-98.5	145.5	178.7	-75.8	-94.8	0	0	0	112.8	M183 Q188 Y194 F195 R209 L211	M183-Y190 HydrophobicContact CE-CE1 4.01Å; M183-Y190 PolarHBondContact O-OH 3.07Å; Q188-Y190 HydrophobicContact CB-CE2 4.17Å; Q188-Y190 HydrophobicContact CG-CD2 4.24Å; Q188-Y190 HydrophobicContact CG-CE2 3.71Å; Y190-Y194 AromaticContact CD1-CD1 3.25Å; Y190-Y194 HydrophobicContact CD1-CD1 3.25Å; Y190-Y194 HydrophobicContact CD1-CD2 4.35Å; Y190-Y194 AromaticContact CD1-CE1 3.39Å; Y190-Y194 HydrophobicContact CD1-CE1 3.39Å; Y190-Y194 HydrophobicContact CD1-CE2 4.47Å; Y190-Y194 AromaticContact CD1-CG 3.77Å; Y190-Y194 HydrophobicContact CD1-CG 3.77Å; Y190-Y194 AromaticContact CE1-CD1 3.83Å; Y190-Y194 HydrophobicContact CE1-CD1 3.83Å; Y190-Y194 AromaticContact CE1-CE1 3.44Å; Y190-Y194 HydrophobicContact CE1-CE1 3.44Å; Y190-Y194 VanDerWaalsContact CE1-CE1 3.44Å; Y190-Y194 HydrophobicContact CG-CD1 4.14Å; Y190-F195 HydrophobicContact CD1-CE1 4.35Å; Y190-F195 AromaticContact CD1-CE2 3.94Å; Y190-F195 HydrophobicContact CD1-CE2 3.94Å; Y190-F195 AromaticContact CD1-CZ 3.54Å; Y190-F195 HydrophobicContact CD1-CZ 3.54Å; Y190-F195 HydrophobicContact CD2-CE2 4.01Å; Y190-F195 AromaticContact CD2-CZ 3.86Å; Y190-F195 HydrophobicContact CD2-CZ 3.86Å; Y190-F195 HydrophobicContact CE1-CE1 4.34Å; Y190-F195 AromaticContact CE1-CZ 3.73Å; Y190-F195 HydrophobicContact CE1-CZ 3.73Å; Y190-F195 HydrophobicContact CE2-CZ 4.12Å; Y190-F195 AromaticContact CG-CE2 3.58Å; Y190-F195 HydrophobicContact CG-CE2 3.58Å; Y190-F195 AromaticContact CG-CZ 3.55Å; Y190-F195 HydrophobicContact CG-CZ 3.55Å; Y190-R209 PolarHBondContact N-O 3.08Å; Y190-R209 PolarHBondContact O-NH1 3.32Å; Y190-L211 HydrophobicContact CD2-CD1 4.35Å; Y190-L211 HydrophobicContact CD2-CG 4.28Å; Y190-L211 HydrophobicContact CE2-CD1 3.34Å; Y190-L211 HydrophobicContact CE2-CG 3.71Å
191	P	59.9	Low	72	Confident	84 Å²	84	65.2 Å²	65.2	55%	0.545	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-56.2	155.3	174.2	-24.6	33.6	0	0	0	113	N193 Y194	P191-N193 PolarHBondContact O-N 3.46Å; P191-Y194 HydrophobicContact CG-CD2 4.44Å; P191-Y194 VanDerWaalsContact O-CB 3.22Å; P191-Y194 WeakPolarHBondContact O-CB 3.33Å; P191-Y194 PolarHBondContact O-N 3.44Å; P191-Y194 VanDerWaalsContact O-N 3.16Å
192	K	59.3	Low	72.6	Confident	161 Å²	161	65.2 Å²	65.2	70%	0.7	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	137.6	174.3	-169.7	177.1	179.6	180	0	107.9	Y194	K192-Y194 PolarHBondContact O-N 2.97Å
193	N	63	Low	73.2	Confident	123 Å²	123	63.6 Å²	63.6	66%	0.658	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	17.7	-177.8	-53	-29.7	0	0	0	115.2	P191 F195	P191-N193 PolarHBondContact O-N 3.46Å; N193-F195 VanDerWaalsContact C-N 3.29Å; N193-F195 PolarHBondContact O-N 2.81Å
194	Y	65	Low	73.6	Confident	49 Å²	49	67 Å²	67	19%	0.192	34%	0.336	C	S	.	.			trans	-61.7	-39	175.8	-179.7	-95.5	0	0	0	112.5	M183 Y190 P191 K192 R230	M183-Y194 HydrophobicContact CE-CE1 4.35Å; M183-Y194 WeakPolarHBondContact CE-OH 3.39Å; Y190-Y194 AromaticContact CD1-CD1 3.25Å; Y190-Y194 HydrophobicContact CD1-CD1 3.25Å; Y190-Y194 HydrophobicContact CD1-CD2 4.35Å; Y190-Y194 AromaticContact CD1-CE1 3.39Å; Y190-Y194 HydrophobicContact CD1-CE1 3.39Å; Y190-Y194 HydrophobicContact CD1-CE2 4.47Å; Y190-Y194 AromaticContact CD1-CG 3.77Å; Y190-Y194 HydrophobicContact CD1-CG 3.77Å; Y190-Y194 AromaticContact CE1-CD1 3.83Å; Y190-Y194 HydrophobicContact CE1-CD1 3.83Å; Y190-Y194 AromaticContact CE1-CE1 3.44Å; Y190-Y194 HydrophobicContact CE1-CE1 3.44Å; Y190-Y194 VanDerWaalsContact CE1-CE1 3.44Å; Y190-Y194 HydrophobicContact CG-CD1 4.14Å; P191-Y194 HydrophobicContact CG-CD2 4.44Å; P191-Y194 VanDerWaalsContact O-CB 3.22Å; P191-Y194 WeakPolarHBondContact O-CB 3.33Å; P191-Y194 PolarHBondContact O-N 3.44Å; P191-Y194 VanDerWaalsContact O-N 3.16Å; K192-Y194 PolarHBondContact O-N 2.97Å; Y194-R230 VanDerWaalsContact CZ-CZ 3.43Å; Y194-R230 PolarHBondContact O-NE 3.45Å; Y194-R230 VanDerWaalsContact O-NE 3.08Å; Y194-R230 PolarHBondContact O-NH2 2.97Å; Y194-R230 WeakPolarHBondContact OH-CD 3.45Å; Y194-R230 PolarHBondContact OH-NE 3.26Å
195	F	71	Confident	73.7	Confident	10 Å²	10	69 Å²	69	4%	0.044	35%	0.346	C	S	.	.	S	Bend	trans	-92.9	138.1	-179.3	-60.9	-68	0	0	0	111.8	Y190 N193 E199 K200 I203 L205 L222	Y190-F195 HydrophobicContact CD1-CE1 4.35Å; Y190-F195 AromaticContact CD1-CE2 3.94Å; Y190-F195 HydrophobicContact CD1-CE2 3.94Å; Y190-F195 AromaticContact CD1-CZ 3.54Å; Y190-F195 HydrophobicContact CD1-CZ 3.54Å; Y190-F195 HydrophobicContact CD2-CE2 4.01Å; Y190-F195 AromaticContact CD2-CZ 3.86Å; Y190-F195 HydrophobicContact CD2-CZ 3.86Å; Y190-F195 HydrophobicContact CE1-CE1 4.34Å; Y190-F195 AromaticContact CE1-CZ 3.73Å; Y190-F195 HydrophobicContact CE1-CZ 3.73Å; Y190-F195 HydrophobicContact CE2-CZ 4.12Å; Y190-F195 AromaticContact CG-CE2 3.58Å; Y190-F195 HydrophobicContact CG-CE2 3.58Å; Y190-F195 AromaticContact CG-CZ 3.55Å; Y190-F195 HydrophobicContact CG-CZ 3.55Å; N193-F195 VanDerWaalsContact C-N 3.29Å; N193-F195 PolarHBondContact O-N 2.81Å; F195-E199 WeakPolarHBondContact CA-OE2 3.43Å; F195-E199 HydrophobicContact CB-CB 4.1Å; F195-E199 HydrophobicContact CD1-CB 4.04Å; F195-E199 HydrophobicContact CG-CB 4.47Å; F195-K200 HydrophobicContact CB-CG 3.66Å; F195-K200 WeakPolarHBondContact O-CE 3.27Å; F195-K200 PolarHBondContact O-NZ 2.82Å; F195-I203 HydrophobicContact CD1-CD1 3.78Å; F195-I203 HydrophobicContact CE1-CD1 3.62Å; F195-I203 HydrophobicContact CZ-CD1 4.23Å; F195-L205 HydrophobicContact CD2-CD1 3.56Å; F195-L205 HydrophobicContact CE2-CD1 3.64Å; F195-L205 HydrophobicContact CE2-CD2 3.91Å; F195-L205 HydrophobicContact CE2-CG 4.36Å; F195-L222 HydrophobicContact CE1-CD2 3.38Å; F195-L222 HydrophobicContact CZ-CD2 3.75Å
196	I	72.4	Confident	73.9	Confident	14 Å²	14	66.3 Å²	66.3	7%	0.072	34%	0.339	C	S	.	.			trans	-74.6	164.5	167	58.1	159.3	0	0	0	110.7	L198 E199 K200 L229 Y269 P289 E291	I196-L198 HydrophobicContact CD1-CB 3.81Å; I196-L198 HydrophobicContact CG1-CB 4.25Å; I196-L198 PolarHBondContact O-N 2.68Å; I196-L198 VanDerWaalsContact O-N 3.16Å; I196-E199 HydrophobicContact CG1-CB 4.31Å; I196-E199 HydrophobicContact CG1-CG 3.87Å; I196-E199 PolarHBondContact N-OE2 2.82Å; I196-E199 PolarHBondContact O-N 3.36Å; I196-K200 WeakPolarHBondContact O-CG 3.17Å; I196-K200 PolarHBondContact O-N 3.01Å; I196-L229 HydrophobicContact CB-CD2 4.22Å; I196-L229 HydrophobicContact CD1-CD2 3.43Å; I196-L229 VanDerWaalsContact CD1-CD2 3.43Å; I196-L229 HydrophobicContact CG1-CD2 3.55Å; I196-L229 HydrophobicContact CG2-CD2 3.67Å; I196-Y269 HydrophobicContact CD1-CE1 4.25Å; I196-P289 HydrophobicContact CD1-CB 3.94Å; I196-P289 HydrophobicContact CD1-CG 3.83Å; I196-E291 HydrophobicContact CG2-CB 4.49Å; I196-E291 HydrophobicContact CG2-CG 4.17Å
197	T	77	Confident	74.2	Confident	83 Å²	83	68.8 Å²	68.8	51%	0.509	35%	0.353	S	S	.	.	H	α-helix	trans	-50	-43.4	-179.6	-57.3	0	0	0	0	111.8	E199 K200 T201 E291	T197-E199 PolarHBondContact O-N 2.92Å; T197-K200 PolarHBondContact O-N 2.94Å; T197-T201 WeakPolarHBondContact O-CG2 3.39Å; T197-T201 PolarHBondContact O-N 3.45Å; T197-E291 WeakPolarHBondContact CB-OE1 3.3Å; T197-E291 PolarHBondContact N-OE1 3.17Å; T197-E291 PolarHBondContact OG1-OE1 3.26Å
198	L	81	Confident	74.5	Confident	20 Å²	20	68.7 Å²	68.7	11%	0.105	36%	0.355	C	S	.	.	H	α-helix	trans	-59.8	-48.8	178.8	-167.8	129.2	0	0	0	112.7	I196 T201 Q202 Y269 M273 I277 L286	I196-L198 HydrophobicContact CD1-CB 3.81Å; I196-L198 HydrophobicContact CG1-CB 4.25Å; I196-L198 PolarHBondContact O-N 2.68Å; I196-L198 VanDerWaalsContact O-N 3.16Å; L198-T201 PolarHBondContact O-N 3.22Å; L198-T201 PolarHBondContact O-OG1 3.49Å; L198-Q202 WeakPolarHBondContact O-CG 3.28Å; L198-Y269 HydrophobicContact CD2-CE1 4.48Å; L198-M273 HydrophobicContact CD2-CB 4.23Å; L198-M273 HydrophobicContact CD2-CE 3.29Å; L198-M273 HydrophobicContact CD2-CG 4.32Å; L198-I277 HydrophobicContact CD2-CD1 4.16Å; L198-L286 HydrophobicContact CD1-CB 4.09Å; L198-L286 HydrophobicContact CD1-CD1 3.86Å; L198-L286 HydrophobicContact CD1-CD2 3.95Å; L198-L286 HydrophobicContact CD1-CG 4.17Å; L198-L286 HydrophobicContact CD2-CD1 4.29Å
199	E	79.9	Confident	74.5	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-67.3	-39.4	179	-66.2	169.8	137.9	0	0	111.8	F195 I196 T197 T201 Q202 I203 G225 R230 M273	F195-E199 WeakPolarHBondContact CA-OE2 3.43Å; F195-E199 HydrophobicContact CB-CB 4.1Å; F195-E199 HydrophobicContact CD1-CB 4.04Å; F195-E199 HydrophobicContact CG-CB 4.47Å; I196-E199 HydrophobicContact CG1-CB 4.31Å; I196-E199 HydrophobicContact CG1-CG 3.87Å; I196-E199 PolarHBondContact N-OE2 2.82Å; I196-E199 PolarHBondContact O-N 3.36Å; T197-E199 PolarHBondContact O-N 2.92Å; E199-T201 PolarHBondContact O-N 3.49Å; E199-Q202 PolarHBondContact O-N 3.02Å; E199-I203 HydrophobicContact CB-CD1 4.09Å; E199-I203 WeakPolarHBondContact O-CG1 3.13Å; E199-I203 PolarHBondContact O-N 2.79Å; E199-G225 VanDerWaalsContact OE1-CA 3.27Å; E199-G225 WeakPolarHBondContact OE1-CA 3.49Å; E199-R230 VanDerWaalsContact CD-NH2 3.34Å; E199-R230 IonicContact OE1-CZ 3.11Å; E199-R230 IonicContact OE1-NH1 2.64Å; E199-R230 PolarHBondContact OE1-NH1 3.19Å; E199-R230 IonicContact OE1-NH2 3.23Å; E199-R230 PolarHBondContact OE1-NH2 2.94Å; E199-R230 IonicContact OE2-CZ 3.52Å; E199-R230 IonicContact OE2-NH1 2.95Å; E199-R230 IonicContact OE2-NH2 2.69Å; E199-R230 PolarHBondContact OE2-NH2 2.76Å; E199-M273 HydrophobicContact CG-CE 4.35Å
200	K	81.5	Confident	74.8	Confident	99 Å²	99	68.3 Å²	68.3	43%	0.43	35%	0.348	S	S	.	.	H	α-helix	trans	-57.8	-35.2	179	-74.3	174.9	175.4	160.6	0	112.8	F195 I196 T197 Q202	F195-K200 HydrophobicContact CB-CG 3.66Å; F195-K200 WeakPolarHBondContact O-CE 3.27Å; F195-K200 PolarHBondContact O-NZ 2.82Å; I196-K200 WeakPolarHBondContact O-CG 3.17Å; I196-K200 PolarHBondContact O-N 3.01Å; T197-K200 PolarHBondContact O-N 2.94Å; K200-Q202 PolarHBondContact O-N 3.41Å
201	T	82.9	Confident	75.1	Confident	95 Å²	95	68 Å²	68	58%	0.583	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-13.8	179.3	62.8	0	0	0	0	113.8	T197 L198 E199	T197-T201 WeakPolarHBondContact O-CG2 3.39Å; T197-T201 PolarHBondContact O-N 3.45Å; L198-T201 PolarHBondContact O-N 3.22Å; L198-T201 PolarHBondContact O-OG1 3.49Å; E199-T201 PolarHBondContact O-N 3.49Å
202	Q	85.3	Confident	75.8	Confident	38 Å²	38	66.5 Å²	66.5	18%	0.178	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	-18.1	-172.8	-54.2	-56.3	-54	0	0	113.2	L198 E199 K200 Y217 L221 I277	L198-Q202 WeakPolarHBondContact O-CG 3.28Å; E199-Q202 PolarHBondContact O-N 3.02Å; K200-Q202 PolarHBondContact O-N 3.41Å; Q202-Y217 HydrophobicContact CB-CE1 4.49Å; Q202-Y217 PolarHBondContact OE1-OH 3.43Å; Q202-L221 HydrophobicContact CB-CD1 3.63Å; Q202-I277 HydrophobicContact CG-CD1 3.63Å; Q202-I277 HydrophobicContact CG-CG1 3.87Å
203	I	82.8	Confident	76.7	Confident	7 Å²	7	62 Å²	62	4%	0.036	32%	0.324	C	S	.	.	S	Bend	trans	-103.6	123	-178.2	-61.1	172.8	0	0	0	109.4	F195 E199 L205 L211 L221 L222	F195-I203 HydrophobicContact CD1-CD1 3.78Å; F195-I203 HydrophobicContact CE1-CD1 3.62Å; F195-I203 HydrophobicContact CZ-CD1 4.23Å; E199-I203 HydrophobicContact CB-CD1 4.09Å; E199-I203 WeakPolarHBondContact O-CG1 3.13Å; E199-I203 PolarHBondContact O-N 2.79Å; I203-L205 HydrophobicContact CG2-CD2 3.95Å; I203-L205 HydrophobicContact CG2-CG 3.97Å; I203-L205 PolarHBondContact O-N 2.83Å; I203-L205 VanDerWaalsContact O-N 3.13Å; I203-L211 HydrophobicContact CG2-CD2 3.26Å; I203-L221 HydrophobicContact CG1-CD1 4.18Å; I203-L222 HydrophobicContact CD1-CD2 3.69Å; I203-L222 HydrophobicContact CD1-CG 4.3Å
204	N	80	Confident	77.7	Confident	96 Å²	96	57.8 Å²	57.8	51%	0.513	30%	0.301	S	S	.	.			trans	-76.4	98.5	173.5	-68.1	-26.2	0	0	0	110.1	S212	N204-S212 PolarHBondContact O-OG 3.34Å
205	L	77.8	Confident	78.8	Confident	57 Å²	57	58.4 Å²	58.4	30%	0.298	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	-99.8	138.1	172	-63.8	171	0	0	0	109.7	F195 I203 M210 L211	F195-L205 HydrophobicContact CD2-CD1 3.56Å; F195-L205 HydrophobicContact CE2-CD1 3.64Å; F195-L205 HydrophobicContact CE2-CD2 3.91Å; F195-L205 HydrophobicContact CE2-CG 4.36Å; I203-L205 HydrophobicContact CG2-CD2 3.95Å; I203-L205 HydrophobicContact CG2-CG 3.97Å; I203-L205 PolarHBondContact O-N 2.83Å; I203-L205 VanDerWaalsContact O-N 3.13Å; L205-M210 WeakPolarHBondContact CA-O 3.37Å; L205-L211 HydrophobicContact CD2-CD2 3.95Å; L205-L211 HydrophobicContact CD2-CG 4.21Å
206	T	80.7	Confident	79.7	Confident	48 Å²	48	60 Å²	60	29%	0.294	32%	0.319	S	S	.	.			trans	-65.9	169.5	166.6	66.5	0	0	0	0	110.8	T208 R209 M210	T206-T208 PolarHBondContact O-N 3.39Å; T206-T208 VanDerWaalsContact O-N 3.14Å; T206-T208 PolarHBondContact OG1-N 3.27Å; T206-T208 PolarHBondContact OG1-OG1 2.93Å; T206-R209 WeakPolarHBondContact O-CA 3.5Å; T206-R209 PolarHBondContact O-N 3.49Å; T206-R209 PolarHBondContact OG1-N 2.92Å; T206-M210 HydrophobicContact CG2-CB 4.21Å; T206-M210 HydrophobicContact CG2-CE 4.14Å; T206-M210 PolarHBondContact N-O 3.37Å; T206-M210 VanDerWaalsContact OG1-CB 3.26Å; T206-M210 WeakPolarHBondContact OG1-CB 3.21Å; T206-M210 PolarHBondContact OG1-N 2.86Å
207	E	79	Confident	80.6	Confident	205 Å²	205	59.8 Å²	59.8	96%	0.958	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-31.2	170.5	-63	-177.4	174.6	0	0	112.6	R209	E207-R209 VanDerWaalsContact C-N 3.26Å; E207-R209 PolarHBondContact O-N 3.43Å
208	T	78	Confident	81.1	Confident	84 Å²	84	55.9 Å²	55.9	52%	0.515	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	3	176.1	54.8	0	0	0	0	114.4	T206 M210	T206-T208 PolarHBondContact O-N 3.39Å; T206-T208 VanDerWaalsContact O-N 3.14Å; T206-T208 PolarHBondContact OG1-N 3.27Å; T206-T208 PolarHBondContact OG1-OG1 2.93Å; T208-M210 VanDerWaalsContact C-N 3.32Å
209	R	70.6	Confident	81.4	Confident	107 Å²	107	55 Å²	55	40%	0.404	29%	0.288	S	S	.	.	S	Bend	trans	66	30.1	-176	-52.4	163.2	-70.3	169.7	-2.8	114	Y190 T206 E207	Y190-R209 PolarHBondContact N-O 3.08Å; Y190-R209 PolarHBondContact O-NH1 3.32Å; T206-R209 WeakPolarHBondContact O-CA 3.5Å; T206-R209 PolarHBondContact O-N 3.49Å; T206-R209 PolarHBondContact OG1-N 2.92Å; E207-R209 VanDerWaalsContact C-N 3.26Å; E207-R209 PolarHBondContact O-N 3.43Å
210	M	76.2	Confident	81.8	Confident	48 Å²	48	55.6 Å²	55.6	24%	0.236	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-92.5	137.8	176.8	-176.8	168	49.5	0	0	109.8	D187 Q188 L205 T206 T208 S212	D187-M210 VanDerWaalsContact CA-CG 3.47Å; D187-M210 VanDerWaalsContact CA-SD 3.55Å; D187-M210 HydrophobicContact CB-CG 4.24Å; D187-M210 HydrophobicContact CB-SD 3.61Å; Q188-M210 WeakPolarHBondContact O-CA 3.38Å; L205-M210 WeakPolarHBondContact CA-O 3.37Å; T206-M210 HydrophobicContact CG2-CB 4.21Å; T206-M210 HydrophobicContact CG2-CE 4.14Å; T206-M210 PolarHBondContact N-O 3.37Å; T206-M210 VanDerWaalsContact OG1-CB 3.26Å; T206-M210 WeakPolarHBondContact OG1-CB 3.21Å; T206-M210 PolarHBondContact OG1-N 2.86Å; T208-M210 VanDerWaalsContact C-N 3.32Å; M210-S212 PolarHBondContact O-N 3.03Å
211	L	74.5	Confident	82.1	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-70.2	112.3	170.2	-78.3	171.2	0	0	0	109.5	Q188 Y190 I203 L205 I214 L222	Q188-L211 PolarHBondContact O-N 3.27Å; Y190-L211 HydrophobicContact CD2-CD1 4.35Å; Y190-L211 HydrophobicContact CD2-CG 4.28Å; Y190-L211 HydrophobicContact CE2-CD1 3.34Å; Y190-L211 HydrophobicContact CE2-CG 3.71Å; I203-L211 HydrophobicContact CG2-CD2 3.26Å; L205-L211 HydrophobicContact CD2-CD2 3.95Å; L205-L211 HydrophobicContact CD2-CG 4.21Å; L211-I214 HydrophobicContact CB-CD1 4.16Å; L211-I214 HydrophobicContact CB-CG1 4.08Å; L211-I214 HydrophobicContact CD1-CD1 3.76Å; L211-I214 HydrophobicContact CD1-CG1 4.02Å; L211-L222 HydrophobicContact CD1-CD1 3.49Å; L211-L222 VanDerWaalsContact CD1-CD1 3.49Å; L211-L222 HydrophobicContact CD2-CD1 4.3Å
212	S	73.3	Confident	82	Confident	52 Å²	52	46.4 Å²	46.4	36%	0.364	24%	0.243	S	C	.	.	S	Bend	trans	-70.3	-35.9	-179.9	58.2	0	0	0	0	112.6	N204 M210	N204-S212 PolarHBondContact O-OG 3.34Å; M210-S212 PolarHBondContact O-N 3.03Å
213	T	78.8	Confident	81.7	Confident	67 Å²	67	44.7 Å²	44.7	41%	0.411	24%	0.235	S	C	.	.			trans	-147.2	137.1	-175.3	51.9	0	0	0	0	109.7
214	I	84.1	Confident	81.8	Confident	35 Å²	35	44.4 Å²	44.4	18%	0.179	23%	0.233	C	C	.	.			trans	-120.8	89.1	177.7	-57	178.8	0	0	0	107.2	L184 K185 L211 L333	L184-I214 HydrophobicContact CB-CG2 4.35Å; L184-I214 HydrophobicContact CD2-CG2 4.14Å; L184-I214 WeakPolarHBondContact O-CD1 3.34Å; K185-I214 VanDerWaalsContact C-CD1 3.46Å; K185-I214 VanDerWaalsContact O-CD1 3.22Å; K185-I214 WeakPolarHBondContact O-CD1 3.06Å; L211-I214 HydrophobicContact CB-CD1 4.16Å; L211-I214 HydrophobicContact CB-CG1 4.08Å; L211-I214 HydrophobicContact CD1-CD1 3.76Å; L211-I214 HydrophobicContact CD1-CG1 4.02Å; I214-L333 HydrophobicContact CG2-CD2 3.82Å
215	T	88.5	Confident	81.6	Confident	61 Å²	61	39.8 Å²	39.8	37%	0.374	21%	0.209	S	C	.	.			trans	-87.8	173.8	170.1	82.9	0	0	0	0	109.5	Y217 E218 A219 R280	T215-Y217 PolarHBondContact O-N 3.49Å; T215-Y217 WeakPolarHBondContact OG1-CB 3.31Å; T215-Y217 PolarHBondContact OG1-N 3.36Å; T215-E218 WeakPolarHBondContact CA-OE2 3.37Å; T215-E218 WeakPolarHBondContact CB-OE2 3.24Å; T215-E218 WeakPolarHBondContact CG2-OE2 3.31Å; T215-E218 PolarHBondContact N-OE2 3.46Å; T215-E218 PolarHBondContact O-N 2.86Å; T215-E218 PolarHBondContact OG1-OE2 3.03Å; T215-A219 PolarHBondContact O-N 2.88Å; T215-R280 PolarHBondContact OG1-NH2 3.47Å
216	L	89.8	Confident	81.2	Confident	45 Å²	45	38 Å²	38	24%	0.236	20%	0.199	C	C	.	.	H	α-helix	trans	-55.1	-32.8	173.3	-178.8	60.5	0	0	0	112.1	K220 K330 L333	L216-K220 HydrophobicContact CD1-CG 4.45Å; L216-K220 HydrophobicContact CG-CD 4.4Å; L216-K220 WeakPolarHBondContact O-CB 3.41Å; L216-K220 WeakPolarHBondContact O-CG 3.34Å; L216-K220 PolarHBondContact O-N 2.93Å; L216-K330 HydrophobicContact CD1-CG 4.09Å; L216-K330 HydrophobicContact CD2-CG 3.94Å; L216-L333 HydrophobicContact CB-CD1 4.16Å; L216-L333 HydrophobicContact CD1-CD1 4.21Å
217	Y	90.3	Very high	80.5	Confident	8 Å²	8	36 Å²	36	3%	0.031	19%	0.187	C	C	.	.	H	α-helix	trans	-63.7	-52	175.9	175.2	-88.6	0	0	0	112	Q202 T215 A219 K220 L221 I276 E279 R280	Q202-Y217 HydrophobicContact CB-CE1 4.49Å; Q202-Y217 PolarHBondContact OE1-OH 3.43Å; T215-Y217 PolarHBondContact O-N 3.49Å; T215-Y217 WeakPolarHBondContact OG1-CB 3.31Å; T215-Y217 PolarHBondContact OG1-N 3.36Å; Y217-A219 VanDerWaalsContact C-N 3.32Å; Y217-A219 PolarHBondContact O-N 2.92Å; Y217-K220 PolarHBondContact O-N 3.27Å; Y217-L221 HydrophobicContact CD1-CD1 3.87Å; Y217-L221 HydrophobicContact CE1-CD1 3.3Å; Y217-L221 HydrophobicContact CE1-CG 4.29Å; Y217-L221 PolarHBondContact O-N 3.37Å; Y217-L221 VanDerWaalsContact O-N 3.17Å; Y217-I276 HydrophobicContact CD2-CG2 4.11Å; Y217-I276 HydrophobicContact CE2-CG2 4.07Å; Y217-I276 VanDerWaalsContact CE2-O 3.23Å; Y217-I276 WeakPolarHBondContact CE2-O 3.03Å; Y217-E279 HydrophobicContact CD2-CB 4.25Å; Y217-R280 VanDerWaalsContact CD1-NH1 3.32Å; Y217-R280 HydrophobicContact CD2-CG 4.07Å; Y217-R280 HydrophobicContact CE2-CB 4.36Å; Y217-R280 HydrophobicContact CE2-CG 3.82Å
218	E	87.3	Confident	79.9	Confident	2 Å²	2	26.2 Å²	26.2	1%	0.009	14%	0.142	C	C	.	.	H	α-helix	trans	-64.1	-38.7	177.4	-70.6	76	-156.9	0	0	111.1	T215 K220 L221 L222 R280	T215-E218 WeakPolarHBondContact CA-OE2 3.37Å; T215-E218 WeakPolarHBondContact CB-OE2 3.24Å; T215-E218 WeakPolarHBondContact CG2-OE2 3.31Å; T215-E218 PolarHBondContact N-OE2 3.46Å; T215-E218 PolarHBondContact O-N 2.86Å; T215-E218 PolarHBondContact OG1-OE2 3.03Å; E218-K220 PolarHBondContact O-N 3.03Å; E218-L221 PolarHBondContact O-N 3.45Å; E218-L222 WeakPolarHBondContact O-CB 3.33Å; E218-L222 WeakPolarHBondContact O-CG 2.89Å; E218-L222 PolarHBondContact O-N 2.92Å; E218-R280 IonicContact OE1-CZ 3.23Å; E218-R280 VanDerWaalsContact OE1-CZ 3.23Å; E218-R280 IonicContact OE1-NH1 2.82Å; E218-R280 PolarHBondContact OE1-NH1 3.43Å; E218-R280 IonicContact OE1-NH2 2.76Å; E218-R280 PolarHBondContact OE1-NH2 2.92Å; E218-R280 IonicContact OE2-NH2 3.52Å
219	A	87.2	Confident	79.4	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-59.8	-46.1	176.6	0	0	0	0	0	111.9	L184 T215 Y217 L221 L222 I223 L333	L184-A219 HydrophobicContact CD1-CB 4.18Å; L184-A219 HydrophobicContact CD2-CB 4.08Å; T215-A219 PolarHBondContact O-N 2.88Å; Y217-A219 VanDerWaalsContact C-N 3.32Å; Y217-A219 PolarHBondContact O-N 2.92Å; A219-L221 PolarHBondContact O-N 3.43Å; A219-L222 PolarHBondContact O-N 3.39Å; A219-I223 HydrophobicContact CB-CD1 4.31Å; A219-I223 VanDerWaalsContact O-CB 3.3Å; A219-I223 WeakPolarHBondContact O-CB 3.02Å; A219-I223 VanDerWaalsContact O-CD1 3.28Å; A219-I223 WeakPolarHBondContact O-CD1 3.25Å; A219-I223 WeakPolarHBondContact O-CG1 3.16Å; A219-I223 PolarHBondContact O-N 3.42Å; A219-L333 HydrophobicContact CB-CD1 3.8Å; A219-L333 HydrophobicContact CB-CD2 4.25Å; A219-L333 HydrophobicContact CB-CG 4.15Å
220	K	89.6	Confident	79	Confident	13 Å²	13	18.4 Å²	18.4	6%	0.057	10%	0.103	C	C	.	.	H	α-helix	trans	-55.8	-50.4	174.8	-73.9	166.7	176.6	176.2	0	111.6	L216 Y217 E218 L222 F224 I276 E279 L325	L216-K220 HydrophobicContact CD1-CG 4.45Å; L216-K220 HydrophobicContact CG-CD 4.4Å; L216-K220 WeakPolarHBondContact O-CB 3.41Å; L216-K220 WeakPolarHBondContact O-CG 3.34Å; L216-K220 PolarHBondContact O-N 2.93Å; Y217-K220 PolarHBondContact O-N 3.27Å; E218-K220 PolarHBondContact O-N 3.03Å; K220-L222 PolarHBondContact O-N 2.72Å; K220-F224 WeakPolarHBondContact O-CB 3.49Å; K220-F224 PolarHBondContact O-N 3Å; K220-I276 HydrophobicContact CB-CD1 4.14Å; K220-I276 HydrophobicContact CB-CG1 4.34Å; K220-I276 HydrophobicContact CB-CG2 4.03Å; K220-I276 HydrophobicContact CD-CG2 4.34Å; K220-E279 VanDerWaalsContact NZ-CD 3.27Å; K220-E279 IonicContact NZ-OE1 2.72Å; K220-E279 PolarHBondContact NZ-OE1 2.92Å; K220-E279 IonicContact NZ-OE2 3.39Å; K220-E279 PolarHBondContact NZ-OE2 3.26Å; K220-E279 VanDerWaalsContact NZ-OE2 3.11Å; K220-L325 HydrophobicContact CB-CD2 3.64Å; K220-L325 HydrophobicContact CB-CG 3.98Å; K220-L325 HydrophobicContact CG-CD2 3.92Å; K220-L325 HydrophobicContact CG-CG 3.87Å
221	L	87.5	Confident	78.1	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-59.1	-47.2	179.3	-68.3	173.2	0	0	0	111.7	Q202 I203 Y217 E218 A219 G225 M273 I276 I277	Q202-L221 HydrophobicContact CB-CD1 3.63Å; I203-L221 HydrophobicContact CG1-CD1 4.18Å; Y217-L221 HydrophobicContact CD1-CD1 3.87Å; Y217-L221 HydrophobicContact CE1-CD1 3.3Å; Y217-L221 HydrophobicContact CE1-CG 4.29Å; Y217-L221 PolarHBondContact O-N 3.37Å; Y217-L221 VanDerWaalsContact O-N 3.17Å; E218-L221 PolarHBondContact O-N 3.45Å; A219-L221 PolarHBondContact O-N 3.43Å; L221-G225 PolarHBondContact O-N 3.09Å; L221-M273 HydrophobicContact CD2-CE 3.3Å; L221-M273 HydrophobicContact CD2-SD 3.81Å; L221-I276 HydrophobicContact CD2-CB 4.33Å; L221-I276 HydrophobicContact CD2-CG2 3.7Å; L221-I276 HydrophobicContact CG-CG2 3.92Å; L221-I277 HydrophobicContact CD2-CG1 4.24Å
222	L	80.1	Confident	77.4	Confident	2 Å²	2	19.2 Å²	19.2	1%	0.01	11%	0.107	C	C	.	.	H	α-helix	trans	-67.1	-47.1	-176.7	-70.3	171.1	0	0	0	112.6	L184 F195 I203 L211 E218 A219 K220 L226	L184-L222 HydrophobicContact CD2-CB 3.93Å; L184-L222 HydrophobicContact CD2-CD1 3.56Å; L184-L222 HydrophobicContact CD2-CG 4.39Å; F195-L222 HydrophobicContact CE1-CD2 3.38Å; F195-L222 HydrophobicContact CZ-CD2 3.75Å; I203-L222 HydrophobicContact CD1-CD2 3.69Å; I203-L222 HydrophobicContact CD1-CG 4.3Å; L211-L222 HydrophobicContact CD1-CD1 3.49Å; L211-L222 VanDerWaalsContact CD1-CD1 3.49Å; L211-L222 HydrophobicContact CD2-CD1 4.3Å; E218-L222 WeakPolarHBondContact O-CB 3.33Å; E218-L222 WeakPolarHBondContact O-CG 2.89Å; E218-L222 PolarHBondContact O-N 2.92Å; A219-L222 PolarHBondContact O-N 3.39Å; K220-L222 PolarHBondContact O-N 2.72Å; L222-L226 VanDerWaalsContact O-CB 3.3Å; L222-L226 WeakPolarHBondContact O-CB 3.12Å; L222-L226 PolarHBondContact O-N 3.2Å
223	I	80.1	Confident	76.7	Confident	2 Å²	2	16.7 Å²	16.7	1%	0.01	9%	0.09	C	C	.	.	H	α-helix	trans	-62.6	-49.9	179.4	-66	165	0	0	0	109.5	I180 L184 A219 L226 V227 W324 L325 Y328 I332	I180-I223 HydrophobicContact CD1-CG2 4.32Å; I180-I223 HydrophobicContact CG2-CD1 4.2Å; I180-I223 HydrophobicContact CG2-CG1 3.62Å; L184-I223 HydrophobicContact CD1-CD1 3.95Å; L184-I223 HydrophobicContact CD1-CG1 4.11Å; A219-I223 HydrophobicContact CB-CD1 4.31Å; A219-I223 VanDerWaalsContact O-CB 3.3Å; A219-I223 WeakPolarHBondContact O-CB 3.02Å; A219-I223 VanDerWaalsContact O-CD1 3.28Å; A219-I223 WeakPolarHBondContact O-CD1 3.25Å; A219-I223 WeakPolarHBondContact O-CG1 3.16Å; A219-I223 PolarHBondContact O-N 3.42Å; I223-L226 PolarHBondContact O-N 3.22Å; I223-V227 WeakPolarHBondContact O-CB 3.49Å; I223-V227 WeakPolarHBondContact O-CG2 3.16Å; I223-V227 PolarHBondContact O-N 3.02Å; I223-W324 HydrophobicContact CG2-CH2 3.76Å; I223-W324 HydrophobicContact CG2-CZ3 4.15Å; I223-L325 HydrophobicContact CB-CD1 3.76Å; I223-L325 HydrophobicContact CG2-CD1 3.57Å; I223-Y328 HydrophobicContact CD1-CD1 3.82Å; I223-Y328 HydrophobicContact CD1-CE1 4.02Å; I223-Y328 HydrophobicContact CG1-CE1 4.42Å; I223-Y328 HydrophobicContact CG2-CD1 3.97Å; I223-Y328 HydrophobicContact CG2-CE1 4.1Å; I223-I332 HydrophobicContact CD1-CG2 4.17Å
224	F	84.5	Confident	75.4	Confident	0 Å²	0	16 Å²	16	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-69.6	-39.4	-176.1	-166.3	-110.8	0	0	0	112	K220 V227 F228 Y269 V272 M273 C321 L325	K220-F224 WeakPolarHBondContact O-CB 3.49Å; K220-F224 PolarHBondContact O-N 3Å; F224-V227 PolarHBondContact O-N 2.97Å; F224-F228 HydrophobicContact CD2-CB 4.5Å; F224-F228 AromaticContact CD2-CD2 3.47Å; F224-F228 HydrophobicContact CD2-CD2 3.47Å; F224-F228 VanDerWaalsContact CD2-CD2 3.47Å; F224-F228 AromaticContact CD2-CE2 3.92Å; F224-F228 HydrophobicContact CD2-CE2 3.92Å; F224-F228 HydrophobicContact CD2-CG 4.15Å; F224-F228 HydrophobicContact CE1-CB 4.38Å; F224-F228 HydrophobicContact CE1-CG 4.5Å; F224-F228 HydrophobicContact CE2-CB 4.18Å; F224-F228 HydrophobicContact CE2-CD1 4.18Å; F224-F228 AromaticContact CE2-CD2 3.12Å; F224-F228 HydrophobicContact CE2-CD2 3.12Å; F224-F228 HydrophobicContact CE2-CE1 4.37Å; F224-F228 AromaticContact CE2-CE2 3.37Å; F224-F228 HydrophobicContact CE2-CE2 3.37Å; F224-F228 AromaticContact CE2-CG 3.56Å; F224-F228 HydrophobicContact CE2-CG 3.56Å; F224-F228 AromaticContact CE2-CZ 4Å; F224-F228 HydrophobicContact CE2-CZ 4Å; F224-F228 HydrophobicContact CG-CD2 4.39Å; F224-F228 HydrophobicContact CZ-CB 4.1Å; F224-F228 HydrophobicContact CZ-CD1 4.15Å; F224-F228 AromaticContact CZ-CD2 3.83Å; F224-F228 HydrophobicContact CZ-CD2 3.83Å; F224-F228 HydrophobicContact CZ-CE2 4.26Å; F224-F228 AromaticContact CZ-CG 3.75Å; F224-F228 HydrophobicContact CZ-CG 3.75Å; F224-F228 WeakPolarHBondContact O-CB 3.43Å; F224-F228 PolarHBondContact O-N 2.93Å; F224-Y269 AromaticContact CD1-CD2 3.69Å; F224-Y269 HydrophobicContact CD1-CD2 3.69Å; F224-Y269 AromaticContact CD1-CE2 3.88Å; F224-Y269 HydrophobicContact CD1-CE2 3.88Å; F224-Y269 AromaticContact CE1-CD2 3.41Å; F224-Y269 HydrophobicContact CE1-CD2 3.41Å; F224-Y269 VanDerWaalsContact CE1-CD2 3.41Å; F224-Y269 HydrophobicContact CE1-CE2 4.06Å; F224-Y269 HydrophobicContact CE1-CG 4.13Å; F224-Y269 HydrophobicContact CZ-CD2 4.33Å; F224-V272 HydrophobicContact CD1-CB 4.31Å; F224-V272 HydrophobicContact CD1-CG1 3.92Å; F224-V272 HydrophobicContact CD2-CG1 4.1Å; F224-V272 HydrophobicContact CE1-CB 3.5Å; F224-V272 VanDerWaalsContact CE1-CB 3.5Å; F224-V272 HydrophobicContact CE1-CG1 3.57Å; F224-V272 HydrophobicContact CE1-CG2 4.31Å; F224-V272 HydrophobicContact CE2-CB 4.13Å; F224-V272 HydrophobicContact CE2-CG1 3.78Å; F224-V272 HydrophobicContact CE2-CG2 4.26Å; F224-V272 HydrophobicContact CG-CG1 4.17Å; F224-V272 HydrophobicContact CZ-CB 3.41Å; F224-V272 VanDerWaalsContact CZ-CB 3.41Å; F224-V272 HydrophobicContact CZ-CG1 3.52Å; F224-V272 HydrophobicContact CZ-CG2 3.72Å; F224-M273 HydrophobicContact CD1-CG 3.95Å; F224-M273 HydrophobicContact CD1-SD 3.79Å; F224-M273 HydrophobicContact CE1-CG 4.1Å; F224-C321 HydrophobicContact CE2-CB 4.45Å; F224-L325 HydrophobicContact CB-CD1 3.98Å; F224-L325 HydrophobicContact CB-CD2 3.9Å; F224-L325 HydrophobicContact CD2-CD2 4.46Å; F224-L325 HydrophobicContact CG-CD2 4.31Å
225	G	76.7	Confident	73.8	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.096	C	C	.	.	I	π-helix	trans	-61.9	-41.6	171.6	0	0	0	0	0	113.6	E199 L221 L229 R230	E199-G225 VanDerWaalsContact OE1-CA 3.27Å; E199-G225 WeakPolarHBondContact OE1-CA 3.49Å; L221-G225 PolarHBondContact O-N 3.09Å; G225-L229 VanDerWaalsContact O-CB 3.28Å; G225-L229 WeakPolarHBondContact O-CB 3.08Å; G225-L229 PolarHBondContact O-N 2.8Å; G225-R230 PolarHBondContact O-N 3Å; G225-R230 PolarHBondContact O-NH1 3.45Å
226	L	68.4	Low	71.9	Confident	19 Å²	19	17.3 Å²	17.3	10%	0.099	8%	0.083	C	C	.	.	I	π-helix	trans	-61.6	-49.7	175	176.4	68.2	0	0	0	110.8	I180 M183 L222 I223 R230 I231	I180-L226 HydrophobicContact CG1-CD2 3.84Å; M183-L226 HydrophobicContact CE-CB 4.25Å; M183-L226 HydrophobicContact CE-CD1 4Å; M183-L226 HydrophobicContact CE-CD2 3.98Å; M183-L226 HydrophobicContact CE-CG 4.29Å; M183-L226 HydrophobicContact SD-CD1 4.05Å; M183-L226 HydrophobicContact SD-CD2 3.59Å; M183-L226 VanDerWaalsContact SD-CD2 3.59Å; M183-L226 HydrophobicContact SD-CG 4.35Å; L222-L226 VanDerWaalsContact O-CB 3.3Å; L222-L226 WeakPolarHBondContact O-CB 3.12Å; L222-L226 PolarHBondContact O-N 3.2Å; I223-L226 PolarHBondContact O-N 3.22Å; L226-R230 WeakPolarHBondContact O-CB 3.48Å; L226-R230 PolarHBondContact O-N 3.38Å; L226-I231 HydrophobicContact CD1-CD1 4.48Å; L226-I231 HydrophobicContact CG-CD1 4.2Å; L226-I231 WeakPolarHBondContact O-CG1 3.3Å; L226-I231 PolarHBondContact O-N 2.79Å
227	V	66.1	Low	69.9	Low	5 Å²	5	17 Å²	17	3%	0.03	8%	0.08	C	C	.	.	I	π-helix	trans	-79.3	-50.7	-167.2	176.1	0	0	0	0	111.5	L164 F172 I180 I223 F224 I231 V232 W324	L164-V227 HydrophobicContact CD2-CG1 3.52Å; F172-V227 HydrophobicContact CD1-CG2 4.45Å; F172-V227 HydrophobicContact CE1-CB 4.32Å; F172-V227 HydrophobicContact CE1-CG1 3.82Å; F172-V227 HydrophobicContact CE1-CG2 3.48Å; F172-V227 VanDerWaalsContact CE1-CG2 3.48Å; F172-V227 HydrophobicContact CZ-CG1 3.91Å; F172-V227 HydrophobicContact CZ-CG2 4.15Å; I180-V227 HydrophobicContact CD1-CG2 4.49Å; I223-V227 WeakPolarHBondContact O-CB 3.49Å; I223-V227 WeakPolarHBondContact O-CG2 3.16Å; I223-V227 PolarHBondContact O-N 3.02Å; F224-V227 PolarHBondContact O-N 2.97Å; V227-I231 WeakPolarHBondContact O-CB 3.25Å; V227-V232 WeakPolarHBondContact O-CG2 3.32Å; V227-V232 PolarHBondContact O-N 2.79Å; V227-W324 HydrophobicContact CG2-CH2 4.42Å
228	F	66.9	Low	67.4	Low	1 Å²	1	19.2 Å²	19.2	0%	0.004	9%	0.092	C	C	.	.	I	π-helix	trans	-86	-43.1	-176	-85.6	-99.6	0	0	0	112.8	L160 L164 F224 V232 I233 I268 Y269 Y317	L160-F228 HydrophobicContact CD2-CE1 3.83Å; L160-F228 HydrophobicContact CD2-CZ 4.22Å; L164-F228 HydrophobicContact CD1-CE2 3.58Å; L164-F228 HydrophobicContact CD1-CZ 3.73Å; F224-F228 HydrophobicContact CD2-CB 4.5Å; F224-F228 AromaticContact CD2-CD2 3.47Å; F224-F228 HydrophobicContact CD2-CD2 3.47Å; F224-F228 VanDerWaalsContact CD2-CD2 3.47Å; F224-F228 AromaticContact CD2-CE2 3.92Å; F224-F228 HydrophobicContact CD2-CE2 3.92Å; F224-F228 HydrophobicContact CD2-CG 4.15Å; F224-F228 HydrophobicContact CE1-CB 4.38Å; F224-F228 HydrophobicContact CE1-CG 4.5Å; F224-F228 HydrophobicContact CE2-CB 4.18Å; F224-F228 HydrophobicContact CE2-CD1 4.18Å; F224-F228 AromaticContact CE2-CD2 3.12Å; F224-F228 HydrophobicContact CE2-CD2 3.12Å; F224-F228 HydrophobicContact CE2-CE1 4.37Å; F224-F228 AromaticContact CE2-CE2 3.37Å; F224-F228 HydrophobicContact CE2-CE2 3.37Å; F224-F228 AromaticContact CE2-CG 3.56Å; F224-F228 HydrophobicContact CE2-CG 3.56Å; F224-F228 AromaticContact CE2-CZ 4Å; F224-F228 HydrophobicContact CE2-CZ 4Å; F224-F228 HydrophobicContact CG-CD2 4.39Å; F224-F228 HydrophobicContact CZ-CB 4.1Å; F224-F228 HydrophobicContact CZ-CD1 4.15Å; F224-F228 AromaticContact CZ-CD2 3.83Å; F224-F228 HydrophobicContact CZ-CD2 3.83Å; F224-F228 HydrophobicContact CZ-CE2 4.26Å; F224-F228 AromaticContact CZ-CG 3.75Å; F224-F228 HydrophobicContact CZ-CG 3.75Å; F224-F228 WeakPolarHBondContact O-CB 3.43Å; F224-F228 PolarHBondContact O-N 2.93Å; F228-V232 WeakPolarHBondContact O-CB 3.04Å; F228-I233 VanDerWaalsContact O-CG1 3.31Å; F228-I233 WeakPolarHBondContact O-CG1 3.47Å; F228-I233 PolarHBondContact O-N 2.88Å; F228-I268 HydrophobicContact CE1-CG2 4.14Å; F228-Y269 HydrophobicContact CB-CD2 4.07Å; F228-Y317 HydrophobicContact CE1-CE1 4.45Å
229	L	66.9	Low	65.1	Low	1 Å²	1	19.7 Å²	19.7	1%	0.005	10%	0.098	C	C	.	.	I	π-helix	trans	-80.8	-53.8	-178.2	178.1	71.9	0	0	0	111.6	I196 G225 I233 I234 Y269 L292	I196-L229 HydrophobicContact CB-CD2 4.22Å; I196-L229 HydrophobicContact CD1-CD2 3.43Å; I196-L229 VanDerWaalsContact CD1-CD2 3.43Å; I196-L229 HydrophobicContact CG1-CD2 3.55Å; I196-L229 HydrophobicContact CG2-CD2 3.67Å; G225-L229 VanDerWaalsContact O-CB 3.28Å; G225-L229 WeakPolarHBondContact O-CB 3.08Å; G225-L229 PolarHBondContact O-N 2.8Å; L229-I233 HydrophobicContact CD1-CB 4.26Å; L229-I233 HydrophobicContact CD1-CD1 4.15Å; L229-I233 HydrophobicContact CD1-CG2 4.21Å; L229-I233 WeakPolarHBondContact O-CB 3.24Å; L229-I233 PolarHBondContact O-N 2.66Å; L229-I234 HydrophobicContact CD1-CD1 4.4Å; L229-I234 HydrophobicContact CD1-CG1 4.49Å; L229-I234 HydrophobicContact CG-CD1 4.02Å; L229-I234 WeakPolarHBondContact O-CB 3.42Å; L229-I234 WeakPolarHBondContact O-CG1 3.13Å; L229-I234 PolarHBondContact O-N 2.92Å; L229-Y269 HydrophobicContact CB-CD2 4.29Å; L229-Y269 HydrophobicContact CB-CE2 3.9Å; L229-L292 HydrophobicContact CD1-CD1 3.86Å
230	R	62.6	Low	62.7	Low	26 Å²	26	24.1 Å²	24.1	10%	0.098	12%	0.117	C	C	.	.	I	π-helix	trans	-78.6	-45.5	-172.4	-62	175.1	-173	82	0.6	113	Y194 E199 G225 L226 I234 K235	Y194-R230 VanDerWaalsContact CZ-CZ 3.43Å; Y194-R230 PolarHBondContact O-NE 3.45Å; Y194-R230 VanDerWaalsContact O-NE 3.08Å; Y194-R230 PolarHBondContact O-NH2 2.97Å; Y194-R230 WeakPolarHBondContact OH-CD 3.45Å; Y194-R230 PolarHBondContact OH-NE 3.26Å; E199-R230 VanDerWaalsContact CD-NH2 3.34Å; E199-R230 IonicContact OE1-CZ 3.11Å; E199-R230 IonicContact OE1-NH1 2.64Å; E199-R230 PolarHBondContact OE1-NH1 3.19Å; E199-R230 IonicContact OE1-NH2 3.23Å; E199-R230 PolarHBondContact OE1-NH2 2.94Å; E199-R230 IonicContact OE2-CZ 3.52Å; E199-R230 IonicContact OE2-NH1 2.95Å; E199-R230 IonicContact OE2-NH2 2.69Å; E199-R230 PolarHBondContact OE2-NH2 2.76Å; G225-R230 PolarHBondContact O-N 3Å; G225-R230 PolarHBondContact O-NH1 3.45Å; L226-R230 WeakPolarHBondContact O-CB 3.48Å; L226-R230 PolarHBondContact O-N 3.38Å; R230-I234 HydrophobicContact CG-CD1 4.28Å; R230-K235 PolarHBondContact O-N 3.42Å
231	I	57.2	Low	59.9	Low	55 Å²	55	31.3 Å²	31.3	28%	0.282	15%	0.151	S	C	.	.	I	π-helix	trans	-81.3	-40.2	-176.3	-66.8	171.3	0	0	0	112	L171 L226 V227 K235	L171-I231 HydrophobicContact CD2-CD1 3.57Å; L226-I231 HydrophobicContact CD1-CD1 4.48Å; L226-I231 HydrophobicContact CG-CD1 4.2Å; L226-I231 WeakPolarHBondContact O-CG1 3.3Å; L226-I231 PolarHBondContact O-N 2.79Å; V227-I231 WeakPolarHBondContact O-CB 3.25Å; I231-K235 WeakPolarHBondContact O-CB 3.28Å
232	V	59.8	Low	57	Low	9 Å²	9	37.5 Å²	37.5	6%	0.055	18%	0.183	C	C	.	.	I	π-helix	trans	-89.9	-69	-179.1	177.2	0	0	0	0	110.2	V227 F228 L236 C265	V227-V232 WeakPolarHBondContact O-CG2 3.32Å; V227-V232 PolarHBondContact O-N 2.79Å; F228-V232 WeakPolarHBondContact O-CB 3.04Å; V232-L236 HydrophobicContact CG1-CD1 3.67Å; V232-L236 WeakPolarHBondContact O-CB 3.39Å; V232-L236 VanDerWaalsContact O-CD1 3.25Å; V232-L236 WeakPolarHBondContact O-CD1 3.38Å; V232-L236 WeakPolarHBondContact O-CG 3.21Å; V232-L236 PolarHBondContact O-N 2.96Å; V232-C265 HydrophobicContact CG1-CB 4.35Å
233	I	58.6	Low	54.4	Low	0 Å²	0	40 Å²	40	0%	0	21%	0.21	C	C	.	.	I	π-helix	trans	-64	-58.5	-170.7	-65.1	165.6	0	0	0	111.9	F228 L229 K235 L236 F237 C265 Y269 L292	F228-I233 VanDerWaalsContact O-CG1 3.31Å; F228-I233 WeakPolarHBondContact O-CG1 3.47Å; F228-I233 PolarHBondContact O-N 2.88Å; L229-I233 HydrophobicContact CD1-CB 4.26Å; L229-I233 HydrophobicContact CD1-CD1 4.15Å; L229-I233 HydrophobicContact CD1-CG2 4.21Å; L229-I233 WeakPolarHBondContact O-CB 3.24Å; L229-I233 PolarHBondContact O-N 2.66Å; I233-K235 PolarHBondContact O-N 3.39Å; I233-L236 WeakPolarHBondContact O-CB 3.35Å; I233-L236 PolarHBondContact O-N 3.42Å; I233-F237 HydrophobicContact CG2-CD2 3.82Å; I233-F237 HydrophobicContact CG2-CE2 3.9Å; I233-F237 WeakPolarHBondContact O-CD2 3.4Å; I233-F237 PolarHBondContact O-N 3.27Å; I233-F237 VanDerWaalsContact O-N 3.13Å; I233-C265 HydrophobicContact CD1-CB 4.24Å; I233-C265 HydrophobicContact CG1-CB 3.78Å; I233-Y269 HydrophobicContact CD1-CG 4.45Å; I233-L292 HydrophobicContact CG2-CD1 3.92Å; I233-L292 HydrophobicContact CG2-CD2 3.78Å
234	I	51	Low	52	Low	52 Å²	52	45.1 Å²	45.1	27%	0.267	24%	0.237	S	C	.	.	I	π-helix	trans	-64	-42	-174.3	-77.6	169.7	0	0	0	111.2	L229 R230 F237 L238	L229-I234 HydrophobicContact CD1-CD1 4.4Å; L229-I234 HydrophobicContact CD1-CG1 4.49Å; L229-I234 HydrophobicContact CG-CD1 4.02Å; L229-I234 WeakPolarHBondContact O-CB 3.42Å; L229-I234 WeakPolarHBondContact O-CG1 3.13Å; L229-I234 PolarHBondContact O-N 2.92Å; R230-I234 HydrophobicContact CG-CD1 4.28Å; I234-F237 PolarHBondContact O-N 2.84Å; I234-L238 HydrophobicContact CG2-CB 4.36Å; I234-L238 HydrophobicContact CG2-CD1 3.67Å; I234-L238 WeakPolarHBondContact O-CA 3.45Å; I234-L238 VanDerWaalsContact O-CB 3.25Å; I234-L238 WeakPolarHBondContact O-CB 2.97Å; I234-L238 PolarHBondContact O-N 3.44Å
235	K	50.2	Low	49.5	Very low	102 Å²	102	46.8 Å²	46.8	44%	0.443	25%	0.248	S	C	.	.	H	α-helix	trans	-73.1	-29.4	177.2	-70.4	-174.9	176.6	-166.7	0	113.6	R230 I231 I233 F237 G239	R230-K235 PolarHBondContact O-N 3.42Å; I231-K235 WeakPolarHBondContact O-CB 3.28Å; I233-K235 PolarHBondContact O-N 3.39Å; K235-F237 PolarHBondContact O-N 3.06Å; K235-G239 PolarHBondContact O-N 3.28Å; K235-G239 VanDerWaalsContact O-N 3.11Å
236	L	48.4	Very low	47.6	Very low	21 Å²	21	53.5 Å²	53.5	11%	0.11	28%	0.284	C	S	.	.	H	α-helix	trans	-62	-31.1	170.4	-77.6	168.3	0	0	0	111.8	I132 V232 I233 L261	I132-L236 HydrophobicContact CD1-CD2 4.25Å; V232-L236 HydrophobicContact CG1-CD1 3.67Å; V232-L236 WeakPolarHBondContact O-CB 3.39Å; V232-L236 VanDerWaalsContact O-CD1 3.25Å; V232-L236 WeakPolarHBondContact O-CD1 3.38Å; V232-L236 WeakPolarHBondContact O-CG 3.21Å; V232-L236 PolarHBondContact O-N 2.96Å; I233-L236 WeakPolarHBondContact O-CB 3.35Å; I233-L236 PolarHBondContact O-N 3.42Å; L236-L261 HydrophobicContact CD1-CD2 4.11Å; L236-L261 HydrophobicContact CD1-CG 4.39Å; L236-L261 HydrophobicContact CD2-CD2 4.3Å
237	F	47.8	Very low	46	Very low	38 Å²	38	55.2 Å²	55.2	17%	0.167	30%	0.301	C	S	.	.	H	α-helix	trans	-97.5	-44.6	-177.9	-72.2	-63.3	0	0	0	114.5	I233 I234 K235 M295 V296	I233-F237 HydrophobicContact CG2-CD2 3.82Å; I233-F237 HydrophobicContact CG2-CE2 3.9Å; I233-F237 WeakPolarHBondContact O-CD2 3.4Å; I233-F237 PolarHBondContact O-N 3.27Å; I233-F237 VanDerWaalsContact O-N 3.13Å; I234-F237 PolarHBondContact O-N 2.84Å; K235-F237 PolarHBondContact O-N 3.06Å; F237-M295 HydrophobicContact CB-SD 4.26Å; F237-M295 HydrophobicContact CD1-CB 4.29Å; F237-M295 HydrophobicContact CE1-CB 4.31Å; F237-M295 WeakPolarHBondContact CE1-O 3.45Å; F237-M295 HydrophobicContact CG-CB 4.47Å; F237-M295 HydrophobicContact CG-SD 4.46Å; F237-M295 HydrophobicContact CZ-CB 4.49Å; F237-M295 WeakPolarHBondContact CZ-O 3.46Å; F237-V296 HydrophobicContact CE2-CG1 3.9Å; F237-V296 HydrophobicContact CZ-CG1 3.77Å
238	L	38.5	Very low	44.5	Very low	56 Å²	56	61.9 Å²	61.9	29%	0.293	34%	0.342	S	S	.	.	H	α-helix	trans	-97.2	-1.8	-173.6	-72	163.5	0	0	0	113.8	I234 F240 E241	I234-L238 HydrophobicContact CG2-CB 4.36Å; I234-L238 HydrophobicContact CG2-CD1 3.67Å; I234-L238 WeakPolarHBondContact O-CA 3.45Å; I234-L238 VanDerWaalsContact O-CB 3.25Å; I234-L238 WeakPolarHBondContact O-CB 2.97Å; I234-L238 PolarHBondContact O-N 3.44Å; L238-F240 PolarHBondContact O-N 2.91Å; L238-E241 HydrophobicContact CD2-CB 4.48Å; L238-E241 HydrophobicContact CD2-CG 4.35Å; L238-E241 VanDerWaalsContact CD2-OE2 3.28Å; L238-E241 WeakPolarHBondContact CD2-OE2 3.24Å; L238-E241 PolarHBondContact O-N 2.54Å
239	G	39.5	Very low	43.1	Very low	12 Å²	12	65.3 Å²	65.3	12%	0.124	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-23.9	170.9	0	0	0	0	0	112.8	K235 L244	K235-G239 PolarHBondContact O-N 3.28Å; K235-G239 VanDerWaalsContact O-N 3.11Å; G239-L244 WeakPolarHBondContact O-CB 3.22Å; G239-L244 WeakPolarHBondContact O-CD1 3.47Å
240	F	36.9	Very low	41.7	Very low	92 Å²	92	70.8 Å²	70.8	40%	0.404	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-28.2	178	-66	-76.9	0	0	0	114.5	L238 M249	L238-F240 PolarHBondContact O-N 2.91Å; F240-M249 HydrophobicContact CD1-SD 3.83Å; F240-M249 HydrophobicContact CE1-CE 4.42Å; F240-M249 HydrophobicContact CE1-CG 4.28Å; F240-M249 HydrophobicContact CE1-SD 3.18Å; F240-M249 WeakPolarHBondContact CE1-SD 3.48Å; F240-M249 HydrophobicContact CZ-SD 3.6Å
241	E	29.8	Very low	40.6	Very low	165 Å²	165	74.6 Å²	74.6	77%	0.771	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-16.3	179.4	-71.6	-170	165.9	0	0	113.4	L238 G243	L238-E241 HydrophobicContact CD2-CB 4.48Å; L238-E241 HydrophobicContact CD2-CG 4.35Å; L238-E241 VanDerWaalsContact CD2-OE2 3.28Å; L238-E241 WeakPolarHBondContact CD2-OE2 3.24Å; L238-E241 PolarHBondContact O-N 2.54Å; E241-G243 VanDerWaalsContact C-N 3.29Å; E241-G243 PolarHBondContact O-N 3.35Å
242	L	27.4	Very low	39.7	Very low	129 Å²	129	78.1 Å²	78.1	68%	0.675	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	17	-179.9	-69.3	168.7	0	0	0	113.7	L244	L242-L244 HydrophobicContact CB-CD1 3.99Å; L242-L244 HydrophobicContact CB-CG 4.02Å; L242-L244 PolarHBondContact O-N 2.78Å
243	G	25.6	Very low	38.6	Very low	55 Å²	55	86 Å²	86	57%	0.567	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	20.2	-179.3	0	0	0	0	0	114.1	E241 S245	E241-G243 VanDerWaalsContact C-N 3.29Å; E241-G243 PolarHBondContact O-N 3.35Å; G243-S245 PolarHBondContact O-N 3.5Å
244	L	30.3	Very low	37.9	Very low	110 Å²	110	88 Å²	88	58%	0.576	48%	0.484	S	S	*	.			trans	-82.6	4.7	-178.6	-52.6	165	0	0	0	112.9	G239 L242	G239-L244 WeakPolarHBondContact O-CB 3.22Å; G239-L244 WeakPolarHBondContact O-CD1 3.47Å; L242-L244 HydrophobicContact CB-CD1 3.99Å; L242-L244 HydrophobicContact CB-CG 4.02Å; L242-L244 PolarHBondContact O-N 2.78Å
245	S	30.4	Very low	38	Very low	35 Å²	35	88.3 Å²	88.3	25%	0.245	49%	0.49	C	S	.	.			trans	-151.9	119.9	176.3	165.1	0	0	0	0	110.8	G243 A247	G243-S245 PolarHBondContact O-N 3.5Å; S245-A247 PolarHBondContact O-N 2.81Å; S245-A247 PolarHBondContact OG-N 3.49Å
246	N	37	Very low	38.4	Very low	141 Å²	141	87.6 Å²	87.6	75%	0.754	49%	0.491	S	S	*	.			trans	-85.9	9.3	171.5	-67	-9.8	0	0	0	113
247	A	35.8	Very low	38.6	Very low	55 Å²	55	90.9 Å²	90.9	46%	0.455	51%	0.509	S	S	.	.			trans	-86.1	118.7	178.6	0	0	0	0	0	110.8	S245 M249	S245-A247 PolarHBondContact O-N 2.81Å; S245-A247 PolarHBondContact OG-N 3.49Å; A247-M249 PolarHBondContact O-N 3.12Å
248	T	34.5	Very low	39.1	Very low	144 Å²	144	90.2 Å²	90.2	88%	0.883	51%	0.507	S	S	*	.			trans	-62.1	99	161.6	45.5	0	0	0	0	108.4
249	M	37.3	Very low	40.6	Very low	73 Å²	73	90.2 Å²	90.2	36%	0.36	50%	0.504	S	S	.	.			trans	-75.9	133.1	-177.3	-58.9	-149.3	80.8	0	0	110.9	F240 A247 P251 I254	F240-M249 HydrophobicContact CD1-SD 3.83Å; F240-M249 HydrophobicContact CE1-CE 4.42Å; F240-M249 HydrophobicContact CE1-CG 4.28Å; F240-M249 HydrophobicContact CE1-SD 3.18Å; F240-M249 WeakPolarHBondContact CE1-SD 3.48Å; F240-M249 HydrophobicContact CZ-SD 3.6Å; A247-M249 PolarHBondContact O-N 3.12Å; M249-P251 WeakPolarHBondContact O-CD 3.35Å; M249-I254 HydrophobicContact CE-CB 3.69Å; M249-I254 HydrophobicContact CE-CD1 3.16Å; M249-I254 HydrophobicContact CE-CG1 3.96Å; M249-I254 HydrophobicContact CE-CG2 3.49Å; M249-I254 VanDerWaalsContact CE-CG2 3.49Å; M249-I254 HydrophobicContact SD-CG2 4.27Å
250	T	37.5	Very low	41.8	Very low	117 Å²	117	91.1 Å²	91.1	72%	0.718	51%	0.506	S	S	*	.			trans	-68.1	123.1	165.9	28.3	0	0	0	0	108.9	N252	T250-N252 PolarHBondContact O-N 3.31Å
251	P	39.4	Very low	43.1	Very low	105 Å²	105	89.5 Å²	89.5	68%	0.682	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-14	-164.4	-29.8	35.2	0	0	0	118.4	M249 S255	M249-P251 WeakPolarHBondContact O-CD 3.35Å; P251-S255 VanDerWaalsContact O-CB 3.24Å; P251-S255 WeakPolarHBondContact O-CB 3.31Å; P251-S255 PolarHBondContact O-OG 3.04Å
252	N	38.4	Very low	45.1	Very low	130 Å²	130	81.7 Å²	81.7	70%	0.695	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-27.5	-155.9	-100.4	-7.2	0	0	0	118.2	T250 I256	T250-N252 PolarHBondContact O-N 3.31Å; N252-I256 WeakPolarHBondContact O-CD1 3.5Å; N252-I256 WeakPolarHBondContact O-CG1 3.32Å
253	K	37	Very low	47.5	Very low	173 Å²	173	75.6 Å²	75.6	75%	0.752	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-39.3	-174	-75.3	-174.8	178.5	179	0	114.3	S255 I256 N257	K253-S255 VanDerWaalsContact C-N 3.31Å; K253-I256 PolarHBondContact O-N 2.89Å; K253-N257 PolarHBondContact O-N 3.45Å
254	I	42.7	Very low	49.8	Very low	43 Å²	43	73.2 Å²	73.2	22%	0.221	41%	0.407	C	S	.	.	H	α-helix	trans	-78.5	-26.5	-179.3	-60.8	164.2	0	0	0	110.1	M136 M249 N258	M136-I254 HydrophobicContact CE-CD1 3.2Å; M136-I254 HydrophobicContact CE-CG1 3.66Å; M136-I254 HydrophobicContact CE-CG2 4.33Å; M249-I254 HydrophobicContact CE-CB 3.69Å; M249-I254 HydrophobicContact CE-CD1 3.16Å; M249-I254 HydrophobicContact CE-CG1 3.96Å; M249-I254 HydrophobicContact CE-CG2 3.49Å; M249-I254 VanDerWaalsContact CE-CG2 3.49Å; M249-I254 HydrophobicContact SD-CG2 4.27Å; I254-N258 VanDerWaalsContact O-CB 3.31Å; I254-N258 WeakPolarHBondContact O-CB 3.31Å; I254-N258 VanDerWaalsContact O-CG 3.24Å; I254-N258 PolarHBondContact O-N 3.19Å; I254-N258 PolarHBondContact O-ND2 2.81Å
255	S	54.7	Low	52	Low	58 Å²	58	68.3 Å²	68.3	41%	0.406	38%	0.382	S	S	.	.	H	α-helix	trans	-62.2	-42.5	167.9	65.3	0	0	0	0	112	P251 K253 K259	P251-S255 VanDerWaalsContact O-CB 3.24Å; P251-S255 WeakPolarHBondContact O-CB 3.31Å; P251-S255 PolarHBondContact O-OG 3.04Å; K253-S255 VanDerWaalsContact C-N 3.31Å; S255-K259 WeakPolarHBondContact O-CA 3.4Å; S255-K259 WeakPolarHBondContact O-CB 3.47Å; S255-K259 PolarHBondContact O-N 3.38Å
256	I	56.9	Low	54.6	Low	87 Å²	87	66.7 Å²	66.7	45%	0.446	37%	0.371	S	S	.	.	H	α-helix	trans	-67.1	-47.9	-177.6	-65.7	173.5	0	0	0	111.9	N252 K253 K259 L260 F297	N252-I256 WeakPolarHBondContact O-CD1 3.5Å; N252-I256 WeakPolarHBondContact O-CG1 3.32Å; K253-I256 PolarHBondContact O-N 2.89Å; I256-K259 PolarHBondContact O-N 2.97Å; I256-L260 VanDerWaalsContact O-CB 3.29Å; I256-L260 WeakPolarHBondContact O-CB 2.98Å; I256-L260 PolarHBondContact O-N 3.46Å; I256-F297 HydrophobicContact CG2-CZ 4.29Å
257	N	53.2	Low	56.9	Low	91 Å²	91	62.2 Å²	62.2	49%	0.487	34%	0.344	S	S	.	.	H	α-helix	trans	-64.8	-41.7	-180	-75.3	-9.4	0	0	0	111.8	K253 L260 L261	K253-N257 PolarHBondContact O-N 3.45Å; N257-L260 PolarHBondContact O-N 2.95Å; N257-L261 WeakPolarHBondContact O-CB 3.43Å; N257-L261 PolarHBondContact O-N 3.34Å
258	N	59.4	Low	59.2	Low	24 Å²	24	59.8 Å²	59.8	13%	0.128	32%	0.323	C	S	.	.	H	α-helix	trans	-67	-40.7	176	-70.6	-8.2	0	0	0	111.3	I254 L260 L261 G262	I254-N258 VanDerWaalsContact O-CB 3.31Å; I254-N258 WeakPolarHBondContact O-CB 3.31Å; I254-N258 VanDerWaalsContact O-CG 3.24Å; I254-N258 PolarHBondContact O-N 3.19Å; I254-N258 PolarHBondContact O-ND2 2.81Å; N258-L260 VanDerWaalsContact C-N 3.35Å; N258-L260 PolarHBondContact O-N 3.35Å; N258-L261 PolarHBondContact O-N 3.32Å; N258-G262 PolarHBondContact O-N 3.48Å
259	K	68.3	Low	61.6	Low	56 Å²	56	52.9 Å²	52.9	24%	0.243	28%	0.281	C	S	.	.	H	α-helix	trans	-60.1	-45.4	173.5	-172.9	168	-175	176.7	0	110.5	S255 I256 G262 S263 M295 V296 F297	S255-K259 WeakPolarHBondContact O-CA 3.4Å; S255-K259 WeakPolarHBondContact O-CB 3.47Å; S255-K259 PolarHBondContact O-N 3.38Å; I256-K259 PolarHBondContact O-N 2.97Å; K259-G262 PolarHBondContact O-N 2.89Å; K259-S263 WeakPolarHBondContact O-CB 3.32Å; K259-S263 PolarHBondContact O-N 3.37Å; K259-S263 PolarHBondContact O-OG 3.01Å; K259-M295 WeakPolarHBondContact CG-O 3.49Å; K259-V296 WeakPolarHBondContact CE-O 3.37Å; K259-F297 HydrophobicContact CB-CD2 4.26Å; K259-F297 HydrophobicContact CB-CE2 3.81Å; K259-F297 HydrophobicContact CB-CZ 4.29Å; K259-F297 HydrophobicContact CD-CD1 4.05Å; K259-F297 HydrophobicContact CD-CD2 4.15Å; K259-F297 HydrophobicContact CD-CE1 3.77Å; K259-F297 HydrophobicContact CD-CE2 3.87Å; K259-F297 HydrophobicContact CD-CG 4.22Å; K259-F297 HydrophobicContact CD-CZ 3.67Å; K259-F297 HydrophobicContact CG-CD1 4.37Å; K259-F297 HydrophobicContact CG-CD2 3.6Å; K259-F297 HydrophobicContact CG-CE1 4.3Å; K259-F297 HydrophobicContact CG-CE2 3.51Å; K259-F297 HydrophobicContact CG-CG 4.03Å; K259-F297 HydrophobicContact CG-CZ 3.88Å
260	L	64.7	Low	64.2	Low	30 Å²	30	49.7 Å²	49.7	16%	0.157	27%	0.265	C	S	.	.	H	α-helix	trans	-61.4	-51.4	177.7	-172.1	73	0	0	0	112.1	F149 I256 N257 N258 S263 I264 F297 M302 I305	F149-L260 HydrophobicContact CE2-CD2 4.31Å; F149-L260 HydrophobicContact CZ-CD2 3.86Å; I256-L260 VanDerWaalsContact O-CB 3.29Å; I256-L260 WeakPolarHBondContact O-CB 2.98Å; I256-L260 PolarHBondContact O-N 3.46Å; N257-L260 PolarHBondContact O-N 2.95Å; N258-L260 VanDerWaalsContact C-N 3.35Å; N258-L260 PolarHBondContact O-N 3.35Å; L260-S263 WeakPolarHBondContact O-CB 3.37Å; L260-S263 PolarHBondContact O-N 3.25Å; L260-I264 HydrophobicContact CG-CD1 4.48Å; L260-I264 WeakPolarHBondContact O-CG1 3.48Å; L260-I264 PolarHBondContact O-N 3.16Å; L260-F297 HydrophobicContact CB-CE2 4.3Å; L260-F297 HydrophobicContact CD1-CD2 4.47Å; L260-M302 HydrophobicContact CD1-CE 3.63Å; L260-M302 HydrophobicContact CD1-SD 3.63Å; L260-M302 HydrophobicContact CG-CE 4.43Å; L260-I305 HydrophobicContact CD1-CD1 4.41Å; L260-I305 HydrophobicContact CD1-CG1 4.1Å; L260-I305 HydrophobicContact CD1-CG2 4.29Å
261	L	65.2	Low	66.7	Low	59 Å²	59	46.4 Å²	46.4	31%	0.309	24%	0.241	S	C	.	.	H	α-helix	trans	-61.8	-47.8	178.2	179.9	61.3	0	0	0	111	L236 N257 N258 S263 I264 C265	L236-L261 HydrophobicContact CD1-CD2 4.11Å; L236-L261 HydrophobicContact CD1-CG 4.39Å; L236-L261 HydrophobicContact CD2-CD2 4.3Å; N257-L261 WeakPolarHBondContact O-CB 3.43Å; N257-L261 PolarHBondContact O-N 3.34Å; N258-L261 PolarHBondContact O-N 3.32Å; L261-S263 PolarHBondContact O-N 3.31Å; L261-I264 PolarHBondContact O-N 3.44Å; L261-I264 VanDerWaalsContact O-N 3.12Å; L261-C265 PolarHBondContact O-N 2.92Å; L261-C265 PolarHBondContact O-SG 3.42Å; L261-C265 VanDerWaalsContact O-SG 3.38Å
262	G	71	Confident	69	Low	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.9	-30	176.4	0	0	0	0	0	112.9	N258 K259 T266	N258-G262 PolarHBondContact O-N 3.48Å; K259-G262 PolarHBondContact O-N 2.89Å; G262-T266 WeakPolarHBondContact O-CB 3.18Å; G262-T266 PolarHBondContact O-N 3.3Å; G262-T266 PolarHBondContact O-OG1 3.39Å
263	S	77.8	Confident	71.5	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.014	18%	0.175	C	C	.	.	H	α-helix	trans	-68.1	-40	172.9	-53.9	0	0	0	0	112	K259 L260 L261 Y267 V296 F297 Y306	K259-S263 WeakPolarHBondContact O-CB 3.32Å; K259-S263 PolarHBondContact O-N 3.37Å; K259-S263 PolarHBondContact O-OG 3.01Å; L260-S263 WeakPolarHBondContact O-CB 3.37Å; L260-S263 PolarHBondContact O-N 3.25Å; L261-S263 PolarHBondContact O-N 3.31Å; S263-Y267 VanDerWaalsContact O-CB 3.32Å; S263-Y267 WeakPolarHBondContact O-CB 3.44Å; S263-Y267 PolarHBondContact O-N 3.46Å; S263-V296 WeakPolarHBondContact OG-CB 3.41Å; S263-F297 WeakPolarHBondContact OG-CB 3.44Å; S263-F297 PolarHBondContact OG-N 3.33Å; S263-Y306 PolarHBondContact O-OH 3.42Å
264	I	75.3	Confident	74.1	Confident	4 Å²	4	27.2 Å²	27.2	2%	0.021	14%	0.141	C	C	.	.	H	α-helix	trans	-66.7	-47.2	174.8	-65.4	158.3	0	0	0	110.2	L153 L260 L261 T266 Y267 I268 M302 I305 Y306 I309	L153-I264 HydrophobicContact CD2-CD1 3.42Å; L153-I264 VanDerWaalsContact CD2-CD1 3.42Å; L260-I264 HydrophobicContact CG-CD1 4.48Å; L260-I264 WeakPolarHBondContact O-CG1 3.48Å; L260-I264 PolarHBondContact O-N 3.16Å; L261-I264 PolarHBondContact O-N 3.44Å; L261-I264 VanDerWaalsContact O-N 3.12Å; I264-T266 VanDerWaalsContact C-N 3.33Å; I264-T266 PolarHBondContact O-N 3.14Å; I264-Y267 WeakPolarHBondContact O-CB 3.22Å; I264-Y267 PolarHBondContact O-N 2.82Å; I264-I268 HydrophobicContact CG2-CD1 3.92Å; I264-I268 WeakPolarHBondContact O-CG1 3.35Å; I264-I268 PolarHBondContact O-N 3.43Å; I264-M302 HydrophobicContact CD1-CE 4.33Å; I264-M302 HydrophobicContact CG1-CE 3.69Å; I264-I305 HydrophobicContact CD1-CG2 4.36Å; I264-Y306 HydrophobicContact CG1-CE1 4.33Å; I264-I309 HydrophobicContact CD1-CD1 4.01Å; I264-I309 HydrophobicContact CG1-CD1 4.09Å; I264-I309 HydrophobicContact CG2-CD1 4.3Å
265	C	76.3	Confident	76.3	Confident	8 Å²	8	28.3 Å²	28.3	5%	0.054	15%	0.147	C	C	.	.	H	α-helix	trans	-61.2	-42.1	176.7	-67.5	0	0	0	0	111.7	V232 I233 L261 I268 Y269	V232-C265 HydrophobicContact CG1-CB 4.35Å; I233-C265 HydrophobicContact CD1-CB 4.24Å; I233-C265 HydrophobicContact CG1-CB 3.78Å; L261-C265 PolarHBondContact O-N 2.92Å; L261-C265 PolarHBondContact O-SG 3.42Å; L261-C265 VanDerWaalsContact O-SG 3.38Å; C265-I268 PolarHBondContact O-N 2.73Å; C265-Y269 VanDerWaalsContact O-CB 3.27Å; C265-Y269 WeakPolarHBondContact O-CB 3.37Å; C265-Y269 PolarHBondContact O-N 3.09Å
266	T	83.8	Confident	77.9	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.006	13%	0.129	C	C	.	.	H	α-helix	trans	-66.6	-37.9	177.5	-59.7	0	0	0	0	111.5	G262 I264 Y269 R270 I288 L292 V296	G262-T266 WeakPolarHBondContact O-CB 3.18Å; G262-T266 PolarHBondContact O-N 3.3Å; G262-T266 PolarHBondContact O-OG1 3.39Å; I264-T266 VanDerWaalsContact C-N 3.33Å; I264-T266 PolarHBondContact O-N 3.14Å; T266-Y269 PolarHBondContact O-N 2.64Å; T266-R270 WeakPolarHBondContact O-CB 3.21Å; T266-R270 VanDerWaalsContact O-CG 3.28Å; T266-R270 WeakPolarHBondContact O-CG 3.35Å; T266-R270 PolarHBondContact O-N 3.19Å; T266-I288 HydrophobicContact CG2-CG2 4.4Å; T266-L292 HydrophobicContact CG2-CD1 3.92Å; T266-V296 HydrophobicContact CG2-CG2 4.49Å
267	Y	86.3	Confident	79.5	Confident	46 Å²	46	21.7 Å²	21.7	18%	0.18	11%	0.108	C	C	.	.	H	α-helix	trans	-62.6	-49.9	173.4	175	-92.8	0	0	0	112.2	S263 I264 Y269 R270 K271 Y306 L314 I318	S263-Y267 VanDerWaalsContact O-CB 3.32Å; S263-Y267 WeakPolarHBondContact O-CB 3.44Å; S263-Y267 PolarHBondContact O-N 3.46Å; I264-Y267 WeakPolarHBondContact O-CB 3.22Å; I264-Y267 PolarHBondContact O-N 2.82Å; Y267-Y269 VanDerWaalsContact C-N 3.3Å; Y267-Y269 PolarHBondContact O-N 2.91Å; Y267-R270 PolarHBondContact O-N 3.43Å; Y267-K271 HydrophobicContact CD1-CG 4.41Å; Y267-K271 HydrophobicContact CE1-CG 3.96Å; Y267-K271 HydrophobicContact CE2-CD 4.49Å; Y267-K271 HydrophobicContact CE2-CG 4.17Å; Y267-K271 WeakPolarHBondContact O-CG 3.45Å; Y267-K271 PolarHBondContact O-N 2.89Å; Y267-Y306 VanDerWaalsContact CB-OH 3.31Å; Y267-Y306 WeakPolarHBondContact CB-OH 3.34Å; Y267-Y306 HydrophobicContact CD1-CD1 4.44Å; Y267-Y306 HydrophobicContact CD1-CE1 4.14Å; Y267-Y306 HydrophobicContact CD2-CD2 4.27Å; Y267-Y306 HydrophobicContact CD2-CE1 4.24Å; Y267-Y306 AromaticContact CD2-CE2 3.62Å; Y267-Y306 HydrophobicContact CD2-CE2 3.62Å; Y267-Y306 AromaticContact CD2-CZ 3.62Å; Y267-Y306 HydrophobicContact CE2-CD2 4.24Å; Y267-Y306 AromaticContact CE2-CE2 4Å; Y267-Y306 HydrophobicContact CE2-CE2 4Å; Y267-Y306 HydrophobicContact CG-CD1 4.47Å; Y267-Y306 AromaticContact CG-CE1 3.83Å; Y267-Y306 HydrophobicContact CG-CE1 3.83Å; Y267-Y306 HydrophobicContact CG-CE2 4.07Å; Y267-Y306 AromaticContact CG-CZ 3.61Å; Y267-L314 HydrophobicContact CE1-CD1 4.2Å; Y267-I318 HydrophobicContact CE1-CD1 4.49Å
268	I	83.2	Confident	81.3	Confident	4 Å²	4	19.9 Å²	19.9	2%	0.021	10%	0.103	C	C	.	.	H	α-helix	trans	-57.9	-46.7	175.8	-69.3	166	0	0	0	110	F228 I264 C265 R270 K271 V272 L314 Y317	F228-I268 HydrophobicContact CE1-CG2 4.14Å; I264-I268 HydrophobicContact CG2-CD1 3.92Å; I264-I268 WeakPolarHBondContact O-CG1 3.35Å; I264-I268 PolarHBondContact O-N 3.43Å; C265-I268 PolarHBondContact O-N 2.73Å; I268-R270 VanDerWaalsContact C-N 3.35Å; I268-R270 PolarHBondContact O-N 2.93Å; I268-K271 PolarHBondContact O-N 2.94Å; I268-V272 WeakPolarHBondContact O-CG2 3.36Å; I268-V272 PolarHBondContact O-N 3.27Å; I268-L314 HydrophobicContact CD1-CD2 4.46Å; I268-L314 HydrophobicContact CG1-CD2 4.4Å; I268-Y317 HydrophobicContact CD1-CD1 3.88Å; I268-Y317 HydrophobicContact CD1-CE1 3.83Å; I268-Y317 HydrophobicContact CG1-CD1 4.33Å; I268-Y317 HydrophobicContact CG1-CE1 4.49Å; I268-Y317 HydrophobicContact CG2-CD1 4.02Å; I268-Y317 HydrophobicContact CG2-CE1 3.74Å
269	Y	85.6	Confident	82.6	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-55.4	-50.5	178.3	172.3	-99.1	0	0	0	111	I196 L198 F224 F228 L229 I233 C265 T266 Y267 K271 V272 M273	I196-Y269 HydrophobicContact CD1-CE1 4.25Å; L198-Y269 HydrophobicContact CD2-CE1 4.48Å; F224-Y269 AromaticContact CD1-CD2 3.69Å; F224-Y269 HydrophobicContact CD1-CD2 3.69Å; F224-Y269 AromaticContact CD1-CE2 3.88Å; F224-Y269 HydrophobicContact CD1-CE2 3.88Å; F224-Y269 AromaticContact CE1-CD2 3.41Å; F224-Y269 HydrophobicContact CE1-CD2 3.41Å; F224-Y269 VanDerWaalsContact CE1-CD2 3.41Å; F224-Y269 HydrophobicContact CE1-CE2 4.06Å; F224-Y269 HydrophobicContact CE1-CG 4.13Å; F224-Y269 HydrophobicContact CZ-CD2 4.33Å; F228-Y269 HydrophobicContact CB-CD2 4.07Å; L229-Y269 HydrophobicContact CB-CD2 4.29Å; L229-Y269 HydrophobicContact CB-CE2 3.9Å; I233-Y269 HydrophobicContact CD1-CG 4.45Å; C265-Y269 VanDerWaalsContact O-CB 3.27Å; C265-Y269 WeakPolarHBondContact O-CB 3.37Å; C265-Y269 PolarHBondContact O-N 3.09Å; T266-Y269 PolarHBondContact O-N 2.64Å; Y267-Y269 VanDerWaalsContact C-N 3.3Å; Y267-Y269 PolarHBondContact O-N 2.91Å; Y269-K271 PolarHBondContact O-N 3.48Å; Y269-V272 PolarHBondContact O-N 2.97Å; Y269-M273 HydrophobicContact CD1-CG 4.22Å; Y269-M273 HydrophobicContact CD2-CG 3.99Å; Y269-M273 HydrophobicContact CE1-CG 3.87Å; Y269-M273 HydrophobicContact CE2-CG 3.61Å; Y269-M273 HydrophobicContact CE2-SD 3.98Å; Y269-M273 HydrophobicContact CG-CG 4.27Å; Y269-M273 WeakPolarHBondContact O-CB 3.29Å; Y269-M273 WeakPolarHBondContact O-CG 3.48Å; Y269-M273 PolarHBondContact O-N 3.23Å
270	R	90.7	Very high	83.4	Confident	5 Å²	5	26.8 Å²	26.8	2%	0.019	13%	0.13	C	C	.	.	H	α-helix	trans	-63.1	-40.7	179.3	-72.6	-177.5	-56.4	137.1	-5	113	T266 Y267 I268 M273 A274 L286 P287 D299	T266-R270 WeakPolarHBondContact O-CB 3.21Å; T266-R270 VanDerWaalsContact O-CG 3.28Å; T266-R270 WeakPolarHBondContact O-CG 3.35Å; T266-R270 PolarHBondContact O-N 3.19Å; Y267-R270 PolarHBondContact O-N 3.43Å; I268-R270 VanDerWaalsContact C-N 3.35Å; I268-R270 PolarHBondContact O-N 2.93Å; R270-M273 PolarHBondContact O-N 2.8Å; R270-A274 VanDerWaalsContact O-CB 3.28Å; R270-A274 WeakPolarHBondContact O-CB 3.44Å; R270-A274 PolarHBondContact O-N 3.13Å; R270-L286 HydrophobicContact CB-CB 4.23Å; R270-L286 WeakPolarHBondContact CD-O 3.36Å; R270-L286 HydrophobicContact CG-CB 4.32Å; R270-L286 PolarHBondContact NH1-O 2.9Å; R270-P287 VanDerWaalsContact CD-C 3.49Å; R270-P287 WeakPolarHBondContact CD-O 3.47Å; R270-D299 IonicContact CZ-OD1 2.76Å; R270-D299 IonicContact CZ-OD2 3.77Å; R270-D299 VanDerWaalsContact CZ-OD2 3.3Å; R270-D299 IonicContact NH1-OD2 2.66Å; R270-D299 PolarHBondContact NH1-OD2 3.21Å; R270-D299 IonicContact NH2-OD1 2.94Å; R270-D299 PolarHBondContact NH2-OD1 2.91Å; R270-D299 IonicContact NH2-OD2 3.3Å; R270-D299 PolarHBondContact NH2-OD2 2.93Å
271	K	90.1	Very high	84.4	Confident	49 Å²	49	27.9 Å²	27.9	21%	0.213	14%	0.138	C	C	.	.	H	α-helix	trans	-68.1	-37	179	-67.1	-55.5	-178.4	-165.8	0	112.9	Y267 I268 Y269 D275 D285 I318	Y267-K271 HydrophobicContact CD1-CG 4.41Å; Y267-K271 HydrophobicContact CE1-CG 3.96Å; Y267-K271 HydrophobicContact CE2-CD 4.49Å; Y267-K271 HydrophobicContact CE2-CG 4.17Å; Y267-K271 WeakPolarHBondContact O-CG 3.45Å; Y267-K271 PolarHBondContact O-N 2.89Å; I268-K271 PolarHBondContact O-N 2.94Å; Y269-K271 PolarHBondContact O-N 3.48Å; K271-D275 PolarHBondContact O-N 2.76Å; K271-D285 VanDerWaalsContact NZ-CG 3.27Å; K271-D285 IonicContact NZ-OD1 2.8Å; K271-D285 PolarHBondContact NZ-OD1 3.19Å; K271-D285 IonicContact NZ-OD2 2.88Å; K271-D285 PolarHBondContact NZ-OD2 3.24Å; K271-I318 HydrophobicContact CB-CD1 3.66Å; K271-I318 HydrophobicContact CB-CG1 4.34Å; K271-I318 HydrophobicContact CG-CD1 4.09Å
272	V	89.2	Confident	85.3	Confident	1 Å²	1	37 Å²	37	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-71.4	-43.1	174.1	175.1	0	0	0	0	110.8	F224 I268 Y269 A274 D275 I276 I318 C321 K322	F224-V272 HydrophobicContact CD1-CB 4.31Å; F224-V272 HydrophobicContact CD1-CG1 3.92Å; F224-V272 HydrophobicContact CD2-CG1 4.1Å; F224-V272 HydrophobicContact CE1-CB 3.5Å; F224-V272 VanDerWaalsContact CE1-CB 3.5Å; F224-V272 HydrophobicContact CE1-CG1 3.57Å; F224-V272 HydrophobicContact CE1-CG2 4.31Å; F224-V272 HydrophobicContact CE2-CB 4.13Å; F224-V272 HydrophobicContact CE2-CG1 3.78Å; F224-V272 HydrophobicContact CE2-CG2 4.26Å; F224-V272 HydrophobicContact CG-CG1 4.17Å; F224-V272 HydrophobicContact CZ-CB 3.41Å; F224-V272 VanDerWaalsContact CZ-CB 3.41Å; F224-V272 HydrophobicContact CZ-CG1 3.52Å; F224-V272 HydrophobicContact CZ-CG2 3.72Å; I268-V272 WeakPolarHBondContact O-CG2 3.36Å; I268-V272 PolarHBondContact O-N 3.27Å; Y269-V272 PolarHBondContact O-N 2.97Å; V272-A274 PolarHBondContact O-N 3.26Å; V272-D275 WeakPolarHBondContact O-CB 3.4Å; V272-D275 PolarHBondContact O-N 3.46Å; V272-I276 HydrophobicContact CG1-CD1 4.02Å; V272-I276 WeakPolarHBondContact O-CG1 3.22Å; V272-I276 PolarHBondContact O-N 3.33Å; V272-I318 HydrophobicContact CG2-CB 4.48Å; V272-I318 HydrophobicContact CG2-CG1 4.47Å; V272-I318 HydrophobicContact CG2-CG2 3.98Å; V272-C321 HydrophobicContact CG2-CB 4.1Å; V272-K322 HydrophobicContact CG1-CG 4.46Å
273	M	89.9	Confident	86.1	Confident	0 Å²	0	39 Å²	39	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.9	-38.7	177.6	-71.7	-66.7	-74.9	0	0	112.7	L198 E199 L221 F224 Y269 R270 D275 I276 I277 L286	L198-M273 HydrophobicContact CD2-CB 4.23Å; L198-M273 HydrophobicContact CD2-CE 3.29Å; L198-M273 HydrophobicContact CD2-CG 4.32Å; E199-M273 HydrophobicContact CG-CE 4.35Å; L221-M273 HydrophobicContact CD2-CE 3.3Å; L221-M273 HydrophobicContact CD2-SD 3.81Å; F224-M273 HydrophobicContact CD1-CG 3.95Å; F224-M273 HydrophobicContact CD1-SD 3.79Å; F224-M273 HydrophobicContact CE1-CG 4.1Å; Y269-M273 HydrophobicContact CD1-CG 4.22Å; Y269-M273 HydrophobicContact CD2-CG 3.99Å; Y269-M273 HydrophobicContact CE1-CG 3.87Å; Y269-M273 HydrophobicContact CE2-CG 3.61Å; Y269-M273 HydrophobicContact CE2-SD 3.98Å; Y269-M273 HydrophobicContact CG-CG 4.27Å; Y269-M273 WeakPolarHBondContact O-CB 3.29Å; Y269-M273 WeakPolarHBondContact O-CG 3.48Å; Y269-M273 PolarHBondContact O-N 3.23Å; R270-M273 PolarHBondContact O-N 2.8Å; M273-D275 VanDerWaalsContact C-N 3.25Å; M273-D275 PolarHBondContact O-N 3Å; M273-I276 PolarHBondContact O-N 3.41Å; M273-I276 HydrophobicContact SD-CD1 4.1Å; M273-I277 WeakPolarHBondContact O-CB 3.42Å; M273-I277 VanDerWaalsContact O-CG1 3.25Å; M273-I277 WeakPolarHBondContact O-CG1 3.19Å; M273-I277 PolarHBondContact O-N 3.38Å; M273-L286 HydrophobicContact CB-CD1 3.45Å; M273-L286 VanDerWaalsContact CB-CD1 3.45Å
274	A	91.4	Very high	86.4	Confident	4 Å²	4	45 Å²	45	3%	0.033	22%	0.217	C	C	.	.	H	α-helix	trans	-59.8	-42.2	177.6	0	0	0	0	0	110.3	R270 V272 I277 S278 L286	R270-A274 VanDerWaalsContact O-CB 3.28Å; R270-A274 WeakPolarHBondContact O-CB 3.44Å; R270-A274 PolarHBondContact O-N 3.13Å; V272-A274 PolarHBondContact O-N 3.26Å; A274-I277 PolarHBondContact O-N 3.18Å; A274-S278 WeakPolarHBondContact O-CB 3.31Å; A274-S278 PolarHBondContact O-N 3.42Å; A274-L286 HydrophobicContact CB-CD1 3.93Å; A274-L286 HydrophobicContact CB-CG 3.9Å
275	D	89.1	Confident	86.9	Confident	65 Å²	65	48.6 Å²	48.6	35%	0.348	24%	0.236	S	C	.	.	H	α-helix	trans	-66.1	-44.4	177.6	-159.5	78.9	0	0	0	112.5	K271 V272 M273 I277 S278 K322	K271-D275 PolarHBondContact O-N 2.76Å; V272-D275 WeakPolarHBondContact O-CB 3.4Å; V272-D275 PolarHBondContact O-N 3.46Å; M273-D275 VanDerWaalsContact C-N 3.25Å; M273-D275 PolarHBondContact O-N 3Å; D275-I277 PolarHBondContact O-N 3.36Å; D275-S278 WeakPolarHBondContact O-CB 3.39Å; D275-S278 PolarHBondContact O-N 2.91Å; D275-S278 VanDerWaalsContact O-N 3.15Å; D275-S278 PolarHBondContact O-OG 3.19Å; D275-K322 HydrophobicContact CB-CD 4.47Å; D275-K322 VanDerWaalsContact CB-CE 3.47Å; D275-K322 IonicContact OD1-NZ 3.74Å; D275-K322 PolarHBondContact OD1-NZ 2.89Å; D275-K322 WeakPolarHBondContact OD2-CD 3.3Å; D275-K322 WeakPolarHBondContact OD2-CE 3.34Å; D275-K322 IonicContact OD2-NZ 3.39Å; D275-K322 PolarHBondContact OD2-NZ 3.21Å
276	I	89.8	Confident	87.5	Confident	5 Å²	5	49.1 Å²	49.1	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-59.9	-49.1	175.2	-62.2	161.8	0	0	0	109.8	Y217 K220 L221 V272 M273 S278 E279 L325	Y217-I276 HydrophobicContact CD2-CG2 4.11Å; Y217-I276 HydrophobicContact CE2-CG2 4.07Å; Y217-I276 VanDerWaalsContact CE2-O 3.23Å; Y217-I276 WeakPolarHBondContact CE2-O 3.03Å; K220-I276 HydrophobicContact CB-CD1 4.14Å; K220-I276 HydrophobicContact CB-CG1 4.34Å; K220-I276 HydrophobicContact CB-CG2 4.03Å; K220-I276 HydrophobicContact CD-CG2 4.34Å; L221-I276 HydrophobicContact CD2-CB 4.33Å; L221-I276 HydrophobicContact CD2-CG2 3.7Å; L221-I276 HydrophobicContact CG-CG2 3.92Å; V272-I276 HydrophobicContact CG1-CD1 4.02Å; V272-I276 WeakPolarHBondContact O-CG1 3.22Å; V272-I276 PolarHBondContact O-N 3.33Å; M273-I276 PolarHBondContact O-N 3.41Å; M273-I276 HydrophobicContact SD-CD1 4.1Å; I276-S278 PolarHBondContact O-N 3.46Å; I276-E279 VanDerWaalsContact O-CB 3.24Å; I276-E279 WeakPolarHBondContact O-CB 3.48Å; I276-E279 VanDerWaalsContact O-CG 3.31Å; I276-E279 WeakPolarHBondContact O-CG 3.43Å; I276-E279 PolarHBondContact O-N 2.9Å; I276-E279 VanDerWaalsContact O-N 3.1Å; I276-L325 HydrophobicContact CD1-CD2 3.45Å; I276-L325 VanDerWaalsContact CD1-CD2 3.45Å; I276-L325 HydrophobicContact CG1-CD2 4.18Å
277	I	90	Very high	87.8	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-64.8	-26.7	-180	-68.4	172.6	0	0	0	111.2	L198 Q202 L221 M273 A274 D275 E279 R280 T281 T283 L286	L198-I277 HydrophobicContact CD2-CD1 4.16Å; Q202-I277 HydrophobicContact CG-CD1 3.63Å; Q202-I277 HydrophobicContact CG-CG1 3.87Å; L221-I277 HydrophobicContact CD2-CG1 4.24Å; M273-I277 WeakPolarHBondContact O-CB 3.42Å; M273-I277 VanDerWaalsContact O-CG1 3.25Å; M273-I277 WeakPolarHBondContact O-CG1 3.19Å; M273-I277 PolarHBondContact O-N 3.38Å; A274-I277 PolarHBondContact O-N 3.18Å; D275-I277 PolarHBondContact O-N 3.36Å; I277-E279 PolarHBondContact O-N 3.43Å; I277-R280 PolarHBondContact O-N 3.47Å; I277-R280 VanDerWaalsContact O-N 3.12Å; I277-T281 HydrophobicContact CG2-CG2 4.43Å; I277-T281 WeakPolarHBondContact CG2-OG1 3.42Å; I277-T281 PolarHBondContact O-N 3.4Å; I277-T281 PolarHBondContact O-OG1 3.11Å; I277-T283 HydrophobicContact CG2-CG2 4.32Å; I277-L286 HydrophobicContact CD1-CD1 4Å; I277-L286 HydrophobicContact CD1-CD2 4.21Å
278	S	90.1	Very high	87.8	Confident	53 Å²	53	52.4 Å²	52.4	37%	0.371	26%	0.264	S	S	.	.	H	α-helix	trans	-64.3	-19.4	176.3	84.2	0	0	0	0	113.7	A274 D275 I276 R280 T281 T283	A274-S278 WeakPolarHBondContact O-CB 3.31Å; A274-S278 PolarHBondContact O-N 3.42Å; D275-S278 WeakPolarHBondContact O-CB 3.39Å; D275-S278 PolarHBondContact O-N 2.91Å; D275-S278 VanDerWaalsContact O-N 3.15Å; D275-S278 PolarHBondContact O-OG 3.19Å; I276-S278 PolarHBondContact O-N 3.46Å; S278-R280 PolarHBondContact O-N 3.19Å; S278-T281 CarbonylContact C-O 3.49Å; S278-T281 VanDerWaalsContact C-O 3.29Å; S278-T281 WeakPolarHBondContact CA-O 3.44Å; S278-T283 WeakPolarHBondContact CB-O 3.27Å
279	E	86.8	Confident	87.8	Confident	102 Å²	102	52.6 Å²	52.6	48%	0.477	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-23	174.6	-63	176.3	-159.5	0	0	112.3	Y217 K220 I276 I277	Y217-E279 HydrophobicContact CD2-CB 4.25Å; K220-E279 VanDerWaalsContact NZ-CD 3.27Å; K220-E279 IonicContact NZ-OE1 2.72Å; K220-E279 PolarHBondContact NZ-OE1 2.92Å; K220-E279 IonicContact NZ-OE2 3.39Å; K220-E279 PolarHBondContact NZ-OE2 3.26Å; K220-E279 VanDerWaalsContact NZ-OE2 3.11Å; I276-E279 VanDerWaalsContact O-CB 3.24Å; I276-E279 WeakPolarHBondContact O-CB 3.48Å; I276-E279 VanDerWaalsContact O-CG 3.31Å; I276-E279 WeakPolarHBondContact O-CG 3.43Å; I276-E279 PolarHBondContact O-N 2.9Å; I276-E279 VanDerWaalsContact O-N 3.1Å; I277-E279 PolarHBondContact O-N 3.43Å
280	R	86.1	Confident	87.5	Confident	123 Å²	123	55 Å²	55	46%	0.464	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	-24.6	180	-67.1	-171.7	177.3	172.1	2.4	114	T215 Y217 E218 I277 S278	T215-R280 PolarHBondContact OG1-NH2 3.47Å; Y217-R280 VanDerWaalsContact CD1-NH1 3.32Å; Y217-R280 HydrophobicContact CD2-CG 4.07Å; Y217-R280 HydrophobicContact CE2-CB 4.36Å; Y217-R280 HydrophobicContact CE2-CG 3.82Å; E218-R280 IonicContact OE1-CZ 3.23Å; E218-R280 VanDerWaalsContact OE1-CZ 3.23Å; E218-R280 IonicContact OE1-NH1 2.82Å; E218-R280 PolarHBondContact OE1-NH1 3.43Å; E218-R280 IonicContact OE1-NH2 2.76Å; E218-R280 PolarHBondContact OE1-NH2 2.92Å; E218-R280 IonicContact OE2-NH2 3.52Å; I277-R280 PolarHBondContact O-N 3.47Å; I277-R280 VanDerWaalsContact O-N 3.12Å; S278-R280 PolarHBondContact O-N 3.19Å
281	T	84.9	Confident	86.8	Confident	53 Å²	53	58.2 Å²	58.2	33%	0.325	31%	0.305	S	S	.	.	S	Bend	trans	-131.5	161.8	-175.1	67.7	0	0	0	0	109.4	I277 S278 T283	I277-T281 HydrophobicContact CG2-CG2 4.43Å; I277-T281 WeakPolarHBondContact CG2-OG1 3.42Å; I277-T281 PolarHBondContact O-N 3.4Å; I277-T281 PolarHBondContact O-OG1 3.11Å; S278-T281 CarbonylContact C-O 3.49Å; S278-T281 VanDerWaalsContact C-O 3.29Å; S278-T281 WeakPolarHBondContact CA-O 3.44Å; T281-T283 PolarHBondContact O-N 3.41Å; T281-T283 WeakPolarHBondContact OG1-CB 3.29Å; T281-T283 PolarHBondContact OG1-OG1 2.92Å
282	R	84.7	Confident	86.1	Confident	251 Å²	251	56.1 Å²	56.1	95%	0.947	30%	0.296	S	S	*	.			trans	-82.7	33.7	175.4	-65.6	-175.9	179.8	176.9	0.2	112.8	T284	R282-T284 PolarHBondContact O-N 3.02Å
283	T	86.9	Confident	85.6	Confident	41 Å²	41	61.5 Å²	61.5	25%	0.252	32%	0.322	S	S	.	.			trans	-76.8	119.1	-175.4	-57.8	0	0	0	0	110.5	I277 S278 T281 D285 L286	I277-T283 HydrophobicContact CG2-CG2 4.32Å; S278-T283 WeakPolarHBondContact CB-O 3.27Å; T281-T283 PolarHBondContact O-N 3.41Å; T281-T283 WeakPolarHBondContact OG1-CB 3.29Å; T281-T283 PolarHBondContact OG1-OG1 2.92Å; T283-D285 VanDerWaalsContact CG2-O 3.31Å; T283-D285 WeakPolarHBondContact CG2-O 2.95Å; T283-L286 HydrophobicContact CG2-CD2 3.67Å; T283-L286 HydrophobicContact CG2-CG 4.25Å
284	T	84.1	Confident	84.9	Confident	128 Å²	128	68.9 Å²	68.9	79%	0.785	36%	0.361	S	S	*	.			trans	-108.8	-13.3	179.8	56.3	0	0	0	0	113.3	R282	R282-T284 PolarHBondContact O-N 3.02Å
285	D	86.3	Confident	83.9	Confident	80 Å²	80	72.3 Å²	72.3	43%	0.428	38%	0.377	S	S	.	.			trans	-148.9	154	176.8	-151.9	6.4	0	0	0	111.1	K271 T283	K271-D285 VanDerWaalsContact NZ-CG 3.27Å; K271-D285 IonicContact NZ-OD1 2.8Å; K271-D285 PolarHBondContact NZ-OD1 3.19Å; K271-D285 IonicContact NZ-OD2 2.88Å; K271-D285 PolarHBondContact NZ-OD2 3.24Å; T283-D285 VanDerWaalsContact CG2-O 3.31Å; T283-D285 WeakPolarHBondContact CG2-O 2.95Å
286	L	89.7	Confident	83.4	Confident	18 Å²	18	69.4 Å²	69.4	9%	0.094	36%	0.362	C	S	.	.			trans	-126.4	138.3	178.7	-68.3	169.3	0	0	0	109.7	L198 R270 M273 A274 I277 T283	L198-L286 HydrophobicContact CD1-CB 4.09Å; L198-L286 HydrophobicContact CD1-CD1 3.86Å; L198-L286 HydrophobicContact CD1-CD2 3.95Å; L198-L286 HydrophobicContact CD1-CG 4.17Å; L198-L286 HydrophobicContact CD2-CD1 4.29Å; R270-L286 HydrophobicContact CB-CB 4.23Å; R270-L286 WeakPolarHBondContact CD-O 3.36Å; R270-L286 HydrophobicContact CG-CB 4.32Å; R270-L286 PolarHBondContact NH1-O 2.9Å; M273-L286 HydrophobicContact CB-CD1 3.45Å; M273-L286 VanDerWaalsContact CB-CD1 3.45Å; A274-L286 HydrophobicContact CB-CD1 3.93Å; A274-L286 HydrophobicContact CB-CG 3.9Å; I277-L286 HydrophobicContact CD1-CD1 4Å; I277-L286 HydrophobicContact CD1-CD2 4.21Å; T283-L286 HydrophobicContact CG2-CD2 3.67Å; T283-L286 HydrophobicContact CG2-CG 4.25Å
287	P	89.9	Confident	83	Confident	94 Å²	94	71.1 Å²	71.1	61%	0.61	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-68.9	163.2	173.4	31.1	-35.3	0	0	0	110.8	R270 P289	R270-P287 VanDerWaalsContact CD-C 3.49Å; R270-P287 WeakPolarHBondContact CD-O 3.47Å; P287-P289 WeakPolarHBondContact O-CD 3.19Å
288	I	86.3	Confident	82.9	Confident	22 Å²	22	74.1 Å²	74.1	11%	0.113	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-60.4	124.3	168.1	-62.4	173.4	0	0	0	108.2	T266 G290 L292 Q293 V296 N298	T266-I288 HydrophobicContact CG2-CG2 4.4Å; I288-G290 PolarHBondContact O-N 2.87Å; I288-L292 HydrophobicContact CG2-CB 4.03Å; I288-Q293 HydrophobicContact CB-CG 4.18Å; I288-Q293 HydrophobicContact CG2-CG 3.91Å; I288-Q293 PolarHBondContact O-NE2 2.98Å; I288-V296 HydrophobicContact CD1-CG2 4.06Å; I288-V296 HydrophobicContact CG2-CG2 3.73Å; I288-N298 HydrophobicContact CD1-CB 4.25Å
289	P	82.8	Confident	82.9	Confident	8 Å²	8	74 Å²	74	5%	0.052	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-51.4	136.6	176.1	-27.2	34.6	0	0	0	110.6	I196 P287 E291 L292 Q293	I196-P289 HydrophobicContact CD1-CB 3.94Å; I196-P289 HydrophobicContact CD1-CG 3.83Å; P287-P289 WeakPolarHBondContact O-CD 3.19Å; P289-E291 WeakPolarHBondContact CB-OE2 3.44Å; P289-E291 PolarHBondContact O-N 3.41Å; P289-E291 VanDerWaalsContact O-N 3.09Å; P289-L292 HydrophobicContact CB-CD1 4.37Å; P289-L292 HydrophobicContact CB-CG 4.36Å; P289-L292 HydrophobicContact CG-CD1 4.14Å; P289-L292 WeakPolarHBondContact O-CA 3.31Å; P289-L292 PolarHBondContact O-N 3.17Å; P289-Q293 PolarHBondContact O-N 3.03Å
290	G	79.2	Confident	83	Confident	50 Å²	50	74.8 Å²	74.8	52%	0.515	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-53.9	-34.2	-177.3	0	0	0	0	0	112.5	I288 L292 Q293	I288-G290 PolarHBondContact O-N 2.87Å; G290-L292 PolarHBondContact O-N 3.42Å; G290-L292 VanDerWaalsContact O-N 3.16Å; G290-Q293 PolarHBondContact O-N 3.15Å
291	E	74.8	Confident	83	Confident	73 Å²	73	74 Å²	74	34%	0.341	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-62.1	-19.4	176.3	-56.5	87.6	165.4	0	0	113.6	I196 T197 P289	I196-E291 HydrophobicContact CG2-CB 4.49Å; I196-E291 HydrophobicContact CG2-CG 4.17Å; T197-E291 WeakPolarHBondContact CB-OE1 3.3Å; T197-E291 PolarHBondContact N-OE1 3.17Å; T197-E291 PolarHBondContact OG1-OE1 3.26Å; P289-E291 WeakPolarHBondContact CB-OE2 3.44Å; P289-E291 PolarHBondContact O-N 3.41Å; P289-E291 VanDerWaalsContact O-N 3.09Å
292	L	75.6	Confident	82.9	Confident	5 Å²	5	71.6 Å²	71.6	3%	0.026	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-113.4	-13.3	-176.2	-60.1	-179.8	0	0	0	114	L229 I233 T266 I288 P289 G290 N294 M295 V296	L229-L292 HydrophobicContact CD1-CD1 3.86Å; I233-L292 HydrophobicContact CG2-CD1 3.92Å; I233-L292 HydrophobicContact CG2-CD2 3.78Å; T266-L292 HydrophobicContact CG2-CD1 3.92Å; I288-L292 HydrophobicContact CG2-CB 4.03Å; P289-L292 HydrophobicContact CB-CD1 4.37Å; P289-L292 HydrophobicContact CB-CG 4.36Å; P289-L292 HydrophobicContact CG-CD1 4.14Å; P289-L292 WeakPolarHBondContact O-CA 3.31Å; P289-L292 PolarHBondContact O-N 3.17Å; G290-L292 PolarHBondContact O-N 3.42Å; G290-L292 VanDerWaalsContact O-N 3.16Å; L292-N294 PolarHBondContact O-N 3.22Å; L292-M295 HydrophobicContact CD2-SD 4.46Å; L292-M295 WeakPolarHBondContact O-CA 3.4Å; L292-M295 PolarHBondContact O-N 3.15Å; L292-V296 HydrophobicContact CB-CG2 4.48Å; L292-V296 WeakPolarHBondContact O-CG2 3.44Å; L292-V296 PolarHBondContact O-N 3.47Å
293	Q	78.7	Confident	82.9	Confident	115 Å²	115	66.8 Å²	66.8	54%	0.537	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-35.4	-168.3	-75.7	179	2.1	0	0	114.3	I288 P289 G290	I288-Q293 HydrophobicContact CB-CG 4.18Å; I288-Q293 HydrophobicContact CG2-CG 3.91Å; I288-Q293 PolarHBondContact O-NE2 2.98Å; P289-Q293 PolarHBondContact O-N 3.03Å; G290-Q293 PolarHBondContact O-N 3.15Å
294	N	74.9	Confident	82.3	Confident	154 Å²	154	72.5 Å²	72.5	82%	0.824	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-13.2	179.5	-62.5	-31.7	0	0	0	113.6	L292	L292-N294 PolarHBondContact O-N 3.22Å
295	M	70.8	Confident	81.7	Confident	77 Å²	77	68 Å²	68	38%	0.379	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-16.7	-175.7	-58.8	-175.6	-175.6	0	0	113.1	F237 K259 L292	F237-M295 HydrophobicContact CB-SD 4.26Å; F237-M295 HydrophobicContact CD1-CB 4.29Å; F237-M295 HydrophobicContact CE1-CB 4.31Å; F237-M295 WeakPolarHBondContact CE1-O 3.45Å; F237-M295 HydrophobicContact CG-CB 4.47Å; F237-M295 HydrophobicContact CG-SD 4.46Å; F237-M295 HydrophobicContact CZ-CB 4.49Å; F237-M295 WeakPolarHBondContact CZ-O 3.46Å; K259-M295 WeakPolarHBondContact CG-O 3.49Å; L292-M295 HydrophobicContact CD2-SD 4.46Å; L292-M295 WeakPolarHBondContact O-CA 3.4Å; L292-M295 PolarHBondContact O-N 3.15Å
296	V	78.4	Confident	81.1	Confident	4 Å²	4	65.1 Å²	65.1	2%	0.024	34%	0.343	C	S	.	.	S	Bend	trans	-124.3	160	-179.1	-60.5	0	0	0	0	111.6	F237 K259 S263 T266 I288 L292	F237-V296 HydrophobicContact CE2-CG1 3.9Å; F237-V296 HydrophobicContact CZ-CG1 3.77Å; K259-V296 WeakPolarHBondContact CE-O 3.37Å; S263-V296 WeakPolarHBondContact OG-CB 3.41Å; T266-V296 HydrophobicContact CG2-CG2 4.49Å; I288-V296 HydrophobicContact CD1-CG2 4.06Å; I288-V296 HydrophobicContact CG2-CG2 3.73Å; L292-V296 HydrophobicContact CB-CG2 4.48Å; L292-V296 WeakPolarHBondContact O-CG2 3.44Å; L292-V296 PolarHBondContact O-N 3.47Å
297	F	81.2	Confident	80.2	Confident	40 Å²	40	66.3 Å²	66.3	18%	0.175	36%	0.36	C	S	.	.			trans	-74.9	147	166.1	-64.2	-68.2	0	0	0	109.5	I256 K259 L260 S263 E301 M302	I256-F297 HydrophobicContact CG2-CZ 4.29Å; K259-F297 HydrophobicContact CB-CD2 4.26Å; K259-F297 HydrophobicContact CB-CE2 3.81Å; K259-F297 HydrophobicContact CB-CZ 4.29Å; K259-F297 HydrophobicContact CD-CD1 4.05Å; K259-F297 HydrophobicContact CD-CD2 4.15Å; K259-F297 HydrophobicContact CD-CE1 3.77Å; K259-F297 HydrophobicContact CD-CE2 3.87Å; K259-F297 HydrophobicContact CD-CG 4.22Å; K259-F297 HydrophobicContact CD-CZ 3.67Å; K259-F297 HydrophobicContact CG-CD1 4.37Å; K259-F297 HydrophobicContact CG-CD2 3.6Å; K259-F297 HydrophobicContact CG-CE1 4.3Å; K259-F297 HydrophobicContact CG-CE2 3.51Å; K259-F297 HydrophobicContact CG-CG 4.03Å; K259-F297 HydrophobicContact CG-CZ 3.88Å; L260-F297 HydrophobicContact CB-CE2 4.3Å; L260-F297 HydrophobicContact CD1-CD2 4.47Å; S263-F297 WeakPolarHBondContact OG-CB 3.44Å; S263-F297 PolarHBondContact OG-N 3.33Å; F297-E301 VanDerWaalsContact CA-OE2 3.24Å; F297-E301 WeakPolarHBondContact CA-OE2 3.45Å; F297-E301 HydrophobicContact CB-CB 4.04Å; F297-E301 WeakPolarHBondContact CB-OE2 3.46Å; F297-E301 HydrophobicContact CD1-CB 4.44Å; F297-M302 HydrophobicContact CB-CG 3.62Å; F297-M302 HydrophobicContact CB-SD 3.75Å; F297-M302 HydrophobicContact CD2-SD 3.91Å; F297-M302 HydrophobicContact CG-SD 4.18Å
298	N	89.5	Confident	78.8	Confident	65 Å²	65	63.8 Å²	63.8	35%	0.348	34%	0.34	S	S	.	.			trans	-77.7	168.1	176.3	69.9	59	0	0	0	112	I288 T300 E301 M302	I288-N298 HydrophobicContact CD1-CB 4.25Å; N298-T300 PolarHBondContact O-N 3.21Å; N298-T300 WeakPolarHBondContact OD1-CA 3.47Å; N298-T300 WeakPolarHBondContact OD1-CB 3.44Å; N298-T300 PolarHBondContact OD1-N 3.37Å; N298-E301 PolarHBondContact N-OE2 3.33Å; N298-E301 VanDerWaalsContact ND2-CD 3.32Å; N298-E301 PolarHBondContact ND2-OE2 3.39Å; N298-E301 VanDerWaalsContact ND2-OE2 3.09Å; N298-E301 PolarHBondContact O-N 2.95Å; N298-E301 PolarHBondContact OD1-N 3.01Å; N298-M302 WeakPolarHBondContact O-CG 3.38Å; N298-M302 PolarHBondContact O-N 3.31Å
299	D	89.1	Confident	77.7	Confident	51 Å²	51	62.7 Å²	62.7	27%	0.273	34%	0.335	S	S	.	.	H	α-helix	trans	-63	-27.6	-177	-73.7	-35.5	0	0	0	113.7	R270 K303	R270-D299 IonicContact CZ-OD1 2.76Å; R270-D299 IonicContact CZ-OD2 3.77Å; R270-D299 VanDerWaalsContact CZ-OD2 3.3Å; R270-D299 IonicContact NH1-OD2 2.66Å; R270-D299 PolarHBondContact NH1-OD2 3.21Å; R270-D299 IonicContact NH2-OD1 2.94Å; R270-D299 PolarHBondContact NH2-OD1 2.91Å; R270-D299 IonicContact NH2-OD2 3.3Å; R270-D299 PolarHBondContact NH2-OD2 2.93Å; D299-K303 PolarHBondContact O-N 3.35Å; D299-K303 VanDerWaalsContact O-N 3.11Å
300	T	89.8	Confident	77.2	Confident	119 Å²	119	63 Å²	63	73%	0.73	34%	0.339	S	S	*	.	H	α-helix	trans	-70.2	-46.1	177	-54.9	0	0	0	0	110.3	N298 M302 K303	N298-T300 PolarHBondContact O-N 3.21Å; N298-T300 WeakPolarHBondContact OD1-CA 3.47Å; N298-T300 WeakPolarHBondContact OD1-CB 3.44Å; N298-T300 PolarHBondContact OD1-N 3.37Å; T300-M302 VanDerWaalsContact C-N 3.28Å; T300-M302 PolarHBondContact O-N 2.91Å; T300-K303 WeakPolarHBondContact O-CB 3.28Å; T300-K303 PolarHBondContact O-N 3.34Å
301	E	86.4	Confident	77.1	Confident	106 Å²	106	70.5 Å²	70.5	50%	0.495	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-36.2	175.8	-67.1	172.3	132.8	0	0	111.7	F297 N298	F297-E301 VanDerWaalsContact CA-OE2 3.24Å; F297-E301 WeakPolarHBondContact CA-OE2 3.45Å; F297-E301 HydrophobicContact CB-CB 4.04Å; F297-E301 WeakPolarHBondContact CB-OE2 3.46Å; F297-E301 HydrophobicContact CD1-CB 4.44Å; N298-E301 PolarHBondContact N-OE2 3.33Å; N298-E301 VanDerWaalsContact ND2-CD 3.32Å; N298-E301 PolarHBondContact ND2-OE2 3.39Å; N298-E301 VanDerWaalsContact ND2-OE2 3.09Å; N298-E301 PolarHBondContact O-N 2.95Å; N298-E301 PolarHBondContact OD1-N 3.01Å
302	M	82.8	Confident	77.4	Confident	3 Å²	3	77.3 Å²	77.3	2%	0.015	38%	0.375	C	S	.	.	H	α-helix	trans	-88.5	-4	-176.4	-66.4	-65.7	-64.6	0	0	114.7	L260 I264 F297 N298 T300 Q304 I305 Y306	L260-M302 HydrophobicContact CD1-CE 3.63Å; L260-M302 HydrophobicContact CD1-SD 3.63Å; L260-M302 HydrophobicContact CG-CE 4.43Å; I264-M302 HydrophobicContact CD1-CE 4.33Å; I264-M302 HydrophobicContact CG1-CE 3.69Å; F297-M302 HydrophobicContact CB-CG 3.62Å; F297-M302 HydrophobicContact CB-SD 3.75Å; F297-M302 HydrophobicContact CD2-SD 3.91Å; F297-M302 HydrophobicContact CG-SD 4.18Å; N298-M302 WeakPolarHBondContact O-CG 3.38Å; N298-M302 PolarHBondContact O-N 3.31Å; T300-M302 VanDerWaalsContact C-N 3.28Å; T300-M302 PolarHBondContact O-N 2.91Å; M302-Q304 VanDerWaalsContact C-N 3.3Å; M302-Q304 PolarHBondContact O-N 3.02Å; M302-I305 HydrophobicContact CE-CB 3.92Å; M302-I305 HydrophobicContact CE-CG1 4.28Å; M302-I305 HydrophobicContact CE-CG2 3.76Å; M302-I305 WeakPolarHBondContact O-CB 3.5Å; M302-I305 PolarHBondContact O-N 3.35Å; M302-I305 HydrophobicContact SD-CG1 4.36Å; M302-Y306 HydrophobicContact CB-CD1 4.45Å; M302-Y306 HydrophobicContact CB-CD2 3.93Å; M302-Y306 HydrophobicContact CB-CE1 3.89Å; M302-Y306 HydrophobicContact CB-CE2 3.3Å; M302-Y306 HydrophobicContact CB-CG 4.45Å; M302-Y306 WeakPolarHBondContact CB-OH 3.21Å; M302-Y306 HydrophobicContact CE-CE1 3.9Å; M302-Y306 HydrophobicContact CG-CE2 4.4Å; M302-Y306 WeakPolarHBondContact O-CD2 3.44Å; M302-Y306 PolarHBondContact O-N 3.21Å
303	K	84.6	Confident	77.2	Confident	149 Å²	149	78.7 Å²	78.7	65%	0.648	38%	0.38	S	S	*	.	H	α-helix	trans	-53.2	-44	-172.8	-175.1	178.9	179.4	-179.4	0	113.2	D299 T300 G307	D299-K303 PolarHBondContact O-N 3.35Å; D299-K303 VanDerWaalsContact O-N 3.11Å; T300-K303 WeakPolarHBondContact O-CB 3.28Å; T300-K303 PolarHBondContact O-N 3.34Å; K303-G307 PolarHBondContact O-N 2.82Å; K303-G307 VanDerWaalsContact O-N 3.15Å
304	Q	73.7	Confident	76.7	Confident	162 Å²	162	73.5 Å²	73.5	76%	0.757	36%	0.355	S	S	*	.	H	α-helix	trans	-68.3	-43.7	178.2	-70.4	-176.6	-7.3	0	0	111.4	M302 Y306 G307 M308	M302-Q304 VanDerWaalsContact C-N 3.3Å; M302-Q304 PolarHBondContact O-N 3.02Å; Q304-Y306 PolarHBondContact O-N 2.89Å; Q304-G307 CarbonylContact O-C 3.29Å; Q304-G307 VanDerWaalsContact O-CA 3.31Å; Q304-G307 WeakPolarHBondContact O-CA 3.37Å; Q304-G307 PolarHBondContact O-N 2.89Å; Q304-M308 WeakPolarHBondContact O-CG 3.45Å; Q304-M308 PolarHBondContact O-N 2.93Å
305	I	70.7	Confident	77	Confident	32 Å²	32	68.2 Å²	68.2	16%	0.164	33%	0.333	C	S	.	.	H	α-helix	trans	-61.1	-43.5	178.9	-54.6	-64.5	0	0	0	111.3	F149 L260 I264 M302 G307 M308 I309	F149-I305 HydrophobicContact CE1-CD1 3.92Å; F149-I305 HydrophobicContact CE1-CG2 4.21Å; F149-I305 HydrophobicContact CZ-CD1 4.39Å; F149-I305 HydrophobicContact CZ-CG2 4.44Å; L260-I305 HydrophobicContact CD1-CD1 4.41Å; L260-I305 HydrophobicContact CD1-CG1 4.1Å; L260-I305 HydrophobicContact CD1-CG2 4.29Å; I264-I305 HydrophobicContact CD1-CG2 4.36Å; M302-I305 HydrophobicContact CE-CB 3.92Å; M302-I305 HydrophobicContact CE-CG1 4.28Å; M302-I305 HydrophobicContact CE-CG2 3.76Å; M302-I305 WeakPolarHBondContact O-CB 3.5Å; M302-I305 PolarHBondContact O-N 3.35Å; M302-I305 HydrophobicContact SD-CG1 4.36Å; I305-G307 VanDerWaalsContact C-N 3.27Å; I305-G307 PolarHBondContact O-N 2.92Å; I305-M308 HydrophobicContact CD1-SD 4.03Å; I305-M308 WeakPolarHBondContact O-CB 3.29Å; I305-M308 PolarHBondContact O-N 3.34Å; I305-I309 HydrophobicContact CG2-CD1 4.24Å; I305-I309 WeakPolarHBondContact O-CG1 2.91Å; I305-I309 PolarHBondContact O-N 3.16Å
306	Y	73.9	Confident	77.2	Confident	20 Å²	20	69.1 Å²	69.1	8%	0.078	34%	0.34	C	S	.	.	H	α-helix	trans	-63.4	-35.2	173.9	-58.9	-35.2	0	0	0	112.2	S263 I264 Y267 M302 Q304 G310 L314	S263-Y306 PolarHBondContact O-OH 3.42Å; I264-Y306 HydrophobicContact CG1-CE1 4.33Å; Y267-Y306 VanDerWaalsContact CB-OH 3.31Å; Y267-Y306 WeakPolarHBondContact CB-OH 3.34Å; Y267-Y306 HydrophobicContact CD1-CD1 4.44Å; Y267-Y306 HydrophobicContact CD1-CE1 4.14Å; Y267-Y306 HydrophobicContact CD2-CD2 4.27Å; Y267-Y306 HydrophobicContact CD2-CE1 4.24Å; Y267-Y306 AromaticContact CD2-CE2 3.62Å; Y267-Y306 HydrophobicContact CD2-CE2 3.62Å; Y267-Y306 AromaticContact CD2-CZ 3.62Å; Y267-Y306 HydrophobicContact CE2-CD2 4.24Å; Y267-Y306 AromaticContact CE2-CE2 4Å; Y267-Y306 HydrophobicContact CE2-CE2 4Å; Y267-Y306 HydrophobicContact CG-CD1 4.47Å; Y267-Y306 AromaticContact CG-CE1 3.83Å; Y267-Y306 HydrophobicContact CG-CE1 3.83Å; Y267-Y306 HydrophobicContact CG-CE2 4.07Å; Y267-Y306 AromaticContact CG-CZ 3.61Å; M302-Y306 HydrophobicContact CB-CD1 4.45Å; M302-Y306 HydrophobicContact CB-CD2 3.93Å; M302-Y306 HydrophobicContact CB-CE1 3.89Å; M302-Y306 HydrophobicContact CB-CE2 3.3Å; M302-Y306 HydrophobicContact CB-CG 4.45Å; M302-Y306 WeakPolarHBondContact CB-OH 3.21Å; M302-Y306 HydrophobicContact CE-CE1 3.9Å; M302-Y306 HydrophobicContact CG-CE2 4.4Å; M302-Y306 WeakPolarHBondContact O-CD2 3.44Å; M302-Y306 PolarHBondContact O-N 3.21Å; Q304-Y306 PolarHBondContact O-N 2.89Å; Y306-G310 PolarHBondContact O-N 3.41Å; Y306-L314 HydrophobicContact CD1-CD1 4.22Å; Y306-L314 HydrophobicContact CG-CD1 4.47Å
307	G	70.2	Confident	76.9	Confident	44 Å²	44	69 Å²	69	45%	0.454	34%	0.339	S	S	.	.	H	α-helix	trans	-59.1	-49.9	170.6	0	0	0	0	0	112.3	K303 Q304 I305 G310	K303-G307 PolarHBondContact O-N 2.82Å; K303-G307 VanDerWaalsContact O-N 3.15Å; Q304-G307 CarbonylContact O-C 3.29Å; Q304-G307 VanDerWaalsContact O-CA 3.31Å; Q304-G307 WeakPolarHBondContact O-CA 3.37Å; Q304-G307 PolarHBondContact O-N 2.89Å; I305-G307 VanDerWaalsContact C-N 3.27Å; I305-G307 PolarHBondContact O-N 2.92Å; G307-G310 WeakPolarHBondContact O-CA 3.46Å; G307-G310 PolarHBondContact O-N 3.42Å; G307-G310 VanDerWaalsContact O-N 3.1Å
308	M	62.4	Low	76.8	Confident	40 Å²	40	67.8 Å²	67.8	20%	0.197	33%	0.334	C	S	.	.	H	α-helix	trans	-59.9	-50.3	179.5	-64.9	169.4	88	0	0	111.6	E146 F149 T150 Q304 I305 G310	E146-M308 HydrophobicContact CB-CE 3.62Å; E146-M308 HydrophobicContact CG-CE 3.42Å; E146-M308 VanDerWaalsContact CG-CE 3.42Å; E146-M308 HydrophobicContact CG-CG 4.16Å; E146-M308 WeakPolarHBondContact OE1-CG 3.45Å; F149-M308 HydrophobicContact CD1-CE 3.62Å; F149-M308 HydrophobicContact CD1-SD 4.11Å; F149-M308 HydrophobicContact CE1-CE 4.26Å; F149-M308 HydrophobicContact CE1-SD 4.19Å; T150-M308 WeakPolarHBondContact CG2-O 3.49Å; T150-M308 PolarHBondContact OG1-O 3.39Å; Q304-M308 WeakPolarHBondContact O-CG 3.45Å; Q304-M308 PolarHBondContact O-N 2.93Å; I305-M308 HydrophobicContact CD1-SD 4.03Å; I305-M308 WeakPolarHBondContact O-CB 3.29Å; I305-M308 PolarHBondContact O-N 3.34Å; M308-G310 PolarHBondContact O-N 2.87Å; M308-G310 VanDerWaalsContact O-N 3.13Å
309	I	63	Low	76.3	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-53.7	-40	175.9	-63.8	166.3	0	0	0	110.2	L153 R154 I264 I305 Y313 L314	L153-I309 HydrophobicContact CB-CG1 4.12Å; L153-I309 HydrophobicContact CD1-CD1 4.26Å; L153-I309 HydrophobicContact CD1-CG1 3.74Å; L153-I309 HydrophobicContact CD2-CD1 4.2Å; L153-I309 HydrophobicContact CD2-CG1 4.37Å; L153-I309 HydrophobicContact CG-CG1 4.33Å; R154-I309 PolarHBondContact NE-O 3.01Å; R154-I309 PolarHBondContact NH2-O 3.15Å; I264-I309 HydrophobicContact CD1-CD1 4.01Å; I264-I309 HydrophobicContact CG1-CD1 4.09Å; I264-I309 HydrophobicContact CG2-CD1 4.3Å; I305-I309 HydrophobicContact CG2-CD1 4.24Å; I305-I309 WeakPolarHBondContact O-CG1 2.91Å; I305-I309 PolarHBondContact O-N 3.16Å; I309-Y313 HydrophobicContact CG2-CD1 3.62Å; I309-Y313 HydrophobicContact CG2-CE1 4.26Å; I309-L314 HydrophobicContact CB-CD1 4.23Å; I309-L314 HydrophobicContact CB-CG 4.25Å; I309-L314 HydrophobicContact CD1-CD1 4.49Å; I309-L314 HydrophobicContact CD1-CD2 4.43Å; I309-L314 HydrophobicContact CG2-CD1 4.18Å; I309-L314 HydrophobicContact CG2-CD2 3.85Å; I309-L314 HydrophobicContact CG2-CG 3.65Å
310	G	71.2	Confident	75.7	Confident	14 Å²	14	68.4 Å²	68.4	14%	0.144	34%	0.335	C	S	.	.			trans	102.9	122.5	177.7	0	0	0	0	0	110.9	Y306 G307 M308 R312 Y313 L314	Y306-G310 PolarHBondContact O-N 3.41Å; G307-G310 WeakPolarHBondContact O-CA 3.46Å; G307-G310 PolarHBondContact O-N 3.42Å; G307-G310 VanDerWaalsContact O-N 3.1Å; M308-G310 PolarHBondContact O-N 2.87Å; M308-G310 VanDerWaalsContact O-N 3.13Å; G310-R312 VanDerWaalsContact C-N 3.32Å; G310-R312 PolarHBondContact O-N 3.29Å; G310-Y313 WeakPolarHBondContact O-CA 3.43Å; G310-Y313 WeakPolarHBondContact O-CB 3.36Å; G310-Y313 PolarHBondContact O-N 2.95Å; G310-L314 PolarHBondContact O-N 2.98Å
311	R	78.4	Confident	75	Confident	207 Å²	207	62.9 Å²	62.9	78%	0.781	30%	0.3	S	S	*	.	H	α-helix	trans	-55.7	-44.4	-178	-65.6	-174.8	-176.4	-174.5	2.2	112.9	Y313 L314 A315	R311-Y313 VanDerWaalsContact C-N 3.29Å; R311-Y313 PolarHBondContact O-N 2.89Å; R311-L314 PolarHBondContact O-N 3.45Å; R311-A315 VanDerWaalsContact O-CB 3.3Å; R311-A315 WeakPolarHBondContact O-CB 2.7Å; R311-A315 PolarHBondContact O-N 3.35Å
312	R	79.6	Confident	74.7	Confident	217 Å²	217	60.2 Å²	60.2	82%	0.819	29%	0.287	S	S	*	.	H	α-helix	trans	-62.4	-37.6	176.5	-69.7	-175.8	-178.5	173.5	0.5	112	G310 N316	G310-R312 VanDerWaalsContact C-N 3.32Å; G310-R312 PolarHBondContact O-N 3.29Å; R312-N316 WeakPolarHBondContact O-CB 3.5Å; R312-N316 PolarHBondContact O-N 3.19Å; R312-N316 PolarHBondContact O-ND2 3.13Å; R312-N316 PolarHBondContact O-OD1 3.1Å
313	Y	71.1	Confident	74.6	Confident	34 Å²	34	67.5 Å²	67.5	13%	0.133	32%	0.315	C	S	.	.	H	α-helix	trans	-68	-48.3	179.1	-179.1	-84.8	0	0	0	111.1	R154 V157 N158 I309 G310 R311 A315 N316 Y317	R154-Y313 WeakPolarHBondContact CA-OH 3.44Å; R154-Y313 HydrophobicContact CB-CD1 4.5Å; R154-Y313 HydrophobicContact CB-CD2 4.2Å; R154-Y313 HydrophobicContact CB-CE1 3.99Å; R154-Y313 HydrophobicContact CB-CE2 3.64Å; R154-Y313 HydrophobicContact CG-CD1 3.74Å; R154-Y313 HydrophobicContact CG-CD2 3.65Å; R154-Y313 HydrophobicContact CG-CE1 3.71Å; R154-Y313 HydrophobicContact CG-CE2 3.62Å; R154-Y313 HydrophobicContact CG-CG 3.73Å; R154-Y313 PolarHBondContact O-OH 3.48Å; V157-Y313 HydrophobicContact CB-CE1 3.9Å; V157-Y313 HydrophobicContact CG1-CE1 3.67Å; N158-Y313 PolarHBondContact N-OH 3.41Å; N158-Y313 PolarHBondContact ND2-OH 3.43Å; N158-Y313 PolarHBondContact OD1-OH 3.43Å; N158-Y313 VanDerWaalsContact OD1-OH 3.1Å; I309-Y313 HydrophobicContact CG2-CD1 3.62Å; I309-Y313 HydrophobicContact CG2-CE1 4.26Å; G310-Y313 WeakPolarHBondContact O-CA 3.43Å; G310-Y313 WeakPolarHBondContact O-CB 3.36Å; G310-Y313 PolarHBondContact O-N 2.95Å; R311-Y313 VanDerWaalsContact C-N 3.29Å; R311-Y313 PolarHBondContact O-N 2.89Å; Y313-A315 VanDerWaalsContact C-N 3.35Å; Y313-A315 PolarHBondContact O-N 2.99Å; Y313-N316 PolarHBondContact O-N 3.31Å; Y313-Y317 PolarHBondContact O-N 2.93Å
314	L	69.4	Low	74.4	Confident	5 Å²	5	61.7 Å²	61.7	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-60.1	-43.8	174.6	-76.6	170.3	0	0	0	111.7	Y267 I268 Y306 I309 G310 R311 Y317 I318	Y267-L314 HydrophobicContact CE1-CD1 4.2Å; I268-L314 HydrophobicContact CD1-CD2 4.46Å; I268-L314 HydrophobicContact CG1-CD2 4.4Å; Y306-L314 HydrophobicContact CD1-CD1 4.22Å; Y306-L314 HydrophobicContact CG-CD1 4.47Å; I309-L314 HydrophobicContact CB-CD1 4.23Å; I309-L314 HydrophobicContact CB-CG 4.25Å; I309-L314 HydrophobicContact CD1-CD1 4.49Å; I309-L314 HydrophobicContact CD1-CD2 4.43Å; I309-L314 HydrophobicContact CG2-CD1 4.18Å; I309-L314 HydrophobicContact CG2-CD2 3.85Å; I309-L314 HydrophobicContact CG2-CG 3.65Å; G310-L314 PolarHBondContact O-N 2.98Å; R311-L314 PolarHBondContact O-N 3.45Å; L314-Y317 PolarHBondContact O-N 3.47Å; L314-I318 WeakPolarHBondContact O-CB 3.39Å; L314-I318 WeakPolarHBondContact O-CD1 3.28Å; L314-I318 VanDerWaalsContact O-CG1 3.28Å; L314-I318 WeakPolarHBondContact O-CG1 3.41Å; L314-I318 PolarHBondContact O-N 2.92Å
315	A	81	Confident	74.8	Confident	43 Å²	43	54.1 Å²	54.1	36%	0.355	25%	0.253	S	S	.	.	H	α-helix	trans	-59.1	-50	176.2	0	0	0	0	0	111.5	R311 Y313 Y317 I318 D319	R311-A315 VanDerWaalsContact O-CB 3.3Å; R311-A315 WeakPolarHBondContact O-CB 2.7Å; R311-A315 PolarHBondContact O-N 3.35Å; Y313-A315 VanDerWaalsContact C-N 3.35Å; Y313-A315 PolarHBondContact O-N 2.99Å; A315-Y317 VanDerWaalsContact C-N 3.25Å; A315-Y317 PolarHBondContact O-N 3.49Å; A315-I318 WeakPolarHBondContact O-CB 3.5Å; A315-I318 PolarHBondContact O-N 3.26Å; A315-I318 VanDerWaalsContact O-N 3.17Å; A315-D319 VanDerWaalsContact O-CG 3.28Å; A315-D319 PolarHBondContact O-N 3.4Å
316	N	75.4	Confident	75.5	Confident	97 Å²	97	55.2 Å²	55.2	52%	0.519	26%	0.258	S	S	.	.	H	α-helix	trans	-58.3	-37.9	176.6	-74.4	-10.2	0	0	0	112.5	R312 Y313 K320	R312-N316 WeakPolarHBondContact O-CB 3.5Å; R312-N316 PolarHBondContact O-N 3.19Å; R312-N316 PolarHBondContact O-ND2 3.13Å; R312-N316 PolarHBondContact O-OD1 3.1Å; Y313-N316 PolarHBondContact O-N 3.31Å; N316-K320 WeakPolarHBondContact O-CG 3.24Å; N316-K320 PolarHBondContact O-N 3.48Å
317	Y	71.5	Confident	75.9	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.008	28%	0.281	C	S	.	.	H	α-helix	trans	-68.1	-45.8	176.8	-177.8	-99	0	0	0	112.3	V157 L160 A161 F228 I268 Y313 L314 A315 D319 K320 C321	V157-Y317 HydrophobicContact CB-CD2 4.42Å; V157-Y317 HydrophobicContact CB-CE2 4.49Å; V157-Y317 HydrophobicContact CG1-CD1 3.67Å; V157-Y317 HydrophobicContact CG1-CD2 3.09Å; V157-Y317 HydrophobicContact CG1-CE1 3.98Å; V157-Y317 HydrophobicContact CG1-CE2 3.42Å; V157-Y317 VanDerWaalsContact CG1-CE2 3.42Å; V157-Y317 HydrophobicContact CG1-CG 3.2Å; V157-Y317 WeakPolarHBondContact O-CE2 3.3Å; L160-Y317 WeakPolarHBondContact CD2-OH 3.41Å; L160-Y317 WeakPolarHBondContact CG-OH 3.29Å; A161-Y317 HydrophobicContact CB-CD2 3.91Å; A161-Y317 HydrophobicContact CB-CE2 3.32Å; F228-Y317 HydrophobicContact CE1-CE1 4.45Å; I268-Y317 HydrophobicContact CD1-CD1 3.88Å; I268-Y317 HydrophobicContact CD1-CE1 3.83Å; I268-Y317 HydrophobicContact CG1-CD1 4.33Å; I268-Y317 HydrophobicContact CG1-CE1 4.49Å; I268-Y317 HydrophobicContact CG2-CD1 4.02Å; I268-Y317 HydrophobicContact CG2-CE1 3.74Å; Y313-Y317 PolarHBondContact O-N 2.93Å; L314-Y317 PolarHBondContact O-N 3.47Å; A315-Y317 VanDerWaalsContact C-N 3.25Å; A315-Y317 PolarHBondContact O-N 3.49Å; Y317-D319 VanDerWaalsContact C-N 3.28Å; Y317-D319 PolarHBondContact O-N 3.47Å; Y317-K320 WeakPolarHBondContact O-CB 3.31Å; Y317-K320 PolarHBondContact O-N 3.48Å; Y317-K320 VanDerWaalsContact O-N 3.17Å; Y317-C321 WeakPolarHBondContact CE1-SG 3.35Å; Y317-C321 VanDerWaalsContact CZ-SG 3.57Å; Y317-C321 PolarHBondContact O-N 3.04Å; Y317-C321 PolarHBondContact O-SG 2.61Å; Y317-C321 VanDerWaalsContact O-SG 3.34Å
318	I	79.6	Confident	76.4	Confident	14 Å²	14	57.7 Å²	57.7	7%	0.072	26%	0.261	C	S	.	.	H	α-helix	trans	-56.8	-45.5	174.7	-73.6	161.8	0	0	0	109.6	Y267 K271 V272 L314 A315 K320 C321 K322	Y267-I318 HydrophobicContact CE1-CD1 4.49Å; K271-I318 HydrophobicContact CB-CD1 3.66Å; K271-I318 HydrophobicContact CB-CG1 4.34Å; K271-I318 HydrophobicContact CG-CD1 4.09Å; V272-I318 HydrophobicContact CG2-CB 4.48Å; V272-I318 HydrophobicContact CG2-CG1 4.47Å; V272-I318 HydrophobicContact CG2-CG2 3.98Å; L314-I318 WeakPolarHBondContact O-CB 3.39Å; L314-I318 WeakPolarHBondContact O-CD1 3.28Å; L314-I318 VanDerWaalsContact O-CG1 3.28Å; L314-I318 WeakPolarHBondContact O-CG1 3.41Å; L314-I318 PolarHBondContact O-N 2.92Å; A315-I318 WeakPolarHBondContact O-CB 3.5Å; A315-I318 PolarHBondContact O-N 3.26Å; A315-I318 VanDerWaalsContact O-N 3.17Å; I318-K320 VanDerWaalsContact C-N 3.34Å; I318-K320 PolarHBondContact O-N 2.85Å; I318-C321 WeakPolarHBondContact O-CB 3.23Å; I318-C321 PolarHBondContact O-N 3.01Å; I318-C321 VanDerWaalsContact O-N 3.15Å; I318-K322 HydrophobicContact CG2-CD 4.16Å; I318-K322 VanDerWaalsContact CG2-CE 3.49Å; I318-K322 HydrophobicContact CG2-CG 4.5Å; I318-K322 VanDerWaalsContact O-CG 3.31Å; I318-K322 WeakPolarHBondContact O-CG 3.47Å; I318-K322 PolarHBondContact O-N 3.1Å
319	D	79.2	Confident	77.5	Confident	69 Å²	69	55.8 Å²	55.8	37%	0.369	25%	0.252	S	S	.	.	H	α-helix	trans	-65.4	-33.4	177.9	-67	-21.5	0	0	0	113.4	A315 Y317 R323	A315-D319 VanDerWaalsContact O-CG 3.28Å; A315-D319 PolarHBondContact O-N 3.4Å; Y317-D319 VanDerWaalsContact C-N 3.28Å; Y317-D319 PolarHBondContact O-N 3.47Å; D319-R323 WeakPolarHBondContact O-CG 3.5Å; D319-R323 PolarHBondContact O-N 3.07Å; D319-R323 PolarHBondContact O-NE 3.16Å
320	K	75.2	Confident	78.7	Confident	60 Å²	60	61.1 Å²	61.1	26%	0.261	28%	0.275	S	S	.	.	H	α-helix	trans	-65.6	-44.5	171.2	-75.9	175.3	-178.3	-176.1	0	111.2	N158 A161 N316 Y317 I318 K322 R323 W324	N158-K320 PolarHBondContact OD1-NZ 3.48Å; A161-K320 HydrophobicContact CB-CD 4.44Å; N316-K320 WeakPolarHBondContact O-CG 3.24Å; N316-K320 PolarHBondContact O-N 3.48Å; Y317-K320 WeakPolarHBondContact O-CB 3.31Å; Y317-K320 PolarHBondContact O-N 3.48Å; Y317-K320 VanDerWaalsContact O-N 3.17Å; I318-K320 VanDerWaalsContact C-N 3.34Å; I318-K320 PolarHBondContact O-N 2.85Å; K320-K322 VanDerWaalsContact C-N 3.34Å; K320-R323 PolarHBondContact O-N 3.38Å; K320-W324 WeakPolarHBondContact O-CB 3.35Å; K320-W324 PolarHBondContact O-N 3.15Å
321	C	76	Confident	79.3	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.014	28%	0.28	C	S	.	.	H	α-helix	trans	-62	-42.9	177.4	-65.7	0	0	0	0	111.3	F224 V272 Y317 I318 W324 L325	F224-C321 HydrophobicContact CE2-CB 4.45Å; V272-C321 HydrophobicContact CG2-CB 4.1Å; Y317-C321 WeakPolarHBondContact CE1-SG 3.35Å; Y317-C321 VanDerWaalsContact CZ-SG 3.57Å; Y317-C321 PolarHBondContact O-N 3.04Å; Y317-C321 PolarHBondContact O-SG 2.61Å; Y317-C321 VanDerWaalsContact O-SG 3.34Å; I318-C321 WeakPolarHBondContact O-CB 3.23Å; I318-C321 PolarHBondContact O-N 3.01Å; I318-C321 VanDerWaalsContact O-N 3.15Å; C321-W324 PolarHBondContact O-N 2.73Å; C321-L325 VanDerWaalsContact O-CB 3.28Å; C321-L325 WeakPolarHBondContact O-CB 3.21Å; C321-L325 PolarHBondContact O-N 3.12Å
322	K	80.3	Confident	79.5	Confident	51 Å²	51	52 Å²	52	22%	0.222	24%	0.243	C	C	.	.	H	α-helix	trans	-59.7	-50.5	176.4	-71.1	172.9	178.1	-168.2	0	112.3	V272 D275 I318 K320 L325 Q326	V272-K322 HydrophobicContact CG1-CG 4.46Å; D275-K322 HydrophobicContact CB-CD 4.47Å; D275-K322 VanDerWaalsContact CB-CE 3.47Å; D275-K322 IonicContact OD1-NZ 3.74Å; D275-K322 PolarHBondContact OD1-NZ 2.89Å; D275-K322 WeakPolarHBondContact OD2-CD 3.3Å; D275-K322 WeakPolarHBondContact OD2-CE 3.34Å; D275-K322 IonicContact OD2-NZ 3.39Å; D275-K322 PolarHBondContact OD2-NZ 3.21Å; I318-K322 HydrophobicContact CG2-CD 4.16Å; I318-K322 VanDerWaalsContact CG2-CE 3.49Å; I318-K322 HydrophobicContact CG2-CG 4.5Å; I318-K322 VanDerWaalsContact O-CG 3.31Å; I318-K322 WeakPolarHBondContact O-CG 3.47Å; I318-K322 PolarHBondContact O-N 3.1Å; K320-K322 VanDerWaalsContact C-N 3.34Å; K322-L325 PolarHBondContact O-N 3.31Å; K322-Q326 WeakPolarHBondContact O-CB 3.35Å; K322-Q326 PolarHBondContact O-N 3.42Å
323	R	79.1	Confident	79.8	Confident	155 Å²	155	44.7 Å²	44.7	59%	0.585	22%	0.219	S	C	*	.	H	α-helix	trans	-60.9	-47.5	177.7	-77.2	-174.6	-71.9	165.7	-7.9	111.8	D319 K320 L325 Q326 D327	D319-R323 WeakPolarHBondContact O-CG 3.5Å; D319-R323 PolarHBondContact O-N 3.07Å; D319-R323 PolarHBondContact O-NE 3.16Å; K320-R323 PolarHBondContact O-N 3.38Å; R323-L325 VanDerWaalsContact C-N 3.31Å; R323-L325 PolarHBondContact O-N 3.31Å; R323-Q326 WeakPolarHBondContact O-CB 3.46Å; R323-Q326 PolarHBondContact O-N 2.71Å; R323-D327 VanDerWaalsContact O-CG 3.25Å; R323-D327 PolarHBondContact O-N 2.75Å
324	W	80.4	Confident	80.6	Confident	27 Å²	27	48.6 Å²	48.6	10%	0.102	25%	0.247	C	C	.	.	H	α-helix	trans	-55.4	-47.7	175.2	169.5	78.9	0	0	0	111.6	L164 F172 I223 V227 K320 C321 Q326 D327 Y328	L164-W324 HydrophobicContact CB-CD2 4.23Å; L164-W324 HydrophobicContact CB-CZ2 4.24Å; L164-W324 HydrophobicContact CD2-CH2 4.08Å; L164-W324 HydrophobicContact CD2-CZ2 4.09Å; L164-W324 PolarHBondContact O-NE1 3.39Å; F172-W324 HydrophobicContact CD1-CH2 4.32Å; F172-W324 AromaticContact CD1-CZ2 3.8Å; F172-W324 HydrophobicContact CD1-CZ2 3.8Å; F172-W324 HydrophobicContact CE1-CH2 4.17Å; F172-W324 HydrophobicContact CE1-CZ2 4.01Å; I223-W324 HydrophobicContact CG2-CH2 3.76Å; I223-W324 HydrophobicContact CG2-CZ3 4.15Å; V227-W324 HydrophobicContact CG2-CH2 4.42Å; K320-W324 WeakPolarHBondContact O-CB 3.35Å; K320-W324 PolarHBondContact O-N 3.15Å; C321-W324 PolarHBondContact O-N 2.73Å; W324-Q326 VanDerWaalsContact C-N 3.34Å; W324-Q326 PolarHBondContact O-N 3.21Å; W324-D327 PolarHBondContact O-N 2.86Å; W324-Y328 HydrophobicContact CZ2-CD1 4.3Å; W324-Y328 HydrophobicContact CZ2-CG 4.32Å; W324-Y328 WeakPolarHBondContact O-CB 3.43Å; W324-Y328 PolarHBondContact O-N 2.71Å
325	L	84	Confident	81.2	Confident	3 Å²	3	51.8 Å²	51.8	2%	0.016	26%	0.264	C	S	.	.	H	α-helix	trans	-65.2	-37.8	-178.8	-169	68.8	0	0	0	112.4	K220 I223 F224 I276 C321 K322 R323 G329	K220-L325 HydrophobicContact CB-CD2 3.64Å; K220-L325 HydrophobicContact CB-CG 3.98Å; K220-L325 HydrophobicContact CG-CD2 3.92Å; K220-L325 HydrophobicContact CG-CG 3.87Å; I223-L325 HydrophobicContact CB-CD1 3.76Å; I223-L325 HydrophobicContact CG2-CD1 3.57Å; F224-L325 HydrophobicContact CB-CD1 3.98Å; F224-L325 HydrophobicContact CB-CD2 3.9Å; F224-L325 HydrophobicContact CD2-CD2 4.46Å; F224-L325 HydrophobicContact CG-CD2 4.31Å; I276-L325 HydrophobicContact CD1-CD2 3.45Å; I276-L325 VanDerWaalsContact CD1-CD2 3.45Å; I276-L325 HydrophobicContact CG1-CD2 4.18Å; C321-L325 VanDerWaalsContact O-CB 3.28Å; C321-L325 WeakPolarHBondContact O-CB 3.21Å; C321-L325 PolarHBondContact O-N 3.12Å; K322-L325 PolarHBondContact O-N 3.31Å; R323-L325 VanDerWaalsContact C-N 3.31Å; R323-L325 PolarHBondContact O-N 3.31Å; L325-G329 WeakPolarHBondContact O-CA 3.47Å; L325-G329 PolarHBondContact O-N 3.45Å
326	Q	85	Confident	81.2	Confident	56 Å²	56	52.2 Å²	52.2	26%	0.262	26%	0.259	S	S	.	.	H	α-helix	trans	-63.2	-50.8	174.7	178.2	71.1	3.1	0	0	111.4	K322 R323 W324 K330	K322-Q326 WeakPolarHBondContact O-CB 3.35Å; K322-Q326 PolarHBondContact O-N 3.42Å; R323-Q326 WeakPolarHBondContact O-CB 3.46Å; R323-Q326 PolarHBondContact O-N 2.71Å; W324-Q326 VanDerWaalsContact C-N 3.34Å; W324-Q326 PolarHBondContact O-N 3.21Å; Q326-K330 VanDerWaalsContact NE2-CE 3.25Å; Q326-K330 WeakPolarHBondContact O-CB 3.49Å; Q326-K330 WeakPolarHBondContact O-CG 3.42Å; Q326-K330 PolarHBondContact O-N 3.26Å; Q326-K330 VanDerWaalsContact O-N 3.07Å
327	D	81.9	Confident	81.5	Confident	106 Å²	106	49.8 Å²	49.8	57%	0.567	25%	0.245	S	C	*	.	H	α-helix	trans	-69.2	-46.3	-176.3	-63.5	-23.1	0	0	0	110.7	R323 W324 K330 A331	R323-D327 VanDerWaalsContact O-CG 3.25Å; R323-D327 PolarHBondContact O-N 2.75Å; W324-D327 PolarHBondContact O-N 2.86Å; D327-K330 PolarHBondContact O-N 3.24Å; D327-A331 WeakPolarHBondContact O-CB 3.33Å; D327-A331 PolarHBondContact O-N 3.25Å
328	Y	81.1	Confident	82.1	Confident	10 Å²	10	52.5 Å²	52.5	4%	0.039	26%	0.259	C	S	.	.	H	α-helix	trans	-64.6	-45.4	178.2	-173.2	-102.2	0	0	0	112	F172 A173 I174 I180 I223 W324 K330 A331 I332	F172-Y328 VanDerWaalsContact C-OH 3.29Å; F172-Y328 WeakPolarHBondContact CA-OH 3.49Å; F172-Y328 HydrophobicContact CB-CE2 4.41Å; F172-Y328 WeakPolarHBondContact O-CE2 3.49Å; F172-Y328 PolarHBondContact O-OH 2.86Å; A173-Y328 PolarHBondContact O-OH 3.37Å; I174-Y328 HydrophobicContact CD1-CD2 4.02Å; I174-Y328 HydrophobicContact CD1-CE2 4.22Å; I174-Y328 HydrophobicContact CG1-CD2 3.78Å; I174-Y328 HydrophobicContact CG1-CE2 3.47Å; I174-Y328 VanDerWaalsContact CG1-CE2 3.47Å; I180-Y328 HydrophobicContact CD1-CE1 3.68Å; I180-Y328 WeakPolarHBondContact CD1-OH 3.47Å; I180-Y328 HydrophobicContact CG2-CE1 4.05Å; I223-Y328 HydrophobicContact CD1-CD1 3.82Å; I223-Y328 HydrophobicContact CD1-CE1 4.02Å; I223-Y328 HydrophobicContact CG1-CE1 4.42Å; I223-Y328 HydrophobicContact CG2-CD1 3.97Å; I223-Y328 HydrophobicContact CG2-CE1 4.1Å; W324-Y328 HydrophobicContact CZ2-CD1 4.3Å; W324-Y328 HydrophobicContact CZ2-CG 4.32Å; W324-Y328 WeakPolarHBondContact O-CB 3.43Å; W324-Y328 PolarHBondContact O-N 2.71Å; Y328-K330 PolarHBondContact O-N 3.06Å; Y328-A331 PolarHBondContact O-N 2.99Å; Y328-I332 HydrophobicContact CE1-CD1 3.99Å; Y328-I332 WeakPolarHBondContact O-CB 3.41Å; Y328-I332 WeakPolarHBondContact O-CG2 3.02Å; Y328-I332 PolarHBondContact O-N 3.44Å; Y328-I332 VanDerWaalsContact OH-CD1 3.3Å; Y328-I332 WeakPolarHBondContact OH-CD1 3.34Å
329	G	85.5	Confident	82.2	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.6	-39.9	177.4	0	0	0	0	0	112.9	L325 I332 L333	L325-G329 WeakPolarHBondContact O-CA 3.47Å; L325-G329 PolarHBondContact O-N 3.45Å; G329-I332 WeakPolarHBondContact O-CG2 3.45Å; G329-L333 WeakPolarHBondContact O-CB 3.23Å; G329-L333 WeakPolarHBondContact O-CD1 3.37Å; G329-L333 VanDerWaalsContact O-CG 3.22Å; G329-L333 WeakPolarHBondContact O-CG 3.33Å; G329-L333 PolarHBondContact O-N 3.19Å
330	K	87.8	Confident	82.4	Confident	111 Å²	111	53.9 Å²	53.9	48%	0.483	26%	0.263	S	S	.	.	H	α-helix	trans	-64.6	-50.3	173	-78.7	179.2	173.6	-179	0	111.5	L216 Q326 D327 Y328 I332 L333 T334	L216-K330 HydrophobicContact CD1-CG 4.09Å; L216-K330 HydrophobicContact CD2-CG 3.94Å; Q326-K330 VanDerWaalsContact NE2-CE 3.25Å; Q326-K330 WeakPolarHBondContact O-CB 3.49Å; Q326-K330 WeakPolarHBondContact O-CG 3.42Å; Q326-K330 PolarHBondContact O-N 3.26Å; Q326-K330 VanDerWaalsContact O-N 3.07Å; D327-K330 PolarHBondContact O-N 3.24Å; Y328-K330 PolarHBondContact O-N 3.06Å; K330-I332 VanDerWaalsContact C-N 3.34Å; K330-I332 PolarHBondContact O-N 2.98Å; K330-L333 PolarHBondContact O-N 2.97Å; K330-T334 WeakPolarHBondContact O-CG2 3.37Å; K330-T334 PolarHBondContact O-N 3.19Å; K330-T334 PolarHBondContact O-OG1 3.25Å
331	A	84.8	Confident	82.9	Confident	29 Å²	29	53.5 Å²	53.5	24%	0.24	26%	0.264	C	S	.	.	H	α-helix	trans	-63	-40	-174.4	0	0	0	0	0	112.3	I174 D327 Y328 T334	I174-A331 HydrophobicContact CD1-CB 3.76Å; I174-A331 HydrophobicContact CG1-CB 4.38Å; I174-A331 HydrophobicContact CG2-CB 3.76Å; D327-A331 WeakPolarHBondContact O-CB 3.33Å; D327-A331 PolarHBondContact O-N 3.25Å; Y328-A331 PolarHBondContact O-N 2.99Å; A331-T334 PolarHBondContact O-N 2.76Å; A331-T334 PolarHBondContact O-OG1 3.5Å
332	I	82.1	Confident	83.4	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-72.1	-30.3	179.8	-161.4	149.2	0	0	0	113.3	I180 Y181 L184 I223 Y328 G329 K330 T334 L335	I180-I332 HydrophobicContact CB-CD1 3.81Å; I180-I332 HydrophobicContact CG2-CD1 3.48Å; I180-I332 VanDerWaalsContact CG2-CD1 3.48Å; Y181-I332 HydrophobicContact CD2-CG1 4.08Å; L184-I332 HydrophobicContact CD1-CD1 4.39Å; L184-I332 HydrophobicContact CD1-CG1 4.27Å; L184-I332 HydrophobicContact CD1-CG2 3.57Å; I223-I332 HydrophobicContact CD1-CG2 4.17Å; Y328-I332 HydrophobicContact CE1-CD1 3.99Å; Y328-I332 WeakPolarHBondContact O-CB 3.41Å; Y328-I332 WeakPolarHBondContact O-CG2 3.02Å; Y328-I332 PolarHBondContact O-N 3.44Å; Y328-I332 VanDerWaalsContact OH-CD1 3.3Å; Y328-I332 WeakPolarHBondContact OH-CD1 3.34Å; G329-I332 WeakPolarHBondContact O-CG2 3.45Å; K330-I332 VanDerWaalsContact C-N 3.34Å; K330-I332 PolarHBondContact O-N 2.98Å; I332-T334 VanDerWaalsContact C-N 3.3Å; I332-L335 HydrophobicContact CG1-CD1 4.08Å
333	L	86.2	Confident	83.6	Confident	62 Å²	62	57.6 Å²	57.6	33%	0.325	29%	0.286	S	S	.	.	H	α-helix	trans	-77.2	-16.6	176.7	-71	175.5	0	0	0	113.2	I214 L216 A219 G329 K330	I214-L333 HydrophobicContact CG2-CD2 3.82Å; L216-L333 HydrophobicContact CB-CD1 4.16Å; L216-L333 HydrophobicContact CD1-CD1 4.21Å; A219-L333 HydrophobicContact CB-CD1 3.8Å; A219-L333 HydrophobicContact CB-CD2 4.25Å; A219-L333 HydrophobicContact CB-CG 4.15Å; G329-L333 WeakPolarHBondContact O-CB 3.23Å; G329-L333 WeakPolarHBondContact O-CD1 3.37Å; G329-L333 VanDerWaalsContact O-CG 3.22Å; G329-L333 WeakPolarHBondContact O-CG 3.33Å; G329-L333 PolarHBondContact O-N 3.19Å; K330-L333 PolarHBondContact O-N 2.97Å
334	T	87.1	Confident	84	Confident	117 Å²	117	49.5 Å²	49.5	72%	0.718	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	3.1	176.8	52.2	0	0	0	0	114.4	K330 A331 I332	K330-T334 WeakPolarHBondContact O-CG2 3.37Å; K330-T334 PolarHBondContact O-N 3.19Å; K330-T334 PolarHBondContact O-OG1 3.25Å; A331-T334 PolarHBondContact O-N 2.76Å; A331-T334 PolarHBondContact O-OG1 3.5Å; I332-T334 VanDerWaalsContact C-N 3.3Å
335	L	81.8	Confident	84.3	Confident	71 Å²	71	51.5 Å²	51.5	37%	0.372	28%	0.275	S	S	.	.			trans	-82.1	0	177.7	-70.9	171.2	0	0	0	113.2	I174 K176 Y181 I332	I174-L335 HydrophobicContact CG2-CD1 3.92Å; I174-L335 HydrophobicContact CG2-CD2 4.18Å; I174-L335 HydrophobicContact CG2-CG 4.11Å; K176-L335 VanDerWaalsContact CE-C 3.43Å; K176-L335 WeakPolarHBondContact CE-O 3.42Å; K176-L335 HydrophobicContact CG-CB 4.49Å; K176-L335 PolarHBondContact NZ-O 3.43Å; Y181-L335 HydrophobicContact CD2-CB 4.09Å; Y181-L335 HydrophobicContact CD2-CD1 3.85Å; Y181-L335 HydrophobicContact CE2-CB 3.64Å; Y181-L335 HydrophobicContact CE2-CD1 4.25Å; Y181-L335 WeakPolarHBondContact CE2-OXT 3.41Å; Y181-L335 PolarHBondContact OH-OXT 3.35Å; Y181-L335 VanDerWaalsContact OH-OXT 3.04Å; I332-L335 HydrophobicContact CG1-CD1 4.08Å

Retrieved 335 of 335 residues in 322.1 ms (Link to these results)

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