A0A077ZMN1_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZMN1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 345 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	28.7	Very low	31.9	Very low	240 Å²	240	109.5 Å²	109.5	100%	1.182	63%	0.625	S	S	*	*				0	108.4	0	-72.2	-177.8	169.7	0	0	106.7	S3	M1-S3 PolarHBondContact O-N 3.49Å; M1-S3 VanDerWaalsContact O-N 3.16Å
2	A	29.3	Very low	31.9	Very low	82 Å²	82	106.4 Å²	106.4	68%	0.678	64%	0.636	S	S	*	*			trans	-65.6	114.8	174.7	0	0	0	0	0	107.1	N4	A2-N4 PolarHBondContact O-N 2.78Å; A2-N4 VanDerWaalsContact O-N 3.09Å
3	S	30.9	Very low	31.9	Very low	102 Å²	102	110.1 Å²	110.1	71%	0.713	63%	0.633	S	S	*	*			trans	-61.4	116.4	164.5	55	0	0	0	0	105.1	M1 S5	M1-S3 PolarHBondContact O-N 3.49Å; M1-S3 VanDerWaalsContact O-N 3.16Å; S3-S5 PolarHBondContact O-N 2.69Å
4	N	34.2	Very low	31.7	Very low	134 Å²	134	106 Å²	106	72%	0.717	61%	0.614	S	S	*	*			trans	-60.2	93.2	165.9	-77.5	-17.6	0	0	0	105.3	A2 K6	A2-N4 PolarHBondContact O-N 2.78Å; A2-N4 VanDerWaalsContact O-N 3.09Å; N4-K6 PolarHBondContact O-N 2.65Å
5	S	31.8	Very low	31.8	Very low	64 Å²	64	105.9 Å²	105.9	45%	0.448	61%	0.611	S	S	.	*			trans	-58.5	96.8	174.5	51.3	0	0	0	0	105.7	S3 L7	S3-S5 PolarHBondContact O-N 2.69Å; S5-L7 VanDerWaalsContact C-N 3.33Å; S5-L7 PolarHBondContact O-N 3.44Å
6	K	31.7	Very low	31.8	Very low	202 Å²	202	104.9 Å²	104.9	88%	0.878	60%	0.603	S	S	*	*			trans	-65.9	103.5	170	-80.3	-174.2	175.7	-177.6	0	105	N4	N4-K6 PolarHBondContact O-N 2.65Å
7	L	34.6	Very low	31.7	Very low	51 Å²	51	107.1 Å²	107.1	27%	0.267	61%	0.61	S	S	.	*			trans	-57.4	153.9	170.5	-69.8	170.8	0	0	0	109.4	S5 D9 L139 P142 Y203	S5-L7 VanDerWaalsContact C-N 3.33Å; S5-L7 PolarHBondContact O-N 3.44Å; L7-D9 PolarHBondContact O-N 2.89Å; L7-L139 HydrophobicContact CD1-CD2 4.04Å; L7-P142 HydrophobicContact CD1-CG 4.4Å; L7-Y203 HydrophobicContact CD2-CE1 3.44Å; L7-Y203 VanDerWaalsContact CD2-CE1 3.44Å; L7-Y203 VanDerWaalsContact CD2-OH 3.27Å; L7-Y203 WeakPolarHBondContact CD2-OH 3.45Å
8	P	32	Very low	31.7	Very low	78 Å²	78	103.4 Å²	103.4	51%	0.506	59%	0.592	S	S	.	*			trans	-55.4	140.5	-178.3	-22.9	32.7	0	0	0	111.8	T10	P8-T10 PolarHBondContact O-N 3.11Å; P8-T10 VanDerWaalsContact O-N 3.14Å
9	D	33.4	Very low	31.8	Very low	131 Å²	131	101.3 Å²	101.3	70%	0.701	58%	0.578	S	S	*	*			trans	-63.3	112.5	176.4	-175.1	-1.7	0	0	0	110.1	L7 C11	L7-D9 PolarHBondContact O-N 2.89Å; D9-C11 VanDerWaalsContact OD1-CB 3.26Å; D9-C11 WeakPolarHBondContact OD1-CB 3.45Å; D9-C11 PolarHBondContact OD1-N 2.89Å; D9-C11 PolarHBondContact OD1-SG 3.34Å
10	T	33.1	Very low	31.9	Very low	43 Å²	43	98 Å²	98	26%	0.264	56%	0.558	S	S	.	*			trans	-100.1	6	-179.3	50.5	0	0	0	0	112.9	P8 G12 Y13	P8-T10 PolarHBondContact O-N 3.11Å; P8-T10 VanDerWaalsContact O-N 3.14Å; T10-G12 PolarHBondContact O-N 2.94Å; T10-G12 VanDerWaalsContact O-N 3.07Å; T10-Y13 HydrophobicContact CG2-CD2 4.17Å; T10-Y13 HydrophobicContact CG2-CE2 4.32Å; T10-Y13 VanDerWaalsContact O-CD2 3.31Å; T10-Y13 WeakPolarHBondContact O-CD2 3.34Å; T10-Y13 PolarHBondContact O-N 3.2Å
11	C	31.4	Very low	31.9	Very low	77 Å²	77	95.4 Å²	95.4	52%	0.52	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-58.4	-28.7	-176.2	-62.9	0	0	0	0	112.8	D9 Y13 S14	D9-C11 VanDerWaalsContact OD1-CB 3.26Å; D9-C11 WeakPolarHBondContact OD1-CB 3.45Å; D9-C11 PolarHBondContact OD1-N 2.89Å; D9-C11 PolarHBondContact OD1-SG 3.34Å; C11-Y13 PolarHBondContact O-N 2.88Å; C11-Y13 VanDerWaalsContact O-N 3.17Å; C11-S14 WeakPolarHBondContact O-CB 3.41Å; C11-S14 PolarHBondContact O-N 2.94Å; C11-S14 PolarHBondContact O-OG 3.41Å
12	G	31.3	Very low	32.1	Very low	73 Å²	73	90.9 Å²	90.9	75%	0.753	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-63.9	-13	175.9	0	0	0	0	0	115.4	T10	T10-G12 PolarHBondContact O-N 2.94Å; T10-G12 VanDerWaalsContact O-N 3.07Å
13	Y	32.8	Very low	32.2	Very low	154 Å²	154	97.3 Å²	97.3	60%	0.604	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-95.7	0	179.7	-57	-73.9	0	0	0	113.7	T10 C11 N15	T10-Y13 HydrophobicContact CG2-CD2 4.17Å; T10-Y13 HydrophobicContact CG2-CE2 4.32Å; T10-Y13 VanDerWaalsContact O-CD2 3.31Å; T10-Y13 WeakPolarHBondContact O-CD2 3.34Å; T10-Y13 PolarHBondContact O-N 3.2Å; C11-Y13 PolarHBondContact O-N 2.88Å; C11-Y13 VanDerWaalsContact O-N 3.17Å; Y13-N15 PolarHBondContact O-N 3.21Å
14	S	29.1	Very low	32.2	Very low	53 Å²	53	101.9 Å²	101.9	37%	0.371	52%	0.523	S	S	.	.			trans	-72.6	16.3	-176.2	62.2	0	0	0	0	115.7	C11 N16	C11-S14 WeakPolarHBondContact O-CB 3.41Å; C11-S14 PolarHBondContact O-N 2.94Å; C11-S14 PolarHBondContact O-OG 3.41Å; S14-N16 PolarHBondContact O-N 3.4Å; S14-N16 VanDerWaalsContact O-N 3.16Å
15	N	32.1	Very low	32.2	Very low	105 Å²	105	97.8 Å²	97.8	56%	0.561	50%	0.501	S	S	*	.			trans	-77.1	110.1	-176.4	-131.8	-11.4	0	0	0	109.7	Y13 I17 C18	Y13-N15 PolarHBondContact O-N 3.21Å; N15-I17 PolarHBondContact O-N 3.25Å; N15-C18 PolarHBondContact O-N 3.47Å
16	N	32	Very low	32.2	Very low	90 Å²	90	97.7 Å²	97.7	48%	0.481	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-4.9	-178.5	-82.5	-35.6	0	0	0	116.1	S14 L19 G149	S14-N16 PolarHBondContact O-N 3.4Å; S14-N16 VanDerWaalsContact O-N 3.16Å; N16-L19 VanDerWaalsContact O-CD1 3.27Å; N16-L19 WeakPolarHBondContact O-CD1 3.49Å; N16-L19 WeakPolarHBondContact O-CG 3.46Å; N16-G149 PolarHBondContact ND2-O 3.38Å; N16-G149 PolarHBondContact OD1-O 2.94Å
17	I	31	Very low	32.4	Very low	141 Å²	141	91.8 Å²	91.8	72%	0.723	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-17.5	175.8	-53	175.2	0	0	0	111.2	N15 L19	N15-I17 PolarHBondContact O-N 3.25Å; I17-L19 VanDerWaalsContact C-N 3.33Å; I17-L19 PolarHBondContact O-N 3.34Å
18	C	32	Very low	32.3	Very low	42 Å²	42	94 Å²	94	28%	0.284	50%	0.499	S	S	.	.	S	Bend	trans	-93.3	22.2	-178.7	-61.3	0	0	0	0	113.5	N15 L54	N15-C18 PolarHBondContact O-N 3.47Å; C18-L54 WeakPolarHBondContact CB-O 3.5Å
19	L	33.4	Very low	32.3	Very low	63 Å²	63	98.1 Å²	98.1	33%	0.33	51%	0.509	S	S	.	.			trans	-70.7	136.2	178.2	-65.7	171.9	0	0	0	110.3	N16 I17 P21 L54 V151	N16-L19 VanDerWaalsContact O-CD1 3.27Å; N16-L19 WeakPolarHBondContact O-CD1 3.49Å; N16-L19 WeakPolarHBondContact O-CG 3.46Å; I17-L19 VanDerWaalsContact C-N 3.33Å; I17-L19 PolarHBondContact O-N 3.34Å; L19-P21 WeakPolarHBondContact O-CD 3.44Å; L19-L54 WeakPolarHBondContact O-CD2 3.47Å; L19-V151 HydrophobicContact CD2-CB 3.9Å; L19-V151 HydrophobicContact CD2-CG1 3.67Å; L19-V151 HydrophobicContact CD2-CG2 3.73Å
20	I	32.9	Very low	32.4	Very low	34 Å²	34	94 Å²	94	17%	0.174	49%	0.485	C	S	.	.			trans	-83.5	98	176.4	-63.9	167.3	0	0	0	107.7	W22 L25 L54 D154 I158	I20-W22 VanDerWaalsContact C-N 3.28Å; I20-W22 PolarHBondContact O-N 2.89Å; I20-L25 HydrophobicContact CG2-CD1 4.14Å; I20-L54 HydrophobicContact CB-CD2 4.26Å; I20-L54 HydrophobicContact CG1-CD1 4.29Å; I20-L54 HydrophobicContact CG1-CD2 4.02Å; I20-L54 HydrophobicContact CG2-CD1 4.48Å; I20-D154 HydrophobicContact CB-CB 4.35Å; I20-D154 PolarHBondContact N-OD2 3.33Å; I20-D154 VanDerWaalsContact O-CG 3.3Å; I20-I158 HydrophobicContact CD1-CD1 3.27Å
21	P	31.4	Very low	32.4	Very low	44 Å²	44	95.9 Å²	95.9	29%	0.286	49%	0.494	S	S	.	.			trans	-77.8	91.7	178	32.9	-22.6	0	0	0	105.7	L19 R23 R24 L25	L19-P21 WeakPolarHBondContact O-CD 3.44Å; P21-R23 PolarHBondContact O-N 3.49Å; P21-R23 VanDerWaalsContact O-N 3.15Å; P21-R24 HydrophobicContact CB-CB 4.41Å; P21-R24 HydrophobicContact CB-CG 3.93Å; P21-R24 HydrophobicContact CG-CB 3.99Å; P21-R24 VanDerWaalsContact CG-CD 3.5Å; P21-R24 HydrophobicContact CG-CG 3.64Å; P21-R24 WeakPolarHBondContact O-CA 3.39Å; P21-R24 VanDerWaalsContact O-CB 3.25Å; P21-R24 WeakPolarHBondContact O-CB 3.17Å; P21-R24 PolarHBondContact O-N 3.02Å; P21-L25 PolarHBondContact O-N 3.25Å
22	W	33.1	Very low	32.4	Very low	145 Å²	145	103.3 Å²	103.3	55%	0.549	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-59.7	-20.8	173.2	68.4	-91.9	0	0	0	111.8	I20 R24 L25	I20-W22 VanDerWaalsContact C-N 3.28Å; I20-W22 PolarHBondContact O-N 2.89Å; W22-R24 PolarHBondContact O-N 3.25Å; W22-L25 HydrophobicContact CB-CD1 4.14Å; W22-L25 CarbonylContact O-C 3.58Å; W22-L25 VanDerWaalsContact O-C 3.3Å; W22-L25 VanDerWaalsContact O-CA 3.25Å; W22-L25 WeakPolarHBondContact O-CA 3.49Å; W22-L25 VanDerWaalsContact O-CB 3.26Å; W22-L25 WeakPolarHBondContact O-CB 3.4Å; W22-L25 PolarHBondContact O-N 2.85Å
23	R	31.9	Very low	32.7	Very low	217 Å²	217	101.9 Å²	101.9	82%	0.819	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-62.3	-16.8	165.2	-68	-169.6	-177.5	-172.2	2	113.9	P21	P21-R23 PolarHBondContact O-N 3.49Å; P21-R23 VanDerWaalsContact O-N 3.15Å
24	R	31.7	Very low	32.7	Very low	198 Å²	198	101.4 Å²	101.4	75%	0.747	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-92.1	-14.7	166.5	-59	-170	-172.5	167.4	-4.9	112.7	P21 W22 D26	P21-R24 HydrophobicContact CB-CB 4.41Å; P21-R24 HydrophobicContact CB-CG 3.93Å; P21-R24 HydrophobicContact CG-CB 3.99Å; P21-R24 VanDerWaalsContact CG-CD 3.5Å; P21-R24 HydrophobicContact CG-CG 3.64Å; P21-R24 WeakPolarHBondContact O-CA 3.39Å; P21-R24 VanDerWaalsContact O-CB 3.25Å; P21-R24 WeakPolarHBondContact O-CB 3.17Å; P21-R24 PolarHBondContact O-N 3.02Å; W22-R24 PolarHBondContact O-N 3.25Å; R24-D26 PolarHBondContact O-N 3.37Å
25	L	33.2	Very low	33	Very low	49 Å²	49	107.5 Å²	107.5	26%	0.257	51%	0.507	S	S	.	.	S	Bend	trans	-80.1	63.8	163.6	-58.6	173.7	0	0	0	108.2	I20 P21 W22 S27 W48	I20-L25 HydrophobicContact CG2-CD1 4.14Å; P21-L25 PolarHBondContact O-N 3.25Å; W22-L25 HydrophobicContact CB-CD1 4.14Å; W22-L25 CarbonylContact O-C 3.58Å; W22-L25 VanDerWaalsContact O-C 3.3Å; W22-L25 VanDerWaalsContact O-CA 3.25Å; W22-L25 WeakPolarHBondContact O-CA 3.49Å; W22-L25 VanDerWaalsContact O-CB 3.26Å; W22-L25 WeakPolarHBondContact O-CB 3.4Å; W22-L25 PolarHBondContact O-N 2.85Å; L25-S27 PolarHBondContact O-N 3.4Å; L25-S27 VanDerWaalsContact O-N 3.08Å; L25-W48 HydrophobicContact CD2-CH2 3.58Å; L25-W48 HydrophobicContact CD2-CZ2 3.42Å; L25-W48 VanDerWaalsContact CD2-CZ2 3.42Å
26	D	33.2	Very low	33.4	Very low	62 Å²	62	105.7 Å²	105.7	33%	0.332	51%	0.514	S	S	.	.			trans	-59	113.7	167.4	178.5	-6.3	0	0	0	107.4	R24 S28 K29 H30	R24-D26 PolarHBondContact O-N 3.37Å; D26-S28 PolarHBondContact O-N 3.32Å; D26-S28 VanDerWaalsContact OD1-CB 3.29Å; D26-S28 WeakPolarHBondContact OD1-CB 2.94Å; D26-S28 PolarHBondContact OD1-N 3.01Å; D26-S28 PolarHBondContact OD1-OG 3.24Å; D26-S28 PolarHBondContact OD2-OG 2.76Å; D26-S28 VanDerWaalsContact OD2-OG 3.06Å; D26-K29 HydrophobicContact CB-CB 4.13Å; D26-K29 HydrophobicContact CB-CD 4.19Å; D26-K29 HydrophobicContact CB-CG 4.08Å; D26-K29 CarbonylContact O-C 3.42Å; D26-K29 WeakPolarHBondContact O-CA 3.36Å; D26-K29 PolarHBondContact O-N 3.33Å; D26-K29 WeakPolarHBondContact OD2-CE 3.41Å; D26-H30 PolarHBondContact O-CD2 2.98Å; D26-H30 PolarHBondContact O-N 3.28Å
27	S	34.6	Very low	34.2	Very low	77 Å²	77	105.5 Å²	105.5	54%	0.538	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-18.5	-178.3	59.5	0	0	0	0	113.3	L25 H30	L25-S27 PolarHBondContact O-N 3.4Å; L25-S27 VanDerWaalsContact O-N 3.08Å; S27-H30 VanDerWaalsContact CA-CE1 3.46Å; S27-H30 WeakPolarHBondContact CA-CE1 3.14Å; S27-H30 WeakPolarHBondContact CA-ND1 3.43Å; S27-H30 VanDerWaalsContact O-CB 3.32Å; S27-H30 WeakPolarHBondContact O-CB 3.16Å; S27-H30 VanDerWaalsContact O-CG 3.27Å; S27-H30 PolarHBondContact O-ND1 3.13Å
28	S	33.5	Very low	34.9	Very low	98 Å²	98	105.1 Å²	105.1	69%	0.685	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-20.9	171.7	78.1	0	0	0	0	113.9	D26	D26-S28 PolarHBondContact O-N 3.32Å; D26-S28 VanDerWaalsContact OD1-CB 3.29Å; D26-S28 WeakPolarHBondContact OD1-CB 2.94Å; D26-S28 PolarHBondContact OD1-N 3.01Å; D26-S28 PolarHBondContact OD1-OG 3.24Å; D26-S28 PolarHBondContact OD2-OG 2.76Å; D26-S28 VanDerWaalsContact OD2-OG 3.06Å
29	K	31.3	Very low	35.5	Very low	164 Å²	164	106 Å²	106	71%	0.713	51%	0.513	S	S	*	.	S	Bend	trans	-99.9	2.7	175.1	-63.2	-175.7	-174.3	180	0	113.3	D26 L31	D26-K29 HydrophobicContact CB-CB 4.13Å; D26-K29 HydrophobicContact CB-CD 4.19Å; D26-K29 HydrophobicContact CB-CG 4.08Å; D26-K29 CarbonylContact O-C 3.42Å; D26-K29 WeakPolarHBondContact O-CA 3.36Å; D26-K29 PolarHBondContact O-N 3.33Å; D26-K29 WeakPolarHBondContact OD2-CE 3.41Å; K29-L31 PolarHBondContact O-N 3.43Å; K29-L31 VanDerWaalsContact O-N 3.13Å
30	H	35.1	Very low	36.2	Very low	44 Å²	44	104.5 Å²	104.5	20%	0.204	51%	0.509	C	S	.	.	S	Bend	trans	-45.3	121.9	166.1	-76.5	-176.4	0	0	0	109.1	D26 S27 R32 V75	D26-H30 PolarHBondContact O-CD2 2.98Å; D26-H30 PolarHBondContact O-N 3.28Å; S27-H30 VanDerWaalsContact CA-CE1 3.46Å; S27-H30 WeakPolarHBondContact CA-CE1 3.14Å; S27-H30 WeakPolarHBondContact CA-ND1 3.43Å; S27-H30 VanDerWaalsContact O-CB 3.32Å; S27-H30 WeakPolarHBondContact O-CB 3.16Å; S27-H30 VanDerWaalsContact O-CG 3.27Å; S27-H30 PolarHBondContact O-ND1 3.13Å; H30-R32 VanDerWaalsContact C-N 3.26Å; H30-R32 PolarHBondContact O-N 2.92Å; H30-V75 HydrophobicContact CB-CG1 3.51Å; H30-V75 VanDerWaalsContact CG-CG1 3.5Å; H30-V75 PolarHBondContact ND1-O 3.08Å
31	L	32.7	Very low	36.8	Very low	84 Å²	84	103.7 Å²	103.7	44%	0.44	51%	0.507	S	S	.	.			trans	-54.9	94.1	177.2	-93.2	147.7	0	0	0	107.5	K29 I33 H44	K29-L31 PolarHBondContact O-N 3.43Å; K29-L31 VanDerWaalsContact O-N 3.13Å; L31-I33 PolarHBondContact O-N 3.35Å; L31-H44 HydrophobicContact CD2-CB 4.43Å
32	R	32.8	Very low	37.5	Very low	233 Å²	233	106 Å²	106	88%	0.879	52%	0.516	S	S	*	.			trans	-61	95.9	164.6	-82.6	-176.5	175.3	178	-0.6	105.1	H30 L34	H30-R32 VanDerWaalsContact C-N 3.26Å; H30-R32 PolarHBondContact O-N 2.92Å; R32-L34 VanDerWaalsContact C-N 3.34Å; R32-L34 PolarHBondContact O-N 2.9Å
33	I	36.9	Very low	38.2	Very low	42 Å²	42	104.5 Å²	104.5	22%	0.215	51%	0.513	C	S	.	.			trans	-55.8	105.6	169.1	-71.7	-163.2	0	0	0	106.1	L31 R35 S41 H72	L31-I33 PolarHBondContact O-N 3.35Å; I33-R35 PolarHBondContact O-N 2.65Å; I33-S41 WeakPolarHBondContact CG2-OG 3.46Å; I33-H72 WeakPolarHBondContact CD1-CD2 3.49Å; I33-H72 VanDerWaalsContact CD1-CE1 3.45Å; I33-H72 WeakPolarHBondContact CD1-CE1 3.32Å; I33-H72 WeakPolarHBondContact CD1-NE2 3.45Å; I33-H72 VanDerWaalsContact CG1-NE2 3.31Å; I33-H72 WeakPolarHBondContact CG1-NE2 3.46Å
34	L	32.7	Very low	38.9	Very low	144 Å²	144	99.3 Å²	99.3	75%	0.754	50%	0.498	S	S	*	.			trans	-62.7	121	169.2	-73.4	166.6	0	0	0	106	R32 G36 D37	R32-L34 VanDerWaalsContact C-N 3.34Å; R32-L34 PolarHBondContact O-N 2.9Å; L34-G36 PolarHBondContact O-N 2.97Å; L34-D37 PolarHBondContact O-N 3.29Å
35	R	36.5	Very low	39.8	Very low	181 Å²	181	90.5 Å²	90.5	68%	0.683	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.9	-18.2	-176.2	-93.9	-179.5	168.9	177.4	-2.7	115.9	I33 D89	I33-R35 PolarHBondContact O-N 2.65Å; R35-D89 IonicContact NH2-OD2 3.62Å; R35-D89 PolarHBondContact NH2-OD2 2.88Å
36	G	40.6	Very low	40.3	Very low	68 Å²	68	88.3 Å²	88.3	70%	0.701	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-23	-169.3	0	0	0	0	0	117.5	L34	L34-G36 PolarHBondContact O-N 2.97Å
37	D	47.9	Very low	41	Very low	86 Å²	86	89.8 Å²	89.8	46%	0.46	46%	0.464	S	S	.	.			trans	-137	84.2	-175.3	-165.4	-16	0	0	0	112.8	L34 S39 A40 S41	L34-D37 PolarHBondContact O-N 3.29Å; D37-S39 VanDerWaalsContact C-N 3.28Å; D37-S39 PolarHBondContact O-N 3.3Å; D37-S39 PolarHBondContact OD1-N 3.42Å; D37-S39 VanDerWaalsContact OD1-N 3.16Å; D37-A40 HydrophobicContact CB-CB 3.98Å; D37-A40 PolarHBondContact O-N 3.32Å; D37-A40 PolarHBondContact OD1-N 2.97Å; D37-A40 VanDerWaalsContact OD2-CB 3.29Å; D37-A40 WeakPolarHBondContact OD2-CB 3.42Å; D37-S41 WeakPolarHBondContact O-CB 3.12Å; D37-S41 PolarHBondContact O-N 3.04Å; D37-S41 PolarHBondContact O-OG 2.9Å
38	K	45.1	Very low	41.5	Very low	133 Å²	133	90.4 Å²	90.4	58%	0.578	45%	0.454	S	S	*	.	H	α-helix	trans	-62.2	-34.2	178.1	-66.4	-179.6	179.4	-179.4	0	112.3	S41 I42	K38-S41 PolarHBondContact O-N 3.16Å; K38-I42 WeakPolarHBondContact O-CG1 3.27Å; K38-I42 PolarHBondContact O-N 3.39Å
39	S	45.2	Very low	42.2	Very low	61 Å²	61	85.9 Å²	85.9	43%	0.427	42%	0.422	S	S	.	.	H	α-helix	trans	-70.5	-46.2	-179.1	-172.3	0	0	0	0	110.8	D37 S41 I42 K43	D37-S39 VanDerWaalsContact C-N 3.28Å; D37-S39 PolarHBondContact O-N 3.3Å; D37-S39 PolarHBondContact OD1-N 3.42Å; D37-S39 VanDerWaalsContact OD1-N 3.16Å; S39-S41 PolarHBondContact O-N 3.17Å; S39-I42 PolarHBondContact O-N 3.06Å; S39-K43 WeakPolarHBondContact O-CB 3.08Å; S39-K43 WeakPolarHBondContact O-CG 3.45Å; S39-K43 PolarHBondContact O-N 3.29Å
40	A	47.9	Very low	42.8	Very low	30 Å²	30	82.2 Å²	82.2	25%	0.248	41%	0.405	C	S	.	.	H	α-helix	trans	-60.6	-38.9	173.4	0	0	0	0	0	111.1	D37 K43 H44	D37-A40 HydrophobicContact CB-CB 3.98Å; D37-A40 PolarHBondContact O-N 3.32Å; D37-A40 PolarHBondContact OD1-N 2.97Å; D37-A40 VanDerWaalsContact OD2-CB 3.29Å; D37-A40 WeakPolarHBondContact OD2-CB 3.42Å; A40-K43 PolarHBondContact O-N 2.96Å; A40-H44 VanDerWaalsContact O-CB 3.29Å; A40-H44 WeakPolarHBondContact O-CB 3.49Å; A40-H44 PolarHBondContact O-CD2 3.2Å; A40-H44 PolarHBondContact O-N 2.75Å
41	S	46.5	Very low	43.3	Very low	18 Å²	18	84.7 Å²	84.7	13%	0.126	43%	0.427	C	S	.	.	H	α-helix	trans	-67.3	-44.3	-178.6	-57.1	0	0	0	0	113.2	I33 D37 K38 S39 H44 A45	I33-S41 WeakPolarHBondContact CG2-OG 3.46Å; D37-S41 WeakPolarHBondContact O-CB 3.12Å; D37-S41 PolarHBondContact O-N 3.04Å; D37-S41 PolarHBondContact O-OG 2.9Å; K38-S41 PolarHBondContact O-N 3.16Å; S39-S41 PolarHBondContact O-N 3.17Å; S41-H44 PolarHBondContact O-N 3.32Å; S41-A45 WeakPolarHBondContact O-CB 3.49Å; S41-A45 PolarHBondContact O-N 3.41Å
42	I	46	Very low	43.8	Very low	92 Å²	92	82 Å²	82	47%	0.472	42%	0.415	S	S	.	.	H	α-helix	trans	-63.5	-45.6	173.3	-69	169.6	0	0	0	110.2	K38 S39 H44 A45 I46	K38-I42 WeakPolarHBondContact O-CG1 3.27Å; K38-I42 PolarHBondContact O-N 3.39Å; S39-I42 PolarHBondContact O-N 3.06Å; I42-H44 VanDerWaalsContact C-N 3.28Å; I42-H44 PolarHBondContact O-N 3.18Å; I42-A45 PolarHBondContact O-N 3.08Å; I42-I46 HydrophobicContact CG2-CD1 3.62Å; I42-I46 HydrophobicContact CG2-CG1 4.31Å; I42-I46 WeakPolarHBondContact O-CB 3.4Å; I42-I46 VanDerWaalsContact O-CG1 3.26Å; I42-I46 WeakPolarHBondContact O-CG1 3.37Å; I42-I46 PolarHBondContact O-N 3.04Å
43	K	47	Very low	44.1	Very low	113 Å²	113	73.1 Å²	73.1	49%	0.491	40%	0.396	S	S	.	.	H	α-helix	trans	-58.9	-40.2	175.1	-77.1	179	-179.3	178.4	0	111.7	S39 A40 I46 N47	S39-K43 WeakPolarHBondContact O-CB 3.08Å; S39-K43 WeakPolarHBondContact O-CG 3.45Å; S39-K43 PolarHBondContact O-N 3.29Å; A40-K43 PolarHBondContact O-N 2.96Å; K43-I46 PolarHBondContact O-N 3.11Å; K43-N47 WeakPolarHBondContact O-CB 3.34Å; K43-N47 PolarHBondContact O-N 3.09Å; K43-N47 PolarHBondContact O-ND2 3.49Å
44	H	47.3	Very low	44.2	Very low	109 Å²	109	71.6 Å²	71.6	51%	0.505	39%	0.388	S	S	.	.	H	α-helix	trans	-66.5	-42.1	176.1	-91.2	-65.5	0	0	0	111.9	L31 A40 S41 I42 N47 W48	L31-H44 HydrophobicContact CD2-CB 4.43Å; A40-H44 VanDerWaalsContact O-CB 3.29Å; A40-H44 WeakPolarHBondContact O-CB 3.49Å; A40-H44 PolarHBondContact O-CD2 3.2Å; A40-H44 PolarHBondContact O-N 2.75Å; S41-H44 PolarHBondContact O-N 3.32Å; I42-H44 VanDerWaalsContact C-N 3.28Å; I42-H44 PolarHBondContact O-N 3.18Å; H44-N47 PolarHBondContact O-N 3.41Å; H44-W48 WeakPolarHBondContact O-CA 3.11Å; H44-W48 WeakPolarHBondContact O-CB 3.33Å; H44-W48 PolarHBondContact O-N 2.91Å
45	A	49.3	Very low	44.7	Very low	13 Å²	13	66.7 Å²	66.7	11%	0.107	36%	0.361	C	S	.	.	H	α-helix	trans	-65.5	-41.1	176.6	0	0	0	0	0	111.4	S41 I42 W48 V49 A68	S41-A45 WeakPolarHBondContact O-CB 3.49Å; S41-A45 PolarHBondContact O-N 3.41Å; I42-A45 PolarHBondContact O-N 3.08Å; A45-W48 WeakPolarHBondContact O-CB 3.28Å; A45-W48 PolarHBondContact O-N 2.89Å; A45-V49 WeakPolarHBondContact O-CG2 3.47Å; A45-V49 PolarHBondContact O-N 3.18Å; A45-A68 HydrophobicContact CB-CB 3.75Å
46	I	45	Very low	44.9	Very low	2 Å²	2	61 Å²	61	1%	0.01	35%	0.347	C	S	.	.	H	α-helix	trans	-63.4	-49.7	173.3	-69.1	167.3	0	0	0	110.9	I42 K43 W48 V49 Y50 Y61 A64 A65 A68	I42-I46 HydrophobicContact CG2-CD1 3.62Å; I42-I46 HydrophobicContact CG2-CG1 4.31Å; I42-I46 WeakPolarHBondContact O-CB 3.4Å; I42-I46 VanDerWaalsContact O-CG1 3.26Å; I42-I46 WeakPolarHBondContact O-CG1 3.37Å; I42-I46 PolarHBondContact O-N 3.04Å; K43-I46 PolarHBondContact O-N 3.11Å; I46-W48 PolarHBondContact O-N 3.44Å; I46-V49 WeakPolarHBondContact O-CB 3.31Å; I46-V49 PolarHBondContact O-N 3.38Å; I46-V49 VanDerWaalsContact O-N 3.17Å; I46-Y50 HydrophobicContact CG2-CD2 3.65Å; I46-Y50 HydrophobicContact CG2-CE2 3.69Å; I46-Y50 VanDerWaalsContact O-CD2 3.31Å; I46-Y50 WeakPolarHBondContact O-CD2 3.42Å; I46-Y50 PolarHBondContact O-N 2.72Å; I46-Y61 HydrophobicContact CD1-CE1 4.13Å; I46-Y61 HydrophobicContact CD1-CE2 4.16Å; I46-Y61 WeakPolarHBondContact CD1-OH 3.41Å; I46-Y61 HydrophobicContact CG2-CD2 3.98Å; I46-Y61 HydrophobicContact CG2-CE2 3.68Å; I46-A64 HydrophobicContact CG2-CB 4.42Å; I46-A65 HydrophobicContact CD1-CB 3.58Å; I46-A65 HydrophobicContact CG1-CB 3.83Å; I46-A68 HydrophobicContact CG1-CB 4Å
47	N	46.7	Very low	44.9	Very low	93 Å²	93	69.1 Å²	69.1	50%	0.497	36%	0.357	S	S	.	.	H	α-helix	trans	-62.5	-35.3	177.3	-75.7	-15.6	0	0	0	111.3	K43 H44 Y50 S51	K43-N47 WeakPolarHBondContact O-CB 3.34Å; K43-N47 PolarHBondContact O-N 3.09Å; K43-N47 PolarHBondContact O-ND2 3.49Å; H44-N47 PolarHBondContact O-N 3.41Å; N47-Y50 PolarHBondContact O-N 3.06Å; N47-S51 WeakPolarHBondContact O-CB 3.3Å; N47-S51 PolarHBondContact O-N 3.37Å; N47-S51 PolarHBondContact O-OG 3.35Å
48	W	46.1	Very low	44.8	Very low	91 Å²	91	75.4 Å²	75.4	35%	0.345	38%	0.376	S	S	.	.	H	α-helix	trans	-64.4	-48.1	173.4	178.2	82.1	0	0	0	110.4	L25 H44 A45 I46 Y50 S51 S52 L54 A71	L25-W48 HydrophobicContact CD2-CH2 3.58Å; L25-W48 HydrophobicContact CD2-CZ2 3.42Å; L25-W48 VanDerWaalsContact CD2-CZ2 3.42Å; H44-W48 WeakPolarHBondContact O-CA 3.11Å; H44-W48 WeakPolarHBondContact O-CB 3.33Å; H44-W48 PolarHBondContact O-N 2.91Å; A45-W48 WeakPolarHBondContact O-CB 3.28Å; A45-W48 PolarHBondContact O-N 2.89Å; I46-W48 PolarHBondContact O-N 3.44Å; W48-Y50 VanDerWaalsContact C-N 3.32Å; W48-Y50 PolarHBondContact O-N 2.96Å; W48-S51 WeakPolarHBondContact CA-OG 3.02Å; W48-S51 PolarHBondContact O-N 3.02Å; W48-S51 PolarHBondContact O-OG 3.22Å; W48-S52 WeakPolarHBondContact O-CA 3.41Å; W48-S52 WeakPolarHBondContact O-CB 3.38Å; W48-S52 PolarHBondContact O-N 3.36Å; W48-S52 PolarHBondContact O-OG 3.46Å; W48-L54 HydrophobicContact CH2-CD1 3.92Å; W48-L54 HydrophobicContact CZ2-CD1 4.36Å; W48-A71 HydrophobicContact CZ3-CB 4.26Å
49	V	46.7	Very low	44.7	Very low	2 Å²	2	70.2 Å²	70.2	1%	0.012	36%	0.355	C	S	.	.	H	α-helix	trans	-53.8	-48.7	172.8	164.5	0	0	0	0	110.8	A45 I46 S52 F55 A64 W67 A68	A45-V49 WeakPolarHBondContact O-CG2 3.47Å; A45-V49 PolarHBondContact O-N 3.18Å; I46-V49 WeakPolarHBondContact O-CB 3.31Å; I46-V49 PolarHBondContact O-N 3.38Å; I46-V49 VanDerWaalsContact O-N 3.17Å; V49-S52 PolarHBondContact O-OG 2.95Å; V49-F55 HydrophobicContact CB-CD2 4.44Å; V49-F55 HydrophobicContact CB-CE2 4.37Å; V49-F55 HydrophobicContact CG1-CD2 3.49Å; V49-F55 VanDerWaalsContact CG1-CD2 3.49Å; V49-F55 HydrophobicContact CG1-CE2 3.65Å; V49-F55 HydrophobicContact CG1-CG 4.25Å; V49-F55 HydrophobicContact CG2-CE2 4.34Å; V49-A64 HydrophobicContact CG1-CB 3.73Å; V49-W67 HydrophobicContact CG1-CB 4.44Å; V49-A68 HydrophobicContact CG2-CB 3.88Å
50	Y	45.8	Very low	44.5	Very low	88 Å²	88	70.2 Å²	70.2	35%	0.345	35%	0.35	S	S	.	.	H	α-helix	trans	-64.4	-43.4	177.3	-86.4	-64.8	0	0	0	114.6	I46 N47 W48 T59 D60 Y61 A64	I46-Y50 HydrophobicContact CG2-CD2 3.65Å; I46-Y50 HydrophobicContact CG2-CE2 3.69Å; I46-Y50 VanDerWaalsContact O-CD2 3.31Å; I46-Y50 WeakPolarHBondContact O-CD2 3.42Å; I46-Y50 PolarHBondContact O-N 2.72Å; N47-Y50 PolarHBondContact O-N 3.06Å; W48-Y50 VanDerWaalsContact C-N 3.32Å; W48-Y50 PolarHBondContact O-N 2.96Å; Y50-T59 VanDerWaalsContact CE1-O 3.22Å; Y50-T59 WeakPolarHBondContact CE1-O 3.21Å; Y50-T59 PolarHBondContact OH-O 3.38Å; Y50-D60 PolarHBondContact OH-O 3.07Å; Y50-Y61 HydrophobicContact CE2-CD2 4.14Å; Y50-Y61 WeakPolarHBondContact OH-CA 3.42Å; Y50-Y61 PolarHBondContact OH-N 3.24Å; Y50-A64 HydrophobicContact CD2-CB 4.02Å; Y50-A64 HydrophobicContact CE1-CB 4.39Å; Y50-A64 HydrophobicContact CE2-CB 3.51Å
51	S	43.8	Very low	44.1	Very low	96 Å²	96	74 Å²	74	67%	0.671	36%	0.359	S	S	*	.	H	α-helix	trans	-82.4	-19.7	-174.8	59.9	0	0	0	0	113.3	N47 W48 G53	N47-S51 WeakPolarHBondContact O-CB 3.3Å; N47-S51 PolarHBondContact O-N 3.37Å; N47-S51 PolarHBondContact O-OG 3.35Å; W48-S51 WeakPolarHBondContact CA-OG 3.02Å; W48-S51 PolarHBondContact O-N 3.02Å; W48-S51 PolarHBondContact O-OG 3.22Å; S51-G53 PolarHBondContact O-N 2.72Å; S51-G53 VanDerWaalsContact O-N 3.15Å
52	S	43.3	Very low	43.6	Very low	28 Å²	28	78.1 Å²	78.1	20%	0.196	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-18.1	-178.6	66.8	0	0	0	0	113.3	W48 V49 L54	W48-S52 WeakPolarHBondContact O-CA 3.41Å; W48-S52 WeakPolarHBondContact O-CB 3.38Å; W48-S52 PolarHBondContact O-N 3.36Å; W48-S52 PolarHBondContact O-OG 3.46Å; V49-S52 PolarHBondContact O-OG 2.95Å; S52-L54 PolarHBondContact O-N 3.25Å; S52-L54 VanDerWaalsContact OG-CB 3.23Å; S52-L54 WeakPolarHBondContact OG-CB 3.31Å; S52-L54 VanDerWaalsContact OG-CD1 3.3Å; S52-L54 WeakPolarHBondContact OG-CD1 3.5Å; S52-L54 WeakPolarHBondContact OG-CG 3.45Å; S52-L54 PolarHBondContact OG-N 3.42Å
53	G	40.9	Very low	43.4	Very low	45 Å²	45	74.6 Å²	74.6	46%	0.464	36%	0.357	S	S	.	.	S	Bend	trans	69.4	6.1	-173.5	0	0	0	0	0	113.5	S51 F55	S51-G53 PolarHBondContact O-N 2.72Å; S51-G53 VanDerWaalsContact O-N 3.15Å; G53-F55 PolarHBondContact O-N 3.5Å
54	L	37.8	Very low	43.2	Very low	11 Å²	11	69.2 Å²	69.2	6%	0.058	33%	0.334	C	S	.	.			trans	-71.4	-18.1	-178.6	-64.9	177.2	0	0	0	113.2	C18 L19 I20 W48 S52	C18-L54 WeakPolarHBondContact CB-O 3.5Å; L19-L54 WeakPolarHBondContact O-CD2 3.47Å; I20-L54 HydrophobicContact CB-CD2 4.26Å; I20-L54 HydrophobicContact CG1-CD1 4.29Å; I20-L54 HydrophobicContact CG1-CD2 4.02Å; I20-L54 HydrophobicContact CG2-CD1 4.48Å; W48-L54 HydrophobicContact CH2-CD1 3.92Å; W48-L54 HydrophobicContact CZ2-CD1 4.36Å; S52-L54 PolarHBondContact O-N 3.25Å; S52-L54 VanDerWaalsContact OG-CB 3.23Å; S52-L54 WeakPolarHBondContact OG-CB 3.31Å; S52-L54 VanDerWaalsContact OG-CD1 3.3Å; S52-L54 WeakPolarHBondContact OG-CD1 3.5Å; S52-L54 WeakPolarHBondContact OG-CG 3.45Å; S52-L54 PolarHBondContact OG-N 3.42Å
55	F	43	Very low	42.8	Very low	40 Å²	40	64.6 Å²	64.6	18%	0.175	31%	0.314	C	S	.	.	S	Bend	trans	-129.1	147.6	-172.5	-57.7	-82.5	0	0	0	110	V49 G53 R57 W67	V49-F55 HydrophobicContact CB-CD2 4.44Å; V49-F55 HydrophobicContact CB-CE2 4.37Å; V49-F55 HydrophobicContact CG1-CD2 3.49Å; V49-F55 VanDerWaalsContact CG1-CD2 3.49Å; V49-F55 HydrophobicContact CG1-CE2 3.65Å; V49-F55 HydrophobicContact CG1-CG 4.25Å; V49-F55 HydrophobicContact CG2-CE2 4.34Å; G53-F55 PolarHBondContact O-N 3.5Å; F55-R57 PolarHBondContact O-N 3.32Å; F55-W67 HydrophobicContact CE1-CB 4.46Å; F55-W67 HydrophobicContact CE1-CD2 4.03Å; F55-W67 AromaticContact CE1-CG 3.96Å; F55-W67 HydrophobicContact CE1-CG 3.96Å; F55-W67 HydrophobicContact CZ-CB 4.2Å; F55-W67 HydrophobicContact CZ-CD2 4.33Å; F55-W67 HydrophobicContact CZ-CG 4.16Å
56	P	40.7	Very low	42.6	Very low	63 Å²	63	64.1 Å²	64.1	41%	0.409	31%	0.31	S	S	.	.			trans	-49	141	176	-26	32.6	0	0	0	111	Y58 T59	P56-Y58 PolarHBondContact O-N 3.09Å; P56-T59 WeakPolarHBondContact CD-OG1 3.34Å; P56-T59 PolarHBondContact O-N 2.99Å; P56-T59 PolarHBondContact O-OG1 3.34Å; P56-T59 VanDerWaalsContact O-OG1 3.08Å
57	R	41.7	Very low	42.7	Very low	237 Å²	237	67.3 Å²	67.3	89%	0.894	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-5.6	179.6	-76.1	-177	174.9	177.9	-1.8	114.8	F55	F55-R57 PolarHBondContact O-N 3.32Å
58	Y	44	Very low	42.7	Very low	218 Å²	218	63.1 Å²	63.1	86%	0.855	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	15.7	179.7	-52.6	-70.6	0	0	0	113.4	P56 D60	P56-Y58 PolarHBondContact O-N 3.09Å; Y58-D60 PolarHBondContact O-N 3.39Å
59	T	43.4	Very low	42.7	Very low	25 Å²	25	62.2 Å²	62.2	15%	0.153	31%	0.305	C	S	.	.			trans	-60	121.4	166.9	-59	0	0	0	0	108	Y50 P56 A63 A64	Y50-T59 VanDerWaalsContact CE1-O 3.22Å; Y50-T59 WeakPolarHBondContact CE1-O 3.21Å; Y50-T59 PolarHBondContact OH-O 3.38Å; P56-T59 WeakPolarHBondContact CD-OG1 3.34Å; P56-T59 PolarHBondContact O-N 2.99Å; P56-T59 PolarHBondContact O-OG1 3.34Å; P56-T59 VanDerWaalsContact O-OG1 3.08Å; T59-A63 HydrophobicContact CG2-CB 3.67Å; T59-A64 HydrophobicContact CG2-CB 4.33Å
60	D	42.4	Very low	42.7	Very low	61 Å²	61	63.4 Å²	63.4	33%	0.326	31%	0.311	S	S	.	.			trans	-63.1	157.4	179	69.6	65.8	0	0	0	110.9	Y50 Y58 Y62 A63 A64 F112	Y50-D60 PolarHBondContact OH-O 3.07Å; Y58-D60 PolarHBondContact O-N 3.39Å; D60-Y62 PolarHBondContact O-N 2.66Å; D60-Y62 VanDerWaalsContact O-N 3.07Å; D60-Y62 WeakPolarHBondContact OD1-CA 3.41Å; D60-Y62 WeakPolarHBondContact OD1-CB 3.49Å; D60-Y62 PolarHBondContact OD1-N 3.14Å; D60-A63 PolarHBondContact O-N 3.22Å; D60-A63 PolarHBondContact OD1-N 3.14Å; D60-A64 PolarHBondContact O-N 2.81Å; D60-F112 WeakPolarHBondContact OD1-CZ 3.29Å; D60-F112 WeakPolarHBondContact OD2-CE1 3.18Å
61	Y	38.9	Very low	42.7	Very low	108 Å²	108	60.1 Å²	60.1	42%	0.424	30%	0.302	S	S	.	.	H	α-helix	trans	-57.1	-29.4	-173.5	179	-92.4	0	0	0	112.8	I46 Y50 A65	I46-Y61 HydrophobicContact CD1-CE1 4.13Å; I46-Y61 HydrophobicContact CD1-CE2 4.16Å; I46-Y61 WeakPolarHBondContact CD1-OH 3.41Å; I46-Y61 HydrophobicContact CG2-CD2 3.98Å; I46-Y61 HydrophobicContact CG2-CE2 3.68Å; Y50-Y61 HydrophobicContact CE2-CD2 4.14Å; Y50-Y61 WeakPolarHBondContact OH-CA 3.42Å; Y50-Y61 PolarHBondContact OH-N 3.24Å; Y61-A65 WeakPolarHBondContact O-CB 3.35Å; Y61-A65 PolarHBondContact O-N 3.48Å
62	Y	35.9	Very low	42.5	Very low	105 Å²	105	57.9 Å²	57.9	41%	0.412	28%	0.281	S	S	.	.	H	α-helix	trans	-85.5	-39.3	-173.1	-65.5	-61.1	0	0	0	112	D60 A64 A65 A66 A108 F112	D60-Y62 PolarHBondContact O-N 2.66Å; D60-Y62 VanDerWaalsContact O-N 3.07Å; D60-Y62 WeakPolarHBondContact OD1-CA 3.41Å; D60-Y62 WeakPolarHBondContact OD1-CB 3.49Å; D60-Y62 PolarHBondContact OD1-N 3.14Å; Y62-A64 VanDerWaalsContact C-N 3.33Å; Y62-A65 WeakPolarHBondContact O-CB 3.42Å; Y62-A65 PolarHBondContact O-N 2.68Å; Y62-A66 WeakPolarHBondContact O-CB 3.35Å; Y62-A66 PolarHBondContact O-N 3.46Å; Y62-A108 WeakPolarHBondContact CB-O 3.46Å; Y62-A108 HydrophobicContact CD1-CB 3.41Å; Y62-A108 VanDerWaalsContact CD1-CB 3.41Å; Y62-A108 HydrophobicContact CE1-CB 3.99Å; Y62-A108 HydrophobicContact CG-CB 4.34Å; Y62-F112 HydrophobicContact CD2-CE2 4.2Å; Y62-F112 HydrophobicContact CD2-CZ 4.19Å; Y62-F112 HydrophobicContact CG-CE2 4.07Å; Y62-F112 HydrophobicContact CG-CZ 4.44Å
63	A	41.8	Very low	42.5	Very low	18 Å²	18	56.6 Å²	56.6	15%	0.149	27%	0.272	C	S	.	.	H	α-helix	trans	-59.8	-45.3	166.3	0	0	0	0	0	110.3	T59 D60 A65 A66 W67	T59-A63 HydrophobicContact CG2-CB 3.67Å; D60-A63 PolarHBondContact O-N 3.22Å; D60-A63 PolarHBondContact OD1-N 3.14Å; A63-A65 VanDerWaalsContact C-N 3.31Å; A63-A65 PolarHBondContact O-N 3.48Å; A63-A66 WeakPolarHBondContact O-CB 3.45Å; A63-A66 PolarHBondContact O-N 3.35Å; A63-A66 VanDerWaalsContact O-N 3.16Å; A63-W67 WeakPolarHBondContact O-CB 3.33Å; A63-W67 PolarHBondContact O-N 3.09Å
64	A	42.9	Very low	42.3	Very low	0 Å²	0	56.9 Å²	56.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.8	-39.3	175.4	0	0	0	0	0	112.4	I46 V49 Y50 T59 D60 Y62 W67 A68	I46-A64 HydrophobicContact CG2-CB 4.42Å; V49-A64 HydrophobicContact CG1-CB 3.73Å; Y50-A64 HydrophobicContact CD2-CB 4.02Å; Y50-A64 HydrophobicContact CE1-CB 4.39Å; Y50-A64 HydrophobicContact CE2-CB 3.51Å; T59-A64 HydrophobicContact CG2-CB 4.33Å; D60-A64 PolarHBondContact O-N 2.81Å; Y62-A64 VanDerWaalsContact C-N 3.33Å; A64-W67 PolarHBondContact O-N 3.23Å; A64-A68 VanDerWaalsContact O-CB 3.22Å; A64-A68 WeakPolarHBondContact O-CB 3.27Å; A64-A68 PolarHBondContact O-N 3.07Å
65	A	38.8	Very low	42.1	Very low	12 Å²	12	57.7 Å²	57.7	10%	0.099	27%	0.268	C	S	.	.	H	α-helix	trans	-65.5	-40.5	173.1	0	0	0	0	0	112.9	I46 Y61 Y62 A63 W67 A68 V69	I46-A65 HydrophobicContact CD1-CB 3.58Å; I46-A65 HydrophobicContact CG1-CB 3.83Å; Y61-A65 WeakPolarHBondContact O-CB 3.35Å; Y61-A65 PolarHBondContact O-N 3.48Å; Y62-A65 WeakPolarHBondContact O-CB 3.42Å; Y62-A65 PolarHBondContact O-N 2.68Å; A63-A65 VanDerWaalsContact C-N 3.31Å; A63-A65 PolarHBondContact O-N 3.48Å; A65-W67 VanDerWaalsContact C-N 3.33Å; A65-W67 PolarHBondContact O-N 2.7Å; A65-A68 WeakPolarHBondContact O-CB 3.47Å; A65-A68 PolarHBondContact O-N 3.33Å; A65-V69 WeakPolarHBondContact O-CG2 3.37Å; A65-V69 PolarHBondContact O-N 3.19Å
66	A	45	Very low	41.8	Very low	3 Å²	3	57 Å²	57	3%	0.025	27%	0.268	C	S	.	.	H	α-helix	trans	-62	-45.7	176.9	0	0	0	0	0	111.1	Y62 A63 V69 L70 F109	Y62-A66 WeakPolarHBondContact O-CB 3.35Å; Y62-A66 PolarHBondContact O-N 3.46Å; A63-A66 WeakPolarHBondContact O-CB 3.45Å; A63-A66 PolarHBondContact O-N 3.35Å; A63-A66 VanDerWaalsContact O-N 3.16Å; A66-V69 PolarHBondContact O-N 2.95Å; A66-L70 WeakPolarHBondContact O-CB 3.39Å; A66-L70 WeakPolarHBondContact O-CG 3.5Å; A66-L70 PolarHBondContact O-N 3.15Å; A66-F109 HydrophobicContact CB-CD1 4.09Å; A66-F109 HydrophobicContact CB-CD2 3.76Å; A66-F109 HydrophobicContact CB-CE1 3.77Å; A66-F109 HydrophobicContact CB-CE2 3.5Å; A66-F109 HydrophobicContact CB-CG 4.08Å; A66-F109 HydrophobicContact CB-CZ 3.47Å; A66-F109 VanDerWaalsContact CB-CZ 3.47Å
67	W	47.7	Very low	41.3	Very low	70 Å²	70	59.8 Å²	59.8	27%	0.265	28%	0.276	S	S	.	.	H	α-helix	trans	-64.5	-38.4	173.2	-74.6	117.7	0	0	0	113.1	V49 F55 A63 A64 A65 V69 L70 A71 L118	V49-W67 HydrophobicContact CG1-CB 4.44Å; F55-W67 HydrophobicContact CE1-CB 4.46Å; F55-W67 HydrophobicContact CE1-CD2 4.03Å; F55-W67 AromaticContact CE1-CG 3.96Å; F55-W67 HydrophobicContact CE1-CG 3.96Å; F55-W67 HydrophobicContact CZ-CB 4.2Å; F55-W67 HydrophobicContact CZ-CD2 4.33Å; F55-W67 HydrophobicContact CZ-CG 4.16Å; A63-W67 WeakPolarHBondContact O-CB 3.33Å; A63-W67 PolarHBondContact O-N 3.09Å; A64-W67 PolarHBondContact O-N 3.23Å; A65-W67 VanDerWaalsContact C-N 3.33Å; A65-W67 PolarHBondContact O-N 2.7Å; W67-V69 VanDerWaalsContact C-N 3.32Å; W67-V69 PolarHBondContact O-N 2.87Å; W67-L70 HydrophobicContact CD2-CD1 4.37Å; W67-L70 HydrophobicContact CE3-CB 4.39Å; W67-L70 HydrophobicContact CE3-CD1 3.85Å; W67-L70 HydrophobicContact CZ3-CD1 4.15Å; W67-L70 CarbonylContact O-C 3.58Å; W67-L70 PolarHBondContact O-N 2.92Å; W67-A71 WeakPolarHBondContact O-CB 3.49Å; W67-A71 PolarHBondContact O-N 3.42Å; W67-L118 HydrophobicContact CH2-CD2 3.19Å; W67-L118 HydrophobicContact CZ2-CD2 3.36Å; W67-L118 HydrophobicContact CZ3-CD2 4.16Å
68	A	45.8	Very low	40.7	Very low	4 Å²	4	56.9 Å²	56.9	3%	0.033	27%	0.266	C	S	.	.	H	α-helix	trans	-62.6	-40.3	176.5	0	0	0	0	0	111.4	A45 I46 V49 A64 A65 H72	A45-A68 HydrophobicContact CB-CB 3.75Å; I46-A68 HydrophobicContact CG1-CB 4Å; V49-A68 HydrophobicContact CG2-CB 3.88Å; A64-A68 VanDerWaalsContact O-CB 3.22Å; A64-A68 WeakPolarHBondContact O-CB 3.27Å; A64-A68 PolarHBondContact O-N 3.07Å; A65-A68 WeakPolarHBondContact O-CB 3.47Å; A65-A68 PolarHBondContact O-N 3.33Å; A68-H72 WeakPolarHBondContact O-CB 3.39Å; A68-H72 PolarHBondContact O-N 3.35Å
69	V	46.3	Very low	40.2	Very low	72 Å²	72	50.4 Å²	50.4	44%	0.436	27%	0.266	S	S	.	.	H	α-helix	trans	-69.6	-42.3	174.9	174.5	0	0	0	0	111.1	A65 A66 W67 A71 H72 G73 F109	A65-V69 WeakPolarHBondContact O-CG2 3.37Å; A65-V69 PolarHBondContact O-N 3.19Å; A66-V69 PolarHBondContact O-N 2.95Å; W67-V69 VanDerWaalsContact C-N 3.32Å; W67-V69 PolarHBondContact O-N 2.87Å; V69-A71 VanDerWaalsContact C-N 3.34Å; V69-A71 PolarHBondContact O-N 2.91Å; V69-H72 PolarHBondContact O-N 3.18Å; V69-G73 PolarHBondContact O-N 3.45Å; V69-F109 HydrophobicContact CB-CE2 4.08Å; V69-F109 HydrophobicContact CG1-CE2 4.35Å
70	L	47.3	Very low	39.7	Very low	27 Å²	27	51.8 Å²	51.8	14%	0.141	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-37.7	175.2	-74.3	171.8	0	0	0	112.6	A66 W67 G73 L74 F109 I119 I162	A66-L70 WeakPolarHBondContact O-CB 3.39Å; A66-L70 WeakPolarHBondContact O-CG 3.5Å; A66-L70 PolarHBondContact O-N 3.15Å; W67-L70 HydrophobicContact CD2-CD1 4.37Å; W67-L70 HydrophobicContact CE3-CB 4.39Å; W67-L70 HydrophobicContact CE3-CD1 3.85Å; W67-L70 HydrophobicContact CZ3-CD1 4.15Å; W67-L70 CarbonylContact O-C 3.58Å; W67-L70 PolarHBondContact O-N 2.92Å; L70-G73 WeakPolarHBondContact O-CA 3.49Å; L70-L74 WeakPolarHBondContact O-CG 3.44Å; L70-L74 PolarHBondContact O-N 3.18Å; L70-F109 HydrophobicContact CG-CZ 4.31Å; L70-I119 HydrophobicContact CD1-CD1 4.33Å; L70-I119 HydrophobicContact CD1-CG1 4.29Å; L70-I119 HydrophobicContact CD2-CD1 4Å; L70-I119 HydrophobicContact CD2-CG1 4.14Å; L70-I162 HydrophobicContact CD1-CD1 4.49Å; L70-I162 HydrophobicContact CD2-CD1 4.19Å; L70-I162 HydrophobicContact CD2-CG1 4.26Å
71	A	44.5	Very low	39	Very low	20 Å²	20	54.8 Å²	54.8	17%	0.165	30%	0.3	C	S	.	.	H	α-helix	trans	-75.6	-35.1	175.7	0	0	0	0	0	111.4	W48 W67 V69 G73 L74 V75	W48-A71 HydrophobicContact CZ3-CB 4.26Å; W67-A71 WeakPolarHBondContact O-CB 3.49Å; W67-A71 PolarHBondContact O-N 3.42Å; V69-A71 VanDerWaalsContact C-N 3.34Å; V69-A71 PolarHBondContact O-N 2.91Å; A71-G73 CarbonylContact O-C 3.54Å; A71-L74 WeakPolarHBondContact O-CB 2.97Å; A71-L74 PolarHBondContact O-N 2.96Å; A71-V75 VanDerWaalsContact O-CG2 3.27Å; A71-V75 WeakPolarHBondContact O-CG2 3.48Å; A71-V75 PolarHBondContact O-N 3.25Å
72	H	41.3	Very low	38.9	Very low	49 Å²	49	52.8 Å²	52.8	23%	0.227	30%	0.3	C	S	.	.	H	α-helix	trans	-66.3	-49.8	179.5	-175.4	-86.2	0	0	0	112.8	I33 A68 V69 V75 C76	I33-H72 WeakPolarHBondContact CD1-CD2 3.49Å; I33-H72 VanDerWaalsContact CD1-CE1 3.45Å; I33-H72 WeakPolarHBondContact CD1-CE1 3.32Å; I33-H72 WeakPolarHBondContact CD1-NE2 3.45Å; I33-H72 VanDerWaalsContact CG1-NE2 3.31Å; I33-H72 WeakPolarHBondContact CG1-NE2 3.46Å; A68-H72 WeakPolarHBondContact O-CB 3.39Å; A68-H72 PolarHBondContact O-N 3.35Å; V69-H72 PolarHBondContact O-N 3.18Å; H72-V75 PolarHBondContact O-N 3.46Å; H72-C76 PolarHBondContact CE1-SG 3.18Å; H72-C76 PolarHBondContact O-N 2.79Å; H72-C76 PolarHBondContact O-SG 3.22Å; H72-C76 VanDerWaalsContact O-SG 3.34Å
73	G	42.9	Very low	38.7	Very low	1 Å²	1	49.2 Å²	49.2	1%	0.01	29%	0.289	C	S	.	.	H	α-helix		36.6	-123.7	107.7	0	0	0	0	0	121.1	V69 L70 A71 V75 C76 W165	V69-G73 PolarHBondContact O-N 3.45Å; L70-G73 WeakPolarHBondContact O-CA 3.49Å; A71-G73 CarbonylContact O-C 3.54Å; G73-V75 PolarHBondContact O-N 2.85Å; G73-C76 PolarHBondContact O-N 3.18Å; G73-W165 VanDerWaalsContact C-CE2 3.43Å; G73-W165 VanDerWaalsContact N-CH2 3.29Å; G73-W165 WeakPolarHBondContact O-CH2 3.45Å; G73-W165 WeakPolarHBondContact O-CZ2 3.23Å; G73-W165 PolarHBondContact O-NE1 3.11Å
74	L	36.6	Very low	38.4	Very low	50 Å²	50	51.5 Å²	51.5	26%	0.262	30%	0.304	S	S	.	.	H	α-helix	trans	-44.9	-29.3	173.5	-49.5	177.5	0	0	0	114.2	L70 A71 I158 V161	L70-L74 WeakPolarHBondContact O-CG 3.44Å; L70-L74 PolarHBondContact O-N 3.18Å; A71-L74 WeakPolarHBondContact O-CB 2.97Å; A71-L74 PolarHBondContact O-N 2.96Å; L74-I158 HydrophobicContact CD1-CG1 4.29Å; L74-V161 HydrophobicContact CD2-CB 3.42Å; L74-V161 VanDerWaalsContact CD2-CB 3.42Å; L74-V161 HydrophobicContact CD2-CG1 3.14Å; L74-V161 HydrophobicContact CD2-CG2 4.1Å
75	V	34.3	Very low	37.8	Very low	28 Å²	28	56.2 Å²	56.2	17%	0.17	33%	0.33	C	S	.	.	H	α-helix	trans	-82.5	-16.2	-170.1	166.8	0	0	0	0	113.9	H30 A71 H72 G73 E77	H30-V75 HydrophobicContact CB-CG1 3.51Å; H30-V75 VanDerWaalsContact CG-CG1 3.5Å; H30-V75 PolarHBondContact ND1-O 3.08Å; A71-V75 VanDerWaalsContact O-CG2 3.27Å; A71-V75 WeakPolarHBondContact O-CG2 3.48Å; A71-V75 PolarHBondContact O-N 3.25Å; H72-V75 PolarHBondContact O-N 3.46Å; G73-V75 PolarHBondContact O-N 2.85Å; V75-E77 PolarHBondContact O-N 3.21Å
76	C	35	Very low	37.4	Very low	26 Å²	26	62 Å²	62	18%	0.176	35%	0.349	C	S	.	.			trans	-95.2	81.7	-176.2	-68.3	0	0	0	0	112.5	H72 G73 P82 T83	H72-C76 PolarHBondContact CE1-SG 3.18Å; H72-C76 PolarHBondContact O-N 2.79Å; H72-C76 PolarHBondContact O-SG 3.22Å; H72-C76 VanDerWaalsContact O-SG 3.34Å; G73-C76 PolarHBondContact O-N 3.18Å; C76-P82 WeakPolarHBondContact O-CA 3.15Å; C76-T83 PolarHBondContact O-N 2.98Å
77	E	29.9	Very low	36.8	Very low	122 Å²	122	67.4 Å²	67.4	57%	0.57	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	130	165	-70.3	-177.5	171.6	0	0	111	V75	V75-E77 PolarHBondContact O-N 3.21Å
78	Y	30.5	Very low	36	Very low	176 Å²	176	70.9 Å²	70.9	69%	0.69	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117	114.8	161	-169.5	-94.3	0	0	0	108.9	G80 L81 T83	Y78-G80 VanDerWaalsContact C-N 3.26Å; Y78-G80 PolarHBondContact O-N 3.24Å; Y78-L81 PolarHBondContact N-O 3.37Å; Y78-L81 PolarHBondContact O-N 3.25Å; Y78-L81 VanDerWaalsContact O-O 3.05Å; Y78-T83 WeakPolarHBondContact CB-OG1 3.37Å
79	G	32.6	Very low	35.2	Very low	82 Å²	82	74.8 Å²	74.8	85%	0.845	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	27.5	-179.3	0	0	0	0	0	114.8	L81	G79-L81 VanDerWaalsContact C-N 3.28Å; G79-L81 PolarHBondContact O-N 2.87Å
80	G	32.3	Very low	34.4	Very low	53 Å²	53	80 Å²	80	55%	0.546	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	4.6	-175.2	0	0	0	0	0	114.4	Y78	Y78-G80 VanDerWaalsContact C-N 3.26Å; Y78-G80 PolarHBondContact O-N 3.24Å
81	L	29.7	Very low	33.7	Very low	125 Å²	125	82.3 Å²	82.3	65%	0.654	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.1	127.6	172.5	-69.1	169.1	0	0	0	109.1	Y78 G79 T83	Y78-L81 PolarHBondContact N-O 3.37Å; Y78-L81 PolarHBondContact O-N 3.25Å; Y78-L81 VanDerWaalsContact O-O 3.05Å; G79-L81 VanDerWaalsContact C-N 3.28Å; G79-L81 PolarHBondContact O-N 2.87Å; L81-T83 PolarHBondContact O-N 3.35Å
82	P	35	Very low	33.3	Very low	65 Å²	65	92.3 Å²	92.3	42%	0.422	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	115.2	173.6	-18.9	30.9	0	0	0	109.9	C76 W165	C76-P82 WeakPolarHBondContact O-CA 3.15Å; P82-W165 VanDerWaalsContact CB-CD1 3.47Å
83	T	33.6	Very low	32.8	Very low	30 Å²	30	96.6 Å²	96.6	18%	0.184	51%	0.508	C	S	.	.			trans	-111.2	125.2	-178.5	59.4	0	0	0	0	111	C76 Y78 L81 D85	C76-T83 PolarHBondContact O-N 2.98Å; Y78-T83 WeakPolarHBondContact CB-OG1 3.37Å; L81-T83 PolarHBondContact O-N 3.35Å; T83-D85 PolarHBondContact O-N 2.91Å
84	S	34.3	Very low	32.1	Very low	67 Å²	67	107.2 Å²	107.2	47%	0.469	55%	0.548	S	S	.	.	G	3₁₀ helix	trans	-73.5	0.2	173.3	52.5	0	0	0	0	113.8	W86 I87	S84-W86 PolarHBondContact O-N 2.88Å; S84-I87 PolarHBondContact O-N 3.35Å
85	D	30	Very low	31.8	Very low	99 Å²	99	114.8 Å²	114.8	53%	0.529	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-68	-5.6	-169.3	-69.2	-27.5	0	0	0	115	T83 I87 Y88 D89	T83-D85 PolarHBondContact O-N 2.91Å; D85-I87 VanDerWaalsContact C-N 3.33Å; D85-I87 PolarHBondContact O-N 3.26Å; D85-Y88 CarbonylContact O-C 3.51Å; D85-Y88 PolarHBondContact O-N 3Å; D85-D89 PolarHBondContact O-N 3.22Å
86	W	30.5	Very low	31.6	Very low	132 Å²	132	117.6 Å²	117.6	50%	0.5	59%	0.592	S	S	.	*	G	3₁₀ helix	trans	-77.7	-9.1	176.8	-84.7	52.5	0	0	0	115.2	S84 Y88	S84-W86 PolarHBondContact O-N 2.88Å; W86-Y88 PolarHBondContact O-N 3.14Å
87	I	31.9	Very low	31.6	Very low	118 Å²	118	120.5 Å²	120.5	61%	0.605	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-69.5	-24	161.6	-67.3	-179	0	0	0	110.5	S84 D85	S84-I87 PolarHBondContact O-N 3.35Å; D85-I87 VanDerWaalsContact C-N 3.33Å; D85-I87 PolarHBondContact O-N 3.26Å
88	Y	32.1	Very low	31.9	Very low	143 Å²	143	118.6 Å²	118.6	56%	0.561	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.3	2.3	-168.7	-64	-70.6	0	0	0	115.7	D85 W86 K90 E183	D85-Y88 CarbonylContact O-C 3.51Å; D85-Y88 PolarHBondContact O-N 3Å; W86-Y88 PolarHBondContact O-N 3.14Å; Y88-K90 VanDerWaalsContact C-N 3.32Å; Y88-K90 PolarHBondContact O-N 3.02Å; Y88-E183 PolarHBondContact OH-OE1 2.77Å
89	D	29.6	Very low	32.1	Very low	86 Å²	86	115.7 Å²	115.7	46%	0.46	61%	0.606	S	S	.	*	S	Bend	trans	-82	79.9	-179.2	-138.7	22.6	0	0	0	112.3	R35 D85	R35-D89 IonicContact NH2-OD2 3.62Å; R35-D89 PolarHBondContact NH2-OD2 2.88Å; D85-D89 PolarHBondContact O-N 3.22Å
90	K	29.4	Very low	32.2	Very low	182 Å²	182	115.4 Å²	115.4	79%	0.791	58%	0.583	S	S	*	*			trans	52.3	76.9	162.5	-66.1	180	179.4	174.7	0	116.6	Y88 R92	Y88-K90 VanDerWaalsContact C-N 3.32Å; Y88-K90 PolarHBondContact O-N 3.02Å; K90-R92 PolarHBondContact O-N 2.55Å
91	A	31.5	Very low	32.3	Very low	74 Å²	74	117.2 Å²	117.2	61%	0.612	58%	0.58	S	S	*	*			trans	-79.7	90.4	156.5	0	0	0	0	0	109.2	D93	A91-D93 PolarHBondContact O-N 3.44Å
92	R	36	Very low	32.6	Very low	230 Å²	230	114.2 Å²	114.2	87%	0.868	56%	0.564	S	S	*	*	S	Bend	trans	-67.9	-25.3	175	-140.5	177.8	-166.2	-178	2.2	112.3	K90	K90-R92 PolarHBondContact O-N 2.55Å
93	D	31.3	Very low	32.6	Very low	139 Å²	139	116.6 Å²	116.6	74%	0.743	57%	0.57	S	S	*	*	S	Bend	trans	-132.4	-4.6	-165.9	-63.9	-53.6	0	0	0	119.3	A91	A91-D93 PolarHBondContact O-N 3.44Å
94	W	28.4	Very low	32.6	Very low	225 Å²	225	122.5 Å²	122.5	85%	0.852	59%	0.588	S	S	*	*			trans	-128.3	98.9	173	-72.2	-21.8	0	0	0	113.2	I96	W94-I96 PolarHBondContact O-N 2.93Å
95	K	29.5	Very low	32.5	Very low	209 Å²	209	121.6 Å²	121.6	91%	0.909	58%	0.578	S	S	*	*			trans	-72.5	95.9	160	-68.8	-179.6	-179.9	-179.7	0	107.8	N97	K95-N97 PolarHBondContact O-N 3.25Å
96	I	29.9	Very low	32.7	Very low	86 Å²	86	119 Å²	119	44%	0.441	56%	0.564	S	S	.	*			trans	-59.4	118.9	148.4	-60.5	174.3	0	0	0	103.6	W94 E100 L101	W94-I96 PolarHBondContact O-N 2.93Å; I96-E100 HydrophobicContact CG2-CB 4.05Å; I96-L101 HydrophobicContact CG2-CB 4.11Å
97	N	35.2	Very low	32.7	Very low	87 Å²	87	115.7 Å²	115.7	47%	0.465	56%	0.561	S	S	.	*			trans	-62	147.3	180	71	41.7	0	0	0	108.1	K95 I99 E100 L101	K95-N97 PolarHBondContact O-N 3.25Å; N97-I99 PolarHBondContact O-N 3.5Å; N97-I99 WeakPolarHBondContact OD1-CB 3.43Å; N97-I99 PolarHBondContact OD1-N 3.35Å; N97-E100 PolarHBondContact O-N 2.63Å; N97-E100 VanDerWaalsContact O-N 3.1Å; N97-E100 PolarHBondContact OD1-N 3.29Å; N97-L101 PolarHBondContact O-N 3.35Å
98	A	36.1	Very low	32.7	Very low	83 Å²	83	111 Å²	111	69%	0.686	54%	0.539	S	S	*	.	H	α-helix	trans	-54.7	-29.6	-173.8	0	0	0	0	0	112.5	D102	A98-D102 WeakPolarHBondContact O-CB 3.27Å; A98-D102 PolarHBondContact O-N 2.89Å
99	I	35.1	Very low	32.8	Very low	115 Å²	115	104.8 Å²	104.8	59%	0.59	52%	0.515	S	S	*	.	H	α-helix	trans	-64.3	-48.2	179.8	-54.7	172.3	0	0	0	111	N97 L101 D102 E103	N97-I99 PolarHBondContact O-N 3.5Å; N97-I99 WeakPolarHBondContact OD1-CB 3.43Å; N97-I99 PolarHBondContact OD1-N 3.35Å; I99-L101 PolarHBondContact O-N 3.4Å; I99-D102 PolarHBondContact O-N 2.92Å; I99-E103 WeakPolarHBondContact O-CG 3.34Å; I99-E103 PolarHBondContact O-N 2.74Å
100	E	34.5	Very low	33	Very low	76 Å²	76	102.5 Å²	102.5	36%	0.355	50%	0.503	S	S	.	.	H	α-helix	trans	-72.1	-32.2	-175.2	-157.1	-172.7	163.9	0	0	112.4	I96 N97 R104	I96-E100 HydrophobicContact CG2-CB 4.05Å; N97-E100 PolarHBondContact O-N 2.63Å; N97-E100 VanDerWaalsContact O-N 3.1Å; N97-E100 PolarHBondContact OD1-N 3.29Å; E100-R104 VanDerWaalsContact O-CG 3.26Å; E100-R104 WeakPolarHBondContact O-CG 3.12Å; E100-R104 PolarHBondContact O-N 2.88Å; E100-R104 IonicContact OE1-CZ 2.76Å; E100-R104 IonicContact OE1-NE 3.1Å; E100-R104 IonicContact OE1-NH2 3.82Å; E100-R104 PolarHBondContact OE1-NH2 3.41Å
101	L	34.7	Very low	33.3	Very low	91 Å²	91	101.2 Å²	101.2	48%	0.476	50%	0.497	S	S	.	.	H	α-helix	trans	-68.6	-43.2	170.7	-175.1	66.2	0	0	0	111	I96 N97 I99 R104 I105	I96-L101 HydrophobicContact CG2-CB 4.11Å; N97-L101 PolarHBondContact O-N 3.35Å; I99-L101 PolarHBondContact O-N 3.4Å; L101-R104 PolarHBondContact O-N 3.03Å; L101-I105 HydrophobicContact CD1-CD1 4.22Å; L101-I105 HydrophobicContact CG-CD1 3.96Å; L101-I105 WeakPolarHBondContact O-CG1 3.25Å; L101-I105 PolarHBondContact O-N 3.29Å
102	D	35.3	Very low	33.7	Very low	61 Å²	61	100.4 Å²	100.4	33%	0.326	48%	0.48	S	S	.	.	H	α-helix	trans	-63.5	-44.7	178.6	-170.5	39.1	0	0	0	110.9	A98 I99 R104 I105 N106 K178	A98-D102 WeakPolarHBondContact O-CB 3.27Å; A98-D102 PolarHBondContact O-N 2.89Å; I99-D102 PolarHBondContact O-N 2.92Å; D102-R104 VanDerWaalsContact C-N 3.33Å; D102-R104 PolarHBondContact O-N 3.28Å; D102-I105 PolarHBondContact O-N 3.42Å; D102-N106 WeakPolarHBondContact O-CB 3.45Å; D102-N106 PolarHBondContact O-N 3.12Å; D102-N106 PolarHBondContact O-ND2 3.45Å; D102-N106 PolarHBondContact OD1-ND2 2.66Å; D102-N106 PolarHBondContact OD2-ND2 3.36Å; D102-K178 VanDerWaalsContact CG-NZ 3.3Å; D102-K178 WeakPolarHBondContact OD1-CE 3.48Å; D102-K178 IonicContact OD1-NZ 2.67Å; D102-K178 PolarHBondContact OD1-NZ 2.82Å; D102-K178 VanDerWaalsContact OD1-NZ 3.1Å; D102-K178 IonicContact OD2-NZ 3.93Å; D102-K178 PolarHBondContact OD2-NZ 2.73Å
103	E	36.8	Very low	34.2	Very low	116 Å²	116	93.8 Å²	93.8	54%	0.542	47%	0.467	S	S	.	.	H	α-helix	trans	-58.2	-43.1	173.8	-78.3	-178.6	172.8	0	0	112.2	I99 C107	I99-E103 WeakPolarHBondContact O-CG 3.34Å; I99-E103 PolarHBondContact O-N 2.74Å; E103-C107 WeakPolarHBondContact O-CB 3.43Å; E103-C107 PolarHBondContact O-N 3.05Å; E103-C107 PolarHBondContact O-SG 3.29Å
104	R	31.7	Very low	35	Very low	153 Å²	153	90 Å²	90	58%	0.577	46%	0.455	S	S	*	.	H	α-helix	trans	-69.8	-39.3	-179.6	-71.2	177.8	-171.3	-157.3	8.1	112.5	E100 L101 D102 A108	E100-R104 VanDerWaalsContact O-CG 3.26Å; E100-R104 WeakPolarHBondContact O-CG 3.12Å; E100-R104 PolarHBondContact O-N 2.88Å; E100-R104 IonicContact OE1-CZ 2.76Å; E100-R104 IonicContact OE1-NE 3.1Å; E100-R104 IonicContact OE1-NH2 3.82Å; E100-R104 PolarHBondContact OE1-NH2 3.41Å; L101-R104 PolarHBondContact O-N 3.03Å; D102-R104 VanDerWaalsContact C-N 3.33Å; D102-R104 PolarHBondContact O-N 3.28Å; R104-A108 VanDerWaalsContact O-CB 3.3Å; R104-A108 WeakPolarHBondContact O-CB 3.41Å; R104-A108 PolarHBondContact O-N 3.06Å
105	I	33.5	Very low	36	Very low	48 Å²	48	80.2 Å²	80.2	25%	0.246	42%	0.422	C	S	.	.	H	α-helix	trans	-69	-44	174.6	-67.2	172.8	0	0	0	110.5	L101 D102 C107 A108 F109 L110 L174	L101-I105 HydrophobicContact CD1-CD1 4.22Å; L101-I105 HydrophobicContact CG-CD1 3.96Å; L101-I105 WeakPolarHBondContact O-CG1 3.25Å; L101-I105 PolarHBondContact O-N 3.29Å; D102-I105 PolarHBondContact O-N 3.42Å; I105-C107 PolarHBondContact O-N 3.43Å; I105-A108 PolarHBondContact O-N 2.59Å; I105-F109 HydrophobicContact CG2-CB 4.27Å; I105-F109 VanDerWaalsContact O-CB 3.29Å; I105-F109 WeakPolarHBondContact O-CB 3.36Å; I105-F109 PolarHBondContact O-N 2.99Å; I105-L110 HydrophobicContact CG2-CD1 4.49Å; I105-L174 HydrophobicContact CG2-CD2 4.39Å
106	N	33.3	Very low	37.2	Very low	44 Å²	44	71.3 Å²	71.3	24%	0.235	39%	0.385	C	S	.	.	H	α-helix	trans	-65	-38.8	178.9	-72.4	-41	0	0	0	112.3	D102 L110 K178	D102-N106 WeakPolarHBondContact O-CB 3.45Å; D102-N106 PolarHBondContact O-N 3.12Å; D102-N106 PolarHBondContact O-ND2 3.45Å; D102-N106 PolarHBondContact OD1-ND2 2.66Å; D102-N106 PolarHBondContact OD2-ND2 3.36Å; N106-L110 WeakPolarHBondContact OD1-CD1 3.35Å; N106-K178 PolarHBondContact ND2-NZ 3.23Å
107	C	30.3	Very low	38.3	Very low	64 Å²	64	69.1 Å²	69.1	43%	0.432	37%	0.374	S	S	.	.	H	α-helix	trans	-72.4	-35.4	179.2	-77.3	0	0	0	0	113	E103 I105	E103-C107 WeakPolarHBondContact O-CB 3.43Å; E103-C107 PolarHBondContact O-N 3.05Å; E103-C107 PolarHBondContact O-SG 3.29Å; I105-C107 PolarHBondContact O-N 3.43Å
108	A	32.4	Very low	39.3	Very low	18 Å²	18	67.7 Å²	67.7	15%	0.149	37%	0.366	C	S	.	.	H	α-helix	trans	-97.5	-44.7	-173	0	0	0	0	0	114	Y62 R104 I105 F112	Y62-A108 WeakPolarHBondContact CB-O 3.46Å; Y62-A108 HydrophobicContact CD1-CB 3.41Å; Y62-A108 VanDerWaalsContact CD1-CB 3.41Å; Y62-A108 HydrophobicContact CE1-CB 3.99Å; Y62-A108 HydrophobicContact CG-CB 4.34Å; R104-A108 VanDerWaalsContact O-CB 3.3Å; R104-A108 WeakPolarHBondContact O-CB 3.41Å; R104-A108 PolarHBondContact O-N 3.06Å; I105-A108 PolarHBondContact O-N 2.59Å; A108-F112 WeakPolarHBondContact O-CD2 3.2Å; A108-F112 WeakPolarHBondContact O-CE2 3.17Å
109	F	34.1	Very low	40.3	Very low	14 Å²	14	64.1 Å²	64.1	6%	0.061	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-38.4	-163.4	-139.4	-73.1	0	0	0	112.2	A66 V69 L70 I105 A115 I119	A66-F109 HydrophobicContact CB-CD1 4.09Å; A66-F109 HydrophobicContact CB-CD2 3.76Å; A66-F109 HydrophobicContact CB-CE1 3.77Å; A66-F109 HydrophobicContact CB-CE2 3.5Å; A66-F109 HydrophobicContact CB-CG 4.08Å; A66-F109 HydrophobicContact CB-CZ 3.47Å; A66-F109 VanDerWaalsContact CB-CZ 3.47Å; V69-F109 HydrophobicContact CB-CE2 4.08Å; V69-F109 HydrophobicContact CG1-CE2 4.35Å; L70-F109 HydrophobicContact CG-CZ 4.31Å; I105-F109 HydrophobicContact CG2-CB 4.27Å; I105-F109 VanDerWaalsContact O-CB 3.29Å; I105-F109 WeakPolarHBondContact O-CB 3.36Å; I105-F109 PolarHBondContact O-N 2.99Å; F109-A115 HydrophobicContact CE1-CB 4.49Å; F109-I119 HydrophobicContact CE1-CD1 3.48Å; F109-I119 VanDerWaalsContact CE1-CD1 3.48Å; F109-I119 HydrophobicContact CZ-CD1 4Å
110	L	35	Very low	41.7	Very low	38 Å²	38	58.7 Å²	58.7	20%	0.199	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-18.7	-163.4	-80.4	171.9	0	0	0	115.5	I105 N106 F112 L174 A175	I105-L110 HydrophobicContact CG2-CD1 4.49Å; N106-L110 WeakPolarHBondContact OD1-CD1 3.35Å; L110-F112 PolarHBondContact O-N 3.05Å; L110-L174 WeakPolarHBondContact CD2-O 3.41Å; L110-L174 VanDerWaalsContact CG-O 3.31Å; L110-L174 WeakPolarHBondContact CG-O 3.26Å; L110-A175 VanDerWaalsContact CD2-CA 3.47Å
111	K	35.3	Very low	42.9	Very low	155 Å²	155	56.1 Å²	56.1	67%	0.674	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-2.4	175.4	-72.1	-171.9	178.7	-179	0	113.5	P113	K111-P113 WeakPolarHBondContact O-CD 3.45Å
112	F	39.4	Very low	44.3	Very low	56 Å²	56	51.9 Å²	51.9	25%	0.246	28%	0.278	C	S	.	.			trans	-108.5	95.7	177.2	-62.3	-83.3	0	0	0	109.4	D60 Y62 A108 L110 A114 A115 T116	D60-F112 WeakPolarHBondContact OD1-CZ 3.29Å; D60-F112 WeakPolarHBondContact OD2-CE1 3.18Å; Y62-F112 HydrophobicContact CD2-CE2 4.2Å; Y62-F112 HydrophobicContact CD2-CZ 4.19Å; Y62-F112 HydrophobicContact CG-CE2 4.07Å; Y62-F112 HydrophobicContact CG-CZ 4.44Å; A108-F112 WeakPolarHBondContact O-CD2 3.2Å; A108-F112 WeakPolarHBondContact O-CE2 3.17Å; L110-F112 PolarHBondContact O-N 3.05Å; F112-A114 PolarHBondContact O-N 3.45Å; F112-A115 HydrophobicContact CB-CB 4.19Å; F112-A115 PolarHBondContact O-N 3.08Å; F112-T116 PolarHBondContact O-N 3.44Å
113	P	46.7	Very low	45.8	Very low	91 Å²	91	49.1 Å²	49.1	59%	0.591	26%	0.263	S	S	*	.	H	α-helix	trans	-44.9	-38.2	174	-30.5	34.2	0	0	0	112.8	K111 A115 T116 D117	K111-P113 WeakPolarHBondContact O-CD 3.45Å; P113-A115 PolarHBondContact O-N 2.8Å; P113-T116 PolarHBondContact O-N 2.83Å; P113-D117 VanDerWaalsContact O-CB 3.31Å; P113-D117 WeakPolarHBondContact O-CB 3.32Å; P113-D117 VanDerWaalsContact O-CG 3.26Å; P113-D117 PolarHBondContact O-N 3.15Å
114	A	47.6	Very low	47.2	Very low	61 Å²	61	43.8 Å²	43.8	50%	0.504	24%	0.238	S	C	.	.	H	α-helix	trans	-61.7	-38.1	178.9	0	0	0	0	0	114.5	F112 L118	F112-A114 PolarHBondContact O-N 3.45Å; A114-L118 VanDerWaalsContact O-CB 3.25Å; A114-L118 WeakPolarHBondContact O-CB 3.49Å; A114-L118 PolarHBondContact O-N 3.18Å
115	A	50.4	Low	48.8	Very low	19 Å²	19	36.9 Å²	36.9	16%	0.157	21%	0.214	C	C	.	.	H	α-helix	trans	-71.3	-44.4	179.9	0	0	0	0	0	110.7	F109 F112 P113 L118 I119	F109-A115 HydrophobicContact CE1-CB 4.49Å; F112-A115 HydrophobicContact CB-CB 4.19Å; F112-A115 PolarHBondContact O-N 3.08Å; P113-A115 PolarHBondContact O-N 2.8Å; A115-L118 PolarHBondContact O-N 3.17Å; A115-I119 WeakPolarHBondContact O-CG1 3.48Å; A115-I119 PolarHBondContact O-N 3.05Å; A115-I119 VanDerWaalsContact O-N 3.1Å
116	T	54.3	Low	50.3	Low	21 Å²	21	36.1 Å²	36.1	13%	0.129	21%	0.208	C	C	.	.	H	α-helix	trans	-58.5	-55.5	172.6	-60.8	0	0	0	0	110.1	F112 P113 L118 I119 M120 A175	F112-T116 PolarHBondContact O-N 3.44Å; P113-T116 PolarHBondContact O-N 2.83Å; T116-L118 VanDerWaalsContact C-N 3.26Å; T116-L118 PolarHBondContact O-N 2.72Å; T116-I119 PolarHBondContact O-N 2.84Å; T116-I119 VanDerWaalsContact O-N 3.12Å; T116-M120 HydrophobicContact CG2-CG 3.94Å; T116-M120 WeakPolarHBondContact O-CB 3.42Å; T116-M120 WeakPolarHBondContact O-CG 3.26Å; T116-M120 PolarHBondContact O-N 3.39Å; T116-A175 HydrophobicContact CG2-CB 3.68Å
117	D	53.2	Low	51.8	Low	41 Å²	41	34.1 Å²	34.1	22%	0.219	20%	0.197	C	C	.	.	H	α-helix	trans	-54.4	-41.9	-180	-77	-32.2	0	0	0	112.1	P113 M120 A121 Y203	P113-D117 VanDerWaalsContact O-CB 3.31Å; P113-D117 WeakPolarHBondContact O-CB 3.32Å; P113-D117 VanDerWaalsContact O-CG 3.26Å; P113-D117 PolarHBondContact O-N 3.15Å; D117-M120 PolarHBondContact O-N 2.84Å; D117-A121 WeakPolarHBondContact O-CA 3.25Å; D117-A121 WeakPolarHBondContact O-CB 3.46Å; D117-A121 PolarHBondContact O-N 3.16Å; D117-Y203 VanDerWaalsContact CG-OH 3.31Å; D117-Y203 PolarHBondContact OD1-OH 3.36Å
118	L	55.4	Low	53.6	Low	56 Å²	56	31.5 Å²	31.5	29%	0.293	18%	0.178	S	C	.	.	H	α-helix	trans	-66.7	-42.8	179.6	-175.3	69.7	0	0	0	112.7	W67 A114 A115 T116 S122	W67-L118 HydrophobicContact CH2-CD2 3.19Å; W67-L118 HydrophobicContact CZ2-CD2 3.36Å; W67-L118 HydrophobicContact CZ3-CD2 4.16Å; A114-L118 VanDerWaalsContact O-CB 3.25Å; A114-L118 WeakPolarHBondContact O-CB 3.49Å; A114-L118 PolarHBondContact O-N 3.18Å; A115-L118 PolarHBondContact O-N 3.17Å; T116-L118 VanDerWaalsContact C-N 3.26Å; T116-L118 PolarHBondContact O-N 2.72Å; L118-S122 VanDerWaalsContact O-CB 3.22Å; L118-S122 WeakPolarHBondContact O-CB 3.25Å; L118-S122 PolarHBondContact O-N 3.5Å; L118-S122 PolarHBondContact O-OG 3.11Å
119	I	58.2	Low	55.1	Low	9 Å²	9	33.7 Å²	33.7	5%	0.046	19%	0.192	C	C	.	.	H	α-helix	trans	-66.9	-44.5	177.5	-64.2	173.3	0	0	0	109.6	L70 F109 A115 T116 S122 K123 I162 V171	L70-I119 HydrophobicContact CD1-CD1 4.33Å; L70-I119 HydrophobicContact CD1-CG1 4.29Å; L70-I119 HydrophobicContact CD2-CD1 4Å; L70-I119 HydrophobicContact CD2-CG1 4.14Å; F109-I119 HydrophobicContact CE1-CD1 3.48Å; F109-I119 VanDerWaalsContact CE1-CD1 3.48Å; F109-I119 HydrophobicContact CZ-CD1 4Å; A115-I119 WeakPolarHBondContact O-CG1 3.48Å; A115-I119 PolarHBondContact O-N 3.05Å; A115-I119 VanDerWaalsContact O-N 3.1Å; T116-I119 PolarHBondContact O-N 2.84Å; T116-I119 VanDerWaalsContact O-N 3.12Å; I119-S122 PolarHBondContact O-N 3.34Å; I119-K123 WeakPolarHBondContact O-CB 3.33Å; I119-K123 PolarHBondContact O-N 3.2Å; I119-I162 HydrophobicContact CG2-CG2 4.33Å; I119-V171 HydrophobicContact CG2-CB 4.13Å; I119-V171 HydrophobicContact CG2-CG1 3.5Å; I119-V171 HydrophobicContact CG2-CG2 3.81Å
120	M	63	Low	56.5	Low	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.4	-47.3	177.7	-64.5	-48.1	-58.4	0	0	111.2	T116 D117 K123 A124 V171 L172 A175 L200 Y203 F204	T116-M120 HydrophobicContact CG2-CG 3.94Å; T116-M120 WeakPolarHBondContact O-CB 3.42Å; T116-M120 WeakPolarHBondContact O-CG 3.26Å; T116-M120 PolarHBondContact O-N 3.39Å; D117-M120 PolarHBondContact O-N 2.84Å; M120-K123 PolarHBondContact O-N 3.45Å; M120-A124 VanDerWaalsContact O-CB 3.31Å; M120-A124 WeakPolarHBondContact O-CB 3.48Å; M120-A124 PolarHBondContact O-N 3.49Å; M120-V171 HydrophobicContact CE-CG1 4.19Å; M120-V171 HydrophobicContact SD-CG1 3.28Å; M120-V171 WeakPolarHBondContact SD-CG1 3.12Å; M120-L172 HydrophobicContact CE-CD2 3.66Å; M120-L172 HydrophobicContact SD-CD2 4.35Å; M120-A175 HydrophobicContact SD-CB 4.03Å; M120-L200 HydrophobicContact CE-CB 4.39Å; M120-L200 HydrophobicContact CE-CD1 3.98Å; M120-L200 HydrophobicContact CE-CD2 4.37Å; M120-L200 HydrophobicContact CE-CG 4.48Å; M120-L200 HydrophobicContact CG-CD2 3.97Å; M120-L200 HydrophobicContact SD-CD1 4.26Å; M120-Y203 HydrophobicContact CB-CD2 4.45Å; M120-Y203 HydrophobicContact CB-CG 4.49Å; M120-F204 HydrophobicContact CE-CD2 4.37Å; M120-F204 HydrophobicContact CE-CE2 3.1Å; M120-F204 HydrophobicContact CE-CZ 3.3Å
121	A	61.1	Low	58.2	Low	23 Å²	23	32.2 Å²	32.2	19%	0.19	19%	0.19	C	C	.	.	H	α-helix	trans	-64.7	-41.3	177.1	0	0	0	0	0	112	D117 K123 A124 S125 Y203	D117-A121 WeakPolarHBondContact O-CA 3.25Å; D117-A121 WeakPolarHBondContact O-CB 3.46Å; D117-A121 PolarHBondContact O-N 3.16Å; A121-K123 VanDerWaalsContact C-N 3.33Å; A121-K123 PolarHBondContact O-N 3.21Å; A121-A124 PolarHBondContact O-N 2.98Å; A121-S125 WeakPolarHBondContact O-CB 3.33Å; A121-S125 PolarHBondContact O-N 3.23Å; A121-Y203 HydrophobicContact CB-CD1 4.49Å; A121-Y203 HydrophobicContact CB-CE1 4.06Å
122	S	63.2	Low	59.9	Low	2 Å²	2	24.9 Å²	24.9	1%	0.014	16%	0.158	C	C	.	.	H	α-helix	trans	-63	-41.6	175.8	-62	0	0	0	0	111.1	L118 I119 W126	L118-S122 VanDerWaalsContact O-CB 3.22Å; L118-S122 WeakPolarHBondContact O-CB 3.25Å; L118-S122 PolarHBondContact O-N 3.5Å; L118-S122 PolarHBondContact O-OG 3.11Å; I119-S122 PolarHBondContact O-N 3.34Å; S122-W126 WeakPolarHBondContact O-CB 3.34Å; S122-W126 PolarHBondContact O-N 3.37Å
123	K	67.9	Low	61.5	Low	2 Å²	2	22.3 Å²	22.3	1%	0.009	15%	0.147	C	C	.	.	H	α-helix	trans	-68.2	-47.4	177.2	-170.4	61.8	178.1	175.5	0	111.6	I119 M120 A121 W126 W127 G163 A166 T168 V171 F204	I119-K123 WeakPolarHBondContact O-CB 3.33Å; I119-K123 PolarHBondContact O-N 3.2Å; M120-K123 PolarHBondContact O-N 3.45Å; A121-K123 VanDerWaalsContact C-N 3.33Å; A121-K123 PolarHBondContact O-N 3.21Å; K123-W126 HydrophobicContact CD-CE3 4.4Å; K123-W126 PolarHBondContact O-N 2.96Å; K123-W127 VanDerWaalsContact CE-NE1 3.28Å; K123-W127 WeakPolarHBondContact O-CB 3.35Å; K123-W127 VanDerWaalsContact O-CD1 3.27Å; K123-W127 PolarHBondContact O-N 2.88Å; K123-G163 PolarHBondContact NZ-O 2.97Å; K123-A166 WeakPolarHBondContact CE-O 3.34Å; K123-A166 PolarHBondContact NZ-O 2.9Å; K123-T168 WeakPolarHBondContact CE-OG1 3.49Å; K123-V171 HydrophobicContact CB-CG2 4.47Å; K123-V171 HydrophobicContact CD-CG2 4.48Å; K123-V171 HydrophobicContact CG-CG2 4.36Å; K123-F204 HydrophobicContact CG-CE1 4.35Å
124	A	65.8	Low	62.6	Low	4 Å²	4	18.2 Å²	18.2	3%	0.033	12%	0.12	C	C	.	.	H	α-helix	trans	-59.7	-46.6	176	0	0	0	0	0	111.1	M120 A121 W127 Y128 Y203 F204	M120-A124 VanDerWaalsContact O-CB 3.31Å; M120-A124 WeakPolarHBondContact O-CB 3.48Å; M120-A124 PolarHBondContact O-N 3.49Å; A121-A124 PolarHBondContact O-N 2.98Å; A124-W127 WeakPolarHBondContact O-CB 3.26Å; A124-W127 PolarHBondContact O-N 3.19Å; A124-Y128 HydrophobicContact CB-CD2 4.37Å; A124-Y128 HydrophobicContact CB-CE2 4.08Å; A124-Y128 WeakPolarHBondContact O-CD2 3.45Å; A124-Y128 PolarHBondContact O-N 3.43Å; A124-Y203 WeakPolarHBondContact CB-O 3.32Å; A124-F204 HydrophobicContact CB-CD1 4.39Å; A124-F204 HydrophobicContact CB-CE1 4.21Å
125	S	66.1	Low	63.3	Low	9 Å²	9	19 Å²	19	6%	0.063	12%	0.118	C	C	.	.	H	α-helix	trans	-57.3	-52.6	175.1	-178.6	0	0	0	0	110.9	A121 W127 Y128 S129 F140	A121-S125 WeakPolarHBondContact O-CB 3.33Å; A121-S125 PolarHBondContact O-N 3.23Å; S125-W127 VanDerWaalsContact C-N 3.29Å; S125-W127 PolarHBondContact O-N 3.16Å; S125-Y128 CarbonylContact O-C 3.6Å; S125-Y128 PolarHBondContact O-N 2.94Å; S125-Y128 VanDerWaalsContact O-N 3.15Å; S125-S129 WeakPolarHBondContact O-CB 3.29Å; S125-S129 PolarHBondContact O-N 2.94Å; S125-S129 PolarHBondContact O-OG 3.17Å; S125-F140 VanDerWaalsContact O-CE1 3.23Å; S125-F140 WeakPolarHBondContact O-CE1 3.36Å; S125-F140 WeakPolarHBondContact OG-CD1 3.36Å
126	W	64.5	Low	63.6	Low	32 Å²	32	20.4 Å²	20.4	12%	0.121	14%	0.135	C	C	.	.	H	α-helix	trans	-57.8	-40.5	177.5	176.5	86.7	0	0	0	113.4	S122 K123 S129 G130 N160 G163 H164 G261 P263	S122-W126 WeakPolarHBondContact O-CB 3.34Å; S122-W126 PolarHBondContact O-N 3.37Å; K123-W126 HydrophobicContact CD-CE3 4.4Å; K123-W126 PolarHBondContact O-N 2.96Å; W126-S129 WeakPolarHBondContact O-CB 3.28Å; W126-S129 PolarHBondContact O-N 2.85Å; W126-G130 PolarHBondContact O-N 3.28Å; W126-N160 VanDerWaalsContact CD1-OD1 3.3Å; W126-G163 VanDerWaalsContact CB-CA 3.49Å; W126-G163 VanDerWaalsContact CD2-C 3.45Å; W126-G163 VanDerWaalsContact CG-CA 3.47Å; W126-H164 AromaticContact CD1-CE1 3.89Å; W126-H164 AromaticContact CD1-ND1 3.63Å; W126-H164 AromaticContact CE2-CG 3.97Å; W126-H164 AromaticContact CE2-ND1 3.99Å; W126-H164 AromaticContact CZ2-CD2 3.89Å; W126-H164 AromaticContact NE1-CD2 3.7Å; W126-H164 AromaticContact NE1-CE1 3.08Å; W126-H164 PolarHBondContact NE1-CE1 2.85Å; W126-H164 AromaticContact NE1-CG 3.41Å; W126-H164 AromaticContact NE1-ND1 3.01Å; W126-H164 PolarHBondContact NE1-ND1 3.43Å; W126-H164 AromaticContact NE1-NE2 3.48Å; W126-H164 PolarHBondContact NE1-NE2 3.37Å; W126-G261 WeakPolarHBondContact CH2-O 3.06Å; W126-G261 WeakPolarHBondContact CZ3-O 2.81Å; W126-P263 HydrophobicContact CH2-CG 4.04Å; W126-P263 HydrophobicContact CZ3-CG 4.07Å
127	W	65.1	Low	63.8	Low	2 Å²	2	19.6 Å²	19.6	1%	0.008	13%	0.13	C	C	.	.	H	α-helix	trans	-61.6	-47.4	175.2	-95	88.9	0	0	0	112	K123 A124 S125 G130 C131 T168 H253 K257 F258 G261 K262 P263	K123-W127 VanDerWaalsContact CE-NE1 3.28Å; K123-W127 WeakPolarHBondContact O-CB 3.35Å; K123-W127 VanDerWaalsContact O-CD1 3.27Å; K123-W127 PolarHBondContact O-N 2.88Å; A124-W127 WeakPolarHBondContact O-CB 3.26Å; A124-W127 PolarHBondContact O-N 3.19Å; S125-W127 VanDerWaalsContact C-N 3.29Å; S125-W127 PolarHBondContact O-N 3.16Å; W127-G130 PolarHBondContact O-N 3.31Å; W127-C131 PolarHBondContact O-SG 2.93Å; W127-T168 PolarHBondContact NE1-OG1 3.47Å; W127-H253 AromaticContact CE3-CD2 3.52Å; W127-H253 AromaticContact CE3-NE2 3.73Å; W127-H253 AromaticContact CZ3-CD2 3.22Å; W127-H253 WeakPolarHBondContact CZ3-CD2 3.48Å; W127-H253 AromaticContact CZ3-CG 3.86Å; W127-H253 AromaticContact CZ3-NE2 3.57Å; W127-K257 WeakPolarHBondContact CH2-O 3.22Å; W127-F258 HydrophobicContact CD2-CD1 4.17Å; W127-F258 HydrophobicContact CE3-CD1 4.01Å; W127-F258 HydrophobicContact CE3-CE1 4.29Å; W127-F258 WeakPolarHBondContact CZ2-O 3.45Å; W127-F258 HydrophobicContact CZ3-CD1 4.23Å; W127-G261 VanDerWaalsContact CZ2-C 3.43Å; W127-K262 WeakPolarHBondContact CH2-O 3.2Å; W127-P263 HydrophobicContact CD2-CB 4.31Å; W127-P263 HydrophobicContact CE3-CB 3.76Å; W127-P263 VanDerWaalsContact CZ3-CA 3.44Å; W127-P263 HydrophobicContact CZ3-CB 4.08Å
128	Y	68.4	Low	63.6	Low	9 Å²	9	21.4 Å²	21.4	4%	0.035	14%	0.144	C	C	.	.	H	α-helix	trans	-73.2	-26.2	178.1	-61.9	-52.2	0	0	0	112.3	A124 S125 G130 C131 Y134 L139 Y203 F204 P208	A124-Y128 HydrophobicContact CB-CD2 4.37Å; A124-Y128 HydrophobicContact CB-CE2 4.08Å; A124-Y128 WeakPolarHBondContact O-CD2 3.45Å; A124-Y128 PolarHBondContact O-N 3.43Å; S125-Y128 CarbonylContact O-C 3.6Å; S125-Y128 PolarHBondContact O-N 2.94Å; S125-Y128 VanDerWaalsContact O-N 3.15Å; Y128-G130 PolarHBondContact O-N 3.07Å; Y128-C131 WeakPolarHBondContact O-CA 3.47Å; Y128-C131 WeakPolarHBondContact O-CB 3.19Å; Y128-C131 PolarHBondContact O-N 3.48Å; Y128-Y134 AromaticContact CD1-CD2 3.49Å; Y128-Y134 HydrophobicContact CD1-CD2 3.49Å; Y128-Y134 VanDerWaalsContact CD1-CD2 3.49Å; Y128-Y134 AromaticContact CD1-CE2 3.52Å; Y128-Y134 HydrophobicContact CD1-CE2 3.52Å; Y128-Y134 HydrophobicContact CD1-CG 4.43Å; Y128-Y134 HydrophobicContact CE1-CD2 4.35Å; Y128-Y134 AromaticContact CE1-CE2 3.99Å; Y128-Y134 HydrophobicContact CE1-CE2 3.99Å; Y128-Y134 HydrophobicContact CG-CD2 4.06Å; Y128-Y134 HydrophobicContact CG-CE2 4.49Å; Y128-L139 HydrophobicContact CD2-CD1 4.22Å; Y128-L139 HydrophobicContact CE2-CD1 3.96Å; Y128-Y203 WeakPolarHBondContact CE2-O 3.33Å; Y128-Y203 PolarHBondContact OH-O 3.02Å; Y128-F204 VanDerWaalsContact OH-CA 3.28Å; Y128-F204 WeakPolarHBondContact OH-CA 3.11Å; Y128-F204 PolarHBondContact OH-O 2.73Å; Y128-F204 VanDerWaalsContact OH-O 3.09Å; Y128-P208 HydrophobicContact CD1-CG 4.14Å; Y128-P208 HydrophobicContact CD2-CG 3.9Å; Y128-P208 HydrophobicContact CE1-CG 4.4Å; Y128-P208 HydrophobicContact CE2-CG 4.19Å; Y128-P208 HydrophobicContact CG-CG 3.88Å; Y128-P208 VanDerWaalsContact CZ-CD 3.48Å
129	S	63.7	Low	63.4	Low	63 Å²	63	20.7 Å²	20.7	44%	0.441	14%	0.14	S	C	.	.	H	α-helix	trans	-60.8	-35	177	-85.7	0	0	0	0	110.5	S125 W126 C131 F140	S125-S129 WeakPolarHBondContact O-CB 3.29Å; S125-S129 PolarHBondContact O-N 2.94Å; S125-S129 PolarHBondContact O-OG 3.17Å; W126-S129 WeakPolarHBondContact O-CB 3.28Å; W126-S129 PolarHBondContact O-N 2.85Å; S129-C131 PolarHBondContact O-N 3.43Å; S129-F140 WeakPolarHBondContact OG-CE1 3.48Å
130	G	63.7	Low	63	Low	19 Å²	19	21.8 Å²	21.8	20%	0.196	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-3.5	173.1	0	0	0	0	0	114.6	W126 W127 Y128	W126-G130 PolarHBondContact O-N 3.28Å; W127-G130 PolarHBondContact O-N 3.31Å; Y128-G130 PolarHBondContact O-N 3.07Å
131	C	69.6	Low	62	Low	2 Å²	2	24.1 Å²	24.1	1%	0.014	16%	0.161	C	C	.	.			trans	-108.6	106.6	-175.4	-63.2	0	0	0	0	110.3	W127 Y128 S129 L133 Y134 Y252	W127-C131 PolarHBondContact O-SG 2.93Å; Y128-C131 WeakPolarHBondContact O-CA 3.47Å; Y128-C131 WeakPolarHBondContact O-CB 3.19Å; Y128-C131 PolarHBondContact O-N 3.48Å; S129-C131 PolarHBondContact O-N 3.43Å; C131-L133 PolarHBondContact O-N 3.04Å; C131-Y134 HydrophobicContact CB-CD2 3.4Å; C131-Y134 VanDerWaalsContact CB-CD2 3.4Å; C131-Y134 HydrophobicContact CB-CE2 3.91Å; C131-Y134 HydrophobicContact CB-CG 4.35Å; C131-Y134 PolarHBondContact O-N 2.87Å; C131-Y252 HydrophobicContact CB-CD2 3.57Å; C131-Y252 HydrophobicContact CB-CE2 3.48Å; C131-Y252 VanDerWaalsContact CB-CE2 3.48Å; C131-Y252 WeakPolarHBondContact SG-CD2 3.42Å
132	A	71	Confident	61.1	Low	2 Å²	2	24.7 Å²	24.7	2%	0.017	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-28.8	-172.3	0	0	0	0	0	115.3	Y134 T135 S213 L269 E270 N273	A132-Y134 VanDerWaalsContact C-N 3.3Å; A132-Y134 PolarHBondContact O-N 3.35Å; A132-T135 PolarHBondContact O-OG1 3.14Å; A132-S213 PolarHBondContact O-OG 3.22Å; A132-L269 HydrophobicContact CB-CB 3.91Å; A132-L269 HydrophobicContact CB-CD2 4.07Å; A132-L269 HydrophobicContact CB-CG 3.75Å; A132-E270 HydrophobicContact CB-CB 3.97Å; A132-E270 VanDerWaalsContact CB-N 3.34Å; A132-N273 PolarHBondContact O-ND2 2.91Å
133	L	73.3	Confident	59.9	Low	1 Å²	1	25.7 Å²	25.7	1%	0.005	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-21.3	177.1	-73.8	174.7	0	0	0	113.7	C131 C210 L217 L242 F245 Y252 L269 M344	C131-L133 PolarHBondContact O-N 3.04Å; L133-C210 HydrophobicContact CB-CB 4.08Å; L133-C210 VanDerWaalsContact O-CA 3.31Å; L133-C210 WeakPolarHBondContact O-CA 3.1Å; L133-C210 WeakPolarHBondContact O-CB 3.19Å; L133-L217 HydrophobicContact CD2-CD1 4.15Å; L133-L242 HydrophobicContact CD1-CD2 4.1Å; L133-L242 HydrophobicContact CD2-CD2 4.26Å; L133-F245 HydrophobicContact CD1-CD1 3.45Å; L133-F245 VanDerWaalsContact CD1-CD1 3.45Å; L133-F245 HydrophobicContact CD1-CD2 4.18Å; L133-F245 HydrophobicContact CD1-CE1 3.48Å; L133-F245 VanDerWaalsContact CD1-CE1 3.48Å; L133-F245 HydrophobicContact CD1-CE2 4.2Å; L133-F245 HydrophobicContact CD1-CG 3.8Å; L133-F245 HydrophobicContact CD1-CZ 3.85Å; L133-Y252 HydrophobicContact CB-CE2 4.39Å; L133-Y252 WeakPolarHBondContact CB-OH 3.1Å; L133-Y252 VanDerWaalsContact CD1-OH 3.24Å; L133-Y252 WeakPolarHBondContact CD1-OH 2.97Å; L133-Y252 WeakPolarHBondContact CG-OH 2.8Å; L133-Y252 PolarHBondContact N-OH 2.77Å; L133-L269 HydrophobicContact CD1-CD2 4.14Å; L133-L269 HydrophobicContact CD2-CD2 3.86Å; L133-L269 HydrophobicContact CG-CD2 3.56Å; L133-M344 HydrophobicContact CD1-SD 4.08Å
134	Y	69.6	Low	58.4	Low	5 Å²	5	30.9 Å²	30.9	2%	0.02	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-5	-175.8	-54.6	-49.9	0	0	0	113.9	Y128 C131 A132 G136 S137 F140 P207 P208 C210 F245 G250 Y252	Y128-Y134 AromaticContact CD1-CD2 3.49Å; Y128-Y134 HydrophobicContact CD1-CD2 3.49Å; Y128-Y134 VanDerWaalsContact CD1-CD2 3.49Å; Y128-Y134 AromaticContact CD1-CE2 3.52Å; Y128-Y134 HydrophobicContact CD1-CE2 3.52Å; Y128-Y134 HydrophobicContact CD1-CG 4.43Å; Y128-Y134 HydrophobicContact CE1-CD2 4.35Å; Y128-Y134 AromaticContact CE1-CE2 3.99Å; Y128-Y134 HydrophobicContact CE1-CE2 3.99Å; Y128-Y134 HydrophobicContact CG-CD2 4.06Å; Y128-Y134 HydrophobicContact CG-CE2 4.49Å; C131-Y134 HydrophobicContact CB-CD2 3.4Å; C131-Y134 VanDerWaalsContact CB-CD2 3.4Å; C131-Y134 HydrophobicContact CB-CE2 3.91Å; C131-Y134 HydrophobicContact CB-CG 4.35Å; C131-Y134 PolarHBondContact O-N 2.87Å; A132-Y134 VanDerWaalsContact C-N 3.3Å; A132-Y134 PolarHBondContact O-N 3.35Å; Y134-G136 PolarHBondContact O-N 2.92Å; Y134-S137 VanDerWaalsContact O-CB 3.3Å; Y134-S137 WeakPolarHBondContact O-CB 3.16Å; Y134-S137 PolarHBondContact O-N 3.16Å; Y134-F140 VanDerWaalsContact O-CD2 3.29Å; Y134-F140 WeakPolarHBondContact O-CD2 3.35Å; Y134-F140 WeakPolarHBondContact O-CE2 3.11Å; Y134-P207 HydrophobicContact CE1-CB 3.89Å; Y134-P207 WeakPolarHBondContact OH-CB 3.36Å; Y134-P208 HydrophobicContact CD1-CB 4.28Å; Y134-P208 HydrophobicContact CD1-CG 3.65Å; Y134-P208 VanDerWaalsContact CD1-O 3.23Å; Y134-P208 WeakPolarHBondContact CD1-O 3.48Å; Y134-P208 HydrophobicContact CD2-CG 4.13Å; Y134-P208 HydrophobicContact CE1-CG 4.14Å; Y134-P208 WeakPolarHBondContact CE1-O 3.3Å; Y134-P208 HydrophobicContact CG-CG 3.65Å; Y134-C210 HydrophobicContact CD1-CB 4.49Å; Y134-F245 HydrophobicContact CE1-CE2 4.35Å; Y134-F245 AromaticContact CE1-CZ 3.89Å; Y134-F245 HydrophobicContact CE1-CZ 3.89Å; Y134-F245 HydrophobicContact CE2-CE2 4.22Å; Y134-F245 AromaticContact CZ-CE2 3.67Å; Y134-F245 AromaticContact CZ-CZ 3.66Å; Y134-F245 WeakPolarHBondContact OH-CE2 3.49Å; Y134-F245 VanDerWaalsContact OH-CZ 3.23Å; Y134-F245 WeakPolarHBondContact OH-CZ 2.88Å; Y134-G250 PolarHBondContact OH-O 3.08Å; Y134-Y252 HydrophobicContact CD2-CE2 4.36Å; Y134-Y252 AromaticContact CE2-CD2 3.92Å; Y134-Y252 HydrophobicContact CE2-CD2 3.92Å; Y134-Y252 AromaticContact CE2-CE2 3.92Å; Y134-Y252 HydrophobicContact CE2-CE2 3.92Å
135	T	62.7	Low	57	Low	78 Å²	78	33.5 Å²	33.5	48%	0.479	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-13.1	-172	49.7	0	0	0	0	115.9	A132	A132-T135 PolarHBondContact O-OG1 3.14Å
136	G	56.3	Low	55.4	Low	48 Å²	48	34 Å²	34	50%	0.495	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	14	173.1	0	0	0	0	0	115.6	Y134	Y134-G136 PolarHBondContact O-N 2.92Å
137	S	58.1	Low	53.9	Low	5 Å²	5	34.8 Å²	34.8	4%	0.035	22%	0.217	C	C	.	.			trans	-69.5	147.3	-175.5	166.7	0	0	0	0	113.3	Y134 L139 F140 S141 P208	Y134-S137 VanDerWaalsContact O-CB 3.3Å; Y134-S137 WeakPolarHBondContact O-CB 3.16Å; Y134-S137 PolarHBondContact O-N 3.16Å; S137-L139 PolarHBondContact O-N 3.48Å; S137-L139 VanDerWaalsContact O-N 3.14Å; S137-L139 PolarHBondContact OG-N 2.97Å; S137-F140 WeakPolarHBondContact O-CB 3.39Å; S137-F140 VanDerWaalsContact O-CD2 3.31Å; S137-F140 WeakPolarHBondContact O-CD2 3.34Å; S137-F140 PolarHBondContact O-N 3.28Å; S137-S141 PolarHBondContact O-N 3.4Å; S137-P208 WeakPolarHBondContact OG-CB 3.08Å
138	P	48.6	Very low	52.6	Low	79 Å²	79	41.5 Å²	41.5	51%	0.513	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.6	168.2	7	-8.5	0	0	0	115	F140 S141 P142	P138-F140 PolarHBondContact O-N 3.45Å; P138-S141 VanDerWaalsContact CA-CB 3.48Å; P138-S141 VanDerWaalsContact O-CA 3.32Å; P138-S141 WeakPolarHBondContact O-CA 3.15Å; P138-S141 WeakPolarHBondContact O-CB 3.48Å; P138-S141 PolarHBondContact O-N 3.24Å; P138-P142 WeakPolarHBondContact O-CD 3.39Å
139	L	51.2	Low	51.1	Low	41 Å²	41	42.2 Å²	42.2	22%	0.215	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-19.3	170	-72.5	-179	0	0	0	112.7	L7 Y128 S137 P142 P208	L7-L139 HydrophobicContact CD1-CD2 4.04Å; Y128-L139 HydrophobicContact CD2-CD1 4.22Å; Y128-L139 HydrophobicContact CE2-CD1 3.96Å; S137-L139 PolarHBondContact O-N 3.48Å; S137-L139 VanDerWaalsContact O-N 3.14Å; S137-L139 PolarHBondContact OG-N 2.97Å; L139-P142 WeakPolarHBondContact O-CD 3.43Å; L139-P142 WeakPolarHBondContact O-CG 3.07Å; L139-P208 HydrophobicContact CB-CB 4.39Å; L139-P208 HydrophobicContact CD1-CB 3.75Å; L139-P208 HydrophobicContact CD1-CG 3.88Å; L139-P208 HydrophobicContact CG-CB 4.14Å
140	F	50.7	Low	49.8	Very low	32 Å²	32	40.8 Å²	40.8	14%	0.14	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-21	164.7	-54	-79.1	0	0	0	112.1	S125 S129 Y134 S137 P138 P142 F143	S125-F140 VanDerWaalsContact O-CE1 3.23Å; S125-F140 WeakPolarHBondContact O-CE1 3.36Å; S125-F140 WeakPolarHBondContact OG-CD1 3.36Å; S129-F140 WeakPolarHBondContact OG-CE1 3.48Å; Y134-F140 VanDerWaalsContact O-CD2 3.29Å; Y134-F140 WeakPolarHBondContact O-CD2 3.35Å; Y134-F140 WeakPolarHBondContact O-CE2 3.11Å; S137-F140 WeakPolarHBondContact O-CB 3.39Å; S137-F140 VanDerWaalsContact O-CD2 3.31Å; S137-F140 WeakPolarHBondContact O-CD2 3.34Å; S137-F140 PolarHBondContact O-N 3.28Å; P138-F140 PolarHBondContact O-N 3.45Å; F140-P142 VanDerWaalsContact C-CD 3.46Å; F140-F143 WeakPolarHBondContact O-CB 3.27Å; F140-F143 PolarHBondContact O-N 3.49Å
141	S	40.9	Very low	48.4	Very low	49 Å²	49	40.5 Å²	40.5	34%	0.343	25%	0.253	S	S	.	.	H	α-helix	trans	-71.3	-19.1	-179.8	-170.9	0	0	0	0	117.5	S137 P138 F143 H144 S145	S137-S141 PolarHBondContact O-N 3.4Å; P138-S141 VanDerWaalsContact CA-CB 3.48Å; P138-S141 VanDerWaalsContact O-CA 3.32Å; P138-S141 WeakPolarHBondContact O-CA 3.15Å; P138-S141 WeakPolarHBondContact O-CB 3.48Å; P138-S141 PolarHBondContact O-N 3.24Å; S141-F143 PolarHBondContact O-N 2.98Å; S141-H144 VanDerWaalsContact C-N 3.34Å; S141-H144 CarbonylContact O-C 3.36Å; S141-H144 VanDerWaalsContact O-CA 3.32Å; S141-H144 WeakPolarHBondContact O-CA 3.37Å; S141-H144 WeakPolarHBondContact O-CB 3.32Å; S141-H144 PolarHBondContact O-N 2.84Å; S141-S145 PolarHBondContact O-N 2.71Å
142	P	42.1	Very low	46.9	Very low	35 Å²	35	45.8 Å²	45.8	23%	0.227	28%	0.28	C	S	.	.	H	α-helix	trans	-59.7	-26.4	166.7	22.7	-33.5	0	0	0	110.9	L7 P138 L139 F140 S145 L146	L7-P142 HydrophobicContact CD1-CG 4.4Å; P138-P142 WeakPolarHBondContact O-CD 3.39Å; L139-P142 WeakPolarHBondContact O-CD 3.43Å; L139-P142 WeakPolarHBondContact O-CG 3.07Å; F140-P142 VanDerWaalsContact C-CD 3.46Å; P142-S145 PolarHBondContact O-OG 3.12Å; P142-S145 VanDerWaalsContact O-OG 3.05Å; P142-L146 WeakPolarHBondContact O-CD1 3.17Å
143	F	39.8	Very low	45.4	Very low	22 Å²	22	51.2 Å²	51.2	10%	0.096	31%	0.309	C	S	.	.	H	α-helix	trans	-73.3	-36.5	166.1	-54.7	-61.3	0	0	0	111.5	F140 S141 S145 L146 I147 I155 A159	F140-F143 WeakPolarHBondContact O-CB 3.27Å; F140-F143 PolarHBondContact O-N 3.49Å; S141-F143 PolarHBondContact O-N 2.98Å; F143-S145 PolarHBondContact O-N 3.37Å; F143-L146 CarbonylContact O-C 3.6Å; F143-L146 WeakPolarHBondContact O-CA 3.37Å; F143-L146 WeakPolarHBondContact O-CB 3.42Å; F143-L146 PolarHBondContact O-N 3.22Å; F143-L146 VanDerWaalsContact O-N 3.09Å; F143-I147 HydrophobicContact CB-CD1 4.13Å; F143-I147 WeakPolarHBondContact O-CB 3.1Å; F143-I147 WeakPolarHBondContact O-CD1 3.34Å; F143-I147 WeakPolarHBondContact O-CG1 3.27Å; F143-I147 PolarHBondContact O-N 3.4Å; F143-I155 HydrophobicContact CD1-CB 4.15Å; F143-I155 HydrophobicContact CD1-CG2 3.28Å; F143-I155 HydrophobicContact CE1-CG2 3.32Å; F143-A159 HydrophobicContact CE1-CB 3.89Å; F143-A159 HydrophobicContact CE2-CB 4.01Å; F143-A159 HydrophobicContact CZ-CB 3.41Å; F143-A159 VanDerWaalsContact CZ-CB 3.41Å
144	H	36.3	Very low	43.8	Very low	111 Å²	111	52.2 Å²	52.2	51%	0.514	32%	0.315	S	S	.	.	H	α-helix	trans	-60.9	-38.5	175.7	-90.8	-12.1	0	0	0	115.2	S141 L146 I147 N148	S141-H144 VanDerWaalsContact C-N 3.34Å; S141-H144 CarbonylContact O-C 3.36Å; S141-H144 VanDerWaalsContact O-CA 3.32Å; S141-H144 WeakPolarHBondContact O-CA 3.37Å; S141-H144 WeakPolarHBondContact O-CB 3.32Å; S141-H144 PolarHBondContact O-N 2.84Å; H144-L146 PolarHBondContact O-N 3.33Å; H144-I147 VanDerWaalsContact ND1-CD1 3.34Å; H144-I147 WeakPolarHBondContact ND1-CD1 3.31Å; H144-I147 PolarHBondContact O-N 2.88Å; H144-N148 PolarHBondContact O-N 3.39Å
145	S	35.2	Very low	42.4	Very low	59 Å²	59	54.1 Å²	54.1	41%	0.413	33%	0.325	S	S	.	.	H	α-helix	trans	-64.5	-30.8	174.3	47.6	0	0	0	0	112	S141 P142 F143	S141-S145 PolarHBondContact O-N 2.71Å; P142-S145 PolarHBondContact O-OG 3.12Å; P142-S145 VanDerWaalsContact O-OG 3.05Å; F143-S145 PolarHBondContact O-N 3.37Å
146	L	33.1	Very low	41.7	Very low	20 Å²	20	53 Å²	53	11%	0.105	32%	0.323	C	S	.	.	H	α-helix	trans	-79.3	-33	173.1	-64.1	162.8	0	0	0	112.2	P142 F143 H144 G149 V151 I155	P142-L146 WeakPolarHBondContact O-CD1 3.17Å; F143-L146 CarbonylContact O-C 3.6Å; F143-L146 WeakPolarHBondContact O-CA 3.37Å; F143-L146 WeakPolarHBondContact O-CB 3.42Å; F143-L146 PolarHBondContact O-N 3.22Å; F143-L146 VanDerWaalsContact O-N 3.09Å; H144-L146 PolarHBondContact O-N 3.33Å; L146-G149 PolarHBondContact O-N 3.25Å; L146-V151 WeakPolarHBondContact O-CB 3.37Å; L146-V151 PolarHBondContact O-N 3.3Å; L146-I155 HydrophobicContact CB-CD1 3.9Å; L146-I155 HydrophobicContact CD1-CD1 3.59Å; L146-I155 HydrophobicContact CD2-CD1 4.38Å; L146-I155 HydrophobicContact CG-CD1 4.14Å
147	I	32.2	Very low	41.2	Very low	48 Å²	48	55.6 Å²	55.6	25%	0.246	32%	0.322	C	S	.	.	H	α-helix	trans	-66	-41.3	175.9	-70.5	160	0	0	0	110.8	F143 H144 G149 G150	F143-I147 HydrophobicContact CB-CD1 4.13Å; F143-I147 WeakPolarHBondContact O-CB 3.1Å; F143-I147 WeakPolarHBondContact O-CD1 3.34Å; F143-I147 WeakPolarHBondContact O-CG1 3.27Å; F143-I147 PolarHBondContact O-N 3.4Å; H144-I147 VanDerWaalsContact ND1-CD1 3.34Å; H144-I147 WeakPolarHBondContact ND1-CD1 3.31Å; H144-I147 PolarHBondContact O-N 2.88Å; I147-G149 PolarHBondContact O-N 3.13Å; I147-G150 PolarHBondContact O-N 2.79Å
148	N	37.2	Very low	40.7	Very low	143 Å²	143	56.5 Å²	56.5	77%	0.765	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-17.2	175.5	-75.6	-14.2	0	0	0	112.9	H144 G150	H144-N148 PolarHBondContact O-N 3.39Å; N148-G150 VanDerWaalsContact C-N 3.32Å
149	G	37.5	Very low	40.8	Very low	25 Å²	25	53 Å²	53	26%	0.258	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-4.9	175.8	0	0	0	0	0	115	N16 L146 I147	N16-G149 PolarHBondContact ND2-O 3.38Å; N16-G149 PolarHBondContact OD1-O 2.94Å; L146-G149 PolarHBondContact O-N 3.25Å; I147-G149 PolarHBondContact O-N 3.13Å
150	G	36.2	Very low	40.9	Very low	32 Å²	32	54.4 Å²	54.4	33%	0.33	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	98	-0.2	-175.9	0	0	0	0	0	114.5	I147 N148 L152	I147-G150 PolarHBondContact O-N 2.79Å; N148-G150 VanDerWaalsContact C-N 3.32Å; G150-L152 PolarHBondContact O-N 3.31Å
151	V	34.3	Very low	40.8	Very low	14 Å²	14	54.4 Å²	54.4	9%	0.085	31%	0.314	C	S	.	.			trans	-87.1	68.2	174.4	-168.1	0	0	0	0	109.1	L19 L146 N153 I155	L19-V151 HydrophobicContact CD2-CB 3.9Å; L19-V151 HydrophobicContact CD2-CG1 3.67Å; L19-V151 HydrophobicContact CD2-CG2 3.73Å; L146-V151 WeakPolarHBondContact O-CB 3.37Å; L146-V151 PolarHBondContact O-N 3.3Å; V151-N153 PolarHBondContact O-N 3.06Å; V151-I155 HydrophobicContact CB-CD1 4.43Å; V151-I155 HydrophobicContact CG1-CD1 3.73Å; V151-I155 HydrophobicContact CG1-CG1 3.76Å
152	L	39.3	Very low	41.3	Very low	113 Å²	113	52.5 Å²	52.5	59%	0.592	30%	0.3	S	S	*	.			trans	-71.3	-26.2	-157	-106.9	140.8	0	0	0	116.1	G150	G150-L152 PolarHBondContact O-N 3.31Å
153	N	39.4	Very low	41.8	Very low	115 Å²	115	50.8 Å²	50.8	62%	0.615	29%	0.289	S	S	*	.	S	Bend	trans	-139.2	-33.5	-170	-67.3	-45.1	0	0	0	115.3	V151 I155 E157	V151-N153 PolarHBondContact O-N 3.06Å; N153-I155 PolarHBondContact O-N 2.74Å; N153-E157 PolarHBondContact O-N 3.38Å
154	D	38.6	Very low	42.4	Very low	23 Å²	23	55.5 Å²	55.5	12%	0.123	31%	0.311	C	S	.	.	H	α-helix	trans	-66.5	-36.3	-166.2	-52.2	-29.8	0	0	0	112.9	I20 E157 I158	I20-D154 HydrophobicContact CB-CB 4.35Å; I20-D154 PolarHBondContact N-OD2 3.33Å; I20-D154 VanDerWaalsContact O-CG 3.3Å; D154-E157 PolarHBondContact O-N 2.89Å; D154-I158 HydrophobicContact CB-CD1 4.4Å; D154-I158 WeakPolarHBondContact O-CB 3.42Å; D154-I158 WeakPolarHBondContact O-CD1 3.43Å; D154-I158 WeakPolarHBondContact O-CG1 3.34Å; D154-I158 PolarHBondContact O-N 3.34Å
155	I	40.8	Very low	43	Very low	45 Å²	45	53.2 Å²	53.2	23%	0.231	30%	0.298	C	S	.	.	H	α-helix	trans	-75.8	-41.4	-173.1	-53.1	-176.1	0	0	0	111.8	F143 L146 V151 N153 E157 I158 A159	F143-I155 HydrophobicContact CD1-CB 4.15Å; F143-I155 HydrophobicContact CD1-CG2 3.28Å; F143-I155 HydrophobicContact CE1-CG2 3.32Å; L146-I155 HydrophobicContact CB-CD1 3.9Å; L146-I155 HydrophobicContact CD1-CD1 3.59Å; L146-I155 HydrophobicContact CD2-CD1 4.38Å; L146-I155 HydrophobicContact CG-CD1 4.14Å; V151-I155 HydrophobicContact CB-CD1 4.43Å; V151-I155 HydrophobicContact CG1-CD1 3.73Å; V151-I155 HydrophobicContact CG1-CG1 3.76Å; N153-I155 PolarHBondContact O-N 2.74Å; I155-E157 PolarHBondContact O-N 3.24Å; I155-I158 PolarHBondContact O-N 3.31Å; I155-A159 VanDerWaalsContact O-CB 3.24Å; I155-A159 WeakPolarHBondContact O-CB 3.38Å; I155-A159 PolarHBondContact O-N 3.29Å
156	A	47.4	Very low	43.6	Very low	53 Å²	53	51.2 Å²	51.2	44%	0.438	29%	0.285	S	S	.	.	H	α-helix	trans	-61.4	-37.8	173.8	0	0	0	0	0	110.5	N160	A156-N160 WeakPolarHBondContact O-CB 3.03Å; A156-N160 PolarHBondContact O-N 3.22Å
157	E	47.2	Very low	44.4	Very low	103 Å²	103	53 Å²	53	48%	0.481	30%	0.299	S	S	.	.	H	α-helix	trans	-67.3	-47.9	175.4	-169.1	168.9	-170.7	0	0	112	N153 D154 I155 A159 N160 V161	N153-E157 PolarHBondContact O-N 3.38Å; D154-E157 PolarHBondContact O-N 2.89Å; I155-E157 PolarHBondContact O-N 3.24Å; E157-A159 PolarHBondContact O-N 3.45Å; E157-N160 CarbonylContact O-C 3.59Å; E157-N160 WeakPolarHBondContact O-CA 3.21Å; E157-N160 WeakPolarHBondContact O-CB 3.42Å; E157-N160 PolarHBondContact O-N 2.88Å; E157-N160 VanDerWaalsContact O-N 3.14Å; E157-V161 WeakPolarHBondContact O-CG2 3.49Å; E157-V161 PolarHBondContact O-N 2.78Å
158	I	46.5	Very low	45.3	Very low	25 Å²	25	50.7 Å²	50.7	13%	0.128	29%	0.287	C	S	.	.	H	α-helix	trans	-60.8	-45.8	176.6	-71.1	160.7	0	0	0	111	I20 L74 D154 I155 N160 V161 I162	I20-I158 HydrophobicContact CD1-CD1 3.27Å; L74-I158 HydrophobicContact CD1-CG1 4.29Å; D154-I158 HydrophobicContact CB-CD1 4.4Å; D154-I158 WeakPolarHBondContact O-CB 3.42Å; D154-I158 WeakPolarHBondContact O-CD1 3.43Å; D154-I158 WeakPolarHBondContact O-CG1 3.34Å; D154-I158 PolarHBondContact O-N 3.34Å; I155-I158 PolarHBondContact O-N 3.31Å; I158-N160 VanDerWaalsContact C-N 3.28Å; I158-N160 PolarHBondContact O-N 2.94Å; I158-V161 PolarHBondContact O-N 3.16Å; I158-I162 HydrophobicContact CG2-CD1 3.63Å; I158-I162 HydrophobicContact CG2-CG1 4.21Å; I158-I162 WeakPolarHBondContact O-CB 3.39Å; I158-I162 VanDerWaalsContact O-CG1 3.26Å; I158-I162 WeakPolarHBondContact O-CG1 3.11Å; I158-I162 PolarHBondContact O-N 3.38Å
159	A	51.7	Low	46	Very low	4 Å²	4	46.8 Å²	46.8	3%	0.033	26%	0.262	C	S	.	.	H	α-helix	trans	-62.4	-39.6	176.2	0	0	0	0	0	111	F143 I155 E157 G163	F143-A159 HydrophobicContact CE1-CB 3.89Å; F143-A159 HydrophobicContact CE2-CB 4.01Å; F143-A159 HydrophobicContact CZ-CB 3.41Å; F143-A159 VanDerWaalsContact CZ-CB 3.41Å; I155-A159 VanDerWaalsContact O-CB 3.24Å; I155-A159 WeakPolarHBondContact O-CB 3.38Å; I155-A159 PolarHBondContact O-N 3.29Å; E157-A159 PolarHBondContact O-N 3.45Å; A159-G163 WeakPolarHBondContact O-CA 3.41Å; A159-G163 PolarHBondContact O-N 3.46Å
160	N	51.7	Low	46.7	Very low	71 Å²	71	48.5 Å²	48.5	38%	0.38	26%	0.262	S	S	.	.	H	α-helix	trans	-64.9	-41.7	174	-175.8	52.2	0	0	0	111.6	W126 A156 E157 I158 H164	W126-N160 VanDerWaalsContact CD1-OD1 3.3Å; A156-N160 WeakPolarHBondContact O-CB 3.03Å; A156-N160 PolarHBondContact O-N 3.22Å; E157-N160 CarbonylContact O-C 3.59Å; E157-N160 WeakPolarHBondContact O-CA 3.21Å; E157-N160 WeakPolarHBondContact O-CB 3.42Å; E157-N160 PolarHBondContact O-N 2.88Å; E157-N160 VanDerWaalsContact O-N 3.14Å; I158-N160 VanDerWaalsContact C-N 3.28Å; I158-N160 PolarHBondContact O-N 2.94Å; N160-H164 WeakPolarHBondContact O-CB 3.44Å; N160-H164 PolarHBondContact O-N 3.37Å; N160-H164 PolarHBondContact O-ND1 2.79Å; N160-H164 PolarHBondContact OD1-CE1 3.09Å; N160-H164 PolarHBondContact OD1-ND1 3.18Å; N160-H164 VanDerWaalsContact OD1-ND1 3.14Å
161	V	48.8	Very low	47.5	Very low	33 Å²	33	47 Å²	47	20%	0.2	25%	0.247	C	C	.	.	H	α-helix	trans	-66.8	-53.4	176.1	-176.4	0	0	0	0	109.6	L74 E157 I158 G163 H164 W165	L74-V161 HydrophobicContact CD2-CB 3.42Å; L74-V161 VanDerWaalsContact CD2-CB 3.42Å; L74-V161 HydrophobicContact CD2-CG1 3.14Å; L74-V161 HydrophobicContact CD2-CG2 4.1Å; E157-V161 WeakPolarHBondContact O-CG2 3.49Å; E157-V161 PolarHBondContact O-N 2.78Å; I158-V161 PolarHBondContact O-N 3.16Å; V161-G163 PolarHBondContact O-N 3.25Å; V161-H164 CarbonylContact O-C 3.58Å; V161-H164 WeakPolarHBondContact O-CA 3.4Å; V161-H164 WeakPolarHBondContact O-CB 3.44Å; V161-H164 PolarHBondContact O-N 2.97Å; V161-W165 HydrophobicContact CG1-CG 4.41Å; V161-W165 VanDerWaalsContact O-CB 3.23Å; V161-W165 WeakPolarHBondContact O-CB 3.24Å; V161-W165 PolarHBondContact O-N 2.91Å
162	I	51.1	Low	48.3	Very low	8 Å²	8	46.5 Å²	46.5	4%	0.041	24%	0.243	C	C	.	.	H	α-helix	trans	-51.6	-45.4	175.8	-68.5	171.2	0	0	0	110.7	L70 I119 I158 W165 A166	L70-I162 HydrophobicContact CD1-CD1 4.49Å; L70-I162 HydrophobicContact CD2-CD1 4.19Å; L70-I162 HydrophobicContact CD2-CG1 4.26Å; I119-I162 HydrophobicContact CG2-CG2 4.33Å; I158-I162 HydrophobicContact CG2-CD1 3.63Å; I158-I162 HydrophobicContact CG2-CG1 4.21Å; I158-I162 WeakPolarHBondContact O-CB 3.39Å; I158-I162 VanDerWaalsContact O-CG1 3.26Å; I158-I162 WeakPolarHBondContact O-CG1 3.11Å; I158-I162 PolarHBondContact O-N 3.38Å; I162-W165 PolarHBondContact O-N 2.86Å; I162-A166 PolarHBondContact O-N 2.86Å
163	G	54.2	Low	48.9	Very low	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.3	-42.7	176.1	0	0	0	0	0	113.6	K123 W126 A159 V161	K123-G163 PolarHBondContact NZ-O 2.97Å; W126-G163 VanDerWaalsContact CB-CA 3.49Å; W126-G163 VanDerWaalsContact CD2-C 3.45Å; W126-G163 VanDerWaalsContact CG-CA 3.47Å; A159-G163 WeakPolarHBondContact O-CA 3.41Å; A159-G163 PolarHBondContact O-N 3.46Å; V161-G163 PolarHBondContact O-N 3.25Å
164	H	52.1	Low	49.4	Very low	120 Å²	120	40.5 Å²	40.5	56%	0.556	22%	0.217	S	C	*	.	H	α-helix	trans	-70.6	-39.8	172.6	-80.7	94.9	0	0	0	112.8	W126 N160 V161	W126-H164 AromaticContact CD1-CE1 3.89Å; W126-H164 AromaticContact CD1-ND1 3.63Å; W126-H164 AromaticContact CE2-CG 3.97Å; W126-H164 AromaticContact CE2-ND1 3.99Å; W126-H164 AromaticContact CZ2-CD2 3.89Å; W126-H164 AromaticContact NE1-CD2 3.7Å; W126-H164 AromaticContact NE1-CE1 3.08Å; W126-H164 PolarHBondContact NE1-CE1 2.85Å; W126-H164 AromaticContact NE1-CG 3.41Å; W126-H164 AromaticContact NE1-ND1 3.01Å; W126-H164 PolarHBondContact NE1-ND1 3.43Å; W126-H164 AromaticContact NE1-NE2 3.48Å; W126-H164 PolarHBondContact NE1-NE2 3.37Å; N160-H164 WeakPolarHBondContact O-CB 3.44Å; N160-H164 PolarHBondContact O-N 3.37Å; N160-H164 PolarHBondContact O-ND1 2.79Å; N160-H164 PolarHBondContact OD1-CE1 3.09Å; N160-H164 PolarHBondContact OD1-ND1 3.18Å; N160-H164 VanDerWaalsContact OD1-ND1 3.14Å; V161-H164 CarbonylContact O-C 3.58Å; V161-H164 WeakPolarHBondContact O-CA 3.4Å; V161-H164 WeakPolarHBondContact O-CB 3.44Å; V161-H164 PolarHBondContact O-N 2.97Å
165	W	48.6	Very low	49.7	Very low	63 Å²	63	40 Å²	40	24%	0.239	22%	0.216	C	C	.	.	H	α-helix	trans	-69.6	-44.1	-164.8	-131.7	53.5	0	0	0	113	G73 P82 V161 I162	G73-W165 VanDerWaalsContact C-CE2 3.43Å; G73-W165 VanDerWaalsContact N-CH2 3.29Å; G73-W165 WeakPolarHBondContact O-CH2 3.45Å; G73-W165 WeakPolarHBondContact O-CZ2 3.23Å; G73-W165 PolarHBondContact O-NE1 3.11Å; P82-W165 VanDerWaalsContact CB-CD1 3.47Å; V161-W165 HydrophobicContact CG1-CG 4.41Å; V161-W165 VanDerWaalsContact O-CB 3.23Å; V161-W165 WeakPolarHBondContact O-CB 3.24Å; V161-W165 PolarHBondContact O-N 2.91Å; I162-W165 PolarHBondContact O-N 2.86Å
166	A	47.7	Very low	50	Low	17 Å²	17	39.1 Å²	39.1	14%	0.14	22%	0.218	C	C	.	.	S	Bend	trans	-103.3	123.9	-166.8	0	0	0	0	0	110.1	K123 I162 T168 V171	K123-A166 WeakPolarHBondContact CE-O 3.34Å; K123-A166 PolarHBondContact NZ-O 2.9Å; I162-A166 PolarHBondContact O-N 2.86Å; A166-T168 PolarHBondContact O-N 3.32Å; A166-V171 HydrophobicContact CB-CG2 3.23Å
167	S	49.5	Very low	49.7	Very low	57 Å²	57	37.5 Å²	37.5	40%	0.399	20%	0.202	S	C	.	.			trans	-53.2	137.3	160.7	70.9	0	0	0	0	107.2	R169 K170 V171	S167-R169 PolarHBondContact O-N 3.3Å; S167-K170 PolarHBondContact O-N 3.29Å; S167-K170 WeakPolarHBondContact OG-CB 3.1Å; S167-K170 PolarHBondContact OG-N 3.27Å; S167-K170 VanDerWaalsContact OG-N 3.08Å; S167-V171 PolarHBondContact O-N 2.94Å
168	T	52.3	Low	49.6	Very low	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-53.5	-33.2	179.2	-51.9	0	0	0	0	110	K123 W127 A166 V171 L172 F204 F258	K123-T168 WeakPolarHBondContact CE-OG1 3.49Å; W127-T168 PolarHBondContact NE1-OG1 3.47Å; A166-T168 PolarHBondContact O-N 3.32Å; T168-V171 WeakPolarHBondContact O-CB 3.41Å; T168-V171 PolarHBondContact O-N 3.04Å; T168-L172 HydrophobicContact CG2-CD1 3.97Å; T168-L172 HydrophobicContact CG2-CG 4.26Å; T168-L172 WeakPolarHBondContact O-CB 3.22Å; T168-L172 WeakPolarHBondContact O-CG 3.33Å; T168-L172 PolarHBondContact O-N 2.97Å; T168-F204 HydrophobicContact CG2-CE1 4.28Å; T168-F204 HydrophobicContact CG2-CZ 4.19Å; T168-F258 WeakPolarHBondContact CB-O 3.33Å; T168-F258 PolarHBondContact OG1-O 3.34Å
169	R	50.1	Low	49.3	Very low	61 Å²	61	41.2 Å²	41.2	23%	0.23	24%	0.239	C	C	.	.	H	α-helix	trans	-57.3	-45.7	170.3	177.8	175	167.3	-175.7	-7.4	114.1	S167 L172 S173 I181 V186 L194	S167-R169 PolarHBondContact O-N 3.3Å; R169-L172 PolarHBondContact O-N 2.9Å; R169-S173 VanDerWaalsContact O-CB 3.26Å; R169-S173 WeakPolarHBondContact O-CB 3.42Å; R169-S173 PolarHBondContact O-N 3.46Å; R169-I181 HydrophobicContact CG-CD1 4.3Å; R169-I181 VanDerWaalsContact CZ-CG2 3.41Å; R169-V186 VanDerWaalsContact NH2-CG2 3.3Å; R169-L194 HydrophobicContact CB-CD1 4.09Å; R169-L194 HydrophobicContact CG-CD1 3.87Å
170	K	52.9	Low	48.7	Very low	61 Å²	61	45 Å²	45	27%	0.265	26%	0.258	S	S	.	.	H	α-helix	trans	-70	-38	178.2	-172.5	59.6	174.4	-177.7	0	111.5	S167 S173 L174	S167-K170 PolarHBondContact O-N 3.29Å; S167-K170 WeakPolarHBondContact OG-CB 3.1Å; S167-K170 PolarHBondContact OG-N 3.27Å; S167-K170 VanDerWaalsContact OG-N 3.08Å; K170-S173 PolarHBondContact O-N 3.31Å; K170-L174 HydrophobicContact CD-CG 4.34Å; K170-L174 HydrophobicContact CG-CD1 4.15Å; K170-L174 HydrophobicContact CG-CG 4.39Å; K170-L174 VanDerWaalsContact O-CB 3.3Å; K170-L174 WeakPolarHBondContact O-CB 3.23Å; K170-L174 VanDerWaalsContact O-CG 3.24Å; K170-L174 WeakPolarHBondContact O-CG 3.38Å; K170-L174 PolarHBondContact O-N 3.45Å
171	V	53.5	Low	47.8	Very low	2 Å²	2	43.5 Å²	43.5	1%	0.012	25%	0.25	C	C	.	.	H	α-helix	trans	-57	-51.1	170.5	168.7	0	0	0	0	110.6	I119 M120 K123 A166 S167 T168 S173 L174 A175	I119-V171 HydrophobicContact CG2-CB 4.13Å; I119-V171 HydrophobicContact CG2-CG1 3.5Å; I119-V171 HydrophobicContact CG2-CG2 3.81Å; M120-V171 HydrophobicContact CE-CG1 4.19Å; M120-V171 HydrophobicContact SD-CG1 3.28Å; M120-V171 WeakPolarHBondContact SD-CG1 3.12Å; K123-V171 HydrophobicContact CB-CG2 4.47Å; K123-V171 HydrophobicContact CD-CG2 4.48Å; K123-V171 HydrophobicContact CG-CG2 4.36Å; A166-V171 HydrophobicContact CB-CG2 3.23Å; S167-V171 PolarHBondContact O-N 2.94Å; T168-V171 WeakPolarHBondContact O-CB 3.41Å; T168-V171 PolarHBondContact O-N 3.04Å; V171-S173 PolarHBondContact O-N 3.34Å; V171-L174 CarbonylContact O-C 3.5Å; V171-L174 PolarHBondContact O-N 3.43Å; V171-A175 VanDerWaalsContact O-CB 3.31Å; V171-A175 WeakPolarHBondContact O-CB 3.31Å; V171-A175 PolarHBondContact O-N 3.37Å
172	L	50.3	Low	47.3	Very low	2 Å²	2	48.3 Å²	48.3	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-64.1	-41	179.8	-70.2	170.4	0	0	0	112	M120 T168 R169 A175 G176 V177 L200 L259	M120-L172 HydrophobicContact CE-CD2 3.66Å; M120-L172 HydrophobicContact SD-CD2 4.35Å; T168-L172 HydrophobicContact CG2-CD1 3.97Å; T168-L172 HydrophobicContact CG2-CG 4.26Å; T168-L172 WeakPolarHBondContact O-CB 3.22Å; T168-L172 WeakPolarHBondContact O-CG 3.33Å; T168-L172 PolarHBondContact O-N 2.97Å; R169-L172 PolarHBondContact O-N 2.9Å; L172-A175 CarbonylContact O-C 3.52Å; L172-A175 WeakPolarHBondContact O-CA 3.15Å; L172-A175 WeakPolarHBondContact O-CB 3.27Å; L172-A175 PolarHBondContact O-N 3.22Å; L172-A175 VanDerWaalsContact O-N 3.15Å; L172-G176 PolarHBondContact O-N 2.73Å; L172-V177 HydrophobicContact CB-CB 4.15Å; L172-V177 HydrophobicContact CB-CG2 4.1Å; L172-V177 HydrophobicContact CD2-CG2 4.11Å; L172-V177 VanDerWaalsContact O-CB 3.27Å; L172-V177 WeakPolarHBondContact O-CB 3.44Å; L172-V177 WeakPolarHBondContact O-CG2 3.41Å; L172-V177 PolarHBondContact O-N 3.23Å; L172-L200 HydrophobicContact CD2-CD1 3.86Å; L172-L259 HydrophobicContact CD1-CD2 4.1Å
173	S	51.7	Low	46.5	Very low	64 Å²	64	54.3 Å²	54.3	45%	0.448	30%	0.298	S	S	.	.	H	α-helix	trans	-63.6	-42.9	174.7	169.6	0	0	0	0	111.8	R169 K170 V171 A175 G176	R169-S173 VanDerWaalsContact O-CB 3.26Å; R169-S173 WeakPolarHBondContact O-CB 3.42Å; R169-S173 PolarHBondContact O-N 3.46Å; K170-S173 PolarHBondContact O-N 3.31Å; V171-S173 PolarHBondContact O-N 3.34Å; S173-A175 PolarHBondContact O-N 3.45Å; S173-G176 PolarHBondContact O-N 3.27Å; S173-G176 VanDerWaalsContact O-N 3.09Å
174	L	49.9	Very low	45.4	Very low	38 Å²	38	59.1 Å²	59.1	20%	0.199	33%	0.327	C	S	.	.	H	α-helix	trans	-67.6	-24.8	173.7	-73.7	173.1	0	0	0	112.4	I105 L110 K170 V171	I105-L174 HydrophobicContact CG2-CD2 4.39Å; L110-L174 WeakPolarHBondContact CD2-O 3.41Å; L110-L174 VanDerWaalsContact CG-O 3.31Å; L110-L174 WeakPolarHBondContact CG-O 3.26Å; K170-L174 HydrophobicContact CD-CG 4.34Å; K170-L174 HydrophobicContact CG-CD1 4.15Å; K170-L174 HydrophobicContact CG-CG 4.39Å; K170-L174 VanDerWaalsContact O-CB 3.3Å; K170-L174 WeakPolarHBondContact O-CB 3.23Å; K170-L174 VanDerWaalsContact O-CG 3.24Å; K170-L174 WeakPolarHBondContact O-CG 3.38Å; K170-L174 PolarHBondContact O-N 3.45Å; V171-L174 CarbonylContact O-C 3.5Å; V171-L174 PolarHBondContact O-N 3.43Å
175	A	46.4	Very low	44.3	Very low	14 Å²	14	56.3 Å²	56.3	12%	0.116	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	8.5	171.7	0	0	0	0	0	113.3	L110 T116 M120 V171 L172 S173 V177 L200	L110-A175 VanDerWaalsContact CD2-CA 3.47Å; T116-A175 HydrophobicContact CG2-CB 3.68Å; M120-A175 HydrophobicContact SD-CB 4.03Å; V171-A175 VanDerWaalsContact O-CB 3.31Å; V171-A175 WeakPolarHBondContact O-CB 3.31Å; V171-A175 PolarHBondContact O-N 3.37Å; L172-A175 CarbonylContact O-C 3.52Å; L172-A175 WeakPolarHBondContact O-CA 3.15Å; L172-A175 WeakPolarHBondContact O-CB 3.27Å; L172-A175 PolarHBondContact O-N 3.22Å; L172-A175 VanDerWaalsContact O-N 3.15Å; S173-A175 PolarHBondContact O-N 3.45Å; A175-V177 VanDerWaalsContact C-N 3.35Å; A175-V177 PolarHBondContact O-N 2.9Å; A175-L200 HydrophobicContact CB-CD1 4.4Å
176	G	45.8	Very low	43.3	Very low	25 Å²	25	56.8 Å²	56.8	26%	0.258	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	82	10.3	172.3	0	0	0	0	0	114.3	L172 S173 K178	L172-G176 PolarHBondContact O-N 2.73Å; S173-G176 PolarHBondContact O-N 3.27Å; S173-G176 VanDerWaalsContact O-N 3.09Å; G176-K178 PolarHBondContact O-N 2.98Å
177	V	41.7	Very low	42.3	Very low	19 Å²	19	64.6 Å²	64.6	12%	0.115	36%	0.357	C	S	.	.			trans	-72	95.1	173.6	-174.3	0	0	0	0	108.7	L172 A175 M197 L200	L172-V177 HydrophobicContact CB-CB 4.15Å; L172-V177 HydrophobicContact CB-CG2 4.1Å; L172-V177 HydrophobicContact CD2-CG2 4.11Å; L172-V177 VanDerWaalsContact O-CB 3.27Å; L172-V177 WeakPolarHBondContact O-CB 3.44Å; L172-V177 WeakPolarHBondContact O-CG2 3.41Å; L172-V177 PolarHBondContact O-N 3.23Å; A175-V177 VanDerWaalsContact C-N 3.35Å; A175-V177 PolarHBondContact O-N 2.9Å; V177-M197 HydrophobicContact CB-CG 4.49Å; V177-M197 HydrophobicContact CB-SD 4.46Å; V177-M197 HydrophobicContact CG1-CG 3.94Å; V177-M197 HydrophobicContact CG1-SD 4.33Å; V177-M197 HydrophobicContact CG2-CE 3.89Å; V177-M197 HydrophobicContact CG2-CG 3.95Å; V177-M197 HydrophobicContact CG2-SD 4.05Å; V177-L200 HydrophobicContact CG2-CD1 3.93Å
178	K	44.1	Very low	41.3	Very low	126 Å²	126	67.1 Å²	67.1	55%	0.548	37%	0.365	S	S	.	.			trans	-97.7	149.9	-179.4	-68.6	180	174.4	-173.3	0	111.1	D102 N106 G176	D102-K178 VanDerWaalsContact CG-NZ 3.3Å; D102-K178 WeakPolarHBondContact OD1-CE 3.48Å; D102-K178 IonicContact OD1-NZ 2.67Å; D102-K178 PolarHBondContact OD1-NZ 2.82Å; D102-K178 VanDerWaalsContact OD1-NZ 3.1Å; D102-K178 IonicContact OD2-NZ 3.93Å; D102-K178 PolarHBondContact OD2-NZ 2.73Å; N106-K178 PolarHBondContact ND2-NZ 3.23Å; G176-K178 PolarHBondContact O-N 2.98Å
179	G	40.6	Very low	40.2	Very low	80 Å²	80	76.6 Å²	76.6	83%	0.825	41%	0.409	S	S	*	.	S	Bend	trans	111.8	10.8	155.9	0	0	0	0	0	119.6
180	L	38.6	Very low	39.3	Very low	83 Å²	83	77.5 Å²	77.5	44%	0.435	42%	0.421	S	S	.	.	S	Bend	trans	-123.7	-4.2	179.3	-82.6	155.4	0	0	0	115.3	E193 L194 R195	L180-E193 WeakPolarHBondContact CD1-O 2.87Å; L180-E193 WeakPolarHBondContact CD2-O 3.31Å; L180-L194 HydrophobicContact CB-CD2 3.8Å; L180-R195 HydrophobicContact CD1-CB 4.34Å
181	I	34.2	Very low	38.4	Very low	40 Å²	40	80.4 Å²	80.4	21%	0.205	45%	0.447	C	S	.	.			trans	-149.3	120.6	-176.5	-49.8	172.3	0	0	0	112.7	R169 Q192 L194	R169-I181 HydrophobicContact CG-CD1 4.3Å; R169-I181 VanDerWaalsContact CZ-CG2 3.41Å; I181-Q192 HydrophobicContact CD1-CB 4.07Å; I181-Q192 HydrophobicContact CD1-CG 4.48Å; I181-Q192 HydrophobicContact CG1-CB 3.99Å; I181-Q192 HydrophobicContact CG1-CG 4.11Å; I181-Q192 HydrophobicContact CG2-CG 4.46Å; I181-Q192 VanDerWaalsContact CG2-NE2 3.31Å; I181-L194 HydrophobicContact CD1-CD1 3.34Å; I181-L194 HydrophobicContact CD1-CD2 3.6Å; I181-L194 HydrophobicContact CD1-CG 3.41Å; I181-L194 VanDerWaalsContact CD1-CG 3.41Å; I181-L194 HydrophobicContact CG1-CD1 4.47Å; I181-L194 HydrophobicContact CG1-CD2 3.95Å; I181-L194 HydrophobicContact CG1-CG 4.06Å
182	E	37.4	Very low	37.6	Very low	135 Å²	135	82.4 Å²	82.4	63%	0.631	46%	0.456	S	S	*	.			trans	-72.7	132.7	159.9	-63.5	-167.6	164.9	0	0	109.4	T184 D185	E182-T184 PolarHBondContact O-N 3.01Å; E182-D185 PolarHBondContact O-N 3.44Å
183	E	34	Very low	37.1	Very low	134 Å²	134	89 Å²	89	63%	0.626	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-55	-22.5	179.8	-75.2	-171.6	141.3	0	0	113.2	Y88 V186	Y88-E183 PolarHBondContact OH-OE1 2.77Å; E183-V186 WeakPolarHBondContact O-CG2 3.24Å
184	T	31.1	Very low	36.6	Very low	100 Å²	100	87 Å²	87	61%	0.613	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-71.2	-26.1	176.5	38.4	0	0	0	0	114.1	E182 V186	E182-T184 PolarHBondContact O-N 3.01Å; T184-V186 PolarHBondContact O-N 3.29Å
185	D	29.2	Very low	36.6	Very low	61 Å²	61	93.3 Å²	93.3	33%	0.326	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-82.2	2.7	-178.4	-69.4	-25.7	0	0	0	113.1	E182 F187 I188 Q192	E182-D185 PolarHBondContact O-N 3.44Å; D185-F187 PolarHBondContact O-N 3.35Å; D185-I188 PolarHBondContact O-N 2.71Å; D185-Q192 PolarHBondContact O-NE2 3.33Å
186	V	28	Very low	36.9	Very low	73 Å²	73	92.8 Å²	92.8	44%	0.442	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-64.3	-27	-179.2	176.3	0	0	0	0	112.6	R169 E183 T184	R169-V186 VanDerWaalsContact NH2-CG2 3.3Å; E183-V186 WeakPolarHBondContact O-CG2 3.24Å; T184-V186 PolarHBondContact O-N 3.29Å
187	F	27.9	Very low	37.2	Very low	181 Å²	181	95 Å²	95	79%	0.794	49%	0.491	S	S	*	.	S	Bend	trans	-99.5	-12.2	-175.9	-62.4	-73.1	0	0	0	114.2	D185	D185-F187 PolarHBondContact O-N 3.35Å
188	I	27.3	Very low	38.1	Very low	111 Å²	111	99.8 Å²	99.8	57%	0.569	52%	0.516	S	S	*	.	S	Bend	trans	-93.3	126.4	173.6	-53	-179.3	0	0	0	105.7	D185 T190	D185-I188 PolarHBondContact O-N 2.71Å; I188-T190 PolarHBondContact O-N 3.15Å
189	H	30.2	Very low	38.6	Very low	198 Å²	198	100.5 Å²	100.5	92%	0.917	52%	0.522	S	S	*	.			trans	-64.8	40.5	-177.1	-73.4	-65	0	0	0	114.1	P191	H189-P191 WeakPolarHBondContact O-CD 3.36Å
190	T	30	Very low	39.3	Very low	81 Å²	81	97.3 Å²	97.3	50%	0.497	49%	0.486	S	S	.	.			trans	-83.1	122	176.8	-27.7	0	0	0	0	108.2	I188 Q192	I188-T190 PolarHBondContact O-N 3.15Å; T190-Q192 PolarHBondContact O-N 3.28Å
191	P	34.4	Very low	40.3	Very low	122 Å²	122	96.6 Å²	96.6	79%	0.792	48%	0.479	S	S	*	.			trans	-61.3	102	173	-17.2	29.9	0	0	0	109	H189 E193	H189-P191 WeakPolarHBondContact O-CD 3.36Å; P191-E193 PolarHBondContact O-N 2.92Å
192	Q	36.4	Very low	41.6	Very low	44 Å²	44	96.8 Å²	96.8	21%	0.206	48%	0.483	C	S	.	.			trans	-79.7	117.4	177.7	-75.1	162	-5.5	0	0	109	I181 D185 T190 L194	I181-Q192 HydrophobicContact CD1-CB 4.07Å; I181-Q192 HydrophobicContact CD1-CG 4.48Å; I181-Q192 HydrophobicContact CG1-CB 3.99Å; I181-Q192 HydrophobicContact CG1-CG 4.11Å; I181-Q192 HydrophobicContact CG2-CG 4.46Å; I181-Q192 VanDerWaalsContact CG2-NE2 3.31Å; D185-Q192 PolarHBondContact O-NE2 3.33Å; T190-Q192 PolarHBondContact O-N 3.28Å; Q192-L194 PolarHBondContact O-N 3.34Å
193	E	40.7	Very low	42.6	Very low	141 Å²	141	91.6 Å²	91.6	66%	0.659	46%	0.458	S	S	*	.			trans	-72.7	70.8	175.1	-67.5	-171	176.4	0	0	110.6	L180 P191 R195	L180-E193 WeakPolarHBondContact CD1-O 2.87Å; L180-E193 WeakPolarHBondContact CD2-O 3.31Å; P191-E193 PolarHBondContact O-N 2.92Å; E193-R195 PolarHBondContact O-N 2.07Å
194	L	41.4	Very low	43.9	Very low	22 Å²	22	85.2 Å²	85.2	12%	0.115	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-68.7	118.2	165.1	-72.8	161.4	0	0	0	108.9	R169 L180 I181 Q192 L259	R169-L194 HydrophobicContact CB-CD1 4.09Å; R169-L194 HydrophobicContact CG-CD1 3.87Å; L180-L194 HydrophobicContact CB-CD2 3.8Å; I181-L194 HydrophobicContact CD1-CD1 3.34Å; I181-L194 HydrophobicContact CD1-CD2 3.6Å; I181-L194 HydrophobicContact CD1-CG 3.41Å; I181-L194 VanDerWaalsContact CD1-CG 3.41Å; I181-L194 HydrophobicContact CG1-CD1 4.47Å; I181-L194 HydrophobicContact CG1-CD2 3.95Å; I181-L194 HydrophobicContact CG1-CG 4.06Å; Q192-L194 PolarHBondContact O-N 3.34Å; L194-L259 HydrophobicContact CB-CD1 3.58Å; L194-L259 HydrophobicContact CB-CD2 3.6Å; L194-L259 HydrophobicContact CB-CG 4.18Å; L194-L259 HydrophobicContact CD1-CD1 4.11Å; L194-L259 HydrophobicContact CD1-CD2 3.74Å; L194-L259 HydrophobicContact CD1-CG 4.31Å; L194-L259 HydrophobicContact CG-CD1 4.32Å; L194-L259 HydrophobicContact CG-CD2 4.35Å
195	R	49.4	Very low	45.3	Very low	170 Å²	170	83.1 Å²	83.1	64%	0.642	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-87.3	130.2	167.7	-65.4	-175.1	-178.1	-173.7	0.4	108.8	L180 E193 M197	L180-R195 HydrophobicContact CD1-CB 4.34Å; E193-R195 PolarHBondContact O-N 2.07Å; R195-M197 PolarHBondContact O-N 2.91Å
196	I	52.2	Low	46.8	Very low	2 Å²	2	83 Å²	83	1%	0.01	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-68.6	127.9	168.8	-57.4	175.1	0	0	0	106.6	L200 K201 F204 L205 E255	I196-L200 HydrophobicContact CG2-CB 3.82Å; I196-K201 HydrophobicContact CB-CG 4.05Å; I196-K201 HydrophobicContact CG2-CB 4.48Å; I196-K201 HydrophobicContact CG2-CG 3.92Å; I196-K201 WeakPolarHBondContact O-CE 3.29Å; I196-F204 HydrophobicContact CD1-CB 3.87Å; I196-F204 HydrophobicContact CD1-CD2 3.93Å; I196-F204 HydrophobicContact CD1-CG 4.12Å; I196-F204 HydrophobicContact CG2-CD2 4.21Å; I196-L205 HydrophobicContact CD1-CD2 4.46Å; I196-L205 HydrophobicContact CD1-CG 4.49Å; I196-E255 HydrophobicContact CD1-CG 4.42Å
197	M	53.1	Low	48.4	Very low	71 Å²	71	81.7 Å²	81.7	35%	0.35	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-61.2	147.4	176.3	-59	-163.3	-46.9	0	0	110.4	V177 R195 E199 L200 K201	V177-M197 HydrophobicContact CB-CG 4.49Å; V177-M197 HydrophobicContact CB-SD 4.46Å; V177-M197 HydrophobicContact CG1-CG 3.94Å; V177-M197 HydrophobicContact CG1-SD 4.33Å; V177-M197 HydrophobicContact CG2-CE 3.89Å; V177-M197 HydrophobicContact CG2-CG 3.95Å; V177-M197 HydrophobicContact CG2-SD 4.05Å; R195-M197 PolarHBondContact O-N 2.91Å; M197-E199 PolarHBondContact O-N 3.47Å; M197-E199 VanDerWaalsContact O-N 3.09Å; M197-L200 PolarHBondContact O-N 3.17Å; M197-K201 WeakPolarHBondContact O-CG 3.36Å; M197-K201 PolarHBondContact O-N 3Å
198	D	59.3	Low	50.1	Low	120 Å²	120	73.6 Å²	73.6	64%	0.642	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-32.9	-173.7	-71.3	-31.6	0	0	0	113.3	L200 K201 P202	D198-L200 VanDerWaalsContact C-N 3.3Å; D198-L200 PolarHBondContact O-N 2.8Å; D198-K201 WeakPolarHBondContact OD1-CD 3.3Å; D198-K201 WeakPolarHBondContact OD1-CE 3.15Å; D198-K201 IonicContact OD1-NZ 3.22Å; D198-K201 PolarHBondContact OD1-NZ 3.07Å; D198-P202 WeakPolarHBondContact O-CD 3.34Å
199	E	54.2	Low	52	Low	142 Å²	142	73.6 Å²	73.6	66%	0.664	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-29	177.7	-55.9	118	165.8	0	0	113.1	M197 P202	M197-E199 PolarHBondContact O-N 3.47Å; M197-E199 VanDerWaalsContact O-N 3.09Å; E199-P202 WeakPolarHBondContact O-CD 3.19Å
200	L	56.2	Low	53.9	Low	13 Å²	13	64.7 Å²	64.7	7%	0.068	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-17.9	-177.7	-60.6	-178.5	0	0	0	112.7	M120 L172 A175 V177 I196 M197 D198 P202 Y203	M120-L200 HydrophobicContact CE-CB 4.39Å; M120-L200 HydrophobicContact CE-CD1 3.98Å; M120-L200 HydrophobicContact CE-CD2 4.37Å; M120-L200 HydrophobicContact CE-CG 4.48Å; M120-L200 HydrophobicContact CG-CD2 3.97Å; M120-L200 HydrophobicContact SD-CD1 4.26Å; L172-L200 HydrophobicContact CD2-CD1 3.86Å; A175-L200 HydrophobicContact CB-CD1 4.4Å; V177-L200 HydrophobicContact CG2-CD1 3.93Å; I196-L200 HydrophobicContact CG2-CB 3.82Å; M197-L200 PolarHBondContact O-N 3.17Å; D198-L200 VanDerWaalsContact C-N 3.3Å; D198-L200 PolarHBondContact O-N 2.8Å; L200-P202 VanDerWaalsContact C-N 3.29Å; L200-Y203 HydrophobicContact CD2-CD2 4.45Å; L200-Y203 HydrophobicContact CD2-CE2 4.5Å; L200-Y203 PolarHBondContact O-N 2.86Å; L200-Y203 VanDerWaalsContact O-N 3.08Å
201	K	59.8	Low	55.7	Low	68 Å²	68	63.5 Å²	63.5	30%	0.296	32%	0.323	S	S	.	.	H	α-helix	trans	-49.6	-42.2	176.6	-76.9	-176.1	-176.3	170.5	0	113.1	I196 M197 D198 Y203 F204 L205	I196-K201 HydrophobicContact CB-CG 4.05Å; I196-K201 HydrophobicContact CG2-CB 4.48Å; I196-K201 HydrophobicContact CG2-CG 3.92Å; I196-K201 WeakPolarHBondContact O-CE 3.29Å; M197-K201 WeakPolarHBondContact O-CG 3.36Å; M197-K201 PolarHBondContact O-N 3Å; D198-K201 WeakPolarHBondContact OD1-CD 3.3Å; D198-K201 WeakPolarHBondContact OD1-CE 3.15Å; D198-K201 IonicContact OD1-NZ 3.22Å; D198-K201 PolarHBondContact OD1-NZ 3.07Å; K201-Y203 PolarHBondContact O-N 3.28Å; K201-Y203 VanDerWaalsContact O-N 3.14Å; K201-F204 PolarHBondContact O-N 2.77Å; K201-L205 HydrophobicContact CB-CD1 3.97Å; K201-L205 HydrophobicContact CB-CG 4.38Å; K201-L205 HydrophobicContact CD-CD1 3.86Å; K201-L205 HydrophobicContact CG-CD1 3.67Å; K201-L205 HydrophobicContact CG-CG 4.45Å; K201-L205 WeakPolarHBondContact O-CA 3.49Å; K201-L205 WeakPolarHBondContact O-CB 3.5Å; K201-L205 PolarHBondContact O-N 3.43Å
202	P	60.6	Low	57.5	Low	43 Å²	43	60 Å²	60	28%	0.279	31%	0.305	S	S	.	.	H	α-helix	trans	-56.6	-31.6	-180	-27.4	36.2	0	0	0	114.1	D198 E199 L200 F204 S206	D198-P202 WeakPolarHBondContact O-CD 3.34Å; E199-P202 WeakPolarHBondContact O-CD 3.19Å; L200-P202 VanDerWaalsContact C-N 3.29Å; P202-F204 VanDerWaalsContact C-N 3.35Å; P202-F204 PolarHBondContact O-N 3.2Å; P202-S206 VanDerWaalsContact O-CB 3.31Å; P202-S206 WeakPolarHBondContact O-CB 3.15Å; P202-S206 PolarHBondContact O-N 3.14Å
203	Y	58.4	Low	59.4	Low	26 Å²	26	58.3 Å²	58.3	10%	0.102	30%	0.297	C	S	.	.	H	α-helix	trans	-68.2	-32.3	178.6	-71.6	-82.7	0	0	0	113	L7 D117 M120 A121 A124 Y128 L200 K201	L7-Y203 HydrophobicContact CD2-CE1 3.44Å; L7-Y203 VanDerWaalsContact CD2-CE1 3.44Å; L7-Y203 VanDerWaalsContact CD2-OH 3.27Å; L7-Y203 WeakPolarHBondContact CD2-OH 3.45Å; D117-Y203 VanDerWaalsContact CG-OH 3.31Å; D117-Y203 PolarHBondContact OD1-OH 3.36Å; M120-Y203 HydrophobicContact CB-CD2 4.45Å; M120-Y203 HydrophobicContact CB-CG 4.49Å; A121-Y203 HydrophobicContact CB-CD1 4.49Å; A121-Y203 HydrophobicContact CB-CE1 4.06Å; A124-Y203 WeakPolarHBondContact CB-O 3.32Å; Y128-Y203 WeakPolarHBondContact CE2-O 3.33Å; Y128-Y203 PolarHBondContact OH-O 3.02Å; L200-Y203 HydrophobicContact CD2-CD2 4.45Å; L200-Y203 HydrophobicContact CD2-CE2 4.5Å; L200-Y203 PolarHBondContact O-N 2.86Å; L200-Y203 VanDerWaalsContact O-N 3.08Å; K201-Y203 PolarHBondContact O-N 3.28Å; K201-Y203 VanDerWaalsContact O-N 3.14Å
204	F	61.4	Low	61.2	Low	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-113.8	-27.6	-173.3	-57.4	-78.4	0	0	0	114.9	M120 K123 A124 Y128 T168 I196 K201 P202 F258	M120-F204 HydrophobicContact CE-CD2 4.37Å; M120-F204 HydrophobicContact CE-CE2 3.1Å; M120-F204 HydrophobicContact CE-CZ 3.3Å; K123-F204 HydrophobicContact CG-CE1 4.35Å; A124-F204 HydrophobicContact CB-CD1 4.39Å; A124-F204 HydrophobicContact CB-CE1 4.21Å; Y128-F204 VanDerWaalsContact OH-CA 3.28Å; Y128-F204 WeakPolarHBondContact OH-CA 3.11Å; Y128-F204 PolarHBondContact OH-O 2.73Å; Y128-F204 VanDerWaalsContact OH-O 3.09Å; T168-F204 HydrophobicContact CG2-CE1 4.28Å; T168-F204 HydrophobicContact CG2-CZ 4.19Å; I196-F204 HydrophobicContact CD1-CB 3.87Å; I196-F204 HydrophobicContact CD1-CD2 3.93Å; I196-F204 HydrophobicContact CD1-CG 4.12Å; I196-F204 HydrophobicContact CG2-CD2 4.21Å; K201-F204 PolarHBondContact O-N 2.77Å; P202-F204 VanDerWaalsContact C-N 3.35Å; P202-F204 PolarHBondContact O-N 3.2Å; F204-F258 HydrophobicContact CB-CD1 4.19Å; F204-F258 HydrophobicContact CB-CE1 4.09Å; F204-F258 HydrophobicContact CB-CE2 4.48Å; F204-F258 HydrophobicContact CB-CG 4.43Å; F204-F258 HydrophobicContact CB-CZ 4.25Å; F204-F258 HydrophobicContact CD1-CD1 4.02Å; F204-F258 HydrophobicContact CD1-CE1 4.37Å; F204-F258 HydrophobicContact CG-CD1 4.47Å; F204-F258 WeakPolarHBondContact O-CZ 3.49Å
205	L	60.5	Low	63.1	Low	56 Å²	56	59.2 Å²	59.2	29%	0.293	29%	0.293	S	S	.	.	H	α-helix	trans	-107.1	-14	-173.8	-56.7	-173.9	0	0	0	113	I196 K201 P207 E255 F258	I196-L205 HydrophobicContact CD1-CD2 4.46Å; I196-L205 HydrophobicContact CD1-CG 4.49Å; K201-L205 HydrophobicContact CB-CD1 3.97Å; K201-L205 HydrophobicContact CB-CG 4.38Å; K201-L205 HydrophobicContact CD-CD1 3.86Å; K201-L205 HydrophobicContact CG-CD1 3.67Å; K201-L205 HydrophobicContact CG-CG 4.45Å; K201-L205 WeakPolarHBondContact O-CA 3.49Å; K201-L205 WeakPolarHBondContact O-CB 3.5Å; K201-L205 PolarHBondContact O-N 3.43Å; L205-P207 VanDerWaalsContact C-CD 3.44Å; L205-P207 WeakPolarHBondContact O-CD 3.44Å; L205-E255 HydrophobicContact CD2-CG 4.32Å; L205-F258 HydrophobicContact CD2-CD2 4.36Å; L205-F258 HydrophobicContact CD2-CE2 3.8Å
206	S	60.7	Low	64.6	Low	59 Å²	59	52.8 Å²	52.8	41%	0.413	27%	0.272	S	S	.	.	S	Bend	trans	-99.2	84.5	167.4	-58.6	0	0	0	0	107.6	P202	P202-S206 VanDerWaalsContact O-CB 3.31Å; P202-S206 WeakPolarHBondContact O-CB 3.15Å; P202-S206 PolarHBondContact O-N 3.14Å
207	P	62.3	Low	66.2	Low	45 Å²	45	52.7 Å²	52.7	29%	0.292	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-57.4	144.3	-177.7	24.2	-34.5	0	0	0	110.1	Y134 L205 G250	Y134-P207 HydrophobicContact CE1-CB 3.89Å; Y134-P207 WeakPolarHBondContact OH-CB 3.36Å; L205-P207 VanDerWaalsContact C-CD 3.44Å; L205-P207 WeakPolarHBondContact O-CD 3.44Å; P207-G250 WeakPolarHBondContact CG-O 3.05Å
208	P	63.2	Low	67.6	Low	11 Å²	11	53.6 Å²	53.6	7%	0.071	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-61.5	154.9	175.5	15.4	-22.3	0	0	0	112.5	Y128 Y134 S137 L139 C210	Y128-P208 HydrophobicContact CD1-CG 4.14Å; Y128-P208 HydrophobicContact CD2-CG 3.9Å; Y128-P208 HydrophobicContact CE1-CG 4.4Å; Y128-P208 HydrophobicContact CE2-CG 4.19Å; Y128-P208 HydrophobicContact CG-CG 3.88Å; Y128-P208 VanDerWaalsContact CZ-CD 3.48Å; Y134-P208 HydrophobicContact CD1-CB 4.28Å; Y134-P208 HydrophobicContact CD1-CG 3.65Å; Y134-P208 VanDerWaalsContact CD1-O 3.23Å; Y134-P208 WeakPolarHBondContact CD1-O 3.48Å; Y134-P208 HydrophobicContact CD2-CG 4.13Å; Y134-P208 HydrophobicContact CE1-CG 4.14Å; Y134-P208 WeakPolarHBondContact CE1-O 3.3Å; Y134-P208 HydrophobicContact CG-CG 3.65Å; S137-P208 WeakPolarHBondContact OG-CB 3.08Å; L139-P208 HydrophobicContact CB-CB 4.39Å; L139-P208 HydrophobicContact CD1-CB 3.75Å; L139-P208 HydrophobicContact CD1-CG 3.88Å; L139-P208 HydrophobicContact CG-CB 4.14Å; P208-C210 PolarHBondContact O-N 3.46Å
209	E	67.6	Low	68.8	Low	111 Å²	111	49.5 Å²	49.5	52%	0.519	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-61.1	128.2	174.9	-57.7	-179	146.6	0	0	111	I211	E209-I211 HydrophobicContact CB-CD1 3.83Å; E209-I211 HydrophobicContact CB-CG1 3.82Å; E209-I211 HydrophobicContact CG-CD1 4.43Å; E209-I211 PolarHBondContact O-N 2.91Å; E209-I211 WeakPolarHBondContact OE2-CD1 3.42Å
210	C	70.2	Confident	70	Confident	12 Å²	12	49.6 Å²	49.6	8%	0.081	25%	0.249	C	C	.	.			trans	-78.2	22.4	-178.5	71.5	0	0	0	0	114	L133 Y134 P208 A212 S213 C214 M344	L133-C210 HydrophobicContact CB-CB 4.08Å; L133-C210 VanDerWaalsContact O-CA 3.31Å; L133-C210 WeakPolarHBondContact O-CA 3.1Å; L133-C210 WeakPolarHBondContact O-CB 3.19Å; Y134-C210 HydrophobicContact CD1-CB 4.49Å; P208-C210 PolarHBondContact O-N 3.46Å; C210-A212 PolarHBondContact O-N 2.83Å; C210-S213 PolarHBondContact O-N 2.76Å; C210-C214 HydrophobicContact CB-CB 4.25Å; C210-C214 WeakPolarHBondContact CB-SG 3.42Å; C210-C214 WeakPolarHBondContact O-CB 3.5Å; C210-C214 PolarHBondContact O-N 3.2Å; C210-C214 PolarHBondContact O-SG 3.39Å; C210-C214 VanDerWaalsContact O-SG 3.34Å; C210-C214 WeakPolarHBondContact SG-CB 3.49Å; C210-C214 CovalentContact SG-SG 2.07Å; C210-C214 PolarHBondContact SG-SG 2.86Å; C210-M344 PolarHBondContact SG-O 3.31Å
211	I	68.5	Low	71.2	Confident	55 Å²	55	53.5 Å²	53.5	28%	0.282	27%	0.267	S	S	.	.	H	α-helix	trans	-53.5	-49.4	-158	-75.1	169.8	0	0	0	113.1	E209 R215	E209-I211 HydrophobicContact CB-CD1 3.83Å; E209-I211 HydrophobicContact CB-CG1 3.82Å; E209-I211 HydrophobicContact CG-CD1 4.43Å; E209-I211 PolarHBondContact O-N 2.91Å; E209-I211 WeakPolarHBondContact OE2-CD1 3.42Å; I211-R215 HydrophobicContact CG2-CG 4.25Å; I211-R215 VanDerWaalsContact CG2-NE 3.26Å; I211-R215 WeakPolarHBondContact O-CB 3.42Å; I211-R215 WeakPolarHBondContact O-CG 3.08Å; I211-R215 PolarHBondContact O-N 3.14Å
212	A	72.1	Confident	72.4	Confident	50 Å²	50	50.6 Å²	50.6	41%	0.413	26%	0.255	S	S	.	.	H	α-helix	trans	-65.7	-53.5	-172.6	0	0	0	0	0	112	C210 R215 L216	C210-A212 PolarHBondContact O-N 2.83Å; A212-R215 PolarHBondContact O-N 3.36Å; A212-L216 PolarHBondContact O-N 2.79Å
213	S	76	Confident	73.6	Confident	7 Å²	7	49.5 Å²	49.5	5%	0.049	25%	0.248	C	C	.	.	H	α-helix	trans	-65.7	-42.5	179.7	-55.8	0	0	0	0	111.2	A132 C210 R215 L216 L217 N273	A132-S213 PolarHBondContact O-OG 3.22Å; C210-S213 PolarHBondContact O-N 2.76Å; S213-R215 PolarHBondContact O-N 2.75Å; S213-L216 PolarHBondContact O-N 3.02Å; S213-L217 VanDerWaalsContact O-CG 3.28Å; S213-L217 WeakPolarHBondContact O-CG 3.19Å; S213-L217 PolarHBondContact O-N 3.34Å; S213-N273 PolarHBondContact OG-ND2 2.77Å
214	C	79	Confident	74.8	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.014	25%	0.254	C	S	.	.	H	α-helix	trans	-63.8	-37.8	176.5	-71	0	0	0	0	112	C210 R218 V341	C210-C214 HydrophobicContact CB-CB 4.25Å; C210-C214 WeakPolarHBondContact CB-SG 3.42Å; C210-C214 WeakPolarHBondContact O-CB 3.5Å; C210-C214 PolarHBondContact O-N 3.2Å; C210-C214 PolarHBondContact O-SG 3.39Å; C210-C214 VanDerWaalsContact O-SG 3.34Å; C210-C214 WeakPolarHBondContact SG-CB 3.49Å; C210-C214 CovalentContact SG-SG 2.07Å; C210-C214 PolarHBondContact SG-SG 2.86Å; C214-R218 WeakPolarHBondContact O-CB 3.32Å; C214-R218 WeakPolarHBondContact O-CD 3.23Å; C214-R218 WeakPolarHBondContact O-CG 3.17Å; C214-R218 PolarHBondContact O-N 2.81Å; C214-R218 VanDerWaalsContact O-N 3.12Å; C214-V341 HydrophobicContact CB-CG1 4.15Å; C214-V341 WeakPolarHBondContact O-CG1 3.12Å
215	R	81.3	Confident	76.1	Confident	180 Å²	180	51.2 Å²	51.2	68%	0.679	26%	0.256	S	S	*	.	H	α-helix	trans	-65.7	-44	173	-79.6	176.5	-176.6	163.7	8.2	112.1	I211 A212 S213 L217 R218 S219	I211-R215 HydrophobicContact CG2-CG 4.25Å; I211-R215 VanDerWaalsContact CG2-NE 3.26Å; I211-R215 WeakPolarHBondContact O-CB 3.42Å; I211-R215 WeakPolarHBondContact O-CG 3.08Å; I211-R215 PolarHBondContact O-N 3.14Å; A212-R215 PolarHBondContact O-N 3.36Å; S213-R215 PolarHBondContact O-N 2.75Å; R215-L217 PolarHBondContact O-N 3.09Å; R215-R218 PolarHBondContact O-N 3.42Å; R215-S219 PolarHBondContact O-N 3.26Å
216	L	81.1	Confident	77.4	Confident	36 Å²	36	48.5 Å²	48.5	19%	0.188	24%	0.242	C	C	.	.	H	α-helix	trans	-60.8	-45.5	178.7	-177.4	64	0	0	0	111.2	A212 S213 R218 S219 T222 L276	A212-L216 PolarHBondContact O-N 2.79Å; S213-L216 PolarHBondContact O-N 3.02Å; L216-R218 VanDerWaalsContact C-N 3.29Å; L216-R218 PolarHBondContact O-N 3.24Å; L216-S219 PolarHBondContact O-N 3.29Å; L216-S219 PolarHBondContact O-OG 3.05Å; L216-T222 WeakPolarHBondContact O-CB 3.24Å; L216-T222 WeakPolarHBondContact O-CG2 3.47Å; L216-T222 PolarHBondContact O-OG1 3.38Å; L216-L276 HydrophobicContact CD1-CB 4.44Å; L216-L276 HydrophobicContact CD2-CB 3.65Å; L216-L276 HydrophobicContact CD2-CD1 4.24Å; L216-L276 HydrophobicContact CG-CB 4.13Å; L216-L276 HydrophobicContact CG-CD1 4.25Å
217	L	84.6	Confident	78.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-68.3	-25.7	178.6	-65.9	170.6	0	0	0	113	L133 S213 R215 M226 L269 I272 L276 V341	L133-L217 HydrophobicContact CD2-CD1 4.15Å; S213-L217 VanDerWaalsContact O-CG 3.28Å; S213-L217 WeakPolarHBondContact O-CG 3.19Å; S213-L217 PolarHBondContact O-N 3.34Å; R215-L217 PolarHBondContact O-N 3.09Å; L217-M226 HydrophobicContact CD2-CE 3.25Å; L217-L269 HydrophobicContact CD1-CD1 4.27Å; L217-I272 HydrophobicContact CD2-CG2 4.4Å; L217-L276 HydrophobicContact CD2-CD1 3.86Å; L217-V341 HydrophobicContact CB-CG1 3.99Å; L217-V341 HydrophobicContact CB-CG2 3.96Å; L217-V341 HydrophobicContact CD1-CG2 3.91Å
218	R	83.6	Confident	79.9	Confident	90 Å²	90	46.4 Å²	46.4	34%	0.34	22%	0.22	S	C	.	.	H	α-helix	trans	-81.5	-10.9	177.5	-76.4	172.2	-175.4	-170.2	0.6	114.4	C214 R215 L216 M338 V341 S342	C214-R218 WeakPolarHBondContact O-CB 3.32Å; C214-R218 WeakPolarHBondContact O-CD 3.23Å; C214-R218 WeakPolarHBondContact O-CG 3.17Å; C214-R218 PolarHBondContact O-N 2.81Å; C214-R218 VanDerWaalsContact O-N 3.12Å; R215-R218 PolarHBondContact O-N 3.42Å; L216-R218 VanDerWaalsContact C-N 3.29Å; L216-R218 PolarHBondContact O-N 3.24Å; R218-M338 WeakPolarHBondContact O-CE 3.26Å; R218-V341 HydrophobicContact CG-CB 4.5Å; R218-V341 HydrophobicContact CG-CG1 3.69Å; R218-V341 PolarHBondContact NE-O 3.28Å; R218-V341 PolarHBondContact NH2-O 2.9Å; R218-S342 PolarHBondContact NH2-O 3.28Å; R218-S342 VanDerWaalsContact NH2-O 3.14Å
219	S	82.6	Confident	81.1	Confident	33 Å²	33	45.9 Å²	45.9	23%	0.231	22%	0.217	C	C	.	.	S	Bend	trans	-69.7	144.6	-178.2	81.9	0	0	0	0	110.8	R215 L216 E221 T222 S223	R215-S219 PolarHBondContact O-N 3.26Å; L216-S219 PolarHBondContact O-N 3.29Å; L216-S219 PolarHBondContact O-OG 3.05Å; S219-E221 PolarHBondContact O-N 2.68Å; S219-T222 PolarHBondContact O-N 2.73Å; S219-T222 WeakPolarHBondContact OG-CB 3.45Å; S219-T222 PolarHBondContact OG-N 3.27Å; S219-T222 PolarHBondContact OG-OG1 3.28Å; S219-S223 PolarHBondContact O-N 2.98Å; S219-S223 VanDerWaalsContact O-N 3.12Å
220	K	80.8	Confident	82	Confident	144 Å²	144	43.2 Å²	43.2	63%	0.626	21%	0.209	S	C	*	.	H	α-helix	trans	-63.6	-37.7	177.2	-72.2	-176.5	178.4	179.8	0	110.3	T222 S223 Y224	K220-T222 VanDerWaalsContact C-N 3.32Å; K220-T222 PolarHBondContact O-N 2.99Å; K220-S223 PolarHBondContact O-N 2.78Å; K220-S223 PolarHBondContact O-OG 3.49Å; K220-Y224 HydrophobicContact CB-CE2 4.35Å; K220-Y224 WeakPolarHBondContact O-CD2 3.44Å; K220-Y224 PolarHBondContact O-N 3.26Å
221	E	81.1	Confident	82.8	Confident	96 Å²	96	45.1 Å²	45.1	45%	0.449	22%	0.218	S	C	.	.	H	α-helix	trans	-59.4	-44.1	177.1	-64.6	70.2	-152.4	0	0	111.2	S219 Y224 L225	S219-E221 PolarHBondContact O-N 2.68Å; E221-Y224 PolarHBondContact O-N 3.15Å; E221-L225 WeakPolarHBondContact O-CB 3.3Å; E221-L225 WeakPolarHBondContact O-CG 3.29Å; E221-L225 PolarHBondContact O-N 3.45Å
222	T	84.4	Confident	83.6	Confident	6 Å²	6	49 Å²	49	4%	0.037	23%	0.233	C	C	.	.	H	α-helix	trans	-64.2	-44	176.7	-68.6	0	0	0	0	111.5	L216 S219 K220 Y224 L225 M226 L276	L216-T222 WeakPolarHBondContact O-CB 3.24Å; L216-T222 WeakPolarHBondContact O-CG2 3.47Å; L216-T222 PolarHBondContact O-OG1 3.38Å; S219-T222 PolarHBondContact O-N 2.73Å; S219-T222 WeakPolarHBondContact OG-CB 3.45Å; S219-T222 PolarHBondContact OG-N 3.27Å; S219-T222 PolarHBondContact OG-OG1 3.28Å; K220-T222 VanDerWaalsContact C-N 3.32Å; K220-T222 PolarHBondContact O-N 2.99Å; T222-Y224 VanDerWaalsContact C-N 3.3Å; T222-Y224 PolarHBondContact O-N 2.79Å; T222-L225 WeakPolarHBondContact O-CB 3.17Å; T222-L225 PolarHBondContact O-N 2.93Å; T222-L225 VanDerWaalsContact O-N 3.15Å; T222-M226 HydrophobicContact CG2-CE 3.47Å; T222-M226 VanDerWaalsContact CG2-CE 3.47Å; T222-M226 HydrophobicContact CG2-CG 4.37Å; T222-M226 HydrophobicContact CG2-SD 4.29Å; T222-M226 WeakPolarHBondContact O-CG 3.19Å; T222-M226 PolarHBondContact O-N 3.37Å; T222-L276 HydrophobicContact CG2-CD1 3.54Å; T222-L276 HydrophobicContact CG2-CD2 3.73Å; T222-L276 HydrophobicContact CG2-CG 4.28Å
223	S	86.2	Confident	84.3	Confident	20 Å²	20	52.3 Å²	52.3	14%	0.14	24%	0.24	C	C	.	.	H	α-helix	trans	-64.1	-37.1	179.3	75.2	0	0	0	0	112	S219 K220	S219-S223 PolarHBondContact O-N 2.98Å; S219-S223 VanDerWaalsContact O-N 3.12Å; K220-S223 PolarHBondContact O-N 2.78Å; K220-S223 PolarHBondContact O-OG 3.49Å
224	Y	84.4	Confident	84.9	Confident	54 Å²	54	52.1 Å²	52.1	21%	0.212	24%	0.239	C	C	.	.	H	α-helix	trans	-65.2	-46.1	170.5	-70.5	-66.1	0	0	0	111.7	K220 E221 T222 M226 K227 Y228 Q319 L322 L323	K220-Y224 HydrophobicContact CB-CE2 4.35Å; K220-Y224 WeakPolarHBondContact O-CD2 3.44Å; K220-Y224 PolarHBondContact O-N 3.26Å; E221-Y224 PolarHBondContact O-N 3.15Å; T222-Y224 VanDerWaalsContact C-N 3.3Å; T222-Y224 PolarHBondContact O-N 2.79Å; Y224-M226 VanDerWaalsContact C-N 3.29Å; Y224-M226 PolarHBondContact O-N 3.49Å; Y224-K227 WeakPolarHBondContact O-CB 3.03Å; Y224-K227 PolarHBondContact O-N 3.31Å; Y224-Y228 WeakPolarHBondContact O-CD2 3.22Å; Y224-Y228 WeakPolarHBondContact O-CE2 3.13Å; Y224-Q319 HydrophobicContact CD2-CG 4.37Å; Y224-Q319 HydrophobicContact CE2-CG 4.11Å; Y224-L322 VanDerWaalsContact CB-CD1 3.46Å; Y224-L322 HydrophobicContact CG-CD1 4.39Å; Y224-L323 HydrophobicContact CE1-CD2 4.41Å
225	L	87	Confident	85.5	Confident	8 Å²	8	52 Å²	52	4%	0.042	24%	0.238	C	C	.	.	H	α-helix	trans	-57.6	-40.5	178.1	-80.1	171.1	0	0	0	112.7	E221 T222 K227 Y228 L276 F279 F305 F309 L322	E221-L225 WeakPolarHBondContact O-CB 3.3Å; E221-L225 WeakPolarHBondContact O-CG 3.29Å; E221-L225 PolarHBondContact O-N 3.45Å; T222-L225 WeakPolarHBondContact O-CB 3.17Å; T222-L225 PolarHBondContact O-N 2.93Å; T222-L225 VanDerWaalsContact O-N 3.15Å; L225-K227 PolarHBondContact O-N 2.76Å; L225-Y228 PolarHBondContact O-N 3.12Å; L225-Y228 VanDerWaalsContact O-N 3.09Å; L225-L276 HydrophobicContact CD1-CD2 4.48Å; L225-F279 HydrophobicContact CD1-CB 4.31Å; L225-F279 HydrophobicContact CD1-CD2 4.22Å; L225-F279 HydrophobicContact CD1-CG 4.12Å; L225-F279 HydrophobicContact CD2-CD1 4.48Å; L225-F279 HydrophobicContact CD2-CE1 4.22Å; L225-F279 HydrophobicContact CD2-CE2 4.39Å; L225-F279 HydrophobicContact CD2-CZ 4.18Å; L225-F305 HydrophobicContact CD2-CZ 4.2Å; L225-F309 HydrophobicContact CD1-CE2 4.36Å; L225-F309 HydrophobicContact CD1-CZ 4.29Å; L225-F309 HydrophobicContact CD2-CD2 4Å; L225-F309 HydrophobicContact CD2-CE2 3.55Å; L225-F309 HydrophobicContact CD2-CZ 4.13Å; L225-F309 HydrophobicContact CG-CE2 4.19Å; L225-L322 HydrophobicContact CD2-CD2 4.43Å
226	M	89.8	Confident	85.8	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.5	-24	177.7	-70.4	176	179.3	0	0	113.6	L217 T222 Y224 Y228 W229 I235 I272 L276 V329 I334 I337	L217-M226 HydrophobicContact CD2-CE 3.25Å; T222-M226 HydrophobicContact CG2-CE 3.47Å; T222-M226 VanDerWaalsContact CG2-CE 3.47Å; T222-M226 HydrophobicContact CG2-CG 4.37Å; T222-M226 HydrophobicContact CG2-SD 4.29Å; T222-M226 WeakPolarHBondContact O-CG 3.19Å; T222-M226 PolarHBondContact O-N 3.37Å; Y224-M226 VanDerWaalsContact C-N 3.29Å; Y224-M226 PolarHBondContact O-N 3.49Å; M226-Y228 PolarHBondContact O-N 3.23Å; M226-W229 WeakPolarHBondContact O-CB 3.41Å; M226-W229 PolarHBondContact O-N 2.97Å; M226-I235 HydrophobicContact CB-CD1 4.1Å; M226-I235 HydrophobicContact CG-CD1 4.04Å; M226-I272 HydrophobicContact CE-CG2 4.41Å; M226-L276 HydrophobicContact CE-CD1 4.07Å; M226-V329 WeakPolarHBondContact O-CG2 3.31Å; M226-I334 HydrophobicContact CB-CD1 3.54Å; M226-I334 HydrophobicContact CB-CG1 4.36Å; M226-I334 HydrophobicContact CB-CG2 4.48Å; M226-I334 HydrophobicContact SD-CD1 4.48Å; M226-I337 HydrophobicContact CE-CG2 4.45Å; M226-I337 HydrophobicContact SD-CG2 4.32Å
227	K	88.7	Confident	86.2	Confident	41 Å²	41	48.8 Å²	48.8	18%	0.178	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-23.2	175.6	-64.2	-178.4	-176.9	-153.8	0	112.9	Y224 L225 P327 T328 V329 N331 I334	Y224-K227 WeakPolarHBondContact O-CB 3.03Å; Y224-K227 PolarHBondContact O-N 3.31Å; L225-K227 PolarHBondContact O-N 2.76Å; K227-P327 HydrophobicContact CB-CB 4.4Å; K227-P327 CarbonylContact O-C 3.53Å; K227-P327 WeakPolarHBondContact O-CA 3.46Å; K227-T328 PolarHBondContact O-N 3.45Å; K227-T328 PolarHBondContact O-OG1 3.2Å; K227-V329 PolarHBondContact O-N 3.1Å; K227-V329 VanDerWaalsContact O-N 3.14Å; K227-N331 WeakPolarHBondContact CD-OD1 3.39Å; K227-N331 WeakPolarHBondContact CE-OD1 3.36Å; K227-N331 PolarHBondContact NZ-OD1 2.9Å; K227-I334 HydrophobicContact CG-CG1 4.14Å
228	Y	85.5	Confident	86.4	Confident	19 Å²	19	48.8 Å²	48.8	8%	0.075	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.7	25.9	-176.2	-48.2	-73.2	0	0	0	111.2	Y224 L225 M226 F305 L322 Q325 T326 P327 T328	Y224-Y228 WeakPolarHBondContact O-CD2 3.22Å; Y224-Y228 WeakPolarHBondContact O-CE2 3.13Å; L225-Y228 PolarHBondContact O-N 3.12Å; L225-Y228 VanDerWaalsContact O-N 3.09Å; M226-Y228 PolarHBondContact O-N 3.23Å; Y228-F305 HydrophobicContact CD2-CE2 4.38Å; Y228-F305 HydrophobicContact CG-CE2 4.04Å; Y228-L322 HydrophobicContact CD2-CB 4.48Å; Y228-L322 HydrophobicContact CD2-CD2 3.79Å; Y228-L322 HydrophobicContact CE2-CB 3.77Å; Y228-L322 HydrophobicContact CE2-CD2 3.96Å; Y228-L322 HydrophobicContact CE2-CG 4.36Å; Y228-L322 PolarHBondContact OH-O 2.97Å; Y228-Q325 HydrophobicContact CD1-CB 3.53Å; Y228-Q325 HydrophobicContact CE1-CB 3.37Å; Y228-Q325 WeakPolarHBondContact CE1-O 3.17Å; Y228-Q325 HydrophobicContact CG-CB 4.31Å; Y228-T326 WeakPolarHBondContact CD1-O 3.36Å; Y228-P327 HydrophobicContact CE1-CB 4.33Å; Y228-P327 HydrophobicContact CE1-CG 4.1Å; Y228-T328 VanDerWaalsContact C-OG1 3.25Å; Y228-T328 WeakPolarHBondContact CA-OG1 3.29Å
229	W	88.8	Confident	86.7	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.223	C	C	.	.			trans	-69.5	134.7	-177.5	-146.3	-105.3	0	0	0	110.9	M226 D231 E234 I235 I272 K275 L276 F301 T328 V329	M226-W229 WeakPolarHBondContact O-CB 3.41Å; M226-W229 PolarHBondContact O-N 2.97Å; W229-D231 VanDerWaalsContact C-N 3.32Å; W229-D231 PolarHBondContact O-N 2.91Å; W229-E234 PolarHBondContact NE1-OE2 2.96Å; W229-I235 HydrophobicContact CB-CD1 3.94Å; W229-I235 HydrophobicContact CB-CG1 3.68Å; W229-I235 HydrophobicContact CD2-CD1 3.88Å; W229-I235 HydrophobicContact CD2-CG1 4.44Å; W229-I235 HydrophobicContact CE3-CD1 4.49Å; W229-I235 HydrophobicContact CG-CD1 3.62Å; W229-I235 HydrophobicContact CG-CG1 3.66Å; W229-I272 HydrophobicContact CH2-CG2 4.35Å; W229-I272 HydrophobicContact CZ2-CB 4.28Å; W229-I272 HydrophobicContact CZ2-CD1 4.41Å; W229-I272 HydrophobicContact CZ2-CG1 4Å; W229-I272 HydrophobicContact CZ2-CG2 4.21Å; W229-K275 HydrophobicContact CH2-CB 3.55Å; W229-K275 HydrophobicContact CH2-CD 4.3Å; W229-K275 HydrophobicContact CZ2-CB 3.52Å; W229-K275 HydrophobicContact CZ2-CD 3.42Å; W229-K275 VanDerWaalsContact CZ2-CD 3.42Å; W229-K275 HydrophobicContact CZ2-CG 4.08Å; W229-L276 HydrophobicContact CH2-CD2 3.78Å; W229-L276 HydrophobicContact CH2-CG 3.85Å; W229-L276 HydrophobicContact CZ3-CD2 3.7Å; W229-L276 HydrophobicContact CZ3-CG 4.29Å; W229-F301 HydrophobicContact CD2-CZ 4.16Å; W229-F301 HydrophobicContact CE3-CE1 4.34Å; W229-F301 AromaticContact CE3-CZ 3.9Å; W229-F301 HydrophobicContact CE3-CZ 3.9Å; W229-F301 HydrophobicContact CH2-CZ 4.25Å; W229-F301 HydrophobicContact CZ2-CZ 4.49Å; W229-F301 AromaticContact CZ3-CZ 3.94Å; W229-F301 HydrophobicContact CZ3-CZ 3.94Å; W229-T328 PolarHBondContact N-OG1 3.01Å; W229-T328 VanDerWaalsContact N-OG1 3.14Å; W229-T328 WeakPolarHBondContact O-CB 3.3Å; W229-T328 PolarHBondContact O-OG1 3.37Å; W229-V329 HydrophobicContact CB-CG2 3.93Å
230	P	85.8	Confident	87	Confident	54 Å²	54	49.9 Å²	49.9	35%	0.351	24%	0.241	S	C	.	.	S	Bend	trans	-67.6	-33.1	-175	24.6	-33.5	0	0	0	112.7	G300 F301	P230-G300 WeakPolarHBondContact CB-O 3.22Å; P230-F301 HydrophobicContact CG-CD1 4.45Å; P230-F301 HydrophobicContact CG-CD2 4.43Å; P230-F301 HydrophobicContact CG-CE1 4.29Å; P230-F301 HydrophobicContact CG-CE2 4.26Å; P230-F301 HydrophobicContact CG-CZ 4.18Å
231	D	87.2	Confident	87.2	Confident	53 Å²	53	44.6 Å²	44.6	28%	0.283	22%	0.219	S	C	.	.			trans	-107.5	99	176.9	-179	-3.6	0	0	0	110.5	W229 E233 E234 K268	W229-D231 VanDerWaalsContact C-N 3.32Å; W229-D231 PolarHBondContact O-N 2.91Å; D231-E233 PolarHBondContact O-N 2.87Å; D231-E233 WeakPolarHBondContact OD1-CB 3.14Å; D231-E233 PolarHBondContact OD1-N 3.47Å; D231-E234 HydrophobicContact CB-CB 3.9Å; D231-E234 WeakPolarHBondContact O-CB 3.23Å; D231-E234 PolarHBondContact O-N 2.66Å; D231-E234 PolarHBondContact OD1-N 2.77Å; D231-E234 VanDerWaalsContact OD1-N 3.09Å; D231-E234 WeakPolarHBondContact OD2-CB 3.05Å; D231-K268 IonicContact OD2-NZ 2.85Å
232	K	85.2	Confident	87.5	Confident	135 Å²	135	40 Å²	40	59%	0.587	20%	0.197	S	C	*	.	H	α-helix	trans	-64.2	-27.7	179	69.1	179.8	-177.8	179.8	0	113.5	S236 V329	K232-S236 PolarHBondContact O-N 3.02Å; K232-S236 PolarHBondContact O-OG 3.34Å; K232-V329 HydrophobicContact CB-CG2 4.27Å
233	E	87.5	Confident	87.6	Confident	120 Å²	120	44.1 Å²	44.1	56%	0.561	21%	0.212	S	C	*	.	H	α-helix	trans	-75.8	-35.2	-179.8	-64.5	-175.4	177.7	0	0	110.4	D231 I235 S236 H237	D231-E233 PolarHBondContact O-N 2.87Å; D231-E233 WeakPolarHBondContact OD1-CB 3.14Å; D231-E233 PolarHBondContact OD1-N 3.47Å; E233-I235 VanDerWaalsContact C-N 3.28Å; E233-I235 PolarHBondContact O-N 3.41Å; E233-S236 PolarHBondContact O-N 3.24Å; E233-H237 PolarHBondContact O-N 2.81Å; E233-H237 PolarHBondContact O-ND1 3.29Å
234	E	89.3	Confident	87.4	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.019	22%	0.217	C	C	.	.	H	α-helix	trans	-56.2	-42	173.3	176.6	169.5	-112.7	0	0	112.2	W229 D231 H237 V238 K268 S271 I272 K275	W229-E234 PolarHBondContact NE1-OE2 2.96Å; D231-E234 HydrophobicContact CB-CB 3.9Å; D231-E234 WeakPolarHBondContact O-CB 3.23Å; D231-E234 PolarHBondContact O-N 2.66Å; D231-E234 PolarHBondContact OD1-N 2.77Å; D231-E234 VanDerWaalsContact OD1-N 3.09Å; D231-E234 WeakPolarHBondContact OD2-CB 3.05Å; E234-H237 PolarHBondContact O-N 3.42Å; E234-V238 PolarHBondContact O-N 3.17Å; E234-K268 HydrophobicContact CB-CD 4.41Å; E234-K268 HydrophobicContact CG-CD 4.09Å; E234-S271 WeakPolarHBondContact OE1-CB 3.35Å; E234-S271 PolarHBondContact OE1-OG 2.99Å; E234-I272 HydrophobicContact CG-CD1 4.08Å; E234-I272 HydrophobicContact CG-CG1 3.83Å; E234-K275 IonicContact OE1-NZ 2.72Å; E234-K275 PolarHBondContact OE1-NZ 3.24Å; E234-K275 IonicContact OE2-NZ 3.44Å; E234-K275 PolarHBondContact OE2-NZ 3.06Å
235	I	90.2	Very high	87.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-68	-41.3	178.9	-61.5	-77.7	0	0	0	111.5	M226 W229 E233 H237 V238 L239 I272 V329 V333 I334 I337	M226-I235 HydrophobicContact CB-CD1 4.1Å; M226-I235 HydrophobicContact CG-CD1 4.04Å; W229-I235 HydrophobicContact CB-CD1 3.94Å; W229-I235 HydrophobicContact CB-CG1 3.68Å; W229-I235 HydrophobicContact CD2-CD1 3.88Å; W229-I235 HydrophobicContact CD2-CG1 4.44Å; W229-I235 HydrophobicContact CE3-CD1 4.49Å; W229-I235 HydrophobicContact CG-CD1 3.62Å; W229-I235 HydrophobicContact CG-CG1 3.66Å; E233-I235 VanDerWaalsContact C-N 3.28Å; E233-I235 PolarHBondContact O-N 3.41Å; I235-H237 VanDerWaalsContact C-N 3.32Å; I235-H237 PolarHBondContact O-N 2.74Å; I235-V238 PolarHBondContact O-N 2.55Å; I235-L239 PolarHBondContact O-N 3.14Å; I235-L239 VanDerWaalsContact O-N 3.11Å; I235-I272 HydrophobicContact CD1-CD1 3.39Å; I235-I272 HydrophobicContact CG1-CD1 4.3Å; I235-V329 HydrophobicContact CB-CG1 4.18Å; I235-V329 HydrophobicContact CG1-CG2 4.16Å; I235-V329 HydrophobicContact CG2-CG1 3.84Å; I235-V333 HydrophobicContact CG2-CG1 3.89Å; I235-I334 HydrophobicContact CG2-CD1 3.66Å; I235-I337 HydrophobicContact CG2-CD1 3.58Å
236	S	88.7	Confident	86.8	Confident	58 Å²	58	46.3 Å²	46.3	41%	0.406	22%	0.222	S	C	.	.	H	α-helix	trans	-62	-40.7	175.1	-59	0	0	0	0	111.9	K232 E233 V238 L239 H240	K232-S236 PolarHBondContact O-N 3.02Å; K232-S236 PolarHBondContact O-OG 3.34Å; E233-S236 PolarHBondContact O-N 3.24Å; S236-V238 VanDerWaalsContact C-N 3.34Å; S236-L239 PolarHBondContact O-N 2.75Å; S236-H240 PolarHBondContact O-N 3.43Å
237	H	89.4	Confident	86.3	Confident	89 Å²	89	52.5 Å²	52.5	41%	0.412	25%	0.251	S	S	.	.	H	α-helix	trans	-65.1	-37	174.9	-70.3	123.2	0	0	0	112.4	E233 E234 I235 L239 H240 E241 K268	E233-H237 PolarHBondContact O-N 2.81Å; E233-H237 PolarHBondContact O-ND1 3.29Å; E234-H237 PolarHBondContact O-N 3.42Å; I235-H237 VanDerWaalsContact C-N 3.32Å; I235-H237 PolarHBondContact O-N 2.74Å; H237-L239 PolarHBondContact O-N 3.23Å; H237-H240 WeakPolarHBondContact O-CB 3.13Å; H237-H240 PolarHBondContact O-N 2.69Å; H237-H240 VanDerWaalsContact O-N 3.16Å; H237-E241 WeakPolarHBondContact O-CG 2.99Å; H237-E241 PolarHBondContact O-N 3.48Å; H237-K268 HydrophobicContact CB-CB 4.12Å; H237-K268 HydrophobicContact CB-CG 3.92Å
238	V	88.9	Confident	85.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.3	-41	175.3	159.6	0	0	0	0	112	E234 I235 S236 H240 E241 L242 K268 L269 I272 I337	E234-V238 PolarHBondContact O-N 3.17Å; I235-V238 PolarHBondContact O-N 2.55Å; S236-V238 VanDerWaalsContact C-N 3.34Å; V238-H240 VanDerWaalsContact C-N 3.28Å; V238-H240 PolarHBondContact O-N 3.27Å; V238-E241 PolarHBondContact O-N 2.96Å; V238-L242 HydrophobicContact CG1-CD1 3.87Å; V238-L242 HydrophobicContact CG1-CG 4.27Å; V238-L242 WeakPolarHBondContact O-CB 3.43Å; V238-L242 VanDerWaalsContact O-CG 3.26Å; V238-L242 WeakPolarHBondContact O-CG 3.47Å; V238-L242 PolarHBondContact O-N 3.22Å; V238-K268 HydrophobicContact CG2-CB 4.16Å; V238-L269 HydrophobicContact CG1-CD1 3.73Å; V238-L269 HydrophobicContact CG2-CB 4.22Å; V238-L269 HydrophobicContact CG2-CD1 4.18Å; V238-I272 HydrophobicContact CB-CD1 3.86Å; V238-I272 HydrophobicContact CG1-CD1 4.22Å; V238-I272 HydrophobicContact CG2-CB 4.28Å; V238-I272 HydrophobicContact CG2-CD1 3.35Å; V238-I272 HydrophobicContact CG2-CG1 3.7Å; V238-I337 HydrophobicContact CG1-CD1 4.29Å
239	L	90.1	Very high	84.8	Confident	16 Å²	16	57.2 Å²	57.2	8%	0.084	29%	0.288	C	S	.	.	H	α-helix	trans	-58	-42.8	172.5	178.1	57.7	0	0	0	111.7	I235 S236 H237 L242 R243 V333 E336 I337 E340	I235-L239 PolarHBondContact O-N 3.14Å; I235-L239 VanDerWaalsContact O-N 3.11Å; S236-L239 PolarHBondContact O-N 2.75Å; H237-L239 PolarHBondContact O-N 3.23Å; L239-L242 PolarHBondContact O-N 3.2Å; L239-R243 HydrophobicContact CD1-CG 4.29Å; L239-R243 WeakPolarHBondContact O-CG 2.73Å; L239-R243 PolarHBondContact O-N 3.26Å; L239-V333 HydrophobicContact CB-CG1 4.46Å; L239-V333 HydrophobicContact CD2-CG1 4.12Å; L239-E336 HydrophobicContact CD1-CB 3.93Å; L239-E336 HydrophobicContact CD2-CB 3.91Å; L239-I337 HydrophobicContact CB-CD1 4.32Å; L239-I337 HydrophobicContact CB-CG1 3.84Å; L239-I337 HydrophobicContact CD1-CG1 4Å; L239-I337 HydrophobicContact CG-CG1 4.43Å; L239-E340 HydrophobicContact CD1-CG 3.96Å
240	H	87.9	Confident	83.8	Confident	130 Å²	130	58 Å²	58	60%	0.602	30%	0.295	S	S	*	.	H	α-helix	trans	-64.7	-43.9	176.5	-178.5	-81.5	0	0	0	112.3	S236 H237 V238 L242 R243 S244	S236-H240 PolarHBondContact O-N 3.43Å; H237-H240 WeakPolarHBondContact O-CB 3.13Å; H237-H240 PolarHBondContact O-N 2.69Å; H237-H240 VanDerWaalsContact O-N 3.16Å; V238-H240 VanDerWaalsContact C-N 3.28Å; V238-H240 PolarHBondContact O-N 3.27Å; H240-L242 VanDerWaalsContact C-N 3.34Å; H240-L242 PolarHBondContact O-N 2.8Å; H240-R243 PolarHBondContact O-N 2.89Å; H240-S244 VanDerWaalsContact O-CB 3.32Å; H240-S244 WeakPolarHBondContact O-CB 3.44Å; H240-S244 PolarHBondContact O-N 3.24Å
241	E	85.9	Confident	82.8	Confident	33 Å²	33	56.3 Å²	56.3	15%	0.154	29%	0.285	C	S	.	.	H	α-helix	trans	-60.8	-41.9	175.9	-73.4	-175.6	-179	0	0	111.5	H237 V238 F245 C266 L269	H237-E241 WeakPolarHBondContact O-CG 2.99Å; H237-E241 PolarHBondContact O-N 3.48Å; V238-E241 PolarHBondContact O-N 2.96Å; E241-F245 VanDerWaalsContact O-CB 3.27Å; E241-F245 WeakPolarHBondContact O-CB 3.47Å; E241-F245 PolarHBondContact O-N 3.37Å; E241-C266 WeakPolarHBondContact OE2-CB 3.49Å; E241-L269 WeakPolarHBondContact OE2-CB 3.3Å; E241-L269 PolarHBondContact OE2-N 2.98Å
242	L	86.7	Confident	81.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-65.5	-43.8	176.9	-70.6	171	0	0	0	112.5	L133 V238 L239 H240 F245 R246 L269 I337 E340 V341 M344	L133-L242 HydrophobicContact CD1-CD2 4.1Å; L133-L242 HydrophobicContact CD2-CD2 4.26Å; V238-L242 HydrophobicContact CG1-CD1 3.87Å; V238-L242 HydrophobicContact CG1-CG 4.27Å; V238-L242 WeakPolarHBondContact O-CB 3.43Å; V238-L242 VanDerWaalsContact O-CG 3.26Å; V238-L242 WeakPolarHBondContact O-CG 3.47Å; V238-L242 PolarHBondContact O-N 3.22Å; L239-L242 PolarHBondContact O-N 3.2Å; H240-L242 VanDerWaalsContact C-N 3.34Å; H240-L242 PolarHBondContact O-N 2.8Å; L242-F245 WeakPolarHBondContact O-CB 3.1Å; L242-F245 PolarHBondContact O-N 2.71Å; L242-R246 PolarHBondContact O-N 3.5Å; L242-L269 HydrophobicContact CD2-CD1 4.45Å; L242-L269 HydrophobicContact CD2-CD2 4.25Å; L242-I337 HydrophobicContact CD1-CB 4.42Å; L242-I337 HydrophobicContact CD1-CG1 4.3Å; L242-I337 HydrophobicContact CD1-CG2 3.81Å; L242-E340 HydrophobicContact CB-CB 4.25Å; L242-V341 HydrophobicContact CD1-CG2 3.9Å; L242-V341 HydrophobicContact CD2-CG2 4.27Å; L242-M344 HydrophobicContact CB-CE 3.85Å; L242-M344 HydrophobicContact CD2-CE 3.74Å; L242-M344 HydrophobicContact CD2-SD 3.97Å; L242-M344 HydrophobicContact CG-CE 4.39Å; L242-M344 WeakPolarHBondContact O-CE 3Å
243	R	86.9	Confident	80.3	Confident	92 Å²	92	48.4 Å²	48.4	35%	0.347	25%	0.248	S	C	.	.	H	α-helix	trans	-62.6	-47.9	176	-75.2	176.6	176	173.3	-0.7	111.2	L239 H240 F245 R246 E247 E336 E340	L239-R243 HydrophobicContact CD1-CG 4.29Å; L239-R243 WeakPolarHBondContact O-CG 2.73Å; L239-R243 PolarHBondContact O-N 3.26Å; H240-R243 PolarHBondContact O-N 2.89Å; R243-F245 VanDerWaalsContact C-N 3.28Å; R243-F245 PolarHBondContact O-N 3.06Å; R243-R246 PolarHBondContact O-N 2.91Å; R243-E247 WeakPolarHBondContact O-CB 3.45Å; R243-E247 VanDerWaalsContact O-CG 3.3Å; R243-E247 WeakPolarHBondContact O-CG 3.39Å; R243-E247 PolarHBondContact O-N 2.9Å; R243-E336 IonicContact CZ-OE2 2.68Å; R243-E336 IonicContact NH2-OE2 3.48Å; R243-E336 PolarHBondContact NH2-OE2 2.83Å; R243-E340 HydrophobicContact CG-CG 4Å
244	S	80.9	Confident	78.9	Confident	34 Å²	34	48.4 Å²	48.4	24%	0.238	25%	0.246	C	C	.	.	H	α-helix	trans	-58.5	-41.5	175.4	177.9	0	0	0	0	111.3	H240 N248	H240-S244 VanDerWaalsContact O-CB 3.32Å; H240-S244 WeakPolarHBondContact O-CB 3.44Å; H240-S244 PolarHBondContact O-N 3.24Å; S244-N248 WeakPolarHBondContact O-CB 3.17Å; S244-N248 PolarHBondContact O-N 3.46Å; S244-N248 VanDerWaalsContact O-N 3.12Å; S244-N248 PolarHBondContact O-ND2 3.29Å; S244-N248 PolarHBondContact OG-ND2 3.45Å
245	F	79.1	Confident	77.4	Confident	8 Å²	8	52 Å²	52	4%	0.035	26%	0.263	C	S	.	.	H	α-helix	trans	-61.9	-47.8	176.8	-179.8	-102.7	0	0	0	111.9	L133 Y134 E241 L242 R243 N248 G250 Y252 M344	L133-F245 HydrophobicContact CD1-CD1 3.45Å; L133-F245 VanDerWaalsContact CD1-CD1 3.45Å; L133-F245 HydrophobicContact CD1-CD2 4.18Å; L133-F245 HydrophobicContact CD1-CE1 3.48Å; L133-F245 VanDerWaalsContact CD1-CE1 3.48Å; L133-F245 HydrophobicContact CD1-CE2 4.2Å; L133-F245 HydrophobicContact CD1-CG 3.8Å; L133-F245 HydrophobicContact CD1-CZ 3.85Å; Y134-F245 HydrophobicContact CE1-CE2 4.35Å; Y134-F245 AromaticContact CE1-CZ 3.89Å; Y134-F245 HydrophobicContact CE1-CZ 3.89Å; Y134-F245 HydrophobicContact CE2-CE2 4.22Å; Y134-F245 AromaticContact CZ-CE2 3.67Å; Y134-F245 AromaticContact CZ-CZ 3.66Å; Y134-F245 WeakPolarHBondContact OH-CE2 3.49Å; Y134-F245 VanDerWaalsContact OH-CZ 3.23Å; Y134-F245 WeakPolarHBondContact OH-CZ 2.88Å; E241-F245 VanDerWaalsContact O-CB 3.27Å; E241-F245 WeakPolarHBondContact O-CB 3.47Å; E241-F245 PolarHBondContact O-N 3.37Å; L242-F245 WeakPolarHBondContact O-CB 3.1Å; L242-F245 PolarHBondContact O-N 2.71Å; R243-F245 VanDerWaalsContact C-N 3.28Å; R243-F245 PolarHBondContact O-N 3.06Å; F245-N248 CarbonylContact O-C 3.3Å; F245-N248 PolarHBondContact O-N 3.31Å; F245-G250 WeakPolarHBondContact CE2-O 3.39Å; F245-G250 VanDerWaalsContact CZ-C 3.44Å; F245-G250 WeakPolarHBondContact CZ-O 3.31Å; F245-G250 VanDerWaalsContact O-CA 3.3Å; F245-G250 WeakPolarHBondContact O-CA 3.23Å; F245-G250 PolarHBondContact O-N 2.8Å; F245-Y252 HydrophobicContact CB-CE1 4.23Å; F245-Y252 AromaticContact CD2-CD1 3.81Å; F245-Y252 HydrophobicContact CD2-CD1 3.81Å; F245-Y252 AromaticContact CD2-CD2 3.54Å; F245-Y252 HydrophobicContact CD2-CD2 3.54Å; F245-Y252 AromaticContact CD2-CE1 3.65Å; F245-Y252 HydrophobicContact CD2-CE1 3.65Å; F245-Y252 AromaticContact CD2-CE2 3.35Å; F245-Y252 HydrophobicContact CD2-CE2 3.35Å; F245-Y252 AromaticContact CD2-CG 3.78Å; F245-Y252 HydrophobicContact CD2-CG 3.78Å; F245-Y252 AromaticContact CD2-CZ 3.45Å; F245-Y252 VanDerWaalsContact CD2-CZ 3.45Å; F245-Y252 AromaticContact CE2-CD2 3.48Å; F245-Y252 HydrophobicContact CE2-CD2 3.48Å; F245-Y252 VanDerWaalsContact CE2-CD2 3.48Å; F245-Y252 HydrophobicContact CE2-CE1 4.4Å; F245-Y252 AromaticContact CE2-CE2 3.23Å; F245-Y252 HydrophobicContact CE2-CE2 3.23Å; F245-Y252 HydrophobicContact CE2-CG 4.18Å; F245-Y252 AromaticContact CE2-CZ 3.79Å; F245-Y252 HydrophobicContact CG-CE1 4.26Å; F245-Y252 HydrophobicContact CG-CE2 4.43Å; F245-Y252 HydrophobicContact CZ-CE2 4.26Å; F245-M344 HydrophobicContact CD1-CE 3.88Å; F245-M344 HydrophobicContact CD1-SD 3.95Å; F245-M344 HydrophobicContact CE1-SD 4.26Å
246	R	80.5	Confident	75.7	Confident	87 Å²	87	57.8 Å²	57.8	33%	0.328	29%	0.288	S	S	.	.	H	α-helix	trans	-62.2	-46.7	177.1	-175.7	-159.3	66.3	-165.2	0.1	112.1	L242 R243 N248 S249 E340 K343 M344	L242-R246 PolarHBondContact O-N 3.5Å; R243-R246 PolarHBondContact O-N 2.91Å; R246-N248 PolarHBondContact O-N 3.32Å; R246-S249 PolarHBondContact O-N 3.38Å; R246-E340 VanDerWaalsContact CD-OE2 3.29Å; R246-E340 WeakPolarHBondContact CD-OE2 3.38Å; R246-E340 IonicContact CZ-OE1 2.81Å; R246-E340 IonicContact CZ-OE2 3.47Å; R246-E340 VanDerWaalsContact CZ-OE2 3.24Å; R246-E340 IonicContact NE-OE2 3.88Å; R246-E340 PolarHBondContact NE-OE2 3.48Å; R246-E340 IonicContact NH1-OE1 3.42Å; R246-E340 PolarHBondContact NH1-OE1 3.24Å; R246-E340 IonicContact NH1-OE2 3.94Å; R246-E340 PolarHBondContact NH1-OE2 3.22Å; R246-K343 VanDerWaalsContact NH1-NZ 3.11Å; R246-M344 HydrophobicContact CB-CE 4.22Å
247	E	79.1	Confident	74.1	Confident	130 Å²	130	58.3 Å²	58.3	61%	0.607	28%	0.283	S	S	*	.	H	α-helix	trans	-62.6	-28.6	-178.8	-75.9	167.5	-168.7	0	0	112.6	R243 S249	R243-E247 WeakPolarHBondContact O-CB 3.45Å; R243-E247 VanDerWaalsContact O-CG 3.3Å; R243-E247 WeakPolarHBondContact O-CG 3.39Å; R243-E247 PolarHBondContact O-N 2.9Å; E247-S249 PolarHBondContact O-N 2.84Å
248	N	71.9	Confident	72.5	Confident	49 Å²	49	54.3 Å²	54.3	26%	0.262	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	30.6	172.5	-68.8	-60.4	0	0	0	112.3	S244 F245 R246 G250 C251	S244-N248 WeakPolarHBondContact O-CB 3.17Å; S244-N248 PolarHBondContact O-N 3.46Å; S244-N248 VanDerWaalsContact O-N 3.12Å; S244-N248 PolarHBondContact O-ND2 3.29Å; S244-N248 PolarHBondContact OG-ND2 3.45Å; F245-N248 CarbonylContact O-C 3.3Å; F245-N248 PolarHBondContact O-N 3.31Å; R246-N248 PolarHBondContact O-N 3.32Å; N248-G250 VanDerWaalsContact C-N 3.25Å; N248-G250 PolarHBondContact O-N 3.48Å; N248-C251 WeakPolarHBondContact CB-O 3.22Å; N248-C251 WeakPolarHBondContact O-CB 3.17Å; N248-C251 PolarHBondContact O-N 2.72Å
249	S	70.7	Confident	70.6	Confident	110 Å²	110	55.4 Å²	55.4	77%	0.769	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	35.1	177.1	-56.6	0	0	0	0	114.2	R246 E247 C251	R246-S249 PolarHBondContact O-N 3.38Å; E247-S249 PolarHBondContact O-N 2.84Å; S249-C251 VanDerWaalsContact C-N 3.28Å
250	G	68.2	Low	68.9	Low	15 Å²	15	59 Å²	59	16%	0.155	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	24.4	-177.1	0	0	0	0	0	112.7	Y134 P207 F245 N248	Y134-G250 PolarHBondContact OH-O 3.08Å; P207-G250 WeakPolarHBondContact CG-O 3.05Å; F245-G250 WeakPolarHBondContact CE2-O 3.39Å; F245-G250 VanDerWaalsContact CZ-C 3.44Å; F245-G250 WeakPolarHBondContact CZ-O 3.31Å; F245-G250 VanDerWaalsContact O-CA 3.3Å; F245-G250 WeakPolarHBondContact O-CA 3.23Å; F245-G250 PolarHBondContact O-N 2.8Å; N248-G250 VanDerWaalsContact C-N 3.25Å; N248-G250 PolarHBondContact O-N 3.48Å
251	C	63.9	Low	67.2	Low	19 Å²	19	53.1 Å²	53.1	13%	0.128	27%	0.268	C	S	.	.			trans	-115.3	137.3	169.9	-64.6	0	0	0	0	108.7	N248 S249 H253	N248-C251 WeakPolarHBondContact CB-O 3.22Å; N248-C251 WeakPolarHBondContact O-CB 3.17Å; N248-C251 PolarHBondContact O-N 2.72Å; S249-C251 VanDerWaalsContact C-N 3.28Å; C251-H253 PolarHBondContact O-N 2.94Å; C251-H253 VanDerWaalsContact O-N 3.17Å
252	Y	61.9	Low	65.7	Low	12 Å²	12	59.4 Å²	59.4	5%	0.047	30%	0.295	C	S	.	.	S	Bend	trans	-70	-10.9	174.2	-74.7	-80.3	0	0	0	113.2	C131 L133 Y134 F245 C266 L269	C131-Y252 HydrophobicContact CB-CD2 3.57Å; C131-Y252 HydrophobicContact CB-CE2 3.48Å; C131-Y252 VanDerWaalsContact CB-CE2 3.48Å; C131-Y252 WeakPolarHBondContact SG-CD2 3.42Å; L133-Y252 HydrophobicContact CB-CE2 4.39Å; L133-Y252 WeakPolarHBondContact CB-OH 3.1Å; L133-Y252 VanDerWaalsContact CD1-OH 3.24Å; L133-Y252 WeakPolarHBondContact CD1-OH 2.97Å; L133-Y252 WeakPolarHBondContact CG-OH 2.8Å; L133-Y252 PolarHBondContact N-OH 2.77Å; Y134-Y252 HydrophobicContact CD2-CE2 4.36Å; Y134-Y252 AromaticContact CE2-CD2 3.92Å; Y134-Y252 HydrophobicContact CE2-CD2 3.92Å; Y134-Y252 AromaticContact CE2-CE2 3.92Å; Y134-Y252 HydrophobicContact CE2-CE2 3.92Å; F245-Y252 HydrophobicContact CB-CE1 4.23Å; F245-Y252 AromaticContact CD2-CD1 3.81Å; F245-Y252 HydrophobicContact CD2-CD1 3.81Å; F245-Y252 AromaticContact CD2-CD2 3.54Å; F245-Y252 HydrophobicContact CD2-CD2 3.54Å; F245-Y252 AromaticContact CD2-CE1 3.65Å; F245-Y252 HydrophobicContact CD2-CE1 3.65Å; F245-Y252 AromaticContact CD2-CE2 3.35Å; F245-Y252 HydrophobicContact CD2-CE2 3.35Å; F245-Y252 AromaticContact CD2-CG 3.78Å; F245-Y252 HydrophobicContact CD2-CG 3.78Å; F245-Y252 AromaticContact CD2-CZ 3.45Å; F245-Y252 VanDerWaalsContact CD2-CZ 3.45Å; F245-Y252 AromaticContact CE2-CD2 3.48Å; F245-Y252 HydrophobicContact CE2-CD2 3.48Å; F245-Y252 VanDerWaalsContact CE2-CD2 3.48Å; F245-Y252 HydrophobicContact CE2-CE1 4.4Å; F245-Y252 AromaticContact CE2-CE2 3.23Å; F245-Y252 HydrophobicContact CE2-CE2 3.23Å; F245-Y252 HydrophobicContact CE2-CG 4.18Å; F245-Y252 AromaticContact CE2-CZ 3.79Å; F245-Y252 HydrophobicContact CG-CE1 4.26Å; F245-Y252 HydrophobicContact CG-CE2 4.43Å; F245-Y252 HydrophobicContact CZ-CE2 4.26Å; Y252-C266 WeakPolarHBondContact CD1-SG 3.49Å; Y252-C266 HydrophobicContact CE1-CB 4.01Å; Y252-C266 WeakPolarHBondContact CE1-SG 3.49Å; Y252-L269 WeakPolarHBondContact OH-CD2 3.38Å
253	H	59.6	Low	64.3	Low	11 Å²	11	60.3 Å²	60.3	5%	0.051	30%	0.3	C	S	.	.	S	Bend	trans	-145.3	149.1	-167.4	-42.3	-52.2	0	0	0	111.7	W127 C251 K257 Q264	W127-H253 AromaticContact CE3-CD2 3.52Å; W127-H253 AromaticContact CE3-NE2 3.73Å; W127-H253 AromaticContact CZ3-CD2 3.22Å; W127-H253 WeakPolarHBondContact CZ3-CD2 3.48Å; W127-H253 AromaticContact CZ3-CG 3.86Å; W127-H253 AromaticContact CZ3-NE2 3.57Å; C251-H253 PolarHBondContact O-N 2.94Å; C251-H253 VanDerWaalsContact O-N 3.17Å; H253-K257 HydrophobicContact CB-CB 3.82Å; H253-K257 HydrophobicContact CB-CD 3.99Å; H253-Q264 WeakPolarHBondContact CE1-CB 3.4Å; H253-Q264 PolarHBondContact CE1-N 3.36Å; H253-Q264 WeakPolarHBondContact ND1-CB 3.33Å
254	K	57	Low	63	Low	120 Å²	120	60.5 Å²	60.5	52%	0.522	31%	0.305	S	S	.	.			trans	-73.3	153.1	169.1	-62.3	-177.3	176.8	-174.8	0	109.7	F256 K257	K254-F256 HydrophobicContact CB-CD1 3.67Å; K254-F256 HydrophobicContact CB-CE1 3.39Å; K254-F256 HydrophobicContact CB-CZ 4.11Å; K254-F256 HydrophobicContact CD-CD1 4.46Å; K254-F256 HydrophobicContact CD-CE1 3.47Å; K254-F256 VanDerWaalsContact CD-CE1 3.47Å; K254-F256 HydrophobicContact CD-CZ 4.02Å; K254-F256 HydrophobicContact CG-CE1 4.02Å; K254-F256 PolarHBondContact O-N 3.18Å; K254-F256 VanDerWaalsContact O-N 3.09Å; K254-K257 WeakPolarHBondContact O-CB 3.48Å; K254-K257 PolarHBondContact O-N 3.37Å
255	E	57.7	Low	62.1	Low	80 Å²	80	65.9 Å²	65.9	37%	0.374	32%	0.324	S	S	.	.	H	α-helix	trans	-47.6	-44.7	-175.4	-172.3	175.2	-179.6	0	0	113.2	I196 L205 K257 F258	I196-E255 HydrophobicContact CD1-CG 4.42Å; L205-E255 HydrophobicContact CD2-CG 4.32Å; E255-K257 VanDerWaalsContact C-N 3.26Å; E255-K257 PolarHBondContact O-N 2.87Å; E255-F258 WeakPolarHBondContact O-CB 3.29Å; E255-F258 VanDerWaalsContact O-CD2 3.32Å; E255-F258 WeakPolarHBondContact O-CD2 3.45Å; E255-F258 PolarHBondContact O-N 3.3Å
256	F	53.8	Low	61.4	Low	120 Å²	120	65.8 Å²	65.8	53%	0.526	33%	0.325	S	S	.	.	H	α-helix	trans	-64.1	-26.3	179.6	71.4	-96.8	0	0	0	114.1	K254 F258 L259	K254-F256 HydrophobicContact CB-CD1 3.67Å; K254-F256 HydrophobicContact CB-CE1 3.39Å; K254-F256 HydrophobicContact CB-CZ 4.11Å; K254-F256 HydrophobicContact CD-CD1 4.46Å; K254-F256 HydrophobicContact CD-CE1 3.47Å; K254-F256 VanDerWaalsContact CD-CE1 3.47Å; K254-F256 HydrophobicContact CD-CZ 4.02Å; K254-F256 HydrophobicContact CG-CE1 4.02Å; K254-F256 PolarHBondContact O-N 3.18Å; K254-F256 VanDerWaalsContact O-N 3.09Å; F256-F258 VanDerWaalsContact C-N 3.31Å; F256-F258 PolarHBondContact O-N 2.96Å; F256-L259 VanDerWaalsContact O-CB 3.31Å; F256-L259 WeakPolarHBondContact O-CB 3.43Å; F256-L259 WeakPolarHBondContact O-CG 3.32Å; F256-L259 PolarHBondContact O-N 2.74Å
257	K	56.7	Low	60.8	Low	69 Å²	69	66.7 Å²	66.7	30%	0.3	34%	0.336	S	S	.	.	H	α-helix	trans	-70.2	-29.6	-179.6	-74.3	-172.4	177.4	-179.2	0	111.3	W127 H253 K254 E255 L259 T260 Q264	W127-K257 WeakPolarHBondContact CH2-O 3.22Å; H253-K257 HydrophobicContact CB-CB 3.82Å; H253-K257 HydrophobicContact CB-CD 3.99Å; K254-K257 WeakPolarHBondContact O-CB 3.48Å; K254-K257 PolarHBondContact O-N 3.37Å; E255-K257 VanDerWaalsContact C-N 3.26Å; E255-K257 PolarHBondContact O-N 2.87Å; K257-L259 PolarHBondContact O-N 3.2Å; K257-T260 PolarHBondContact O-N 3.46Å; K257-T260 PolarHBondContact O-OG1 2.8Å; K257-Q264 VanDerWaalsContact NZ-OE1 3.1Å
258	F	56.1	Low	60.9	Low	6 Å²	6	63.9 Å²	63.9	3%	0.026	32%	0.321	C	S	.	.	H	α-helix	trans	-52.9	-31.8	174.9	-71.5	-72.3	0	0	0	111.6	W127 T168 F204 L205 E255 F256 T260 G261	W127-F258 HydrophobicContact CD2-CD1 4.17Å; W127-F258 HydrophobicContact CE3-CD1 4.01Å; W127-F258 HydrophobicContact CE3-CE1 4.29Å; W127-F258 WeakPolarHBondContact CZ2-O 3.45Å; W127-F258 HydrophobicContact CZ3-CD1 4.23Å; T168-F258 WeakPolarHBondContact CB-O 3.33Å; T168-F258 PolarHBondContact OG1-O 3.34Å; F204-F258 HydrophobicContact CB-CD1 4.19Å; F204-F258 HydrophobicContact CB-CE1 4.09Å; F204-F258 HydrophobicContact CB-CE2 4.48Å; F204-F258 HydrophobicContact CB-CG 4.43Å; F204-F258 HydrophobicContact CB-CZ 4.25Å; F204-F258 HydrophobicContact CD1-CD1 4.02Å; F204-F258 HydrophobicContact CD1-CE1 4.37Å; F204-F258 HydrophobicContact CG-CD1 4.47Å; F204-F258 WeakPolarHBondContact O-CZ 3.49Å; L205-F258 HydrophobicContact CD2-CD2 4.36Å; L205-F258 HydrophobicContact CD2-CE2 3.8Å; E255-F258 WeakPolarHBondContact O-CB 3.29Å; E255-F258 VanDerWaalsContact O-CD2 3.32Å; E255-F258 WeakPolarHBondContact O-CD2 3.45Å; E255-F258 PolarHBondContact O-N 3.3Å; F256-F258 VanDerWaalsContact C-N 3.31Å; F256-F258 PolarHBondContact O-N 2.96Å; F258-T260 PolarHBondContact O-N 3.23Å; F258-G261 PolarHBondContact O-N 2.73Å
259	L	48.7	Very low	61.3	Low	23 Å²	23	61.6 Å²	61.6	12%	0.12	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-29.4	-176.4	-50.9	172	0	0	0	113.3	L172 L194 F256 K257 G261	L172-L259 HydrophobicContact CD1-CD2 4.1Å; L194-L259 HydrophobicContact CB-CD1 3.58Å; L194-L259 HydrophobicContact CB-CD2 3.6Å; L194-L259 HydrophobicContact CB-CG 4.18Å; L194-L259 HydrophobicContact CD1-CD1 4.11Å; L194-L259 HydrophobicContact CD1-CD2 3.74Å; L194-L259 HydrophobicContact CD1-CG 4.31Å; L194-L259 HydrophobicContact CG-CD1 4.32Å; L194-L259 HydrophobicContact CG-CD2 4.35Å; F256-L259 VanDerWaalsContact O-CB 3.31Å; F256-L259 WeakPolarHBondContact O-CB 3.43Å; F256-L259 WeakPolarHBondContact O-CG 3.32Å; F256-L259 PolarHBondContact O-N 2.74Å; K257-L259 PolarHBondContact O-N 3.2Å; L259-G261 PolarHBondContact O-N 3.29Å
260	T	53.4	Low	61.7	Low	90 Å²	90	59.1 Å²	59.1	55%	0.552	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-15.8	178.9	68.3	0	0	0	0	112.6	K257 F258 K262	K257-T260 PolarHBondContact O-N 3.46Å; K257-T260 PolarHBondContact O-OG1 2.8Å; F258-T260 PolarHBondContact O-N 3.23Å; T260-K262 PolarHBondContact O-N 2.94Å; T260-K262 PolarHBondContact OG1-N 2.74Å
261	G	51.8	Low	62.4	Low	8 Å²	8	59.9 Å²	59.9	8%	0.082	29%	0.288	C	S	.	.			trans	71.6	5.2	-179	0	0	0	0	0	114.6	W126 W127 F258 L259	W126-G261 WeakPolarHBondContact CH2-O 3.06Å; W126-G261 WeakPolarHBondContact CZ3-O 2.81Å; W127-G261 VanDerWaalsContact CZ2-C 3.43Å; F258-G261 PolarHBondContact O-N 2.73Å; L259-G261 PolarHBondContact O-N 3.29Å
262	K	54.9	Low	63.5	Low	165 Å²	165	59 Å²	59	72%	0.717	28%	0.282	S	S	*	.			trans	-117.1	112.8	179.9	-66.7	-175.8	-178.1	178.7	0	111.5	W127 T260 Q264	W127-K262 WeakPolarHBondContact CH2-O 3.2Å; T260-K262 PolarHBondContact O-N 2.94Å; T260-K262 PolarHBondContact OG1-N 2.74Å; K262-Q264 PolarHBondContact O-N 3.36Å
263	P	58	Low	64.4	Low	18 Å²	18	58.8 Å²	58.8	12%	0.117	28%	0.282	C	S	.	.			trans	-64.2	134.5	170.3	26.6	-32.6	0	0	0	109.3	W126 W127 K265	W126-P263 HydrophobicContact CH2-CG 4.04Å; W126-P263 HydrophobicContact CZ3-CG 4.07Å; W127-P263 HydrophobicContact CD2-CB 4.31Å; W127-P263 HydrophobicContact CE3-CB 3.76Å; W127-P263 VanDerWaalsContact CZ3-CA 3.44Å; W127-P263 HydrophobicContact CZ3-CB 4.08Å; P263-K265 PolarHBondContact O-N 3.44Å; P263-K265 VanDerWaalsContact O-N 3.09Å
264	Q	60.1	Low	65.5	Low	97 Å²	97	63.9 Å²	63.9	45%	0.453	30%	0.304	S	S	.	.			trans	-64.7	108.7	163.8	-171.1	179.7	-21.2	0	0	106.9	H253 K257 K262 C266	H253-Q264 WeakPolarHBondContact CE1-CB 3.4Å; H253-Q264 PolarHBondContact CE1-N 3.36Å; H253-Q264 WeakPolarHBondContact ND1-CB 3.33Å; K257-Q264 VanDerWaalsContact NZ-OE1 3.1Å; K262-Q264 PolarHBondContact O-N 3.36Å; Q264-C266 PolarHBondContact O-N 2.79Å
265	K	61.4	Low	66.9	Low	146 Å²	146	59 Å²	59	64%	0.635	28%	0.283	S	S	*	.			trans	-70	122.9	-178.9	-64.7	-173.2	177.3	-174.7	0	109.7	P263 L267	P263-K265 PolarHBondContact O-N 3.44Å; P263-K265 VanDerWaalsContact O-N 3.09Å; K265-L267 VanDerWaalsContact C-N 3.26Å; K265-L267 HydrophobicContact CB-CD2 3.83Å; K265-L267 HydrophobicContact CB-CG 3.92Å; K265-L267 HydrophobicContact CD-CD2 4.11Å; K265-L267 PolarHBondContact O-N 3.17Å; K265-L267 VanDerWaalsContact O-N 3.16Å
266	C	65.2	Low	68.2	Low	7 Å²	7	55.3 Å²	55.3	5%	0.047	27%	0.265	C	S	.	.			trans	-88.3	68.1	172.1	-72.5	0	0	0	0	110	E241 Y252 Q264 K268 L269 E270	E241-C266 WeakPolarHBondContact OE2-CB 3.49Å; Y252-C266 WeakPolarHBondContact CD1-SG 3.49Å; Y252-C266 HydrophobicContact CE1-CB 4.01Å; Y252-C266 WeakPolarHBondContact CE1-SG 3.49Å; Q264-C266 PolarHBondContact O-N 2.79Å; C266-K268 PolarHBondContact O-N 2.87Å; C266-L269 HydrophobicContact CB-CB 4.39Å; C266-L269 PolarHBondContact O-N 3.49Å; C266-E270 WeakPolarHBondContact O-CB 3.31Å; C266-E270 PolarHBondContact O-N 3.39Å
267	L	66.3	Low	69.5	Low	106 Å²	106	51.7 Å²	51.7	56%	0.555	26%	0.255	S	S	*	.	H	α-helix	trans	-60.1	-32.6	-170.5	-65.3	175.4	0	0	0	112.2	K265 S271	K265-L267 VanDerWaalsContact C-N 3.26Å; K265-L267 HydrophobicContact CB-CD2 3.83Å; K265-L267 HydrophobicContact CB-CG 3.92Å; K265-L267 HydrophobicContact CD-CD2 4.11Å; K265-L267 PolarHBondContact O-N 3.17Å; K265-L267 VanDerWaalsContact O-N 3.16Å; L267-S271 VanDerWaalsContact O-CB 3.27Å; L267-S271 WeakPolarHBondContact O-CB 3.31Å; L267-S271 PolarHBondContact O-N 2.87Å
268	K	81.9	Confident	70.8	Confident	71 Å²	71	48.5 Å²	48.5	31%	0.309	24%	0.242	S	C	.	.	H	α-helix	trans	-78.1	-44.4	-178.2	-64.2	-62.8	-172.1	170.3	0	111.3	D231 E234 H237 V238 C266 E270 S271 I272	D231-K268 IonicContact OD2-NZ 2.85Å; E234-K268 HydrophobicContact CB-CD 4.41Å; E234-K268 HydrophobicContact CG-CD 4.09Å; H237-K268 HydrophobicContact CB-CB 4.12Å; H237-K268 HydrophobicContact CB-CG 3.92Å; V238-K268 HydrophobicContact CG2-CB 4.16Å; C266-K268 PolarHBondContact O-N 2.87Å; K268-E270 VanDerWaalsContact C-N 3.31Å; K268-E270 PolarHBondContact O-N 3.44Å; K268-S271 WeakPolarHBondContact O-CB 2.96Å; K268-S271 PolarHBondContact O-N 3.08Å; K268-I272 WeakPolarHBondContact O-CG1 3.26Å; K268-I272 PolarHBondContact O-N 3.17Å
269	L	80.4	Confident	72.2	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-65.6	-35.2	174	-171.3	63.9	0	0	0	112.6	A132 L133 L217 V238 E241 L242 Y252 C266 I272 N273	A132-L269 HydrophobicContact CB-CB 3.91Å; A132-L269 HydrophobicContact CB-CD2 4.07Å; A132-L269 HydrophobicContact CB-CG 3.75Å; L133-L269 HydrophobicContact CD1-CD2 4.14Å; L133-L269 HydrophobicContact CD2-CD2 3.86Å; L133-L269 HydrophobicContact CG-CD2 3.56Å; L217-L269 HydrophobicContact CD1-CD1 4.27Å; V238-L269 HydrophobicContact CG1-CD1 3.73Å; V238-L269 HydrophobicContact CG2-CB 4.22Å; V238-L269 HydrophobicContact CG2-CD1 4.18Å; E241-L269 WeakPolarHBondContact OE2-CB 3.3Å; E241-L269 PolarHBondContact OE2-N 2.98Å; L242-L269 HydrophobicContact CD2-CD1 4.45Å; L242-L269 HydrophobicContact CD2-CD2 4.25Å; Y252-L269 WeakPolarHBondContact OH-CD2 3.38Å; C266-L269 HydrophobicContact CB-CB 4.39Å; C266-L269 PolarHBondContact O-N 3.49Å; L269-I272 PolarHBondContact O-N 3.07Å; L269-N273 WeakPolarHBondContact O-CB 3.01Å; L269-N273 PolarHBondContact O-N 3.02Å
270	E	78.3	Confident	73.7	Confident	58 Å²	58	51.7 Å²	51.7	27%	0.271	26%	0.256	S	S	.	.	H	α-helix	trans	-63	-44.9	173.1	-167.8	-169.8	155.4	0	0	111.4	A132 C266 K268 N273 K274	A132-E270 HydrophobicContact CB-CB 3.97Å; A132-E270 VanDerWaalsContact CB-N 3.34Å; C266-E270 WeakPolarHBondContact O-CB 3.31Å; C266-E270 PolarHBondContact O-N 3.39Å; K268-E270 VanDerWaalsContact C-N 3.31Å; K268-E270 PolarHBondContact O-N 3.44Å; E270-N273 PolarHBondContact O-N 3.45Å; E270-K274 HydrophobicContact CG-CD 4.32Å; E270-K274 WeakPolarHBondContact O-CB 3.12Å; E270-K274 WeakPolarHBondContact O-CG 3.2Å; E270-K274 PolarHBondContact O-N 2.86Å; E270-K274 VanDerWaalsContact OE1-CE 3.25Å; E270-K274 WeakPolarHBondContact OE1-CE 3.05Å; E270-K274 IonicContact OE1-NZ 3.9Å; E270-K274 PolarHBondContact OE1-NZ 3.46Å
271	S	83.8	Confident	74.8	Confident	31 Å²	31	53.3 Å²	53.3	22%	0.217	25%	0.253	C	S	.	.	H	α-helix	trans	-59.4	-46.6	175	176.7	0	0	0	0	111.7	E234 L267 K268 K274 K275	E234-S271 WeakPolarHBondContact OE1-CB 3.35Å; E234-S271 PolarHBondContact OE1-OG 2.99Å; L267-S271 VanDerWaalsContact O-CB 3.27Å; L267-S271 WeakPolarHBondContact O-CB 3.31Å; L267-S271 PolarHBondContact O-N 2.87Å; K268-S271 WeakPolarHBondContact O-CB 2.96Å; K268-S271 PolarHBondContact O-N 3.08Å; S271-K274 PolarHBondContact O-N 3.18Å; S271-K275 WeakPolarHBondContact O-CB 3.48Å; S271-K275 VanDerWaalsContact O-CG 3.27Å; S271-K275 WeakPolarHBondContact O-CG 3.47Å; S271-K275 PolarHBondContact O-N 3.06Å; S271-K275 WeakPolarHBondContact OG-CE 3.28Å
272	I	86	Confident	75.9	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.1	-48	175.8	-67.5	-153.9	0	0	0	111.4	L217 M226 W229 E234 I235 V238 K268 L269 K274 K275 L276	L217-I272 HydrophobicContact CD2-CG2 4.4Å; M226-I272 HydrophobicContact CE-CG2 4.41Å; W229-I272 HydrophobicContact CH2-CG2 4.35Å; W229-I272 HydrophobicContact CZ2-CB 4.28Å; W229-I272 HydrophobicContact CZ2-CD1 4.41Å; W229-I272 HydrophobicContact CZ2-CG1 4Å; W229-I272 HydrophobicContact CZ2-CG2 4.21Å; E234-I272 HydrophobicContact CG-CD1 4.08Å; E234-I272 HydrophobicContact CG-CG1 3.83Å; I235-I272 HydrophobicContact CD1-CD1 3.39Å; I235-I272 HydrophobicContact CG1-CD1 4.3Å; V238-I272 HydrophobicContact CB-CD1 3.86Å; V238-I272 HydrophobicContact CG1-CD1 4.22Å; V238-I272 HydrophobicContact CG2-CB 4.28Å; V238-I272 HydrophobicContact CG2-CD1 3.35Å; V238-I272 HydrophobicContact CG2-CG1 3.7Å; K268-I272 WeakPolarHBondContact O-CG1 3.26Å; K268-I272 PolarHBondContact O-N 3.17Å; L269-I272 PolarHBondContact O-N 3.07Å; I272-K274 VanDerWaalsContact C-N 3.29Å; I272-K274 PolarHBondContact O-N 3.34Å; I272-K275 PolarHBondContact O-N 3.47Å; I272-L276 HydrophobicContact CG2-CD1 3.61Å; I272-L276 HydrophobicContact CG2-CG 4.06Å; I272-L276 WeakPolarHBondContact O-CB 3.32Å; I272-L276 WeakPolarHBondContact O-CG 3.46Å; I272-L276 PolarHBondContact O-N 3.22Å
273	N	81.3	Confident	76.7	Confident	9 Å²	9	50.2 Å²	50.2	5%	0.048	24%	0.24	C	C	.	.	H	α-helix	trans	-60	-40.6	178.4	-78.6	-16.8	0	0	0	111.6	A132 S213 L269 E270 S277	A132-N273 PolarHBondContact O-ND2 2.91Å; S213-N273 PolarHBondContact OG-ND2 2.77Å; L269-N273 WeakPolarHBondContact O-CB 3.01Å; L269-N273 PolarHBondContact O-N 3.02Å; E270-N273 PolarHBondContact O-N 3.45Å; N273-S277 WeakPolarHBondContact O-CB 3.4Å; N273-S277 PolarHBondContact O-N 3.09Å; N273-S277 PolarHBondContact O-OG 3.23Å
274	K	82.2	Confident	77.3	Confident	117 Å²	117	52.9 Å²	52.9	51%	0.509	26%	0.255	S	S	.	.	H	α-helix	trans	-62.4	-45.6	175.4	-78.4	171.2	170	171.5	0	112.1	E270 S271 I272 S277 A278	E270-K274 HydrophobicContact CG-CD 4.32Å; E270-K274 WeakPolarHBondContact O-CB 3.12Å; E270-K274 WeakPolarHBondContact O-CG 3.2Å; E270-K274 PolarHBondContact O-N 2.86Å; E270-K274 VanDerWaalsContact OE1-CE 3.25Å; E270-K274 WeakPolarHBondContact OE1-CE 3.05Å; E270-K274 IonicContact OE1-NZ 3.9Å; E270-K274 PolarHBondContact OE1-NZ 3.46Å; S271-K274 PolarHBondContact O-N 3.18Å; I272-K274 VanDerWaalsContact C-N 3.29Å; I272-K274 PolarHBondContact O-N 3.34Å; K274-S277 PolarHBondContact O-N 2.71Å; K274-A278 PolarHBondContact O-N 3.35Å
275	K	87.2	Confident	78	Confident	17 Å²	17	51.5 Å²	51.5	7%	0.074	25%	0.251	C	S	.	.	H	α-helix	trans	-64.2	-48.7	179	-72.1	170.4	-178.7	-171.1	0	111.8	W229 E234 S271 I272 A278 F279 F299	W229-K275 HydrophobicContact CH2-CB 3.55Å; W229-K275 HydrophobicContact CH2-CD 4.3Å; W229-K275 HydrophobicContact CZ2-CB 3.52Å; W229-K275 HydrophobicContact CZ2-CD 3.42Å; W229-K275 VanDerWaalsContact CZ2-CD 3.42Å; W229-K275 HydrophobicContact CZ2-CG 4.08Å; E234-K275 IonicContact OE1-NZ 2.72Å; E234-K275 PolarHBondContact OE1-NZ 3.24Å; E234-K275 IonicContact OE2-NZ 3.44Å; E234-K275 PolarHBondContact OE2-NZ 3.06Å; S271-K275 WeakPolarHBondContact O-CB 3.48Å; S271-K275 VanDerWaalsContact O-CG 3.27Å; S271-K275 WeakPolarHBondContact O-CG 3.47Å; S271-K275 PolarHBondContact O-N 3.06Å; S271-K275 WeakPolarHBondContact OG-CE 3.28Å; I272-K275 PolarHBondContact O-N 3.47Å; K275-A278 WeakPolarHBondContact O-CB 3.28Å; K275-A278 PolarHBondContact O-N 2.98Å; K275-F279 WeakPolarHBondContact O-CD2 3.4Å; K275-F279 PolarHBondContact O-N 3.08Å; K275-F299 HydrophobicContact CB-CD2 4.24Å; K275-F299 HydrophobicContact CB-CE2 4.49Å; K275-F299 HydrophobicContact CD-CB 4.3Å; K275-F299 HydrophobicContact CD-CG 4.38Å; K275-F299 HydrophobicContact CG-CB 4.1Å; K275-F299 HydrophobicContact CG-CD1 4.36Å; K275-F299 HydrophobicContact CG-CD2 3.49Å; K275-F299 VanDerWaalsContact CG-CD2 3.49Å; K275-F299 HydrophobicContact CG-CE2 3.87Å; K275-F299 HydrophobicContact CG-CG 3.75Å; K275-F299 HydrophobicContact CG-CZ 4.46Å
276	L	85.1	Confident	78.6	Confident	3 Å²	3	49 Å²	49	2%	0.016	25%	0.25	C	C	.	.	H	α-helix	trans	-62.8	-42.2	175.5	-67.5	174.2	0	0	0	112	L216 L217 T222 L225 M226 W229 I272 A278 F279 H280	L216-L276 HydrophobicContact CD1-CB 4.44Å; L216-L276 HydrophobicContact CD2-CB 3.65Å; L216-L276 HydrophobicContact CD2-CD1 4.24Å; L216-L276 HydrophobicContact CG-CB 4.13Å; L216-L276 HydrophobicContact CG-CD1 4.25Å; L217-L276 HydrophobicContact CD2-CD1 3.86Å; T222-L276 HydrophobicContact CG2-CD1 3.54Å; T222-L276 HydrophobicContact CG2-CD2 3.73Å; T222-L276 HydrophobicContact CG2-CG 4.28Å; L225-L276 HydrophobicContact CD1-CD2 4.48Å; M226-L276 HydrophobicContact CE-CD1 4.07Å; W229-L276 HydrophobicContact CH2-CD2 3.78Å; W229-L276 HydrophobicContact CH2-CG 3.85Å; W229-L276 HydrophobicContact CZ3-CD2 3.7Å; W229-L276 HydrophobicContact CZ3-CG 4.29Å; I272-L276 HydrophobicContact CG2-CD1 3.61Å; I272-L276 HydrophobicContact CG2-CG 4.06Å; I272-L276 WeakPolarHBondContact O-CB 3.32Å; I272-L276 WeakPolarHBondContact O-CG 3.46Å; I272-L276 PolarHBondContact O-N 3.22Å; L276-A278 VanDerWaalsContact C-N 3.25Å; L276-A278 PolarHBondContact O-N 3.29Å; L276-F279 WeakPolarHBondContact O-CB 3.03Å; L276-F279 PolarHBondContact O-N 2.81Å; L276-H280 PolarHBondContact O-N 2.83Å; L276-H280 VanDerWaalsContact O-N 3.08Å
277	S	81.5	Confident	79.2	Confident	44 Å²	44	60.4 Å²	60.4	31%	0.308	29%	0.292	S	S	.	.	H	α-helix	trans	-60.1	-38.2	174.8	-59.4	0	0	0	0	111.2	N273 K274 F279 H280 Y281	N273-S277 WeakPolarHBondContact O-CB 3.4Å; N273-S277 PolarHBondContact O-N 3.09Å; N273-S277 PolarHBondContact O-OG 3.23Å; K274-S277 PolarHBondContact O-N 2.71Å; S277-F279 PolarHBondContact O-N 3.05Å; S277-H280 CarbonylContact O-C 3.52Å; S277-H280 PolarHBondContact O-N 3.17Å; S277-Y281 WeakPolarHBondContact O-CB 3.33Å; S277-Y281 VanDerWaalsContact O-CD2 3.32Å; S277-Y281 WeakPolarHBondContact O-CD2 3.31Å; S277-Y281 PolarHBondContact O-N 2.95Å
278	A	84.2	Confident	79.8	Confident	3 Å²	3	58.8 Å²	58.8	3%	0.025	28%	0.283	C	S	.	.	H	α-helix	trans	-61.1	-42.5	176.6	0	0	0	0	0	112.1	K274 K275 L276 H280 Y281 V282 M295 L296 F299	K274-A278 PolarHBondContact O-N 3.35Å; K275-A278 WeakPolarHBondContact O-CB 3.28Å; K275-A278 PolarHBondContact O-N 2.98Å; L276-A278 VanDerWaalsContact C-N 3.25Å; L276-A278 PolarHBondContact O-N 3.29Å; A278-H280 VanDerWaalsContact C-N 3.33Å; A278-H280 PolarHBondContact O-N 3.22Å; A278-Y281 PolarHBondContact O-N 3.49Å; A278-V282 VanDerWaalsContact O-CG2 3.31Å; A278-V282 WeakPolarHBondContact O-CG2 3.45Å; A278-V282 PolarHBondContact O-N 3.04Å; A278-M295 HydrophobicContact CB-SD 4.28Å; A278-L296 HydrophobicContact CB-CD2 3.88Å; A278-L296 HydrophobicContact CB-CG 4.28Å; A278-F299 HydrophobicContact CB-CE2 4.3Å
279	F	84.4	Confident	79.7	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.018	28%	0.284	C	S	.	.	H	α-helix	trans	-60.3	-41.4	172.8	-79.8	-73.5	0	0	0	112.6	L225 K275 L276 S277 L296 F301 F305 L306 F309	L225-F279 HydrophobicContact CD1-CB 4.31Å; L225-F279 HydrophobicContact CD1-CD2 4.22Å; L225-F279 HydrophobicContact CD1-CG 4.12Å; L225-F279 HydrophobicContact CD2-CD1 4.48Å; L225-F279 HydrophobicContact CD2-CE1 4.22Å; L225-F279 HydrophobicContact CD2-CE2 4.39Å; L225-F279 HydrophobicContact CD2-CZ 4.18Å; K275-F279 WeakPolarHBondContact O-CD2 3.4Å; K275-F279 PolarHBondContact O-N 3.08Å; L276-F279 WeakPolarHBondContact O-CB 3.03Å; L276-F279 PolarHBondContact O-N 2.81Å; S277-F279 PolarHBondContact O-N 3.05Å; F279-L296 HydrophobicContact CD1-CD1 3.91Å; F279-L296 HydrophobicContact CD1-CD2 4.42Å; F279-L296 HydrophobicContact CD2-CD2 3.73Å; F279-L296 HydrophobicContact CE1-CD1 3.84Å; F279-L296 HydrophobicContact CE1-CD2 4.26Å; F279-L296 HydrophobicContact CE2-CD2 3.53Å; F279-L296 HydrophobicContact CG-CD1 4.32Å; F279-L296 HydrophobicContact CG-CD2 4.18Å; F279-L296 HydrophobicContact CZ-CD1 4.18Å; F279-L296 HydrophobicContact CZ-CD2 3.81Å; F279-F301 HydrophobicContact CE2-CD1 4.42Å; F279-F301 HydrophobicContact CE2-CD2 4.31Å; F279-F301 AromaticContact CE2-CE1 3.93Å; F279-F301 HydrophobicContact CE2-CE1 3.93Å; F279-F301 AromaticContact CE2-CE2 3.82Å; F279-F301 HydrophobicContact CE2-CE2 3.82Å; F279-F301 AromaticContact CE2-CZ 3.61Å; F279-F301 HydrophobicContact CE2-CZ 3.61Å; F279-F301 AromaticContact CZ-CD1 3.99Å; F279-F301 HydrophobicContact CZ-CD1 3.99Å; F279-F301 HydrophobicContact CZ-CD2 4.29Å; F279-F301 AromaticContact CZ-CE1 3.9Å; F279-F301 HydrophobicContact CZ-CE1 3.9Å; F279-F301 HydrophobicContact CZ-CE2 4.21Å; F279-F301 HydrophobicContact CZ-CG 4.2Å; F279-F301 HydrophobicContact CZ-CZ 4.03Å; F279-F305 HydrophobicContact CE1-CE1 4.5Å; F279-F305 HydrophobicContact CZ-CE1 4.22Å; F279-L306 HydrophobicContact CE1-CD2 3.97Å; F279-L306 HydrophobicContact CZ-CD2 4.11Å; F279-F309 AromaticContact CD1-CD1 3.95Å; F279-F309 HydrophobicContact CD1-CD1 3.95Å; F279-F309 AromaticContact CD1-CE1 3.53Å; F279-F309 HydrophobicContact CD1-CE1 3.53Å; F279-F309 AromaticContact CD1-CZ 3.94Å; F279-F309 HydrophobicContact CD1-CZ 3.94Å; F279-F309 AromaticContact CE1-CD1 3.97Å; F279-F309 HydrophobicContact CE1-CD1 3.97Å; F279-F309 HydrophobicContact CE1-CE1 4.01Å; F279-F309 HydrophobicContact CE1-CG 4.37Å; F279-F309 HydrophobicContact CE1-CZ 4.42Å
280	H	79.9	Confident	79.8	Confident	91 Å²	91	63.4 Å²	63.4	42%	0.421	32%	0.315	S	S	.	.	H	α-helix	trans	-73.1	-31.8	178.8	-170.6	59.5	0	0	0	113.3	L276 S277 A278 E283 T284	L276-H280 PolarHBondContact O-N 2.83Å; L276-H280 VanDerWaalsContact O-N 3.08Å; S277-H280 CarbonylContact O-C 3.52Å; S277-H280 PolarHBondContact O-N 3.17Å; A278-H280 VanDerWaalsContact C-N 3.33Å; A278-H280 PolarHBondContact O-N 3.22Å; H280-E283 IonicContact CE1-OE2 3.24Å; H280-E283 IonicContact ND1-OE2 3.66Å; H280-E283 PolarHBondContact ND1-OE2 3.09Å; H280-E283 WeakPolarHBondContact O-CB 3.5Å; H280-E283 PolarHBondContact O-N 3.4Å; H280-T284 PolarHBondContact O-N 2.6Å; H280-T284 PolarHBondContact O-OG1 3.37Å
281	Y	77.7	Confident	80	Confident	124 Å²	124	65.3 Å²	65.3	49%	0.486	33%	0.326	S	S	.	.	H	α-helix	trans	-69.2	-36.2	175.9	-96.8	-76.3	0	0	0	112.5	S277 A278 E283 T284 N285	S277-Y281 WeakPolarHBondContact O-CB 3.33Å; S277-Y281 VanDerWaalsContact O-CD2 3.32Å; S277-Y281 WeakPolarHBondContact O-CD2 3.31Å; S277-Y281 PolarHBondContact O-N 2.95Å; A278-Y281 PolarHBondContact O-N 3.49Å; Y281-E283 PolarHBondContact O-N 3Å; Y281-T284 PolarHBondContact O-N 3.05Å; Y281-T284 PolarHBondContact O-OG1 3.45Å; Y281-N285 WeakPolarHBondContact O-CB 3.42Å; Y281-N285 PolarHBondContact O-N 2.88Å
282	V	75.2	Confident	79.9	Confident	9 Å²	9	65.6 Å²	65.6	6%	0.055	32%	0.323	C	S	.	.	H	α-helix	trans	-60	-38.6	174.7	176.7	0	0	0	0	111.1	A278 N285 L289 K292 F310	A278-V282 VanDerWaalsContact O-CG2 3.31Å; A278-V282 WeakPolarHBondContact O-CG2 3.45Å; A278-V282 PolarHBondContact O-N 3.04Å; V282-N285 CarbonylContact O-C 3.52Å; V282-L289 HydrophobicContact CG1-CB 4.41Å; V282-L289 HydrophobicContact CG1-CD1 3.33Å; V282-L289 HydrophobicContact CG1-CG 4.47Å; V282-K292 HydrophobicContact CG2-CB 3.23Å; V282-K292 HydrophobicContact CG2-CG 3.98Å; V282-F310 HydrophobicContact CB-CE1 3.78Å; V282-F310 HydrophobicContact CB-CZ 4.22Å; V282-F310 HydrophobicContact CG1-CD1 3.75Å; V282-F310 HydrophobicContact CG1-CE1 3.27Å; V282-F310 HydrophobicContact CG1-CZ 3.83Å; V282-F310 HydrophobicContact CG2-CE1 4.01Å; V282-F310 HydrophobicContact CG2-CZ 3.93Å
283	E	69.9	Low	79.8	Confident	100 Å²	100	67.5 Å²	67.5	47%	0.467	33%	0.332	S	S	.	.	H	α-helix	trans	-64.7	-49.3	178.5	175.3	178.2	-165	0	0	112.7	H280 Y281 N285 K313	H280-E283 IonicContact CE1-OE2 3.24Å; H280-E283 IonicContact ND1-OE2 3.66Å; H280-E283 PolarHBondContact ND1-OE2 3.09Å; H280-E283 WeakPolarHBondContact O-CB 3.5Å; H280-E283 PolarHBondContact O-N 3.4Å; Y281-E283 PolarHBondContact O-N 3Å; E283-N285 VanDerWaalsContact C-N 3.3Å; E283-N285 PolarHBondContact O-N 3Å; E283-K313 VanDerWaalsContact CB-NZ 3.32Å; E283-K313 VanDerWaalsContact CD-CE 3.42Å; E283-K313 VanDerWaalsContact CG-CE 3.49Å; E283-K313 IonicContact OE1-NZ 2.69Å; E283-K313 IonicContact OE2-NZ 2.65Å; E283-K313 PolarHBondContact OE2-NZ 3.01Å
284	T	71.4	Confident	80.1	Confident	73 Å²	73	72.7 Å²	72.7	45%	0.448	36%	0.356	S	S	.	.	H	α-helix	trans	-75.5	-22.8	-177	50.2	0	0	0	0	112.2	H280 Y281	H280-T284 PolarHBondContact O-N 2.6Å; H280-T284 PolarHBondContact O-OG1 3.37Å; Y281-T284 PolarHBondContact O-N 3.05Å; Y281-T284 PolarHBondContact O-OG1 3.45Å
285	N	75.3	Confident	80.3	Confident	69 Å²	69	70.3 Å²	70.3	37%	0.369	35%	0.347	S	S	.	.			trans	-136.4	77.2	-175.8	-65	-87.7	0	0	0	111.9	Y281 V282 E283 R287 L288	Y281-N285 WeakPolarHBondContact O-CB 3.42Å; Y281-N285 PolarHBondContact O-N 2.88Å; V282-N285 CarbonylContact O-C 3.52Å; E283-N285 VanDerWaalsContact C-N 3.3Å; E283-N285 PolarHBondContact O-N 3Å; N285-R287 PolarHBondContact O-N 3.49Å; N285-L288 HydrophobicContact CB-CB 4.44Å; N285-L288 HydrophobicContact CB-CD1 3.94Å; N285-L288 HydrophobicContact CB-CG 4.16Å; N285-L288 WeakPolarHBondContact O-CB 3.29Å; N285-L288 PolarHBondContact O-N 3.4Å
286	P	73.5	Confident	80.5	Confident	93 Å²	93	69.5 Å²	69.5	60%	0.604	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-57.2	-26.4	-178.9	-26.2	34.4	0	0	0	114.1	L288 L289	P286-L288 PolarHBondContact O-N 2.76Å; P286-L289 WeakPolarHBondContact O-CB 3.26Å; P286-L289 PolarHBondContact O-N 3.46Å
287	R	78.9	Confident	80.7	Confident	247 Å²	247	72.7 Å²	72.7	93%	0.932	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-61.2	-22.4	175	-63.2	-178.2	-177.4	176.5	0.7	113.2	N285	N285-R287 PolarHBondContact O-N 3.49Å
288	L	77.3	Confident	81	Confident	71 Å²	71	77.3 Å²	77.3	37%	0.372	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-96.4	7.5	178.6	-58.7	179.3	0	0	0	112.6	N285 P286 V290 L291 K292	N285-L288 HydrophobicContact CB-CB 4.44Å; N285-L288 HydrophobicContact CB-CD1 3.94Å; N285-L288 HydrophobicContact CB-CG 4.16Å; N285-L288 WeakPolarHBondContact O-CB 3.29Å; N285-L288 PolarHBondContact O-N 3.4Å; P286-L288 PolarHBondContact O-N 2.76Å; L288-V290 VanDerWaalsContact C-N 3.34Å; L288-V290 PolarHBondContact O-N 2.87Å; L288-L291 PolarHBondContact O-N 2.92Å; L288-K292 HydrophobicContact CB-CG 4.27Å; L288-K292 WeakPolarHBondContact O-CB 3.35Å; L288-K292 WeakPolarHBondContact O-CG 3.39Å; L288-K292 PolarHBondContact O-N 3.16Å
289	L	80.3	Confident	81.2	Confident	61 Å²	61	80.2 Å²	80.2	32%	0.319	39%	0.391	S	S	.	.	H	α-helix	trans	-53.4	-47.7	-176.3	174.9	64.7	0	0	0	112.3	V282 P286 K292 K293 F310	V282-L289 HydrophobicContact CG1-CB 4.41Å; V282-L289 HydrophobicContact CG1-CD1 3.33Å; V282-L289 HydrophobicContact CG1-CG 4.47Å; P286-L289 WeakPolarHBondContact O-CB 3.26Å; P286-L289 PolarHBondContact O-N 3.46Å; L289-K292 PolarHBondContact O-N 3.39Å; L289-K293 WeakPolarHBondContact O-CB 3.45Å; L289-K293 PolarHBondContact O-N 3.48Å; L289-F310 HydrophobicContact CD1-CD1 4.01Å; L289-F310 HydrophobicContact CD1-CD2 3.75Å; L289-F310 HydrophobicContact CD1-CE1 4.17Å; L289-F310 HydrophobicContact CD1-CE2 3.89Å; L289-F310 HydrophobicContact CD1-CG 3.83Å; L289-F310 HydrophobicContact CD1-CZ 4.11Å
290	V	82.3	Confident	81.4	Confident	107 Å²	107	82.3 Å²	82.3	65%	0.648	41%	0.413	S	S	*	.	H	α-helix	trans	-60.3	-53.5	-178.9	178.2	0	0	0	0	110.7	L288 K292 K293 E294	L288-V290 VanDerWaalsContact C-N 3.34Å; L288-V290 PolarHBondContact O-N 2.87Å; V290-K292 VanDerWaalsContact C-N 3.31Å; V290-K292 PolarHBondContact O-N 2.97Å; V290-K293 PolarHBondContact O-N 2.85Å; V290-E294 PolarHBondContact O-N 2.92Å
291	L	81.8	Confident	81.9	Confident	98 Å²	98	78.4 Å²	78.4	51%	0.513	40%	0.395	S	S	.	.	H	α-helix	trans	-61.4	-38.6	-178.4	-176.9	134.6	0	0	0	112.4	L288 M295	L288-L291 PolarHBondContact O-N 2.92Å; L291-M295 PolarHBondContact O-N 3.1Å; L291-M295 VanDerWaalsContact O-N 3.13Å
292	K	81.8	Confident	82.4	Confident	37 Å²	37	74.5 Å²	74.5	16%	0.161	39%	0.393	C	S	.	.	H	α-helix	trans	-80.9	-29.6	178.8	-67.7	-63.6	-177.4	-175.7	0	113	V282 L288 L289 V290 E294 M295 L296	V282-K292 HydrophobicContact CG2-CB 3.23Å; V282-K292 HydrophobicContact CG2-CG 3.98Å; L288-K292 HydrophobicContact CB-CG 4.27Å; L288-K292 WeakPolarHBondContact O-CB 3.35Å; L288-K292 WeakPolarHBondContact O-CG 3.39Å; L288-K292 PolarHBondContact O-N 3.16Å; L289-K292 PolarHBondContact O-N 3.39Å; V290-K292 VanDerWaalsContact C-N 3.31Å; V290-K292 PolarHBondContact O-N 2.97Å; K292-E294 VanDerWaalsContact C-N 3.35Å; K292-M295 HydrophobicContact CD-SD 4.03Å; K292-M295 PolarHBondContact O-N 3.43Å; K292-L296 VanDerWaalsContact O-CG 3.3Å; K292-L296 WeakPolarHBondContact O-CG 3.44Å; K292-L296 PolarHBondContact O-N 3.12Å
293	K	83.9	Confident	83.1	Confident	41 Å²	41	78.5 Å²	78.5	18%	0.178	41%	0.411	C	S	.	.	H	α-helix	trans	-61.5	-45.7	169.9	-173.7	-177	-179.1	-168.4	0	109.4	L289 V290 M295 L296 K297 E303 L306 E307 F310	L289-K293 WeakPolarHBondContact O-CB 3.45Å; L289-K293 PolarHBondContact O-N 3.48Å; V290-K293 PolarHBondContact O-N 2.85Å; K293-M295 PolarHBondContact O-N 3.37Å; K293-L296 PolarHBondContact O-N 3.5Å; K293-K297 WeakPolarHBondContact O-CG 3.06Å; K293-K297 PolarHBondContact O-N 3.21Å; K293-E303 IonicContact NZ-OE1 2.79Å; K293-E303 PolarHBondContact NZ-OE1 2.68Å; K293-L306 HydrophobicContact CG-CB 4.46Å; K293-L306 HydrophobicContact CG-CD1 4.19Å; K293-E307 IonicContact NZ-OE1 3.85Å; K293-E307 PolarHBondContact NZ-OE1 3.29Å; K293-F310 HydrophobicContact CB-CE2 4.33Å; K293-F310 HydrophobicContact CG-CE2 4.29Å
294	E	87.4	Confident	84	Confident	118 Å²	118	81.9 Å²	81.9	55%	0.551	43%	0.427	S	S	*	.	H	α-helix	trans	-60.2	-44.3	173.6	-72.3	-175.4	156.2	0	0	112.3	V290 K292 L296 K297 N298	V290-E294 PolarHBondContact O-N 2.92Å; K292-E294 VanDerWaalsContact C-N 3.35Å; E294-L296 VanDerWaalsContact C-N 3.33Å; E294-L296 PolarHBondContact O-N 3.5Å; E294-K297 WeakPolarHBondContact O-CB 3.38Å; E294-K297 PolarHBondContact O-N 3.16Å; E294-N298 VanDerWaalsContact O-CG 3.27Å; E294-N298 PolarHBondContact O-N 2.82Å; E294-N298 PolarHBondContact O-ND2 3.01Å
295	M	88.2	Confident	84.9	Confident	66 Å²	66	79.5 Å²	79.5	33%	0.325	41%	0.411	S	S	.	.	H	α-helix	trans	-58.8	-42.8	175.1	-178.6	176.1	-79	0	0	112.3	A278 L291 K292 K293 N298 F299	A278-M295 HydrophobicContact CB-SD 4.28Å; L291-M295 PolarHBondContact O-N 3.1Å; L291-M295 VanDerWaalsContact O-N 3.13Å; K292-M295 HydrophobicContact CD-SD 4.03Å; K292-M295 PolarHBondContact O-N 3.43Å; K293-M295 PolarHBondContact O-N 3.37Å; M295-N298 PolarHBondContact O-N 3.39Å; M295-F299 HydrophobicContact CG-CD2 4.27Å; M295-F299 HydrophobicContact CG-CE1 4.4Å; M295-F299 HydrophobicContact CG-CE2 3.55Å; M295-F299 HydrophobicContact CG-CZ 3.62Å; M295-F299 WeakPolarHBondContact O-CD2 2.99Å; M295-F299 VanDerWaalsContact O-CG 3.28Å; M295-F299 WeakPolarHBondContact O-CG 3.5Å; M295-F299 PolarHBondContact O-N 2.76Å; M295-F299 VanDerWaalsContact O-N 3.11Å; M295-F299 HydrophobicContact SD-CE2 4.18Å; M295-F299 HydrophobicContact SD-CZ 4.17Å
296	L	89.7	Confident	85.6	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-69.3	-37	177.3	-69.7	166.2	0	0	0	112.2	A278 F279 K292 K293 E294 N298 F299 G300 F301 L306 F310	A278-L296 HydrophobicContact CB-CD2 3.88Å; A278-L296 HydrophobicContact CB-CG 4.28Å; F279-L296 HydrophobicContact CD1-CD1 3.91Å; F279-L296 HydrophobicContact CD1-CD2 4.42Å; F279-L296 HydrophobicContact CD2-CD2 3.73Å; F279-L296 HydrophobicContact CE1-CD1 3.84Å; F279-L296 HydrophobicContact CE1-CD2 4.26Å; F279-L296 HydrophobicContact CE2-CD2 3.53Å; F279-L296 HydrophobicContact CG-CD1 4.32Å; F279-L296 HydrophobicContact CG-CD2 4.18Å; F279-L296 HydrophobicContact CZ-CD1 4.18Å; F279-L296 HydrophobicContact CZ-CD2 3.81Å; K292-L296 VanDerWaalsContact O-CG 3.3Å; K292-L296 WeakPolarHBondContact O-CG 3.44Å; K292-L296 PolarHBondContact O-N 3.12Å; K293-L296 PolarHBondContact O-N 3.5Å; E294-L296 VanDerWaalsContact C-N 3.33Å; E294-L296 PolarHBondContact O-N 3.5Å; L296-N298 VanDerWaalsContact C-N 3.32Å; L296-N298 PolarHBondContact O-N 3.26Å; L296-F299 HydrophobicContact CD2-CD2 4.17Å; L296-F299 WeakPolarHBondContact O-CA 3.46Å; L296-F299 WeakPolarHBondContact O-CB 3.34Å; L296-F299 PolarHBondContact O-N 3.31Å; L296-F299 VanDerWaalsContact O-N 3.08Å; L296-G300 PolarHBondContact O-N 3.14Å; L296-F301 HydrophobicContact CB-CD2 4.32Å; L296-F301 HydrophobicContact CD2-CD2 4.16Å; L296-F301 HydrophobicContact CD2-CE2 4.26Å; L296-F301 WeakPolarHBondContact O-CD2 3.5Å; L296-F301 PolarHBondContact O-N 3.49Å; L296-L306 HydrophobicContact CB-CD1 3.89Å; L296-L306 HydrophobicContact CB-CD2 3.75Å; L296-L306 HydrophobicContact CB-CG 4.5Å; L296-L306 HydrophobicContact CD1-CD2 3.87Å; L296-L306 HydrophobicContact CG-CD2 4.38Å; L296-F310 HydrophobicContact CD1-CE2 4.43Å; L296-F310 HydrophobicContact CD1-CZ 3.74Å
297	K	89.6	Confident	86.3	Confident	71 Å²	71	75.5 Å²	75.5	31%	0.309	38%	0.381	S	S	.	.	H	α-helix	trans	-58.7	-45.3	170.6	-72.6	-175	-176.6	-168.7	0	111.1	K293 E294 F299 G300 E303 L306	K293-K297 WeakPolarHBondContact O-CG 3.06Å; K293-K297 PolarHBondContact O-N 3.21Å; E294-K297 WeakPolarHBondContact O-CB 3.38Å; E294-K297 PolarHBondContact O-N 3.16Å; K297-F299 PolarHBondContact O-N 2.96Å; K297-G300 WeakPolarHBondContact O-CA 3.25Å; K297-G300 PolarHBondContact O-N 2.97Å; K297-E303 WeakPolarHBondContact CE-OE1 3.27Å; K297-E303 IonicContact NZ-OE1 2.78Å; K297-E303 PolarHBondContact NZ-OE1 2.94Å; K297-E303 IonicContact NZ-OE2 2.63Å; K297-E303 PolarHBondContact NZ-OE2 3.31Å; K297-L306 HydrophobicContact CB-CD1 4.48Å; K297-L306 HydrophobicContact CG-CD1 3.6Å
298	N	88.6	Confident	86.8	Confident	140 Å²	140	64.3 Å²	64.3	75%	0.749	34%	0.343	S	S	*	.	H	α-helix	trans	-64.2	-22	176.5	-67.7	-19.6	0	0	0	113	E294 M295 L296 G300	E294-N298 VanDerWaalsContact O-CG 3.27Å; E294-N298 PolarHBondContact O-N 2.82Å; E294-N298 PolarHBondContact O-ND2 3.01Å; M295-N298 PolarHBondContact O-N 3.39Å; L296-N298 VanDerWaalsContact C-N 3.32Å; L296-N298 PolarHBondContact O-N 3.26Å; N298-G300 VanDerWaalsContact C-N 3.26Å
299	F	88.6	Confident	87.3	Confident	64 Å²	64	61.1 Å²	61.1	28%	0.281	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-1.4	171.3	-64.4	-29	0	0	0	114.1	K275 A278 M295 L296 K297 F301	K275-F299 HydrophobicContact CB-CD2 4.24Å; K275-F299 HydrophobicContact CB-CE2 4.49Å; K275-F299 HydrophobicContact CD-CB 4.3Å; K275-F299 HydrophobicContact CD-CG 4.38Å; K275-F299 HydrophobicContact CG-CB 4.1Å; K275-F299 HydrophobicContact CG-CD1 4.36Å; K275-F299 HydrophobicContact CG-CD2 3.49Å; K275-F299 VanDerWaalsContact CG-CD2 3.49Å; K275-F299 HydrophobicContact CG-CE2 3.87Å; K275-F299 HydrophobicContact CG-CG 3.75Å; K275-F299 HydrophobicContact CG-CZ 4.46Å; A278-F299 HydrophobicContact CB-CE2 4.3Å; M295-F299 HydrophobicContact CG-CD2 4.27Å; M295-F299 HydrophobicContact CG-CE1 4.4Å; M295-F299 HydrophobicContact CG-CE2 3.55Å; M295-F299 HydrophobicContact CG-CZ 3.62Å; M295-F299 WeakPolarHBondContact O-CD2 2.99Å; M295-F299 VanDerWaalsContact O-CG 3.28Å; M295-F299 WeakPolarHBondContact O-CG 3.5Å; M295-F299 PolarHBondContact O-N 2.76Å; M295-F299 VanDerWaalsContact O-N 3.11Å; M295-F299 HydrophobicContact SD-CE2 4.18Å; M295-F299 HydrophobicContact SD-CZ 4.17Å; L296-F299 HydrophobicContact CD2-CD2 4.17Å; L296-F299 WeakPolarHBondContact O-CA 3.46Å; L296-F299 WeakPolarHBondContact O-CB 3.34Å; L296-F299 PolarHBondContact O-N 3.31Å; L296-F299 VanDerWaalsContact O-N 3.08Å; K297-F299 PolarHBondContact O-N 2.96Å; F299-F301 HydrophobicContact CB-CD2 4.05Å; F299-F301 HydrophobicContact CB-CE2 4.16Å
300	G	88.8	Confident	87.6	Confident	48 Å²	48	59.1 Å²	59.1	50%	0.495	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.1	5.4	176.7	0	0	0	0	0	114.8	P230 L296 K297 N298	P230-G300 WeakPolarHBondContact CB-O 3.22Å; L296-G300 PolarHBondContact O-N 3.14Å; K297-G300 WeakPolarHBondContact O-CA 3.25Å; K297-G300 PolarHBondContact O-N 2.97Å; N298-G300 VanDerWaalsContact C-N 3.26Å
301	F	89.3	Confident	87.8	Confident	9 Å²	9	60.2 Å²	60.2	4%	0.039	31%	0.313	C	S	.	.			trans	-74.8	128.4	175.3	-67.4	-84.6	0	0	0	110.4	W229 P230 F279 L296 F299 F305 L306	W229-F301 HydrophobicContact CD2-CZ 4.16Å; W229-F301 HydrophobicContact CE3-CE1 4.34Å; W229-F301 AromaticContact CE3-CZ 3.9Å; W229-F301 HydrophobicContact CE3-CZ 3.9Å; W229-F301 HydrophobicContact CH2-CZ 4.25Å; W229-F301 HydrophobicContact CZ2-CZ 4.49Å; W229-F301 AromaticContact CZ3-CZ 3.94Å; W229-F301 HydrophobicContact CZ3-CZ 3.94Å; P230-F301 HydrophobicContact CG-CD1 4.45Å; P230-F301 HydrophobicContact CG-CD2 4.43Å; P230-F301 HydrophobicContact CG-CE1 4.29Å; P230-F301 HydrophobicContact CG-CE2 4.26Å; P230-F301 HydrophobicContact CG-CZ 4.18Å; F279-F301 HydrophobicContact CE2-CD1 4.42Å; F279-F301 HydrophobicContact CE2-CD2 4.31Å; F279-F301 AromaticContact CE2-CE1 3.93Å; F279-F301 HydrophobicContact CE2-CE1 3.93Å; F279-F301 AromaticContact CE2-CE2 3.82Å; F279-F301 HydrophobicContact CE2-CE2 3.82Å; F279-F301 AromaticContact CE2-CZ 3.61Å; F279-F301 HydrophobicContact CE2-CZ 3.61Å; F279-F301 AromaticContact CZ-CD1 3.99Å; F279-F301 HydrophobicContact CZ-CD1 3.99Å; F279-F301 HydrophobicContact CZ-CD2 4.29Å; F279-F301 AromaticContact CZ-CE1 3.9Å; F279-F301 HydrophobicContact CZ-CE1 3.9Å; F279-F301 HydrophobicContact CZ-CE2 4.21Å; F279-F301 HydrophobicContact CZ-CG 4.2Å; F279-F301 HydrophobicContact CZ-CZ 4.03Å; L296-F301 HydrophobicContact CB-CD2 4.32Å; L296-F301 HydrophobicContact CD2-CD2 4.16Å; L296-F301 HydrophobicContact CD2-CE2 4.26Å; L296-F301 WeakPolarHBondContact O-CD2 3.5Å; L296-F301 PolarHBondContact O-N 3.49Å; F299-F301 HydrophobicContact CB-CD2 4.05Å; F299-F301 HydrophobicContact CB-CE2 4.16Å; F301-F305 HydrophobicContact CD1-CD1 4.03Å; F301-F305 AromaticContact CD1-CE1 3.88Å; F301-F305 HydrophobicContact CD1-CE1 3.88Å; F301-F305 HydrophobicContact CE1-CE1 4.37Å; F301-L306 HydrophobicContact CB-CD1 4.05Å; F301-L306 HydrophobicContact CB-CD2 3.76Å; F301-L306 HydrophobicContact CB-CG 3.88Å; F301-L306 HydrophobicContact CG-CD2 4.35Å
302	G	88.5	Confident	88	Confident	43 Å²	43	56.7 Å²	56.7	44%	0.443	30%	0.297	S	S	.	.			trans	-62.8	147.7	179	0	0	0	0	0	112.6	E304 F305 L306	G302-E304 PolarHBondContact O-N 3.29Å; G302-F305 WeakPolarHBondContact O-CB 3.45Å; G302-F305 PolarHBondContact O-N 2.91Å; G302-L306 WeakPolarHBondContact O-CG 3.31Å; G302-L306 PolarHBondContact O-N 3.3Å
303	E	89.4	Confident	87.9	Confident	92 Å²	92	57.3 Å²	57.3	43%	0.43	30%	0.299	S	S	.	.	H	α-helix	trans	-60.8	-47.1	-178.1	176.6	146.9	-141.5	0	0	112.7	K293 K297 F305 L306 E307	K293-E303 IonicContact NZ-OE1 2.79Å; K293-E303 PolarHBondContact NZ-OE1 2.68Å; K297-E303 WeakPolarHBondContact CE-OE1 3.27Å; K297-E303 IonicContact NZ-OE1 2.78Å; K297-E303 PolarHBondContact NZ-OE1 2.94Å; K297-E303 IonicContact NZ-OE2 2.63Å; K297-E303 PolarHBondContact NZ-OE2 3.31Å; E303-F305 VanDerWaalsContact C-N 3.28Å; E303-F305 PolarHBondContact O-N 2.72Å; E303-L306 PolarHBondContact O-N 3.19Å; E303-L306 VanDerWaalsContact O-N 3.11Å; E303-E307 HydrophobicContact CG-CG 4.45Å; E303-E307 WeakPolarHBondContact O-CG 3.46Å; E303-E307 PolarHBondContact O-N 3.5Å
304	E	88.7	Confident	87.7	Confident	172 Å²	172	62.2 Å²	62.2	80%	0.804	33%	0.327	S	S	*	.	H	α-helix	trans	-59.3	-39.6	177.2	-63.4	-179.7	175.6	0	0	112	G302 G308	G302-E304 PolarHBondContact O-N 3.29Å; E304-G308 PolarHBondContact O-N 3.44Å
305	F	90.5	Very high	87.6	Confident	23 Å²	23	58.8 Å²	58.8	10%	0.101	32%	0.32	C	S	.	.	H	α-helix	trans	-63.8	-45.1	175.9	176.1	-91.1	0	0	0	111.2	L225 Y228 F279 F301 G302 E303 F309 F321 L322 Q325	L225-F305 HydrophobicContact CD2-CZ 4.2Å; Y228-F305 HydrophobicContact CD2-CE2 4.38Å; Y228-F305 HydrophobicContact CG-CE2 4.04Å; F279-F305 HydrophobicContact CE1-CE1 4.5Å; F279-F305 HydrophobicContact CZ-CE1 4.22Å; F301-F305 HydrophobicContact CD1-CD1 4.03Å; F301-F305 AromaticContact CD1-CE1 3.88Å; F301-F305 HydrophobicContact CD1-CE1 3.88Å; F301-F305 HydrophobicContact CE1-CE1 4.37Å; G302-F305 WeakPolarHBondContact O-CB 3.45Å; G302-F305 PolarHBondContact O-N 2.91Å; E303-F305 VanDerWaalsContact C-N 3.28Å; E303-F305 PolarHBondContact O-N 2.72Å; F305-F309 WeakPolarHBondContact O-CB 3.06Å; F305-F309 PolarHBondContact O-N 3.36Å; F305-F321 HydrophobicContact CD2-CE1 4.17Å; F305-F321 HydrophobicContact CD2-CZ 4.09Å; F305-F321 HydrophobicContact CE2-CE1 4.05Å; F305-F321 HydrophobicContact CE2-CZ 4.42Å; F305-F321 WeakPolarHBondContact O-CZ 3.39Å; F305-L322 HydrophobicContact CE2-CD2 3.92Å; F305-L322 HydrophobicContact CZ-CD2 3.91Å; F305-Q325 HydrophobicContact CD2-CG 4.19Å; F305-Q325 HydrophobicContact CE2-CG 4.2Å
306	L	90.1	Very high	87.4	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-66.2	-43.8	-179.7	-68.4	174.8	0	0	0	111.8	F279 K293 L296 K297 F301 G302 E303 F309 F310	F279-L306 HydrophobicContact CE1-CD2 3.97Å; F279-L306 HydrophobicContact CZ-CD2 4.11Å; K293-L306 HydrophobicContact CG-CB 4.46Å; K293-L306 HydrophobicContact CG-CD1 4.19Å; L296-L306 HydrophobicContact CB-CD1 3.89Å; L296-L306 HydrophobicContact CB-CD2 3.75Å; L296-L306 HydrophobicContact CB-CG 4.5Å; L296-L306 HydrophobicContact CD1-CD2 3.87Å; L296-L306 HydrophobicContact CG-CD2 4.38Å; K297-L306 HydrophobicContact CB-CD1 4.48Å; K297-L306 HydrophobicContact CG-CD1 3.6Å; F301-L306 HydrophobicContact CB-CD1 4.05Å; F301-L306 HydrophobicContact CB-CD2 3.76Å; F301-L306 HydrophobicContact CB-CG 3.88Å; F301-L306 HydrophobicContact CG-CD2 4.35Å; G302-L306 WeakPolarHBondContact O-CG 3.31Å; G302-L306 PolarHBondContact O-N 3.3Å; E303-L306 PolarHBondContact O-N 3.19Å; E303-L306 VanDerWaalsContact O-N 3.11Å; L306-F309 PolarHBondContact O-N 2.83Å; L306-F310 HydrophobicContact CB-CD2 4.46Å; L306-F310 HydrophobicContact CB-CE2 4.16Å; L306-F310 HydrophobicContact CD2-CE2 4.35Å; L306-F310 WeakPolarHBondContact O-CD2 3.44Å; L306-F310 WeakPolarHBondContact O-CG 3.24Å; L306-F310 PolarHBondContact O-N 3.28Å
307	E	88.3	Confident	87.2	Confident	77 Å²	77	65.9 Å²	65.9	36%	0.36	37%	0.365	S	S	.	.	H	α-helix	trans	-60.8	-53.2	176.1	-72.7	178.7	174.4	0	0	111.1	K293 E303 F309 F310 E311	K293-E307 IonicContact NZ-OE1 3.85Å; K293-E307 PolarHBondContact NZ-OE1 3.29Å; E303-E307 HydrophobicContact CG-CG 4.45Å; E303-E307 WeakPolarHBondContact O-CG 3.46Å; E303-E307 PolarHBondContact O-N 3.5Å; E307-F309 VanDerWaalsContact C-N 3.26Å; E307-F309 PolarHBondContact O-N 3.41Å; E307-F310 PolarHBondContact O-N 3.2Å; E307-E311 WeakPolarHBondContact O-CB 3.32Å; E307-E311 WeakPolarHBondContact O-CG 3.44Å; E307-E311 PolarHBondContact O-N 2.9Å
308	G	88.9	Confident	86.9	Confident	12 Å²	12	63.5 Å²	63.5	12%	0.124	36%	0.357	C	S	.	.	H	α-helix	trans	-59.7	-37	177.5	0	0	0	0	0	112.6	E304 S312 F321	E304-G308 PolarHBondContact O-N 3.44Å; G308-S312 WeakPolarHBondContact O-CB 3.34Å; G308-S312 PolarHBondContact O-N 3.49Å; G308-S312 PolarHBondContact O-OG 3.23Å; G308-F321 VanDerWaalsContact C-CE2 3.43Å; G308-F321 VanDerWaalsContact C-CZ 3.46Å; G308-F321 VanDerWaalsContact CA-CE2 3.44Å
309	F	89	Confident	86.5	Confident	5 Å²	5	61 Å²	61	2%	0.022	34%	0.34	C	S	.	.	H	α-helix	trans	-63.8	-49.9	175.9	179.6	-94.7	0	0	0	111.7	L225 F279 F305 L306 E307 K313 V318 F321 L322	L225-F309 HydrophobicContact CD1-CE2 4.36Å; L225-F309 HydrophobicContact CD1-CZ 4.29Å; L225-F309 HydrophobicContact CD2-CD2 4Å; L225-F309 HydrophobicContact CD2-CE2 3.55Å; L225-F309 HydrophobicContact CD2-CZ 4.13Å; L225-F309 HydrophobicContact CG-CE2 4.19Å; F279-F309 AromaticContact CD1-CD1 3.95Å; F279-F309 HydrophobicContact CD1-CD1 3.95Å; F279-F309 AromaticContact CD1-CE1 3.53Å; F279-F309 HydrophobicContact CD1-CE1 3.53Å; F279-F309 AromaticContact CD1-CZ 3.94Å; F279-F309 HydrophobicContact CD1-CZ 3.94Å; F279-F309 AromaticContact CE1-CD1 3.97Å; F279-F309 HydrophobicContact CE1-CD1 3.97Å; F279-F309 HydrophobicContact CE1-CE1 4.01Å; F279-F309 HydrophobicContact CE1-CG 4.37Å; F279-F309 HydrophobicContact CE1-CZ 4.42Å; F305-F309 WeakPolarHBondContact O-CB 3.06Å; F305-F309 PolarHBondContact O-N 3.36Å; L306-F309 PolarHBondContact O-N 2.83Å; E307-F309 VanDerWaalsContact C-N 3.26Å; E307-F309 PolarHBondContact O-N 3.41Å; F309-K313 HydrophobicContact CE1-CD 4.11Å; F309-K313 HydrophobicContact CZ-CD 4.38Å; F309-K313 VanDerWaalsContact O-CB 3.27Å; F309-K313 WeakPolarHBondContact O-CB 3.26Å; F309-K313 PolarHBondContact O-N 3.2Å; F309-V318 HydrophobicContact CD2-CG1 4.07Å; F309-V318 HydrophobicContact CE2-CG1 3.56Å; F309-V318 HydrophobicContact CZ-CG1 4.33Å; F309-F321 VanDerWaalsContact CA-CE1 3.48Å; F309-F321 HydrophobicContact CB-CD1 4.3Å; F309-F321 HydrophobicContact CB-CE1 3.73Å; F309-F321 HydrophobicContact CB-CZ 4.39Å; F309-F321 HydrophobicContact CD2-CD1 4.47Å; F309-F321 HydrophobicContact CD2-CE1 4.38Å; F309-F321 VanDerWaalsContact N-CZ 3.35Å; F309-L322 HydrophobicContact CD2-CD2 4.18Å; F309-L322 HydrophobicContact CE2-CD1 4.48Å
310	F	86	Confident	86.4	Confident	18 Å²	18	63.3 Å²	63.3	8%	0.079	35%	0.352	C	S	.	.	H	α-helix	trans	-70.1	-40.2	-177.7	-66.6	-51.4	0	0	0	112.6	V282 L289 K293 L296 L306 E307 K313 N314	V282-F310 HydrophobicContact CB-CE1 3.78Å; V282-F310 HydrophobicContact CB-CZ 4.22Å; V282-F310 HydrophobicContact CG1-CD1 3.75Å; V282-F310 HydrophobicContact CG1-CE1 3.27Å; V282-F310 HydrophobicContact CG1-CZ 3.83Å; V282-F310 HydrophobicContact CG2-CE1 4.01Å; V282-F310 HydrophobicContact CG2-CZ 3.93Å; L289-F310 HydrophobicContact CD1-CD1 4.01Å; L289-F310 HydrophobicContact CD1-CD2 3.75Å; L289-F310 HydrophobicContact CD1-CE1 4.17Å; L289-F310 HydrophobicContact CD1-CE2 3.89Å; L289-F310 HydrophobicContact CD1-CG 3.83Å; L289-F310 HydrophobicContact CD1-CZ 4.11Å; K293-F310 HydrophobicContact CB-CE2 4.33Å; K293-F310 HydrophobicContact CG-CE2 4.29Å; L296-F310 HydrophobicContact CD1-CE2 4.43Å; L296-F310 HydrophobicContact CD1-CZ 3.74Å; L306-F310 HydrophobicContact CB-CD2 4.46Å; L306-F310 HydrophobicContact CB-CE2 4.16Å; L306-F310 HydrophobicContact CD2-CE2 4.35Å; L306-F310 WeakPolarHBondContact O-CD2 3.44Å; L306-F310 WeakPolarHBondContact O-CG 3.24Å; L306-F310 PolarHBondContact O-N 3.28Å; E307-F310 PolarHBondContact O-N 3.2Å; F310-K313 PolarHBondContact O-N 3.15Å; F310-N314 PolarHBondContact O-N 2.84Å; F310-N314 PolarHBondContact O-ND2 2.76Å
311	E	86.7	Confident	86.4	Confident	131 Å²	131	62.2 Å²	62.2	61%	0.612	33%	0.334	S	S	*	.	H	α-helix	trans	-61.9	-46.8	174.1	-72.5	-180	177.5	0	0	111.6	E307 K313 N314 A315	E307-E311 WeakPolarHBondContact O-CB 3.32Å; E307-E311 WeakPolarHBondContact O-CG 3.44Å; E307-E311 PolarHBondContact O-N 2.9Å; E311-K313 PolarHBondContact O-N 2.83Å; E311-N314 PolarHBondContact O-N 3.48Å; E311-A315 PolarHBondContact O-N 3.14Å
312	S	85.5	Confident	86.2	Confident	24 Å²	24	61.8 Å²	61.8	17%	0.168	33%	0.332	C	S	.	.	H	α-helix	trans	-66.6	-30.7	178.8	-58.4	0	0	0	0	111.7	G308 A315 G316 R317 V318 F321	G308-S312 WeakPolarHBondContact O-CB 3.34Å; G308-S312 PolarHBondContact O-N 3.49Å; G308-S312 PolarHBondContact O-OG 3.23Å; S312-A315 CarbonylContact O-C 3.54Å; S312-A315 PolarHBondContact O-N 3.08Å; S312-G316 PolarHBondContact O-N 3.43Å; S312-G316 VanDerWaalsContact O-N 3.17Å; S312-R317 CarbonylContact O-C 3.49Å; S312-R317 WeakPolarHBondContact O-CA 3.27Å; S312-R317 PolarHBondContact O-N 2.97Å; S312-V318 PolarHBondContact O-N 3.39Å; S312-F321 WeakPolarHBondContact OG-CB 3.3Å; S312-F321 WeakPolarHBondContact OG-CG 3.17Å
313	K	79.4	Confident	85.9	Confident	50 Å²	50	65.3 Å²	65.3	22%	0.217	34%	0.34	C	S	.	.	H	α-helix	trans	-67.1	-48.2	173.1	-168.8	165.7	-174.1	157.9	0	112.6	E283 F309 F310 E311 A315 G316 V318	E283-K313 VanDerWaalsContact CB-NZ 3.32Å; E283-K313 VanDerWaalsContact CD-CE 3.42Å; E283-K313 VanDerWaalsContact CG-CE 3.49Å; E283-K313 IonicContact OE1-NZ 2.69Å; E283-K313 IonicContact OE2-NZ 2.65Å; E283-K313 PolarHBondContact OE2-NZ 3.01Å; F309-K313 HydrophobicContact CE1-CD 4.11Å; F309-K313 HydrophobicContact CZ-CD 4.38Å; F309-K313 VanDerWaalsContact O-CB 3.27Å; F309-K313 WeakPolarHBondContact O-CB 3.26Å; F309-K313 PolarHBondContact O-N 3.2Å; F310-K313 PolarHBondContact O-N 3.15Å; E311-K313 PolarHBondContact O-N 2.83Å; K313-A315 PolarHBondContact O-N 2.85Å; K313-A315 VanDerWaalsContact O-N 3.16Å; K313-G316 PolarHBondContact O-N 2.85Å; K313-V318 HydrophobicContact CB-CG2 3.52Å; K313-V318 HydrophobicContact CD-CG2 4.39Å; K313-V318 HydrophobicContact CG-CG2 3.76Å
314	N	80.1	Confident	85.7	Confident	143 Å²	143	69.2 Å²	69.2	77%	0.765	36%	0.355	S	S	*	.	H	α-helix	trans	-58.4	-29.1	174.8	-69.3	-21.6	0	0	0	112.1	F310 E311	F310-N314 PolarHBondContact O-N 2.84Å; F310-N314 PolarHBondContact O-ND2 2.76Å; E311-N314 PolarHBondContact O-N 3.48Å
315	A	85.7	Confident	85.5	Confident	47 Å²	47	64 Å²	64	39%	0.388	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	3.7	176.4	0	0	0	0	0	115.1	E311 S312 K313 R317	E311-A315 PolarHBondContact O-N 3.14Å; S312-A315 CarbonylContact O-C 3.54Å; S312-A315 PolarHBondContact O-N 3.08Å; K313-A315 PolarHBondContact O-N 2.85Å; K313-A315 VanDerWaalsContact O-N 3.16Å; A315-R317 VanDerWaalsContact C-N 3.26Å; A315-R317 PolarHBondContact O-N 3.43Å
316	G	83.2	Confident	85.1	Confident	72 Å²	72	68.8 Å²	68.8	74%	0.742	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	21.3	-178	0	0	0	0	0	114.8	S312 K313	S312-G316 PolarHBondContact O-N 3.43Å; S312-G316 VanDerWaalsContact O-N 3.17Å; K313-G316 PolarHBondContact O-N 2.85Å
317	R	86.2	Confident	84.9	Confident	142 Å²	142	71.9 Å²	71.9	54%	0.536	38%	0.382	S	S	.	.			trans	-120.3	22.8	-171.2	-71.9	-177.4	-77.7	176	-0.6	113.7	S312 A315 Q319 Q320 F321	S312-R317 CarbonylContact O-C 3.49Å; S312-R317 WeakPolarHBondContact O-CA 3.27Å; S312-R317 PolarHBondContact O-N 2.97Å; A315-R317 VanDerWaalsContact C-N 3.26Å; A315-R317 PolarHBondContact O-N 3.43Å; R317-Q319 VanDerWaalsContact C-N 3.29Å; R317-Q319 PolarHBondContact O-N 3.01Å; R317-Q320 HydrophobicContact CB-CB 4.47Å; R317-Q320 VanDerWaalsContact CD-OE1 3.26Å; R317-Q320 WeakPolarHBondContact O-CB 3.31Å; R317-Q320 PolarHBondContact O-N 2.83Å; R317-F321 PolarHBondContact O-N 3.4Å
318	V	83.4	Confident	84.9	Confident	22 Å²	22	71.8 Å²	71.8	13%	0.133	39%	0.387	C	S	.	.	H	α-helix	trans	-50.6	-47.4	-179.7	-179.3	0	0	0	0	112.3	F309 S312 K313 Q320 F321 L322	F309-V318 HydrophobicContact CD2-CG1 4.07Å; F309-V318 HydrophobicContact CE2-CG1 3.56Å; F309-V318 HydrophobicContact CZ-CG1 4.33Å; S312-V318 PolarHBondContact O-N 3.39Å; K313-V318 HydrophobicContact CB-CG2 3.52Å; K313-V318 HydrophobicContact CD-CG2 4.39Å; K313-V318 HydrophobicContact CG-CG2 3.76Å; V318-Q320 VanDerWaalsContact C-N 3.32Å; V318-Q320 PolarHBondContact O-N 2.93Å; V318-F321 PolarHBondContact O-N 2.77Å; V318-L322 HydrophobicContact CG1-CD1 3.64Å; V318-L322 HydrophobicContact CG1-CG 4.07Å; V318-L322 WeakPolarHBondContact O-CB 3.36Å; V318-L322 VanDerWaalsContact O-CG 3.31Å; V318-L322 WeakPolarHBondContact O-CG 3.37Å; V318-L322 PolarHBondContact O-N 2.77Å
319	Q	80.4	Confident	84.9	Confident	87 Å²	87	71.6 Å²	71.6	41%	0.407	38%	0.383	S	S	.	.	H	α-helix	trans	-61.2	-41.6	-178.8	-68	-179.4	0.5	0	0	111.9	Y224 R317 L322 L323	Y224-Q319 HydrophobicContact CD2-CG 4.37Å; Y224-Q319 HydrophobicContact CE2-CG 4.11Å; R317-Q319 VanDerWaalsContact C-N 3.29Å; R317-Q319 PolarHBondContact O-N 3.01Å; Q319-L322 PolarHBondContact O-N 3.09Å; Q319-L323 WeakPolarHBondContact O-CB 3.49Å; Q319-L323 WeakPolarHBondContact O-CG 3.38Å; Q319-L323 PolarHBondContact O-N 2.97Å
320	Q	86.2	Confident	84.9	Confident	113 Å²	113	77 Å²	77	53%	0.528	41%	0.413	S	S	.	.	H	α-helix	trans	-66.5	-38.5	178.1	-63.8	175.9	-5.9	0	0	111.9	R317 V318 K324	R317-Q320 HydrophobicContact CB-CB 4.47Å; R317-Q320 VanDerWaalsContact CD-OE1 3.26Å; R317-Q320 WeakPolarHBondContact O-CB 3.31Å; R317-Q320 PolarHBondContact O-N 2.83Å; V318-Q320 VanDerWaalsContact C-N 3.32Å; V318-Q320 PolarHBondContact O-N 2.93Å; Q320-K324 WeakPolarHBondContact O-CG 2.94Å; Q320-K324 PolarHBondContact O-N 3.44Å
321	F	88.5	Confident	85	Confident	24 Å²	24	79.4 Å²	79.4	11%	0.105	43%	0.426	C	S	.	.	H	α-helix	trans	-63.5	-50.7	174.5	165	-100.5	0	0	0	111.7	F305 G308 F309 S312 R317 V318 L323 K324 Q325	F305-F321 HydrophobicContact CD2-CE1 4.17Å; F305-F321 HydrophobicContact CD2-CZ 4.09Å; F305-F321 HydrophobicContact CE2-CE1 4.05Å; F305-F321 HydrophobicContact CE2-CZ 4.42Å; F305-F321 WeakPolarHBondContact O-CZ 3.39Å; G308-F321 VanDerWaalsContact C-CE2 3.43Å; G308-F321 VanDerWaalsContact C-CZ 3.46Å; G308-F321 VanDerWaalsContact CA-CE2 3.44Å; F309-F321 VanDerWaalsContact CA-CE1 3.48Å; F309-F321 HydrophobicContact CB-CD1 4.3Å; F309-F321 HydrophobicContact CB-CE1 3.73Å; F309-F321 HydrophobicContact CB-CZ 4.39Å; F309-F321 HydrophobicContact CD2-CD1 4.47Å; F309-F321 HydrophobicContact CD2-CE1 4.38Å; F309-F321 VanDerWaalsContact N-CZ 3.35Å; S312-F321 WeakPolarHBondContact OG-CB 3.3Å; S312-F321 WeakPolarHBondContact OG-CG 3.17Å; R317-F321 PolarHBondContact O-N 3.4Å; V318-F321 PolarHBondContact O-N 2.77Å; F321-L323 VanDerWaalsContact C-N 3.32Å; F321-L323 PolarHBondContact O-N 2.73Å; F321-K324 PolarHBondContact O-N 2.98Å; F321-Q325 HydrophobicContact CE1-CG 4.24Å; F321-Q325 HydrophobicContact CE2-CG 4.4Å; F321-Q325 HydrophobicContact CZ-CG 4.07Å
322	L	84.7	Confident	85.2	Confident	1 Å²	1	78.8 Å²	78.8	1%	0.005	43%	0.427	C	S	.	.	H	α-helix	trans	-59	-45.3	-180	-69.1	178.3	0	0	0	110.4	Y224 L225 Y228 F305 F309 V318 Q319 K324 Q325	Y224-L322 VanDerWaalsContact CB-CD1 3.46Å; Y224-L322 HydrophobicContact CG-CD1 4.39Å; L225-L322 HydrophobicContact CD2-CD2 4.43Å; Y228-L322 HydrophobicContact CD2-CB 4.48Å; Y228-L322 HydrophobicContact CD2-CD2 3.79Å; Y228-L322 HydrophobicContact CE2-CB 3.77Å; Y228-L322 HydrophobicContact CE2-CD2 3.96Å; Y228-L322 HydrophobicContact CE2-CG 4.36Å; Y228-L322 PolarHBondContact OH-O 2.97Å; F305-L322 HydrophobicContact CE2-CD2 3.92Å; F305-L322 HydrophobicContact CZ-CD2 3.91Å; F309-L322 HydrophobicContact CD2-CD2 4.18Å; F309-L322 HydrophobicContact CE2-CD1 4.48Å; V318-L322 HydrophobicContact CG1-CD1 3.64Å; V318-L322 HydrophobicContact CG1-CG 4.07Å; V318-L322 WeakPolarHBondContact O-CB 3.36Å; V318-L322 VanDerWaalsContact O-CG 3.31Å; V318-L322 WeakPolarHBondContact O-CG 3.37Å; V318-L322 PolarHBondContact O-N 2.77Å; Q319-L322 PolarHBondContact O-N 3.09Å; L322-K324 PolarHBondContact O-N 3.07Å; L322-K324 VanDerWaalsContact O-N 3.09Å; L322-Q325 WeakPolarHBondContact O-CB 3.31Å; L322-Q325 PolarHBondContact O-N 2.9Å
323	L	83	Confident	85.5	Confident	116 Å²	116	79 Å²	79	61%	0.607	43%	0.427	S	S	*	.	H	α-helix	trans	-58.7	-22.8	176.3	-73.3	170.4	0	0	0	115.3	Y224 Q319 F321	Y224-L323 HydrophobicContact CE1-CD2 4.41Å; Q319-L323 WeakPolarHBondContact O-CB 3.49Å; Q319-L323 WeakPolarHBondContact O-CG 3.38Å; Q319-L323 PolarHBondContact O-N 2.97Å; F321-L323 VanDerWaalsContact C-N 3.32Å; F321-L323 PolarHBondContact O-N 2.73Å
324	K	84.8	Confident	86.1	Confident	175 Å²	175	76.8 Å²	76.8	76%	0.761	42%	0.418	S	S	*	.	H	α-helix	trans	-84.3	-14.1	175.7	-70.1	176.4	-179	-175.6	0	113.4	Q320 F321 L322	Q320-K324 WeakPolarHBondContact O-CG 2.94Å; Q320-K324 PolarHBondContact O-N 3.44Å; F321-K324 PolarHBondContact O-N 2.98Å; L322-K324 PolarHBondContact O-N 3.07Å; L322-K324 VanDerWaalsContact O-N 3.09Å
325	Q	84.3	Confident	86.6	Confident	63 Å²	63	76 Å²	76	29%	0.294	41%	0.409	S	S	.	.	S	Bend	trans	-80.1	151.6	179	-57.2	-53.7	-55.1	0	0	110.8	Y228 F305 F321 L322 P327	Y228-Q325 HydrophobicContact CD1-CB 3.53Å; Y228-Q325 HydrophobicContact CE1-CB 3.37Å; Y228-Q325 WeakPolarHBondContact CE1-O 3.17Å; Y228-Q325 HydrophobicContact CG-CB 4.31Å; F305-Q325 HydrophobicContact CD2-CG 4.19Å; F305-Q325 HydrophobicContact CE2-CG 4.2Å; F321-Q325 HydrophobicContact CE1-CG 4.24Å; F321-Q325 HydrophobicContact CE2-CG 4.4Å; F321-Q325 HydrophobicContact CZ-CG 4.07Å; L322-Q325 WeakPolarHBondContact O-CB 3.31Å; L322-Q325 PolarHBondContact O-N 2.9Å; Q325-P327 WeakPolarHBondContact O-CD 3.31Å
326	T	83.1	Confident	86.9	Confident	122 Å²	122	76.1 Å²	76.1	75%	0.748	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-79.4	120.5	171.9	-51.7	0	0	0	0	109.8	Y228 T328	Y228-T326 WeakPolarHBondContact CD1-O 3.36Å; T326-T328 PolarHBondContact O-N 3.22Å
327	P	86.2	Confident	87.3	Confident	66 Å²	66	72.7 Å²	72.7	43%	0.429	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-61.6	136.5	176.8	-22.1	33.8	0	0	0	111.6	K227 Y228 Q325	K227-P327 HydrophobicContact CB-CB 4.4Å; K227-P327 CarbonylContact O-C 3.53Å; K227-P327 WeakPolarHBondContact O-CA 3.46Å; Y228-P327 HydrophobicContact CE1-CB 4.33Å; Y228-P327 HydrophobicContact CE1-CG 4.1Å; Q325-P327 WeakPolarHBondContact O-CD 3.31Å
328	T	88	Confident	87.5	Confident	74 Å²	74	68.3 Å²	68.3	45%	0.454	35%	0.353	S	S	.	.	S	Bend	trans	-95.2	-19.4	173.1	53.9	0	0	0	0	112.2	K227 Y228 W229 T326	K227-T328 PolarHBondContact O-N 3.45Å; K227-T328 PolarHBondContact O-OG1 3.2Å; Y228-T328 VanDerWaalsContact C-OG1 3.25Å; Y228-T328 WeakPolarHBondContact CA-OG1 3.29Å; W229-T328 PolarHBondContact N-OG1 3.01Å; W229-T328 VanDerWaalsContact N-OG1 3.14Å; W229-T328 WeakPolarHBondContact O-CB 3.3Å; W229-T328 PolarHBondContact O-OG1 3.37Å; T326-T328 PolarHBondContact O-N 3.22Å
329	V	88.3	Confident	87.9	Confident	8 Å²	8	72.1 Å²	72.1	5%	0.048	37%	0.368	C	S	.	.	S	Bend	trans	-118.9	138.9	-176.7	-173.5	0	0	0	0	110.4	M226 K227 W229 K232 I235 N331 V333 I334	M226-V329 WeakPolarHBondContact O-CG2 3.31Å; K227-V329 PolarHBondContact O-N 3.1Å; K227-V329 VanDerWaalsContact O-N 3.14Å; W229-V329 HydrophobicContact CB-CG2 3.93Å; K232-V329 HydrophobicContact CB-CG2 4.27Å; I235-V329 HydrophobicContact CB-CG1 4.18Å; I235-V329 HydrophobicContact CG1-CG2 4.16Å; I235-V329 HydrophobicContact CG2-CG1 3.84Å; V329-N331 PolarHBondContact O-N 3.42Å; V329-V333 HydrophobicContact CG1-CB 4.44Å; V329-I334 HydrophobicContact CB-CD1 4.42Å; V329-I334 HydrophobicContact CG1-CD1 3.79Å; V329-I334 HydrophobicContact CG1-CG1 4.32Å
330	N	88.4	Confident	88.3	Confident	120 Å²	120	68.1 Å²	68.1	64%	0.642	35%	0.349	S	S	*	.			trans	-61.8	133	177.5	-70.6	-15.9	0	0	0	111.4	D332 V333	N330-D332 PolarHBondContact O-N 3.09Å; N330-V333 HydrophobicContact CB-CG2 4.19Å; N330-V333 PolarHBondContact O-N 3.5Å; N330-V333 VanDerWaalsContact O-N 3.14Å
331	N	89	Confident	88.3	Confident	68 Å²	68	62.7 Å²	62.7	36%	0.364	32%	0.324	S	S	.	.	H	α-helix	trans	-56	-39.4	179.3	-75.7	-36	0	0	0	112.3	K227 V329 V333 I334 E335	K227-N331 WeakPolarHBondContact CD-OD1 3.39Å; K227-N331 WeakPolarHBondContact CE-OD1 3.36Å; K227-N331 PolarHBondContact NZ-OD1 2.9Å; V329-N331 PolarHBondContact O-N 3.42Å; N331-V333 PolarHBondContact O-N 2.97Å; N331-I334 WeakPolarHBondContact O-CA 3.43Å; N331-I334 WeakPolarHBondContact O-CB 3.35Å; N331-I334 PolarHBondContact O-N 3.09Å; N331-E335 WeakPolarHBondContact O-CG 3.49Å; N331-E335 PolarHBondContact O-N 3.42Å
332	D	91.3	Very high	88.1	Confident	118 Å²	118	64.7 Å²	64.7	63%	0.631	34%	0.341	S	S	*	.	H	α-helix	trans	-57.4	-36.8	-179.3	-55.2	-10	0	0	0	112.5	N330 E336	N330-D332 PolarHBondContact O-N 3.09Å; D332-E336 WeakPolarHBondContact O-CB 3.36Å; D332-E336 WeakPolarHBondContact O-CG 3.03Å; D332-E336 PolarHBondContact O-N 2.66Å
333	V	91.6	Very high	88	Confident	27 Å²	27	69.2 Å²	69.2	16%	0.164	36%	0.36	C	S	.	.	H	α-helix	trans	-67.9	-40.9	177.9	-178.3	0	0	0	0	110.2	I235 L239 V329 N330 N331 E336 I337	I235-V333 HydrophobicContact CG2-CG1 3.89Å; L239-V333 HydrophobicContact CB-CG1 4.46Å; L239-V333 HydrophobicContact CD2-CG1 4.12Å; V329-V333 HydrophobicContact CG1-CB 4.44Å; N330-V333 HydrophobicContact CB-CG2 4.19Å; N330-V333 PolarHBondContact O-N 3.5Å; N330-V333 VanDerWaalsContact O-N 3.14Å; N331-V333 PolarHBondContact O-N 2.97Å; V333-E336 PolarHBondContact O-N 2.76Å; V333-I337 HydrophobicContact CG1-CD1 4.31Å; V333-I337 WeakPolarHBondContact O-CG1 3.33Å; V333-I337 PolarHBondContact O-N 3.48Å
334	I	91	Very high	87.7	Confident	5 Å²	5	65.2 Å²	65.2	3%	0.026	34%	0.339	C	S	.	.	H	α-helix	trans	-67.1	-45	178.3	-53.8	-46.9	0	0	0	110.6	M226 K227 I235 V329 N331 E336 I337 M338	M226-I334 HydrophobicContact CB-CD1 3.54Å; M226-I334 HydrophobicContact CB-CG1 4.36Å; M226-I334 HydrophobicContact CB-CG2 4.48Å; M226-I334 HydrophobicContact SD-CD1 4.48Å; K227-I334 HydrophobicContact CG-CG1 4.14Å; I235-I334 HydrophobicContact CG2-CD1 3.66Å; V329-I334 HydrophobicContact CB-CD1 4.42Å; V329-I334 HydrophobicContact CG1-CD1 3.79Å; V329-I334 HydrophobicContact CG1-CG1 4.32Å; N331-I334 WeakPolarHBondContact O-CA 3.43Å; N331-I334 WeakPolarHBondContact O-CB 3.35Å; N331-I334 PolarHBondContact O-N 3.09Å; I334-E336 VanDerWaalsContact C-N 3.31Å; I334-E336 PolarHBondContact O-N 3.36Å; I334-I337 WeakPolarHBondContact O-CB 3.16Å; I334-I337 PolarHBondContact O-N 2.87Å; I334-M338 VanDerWaalsContact O-CG 3.29Å; I334-M338 WeakPolarHBondContact O-CG 3.33Å; I334-M338 PolarHBondContact O-N 3.3Å
335	E	91.4	Very high	86.6	Confident	125 Å²	125	63.9 Å²	63.9	58%	0.584	35%	0.345	S	S	*	.	H	α-helix	trans	-61.1	-41.4	177.7	-71.6	-179.6	-171	0	0	111.8	N331 M338 K339	N331-E335 WeakPolarHBondContact O-CG 3.49Å; N331-E335 PolarHBondContact O-N 3.42Å; E335-M338 PolarHBondContact O-N 3.1Å; E335-K339 WeakPolarHBondContact O-CB 3.48Å; E335-K339 PolarHBondContact O-N 3.24Å
336	E	92.6	Very high	86.7	Confident	50 Å²	50	63.9 Å²	63.9	23%	0.234	35%	0.347	C	S	.	.	H	α-helix	trans	-65.5	-39.9	174.4	-78.4	-73.5	128.7	0	0	112	L239 R243 D332 V333 I334 M338 K339 E340	L239-E336 HydrophobicContact CD1-CB 3.93Å; L239-E336 HydrophobicContact CD2-CB 3.91Å; R243-E336 IonicContact CZ-OE2 2.68Å; R243-E336 IonicContact NH2-OE2 3.48Å; R243-E336 PolarHBondContact NH2-OE2 2.83Å; D332-E336 WeakPolarHBondContact O-CB 3.36Å; D332-E336 WeakPolarHBondContact O-CG 3.03Å; D332-E336 PolarHBondContact O-N 2.66Å; V333-E336 PolarHBondContact O-N 2.76Å; I334-E336 VanDerWaalsContact C-N 3.31Å; I334-E336 PolarHBondContact O-N 3.36Å; E336-M338 PolarHBondContact O-N 2.82Å; E336-K339 PolarHBondContact O-N 2.96Å; E336-K339 WeakPolarHBondContact OE1-CD 3.05Å; E336-K339 IonicContact OE1-NZ 2.66Å; E336-K339 PolarHBondContact OE1-NZ 3.38Å; E336-E340 WeakPolarHBondContact O-CG 3.2Å; E336-E340 PolarHBondContact O-N 3.16Å
337	I	91.7	Very high	86.9	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-58.3	-49	172	-73	168.7	0	0	0	110.5	M226 I235 V238 L239 L242 V333 I334 K339 E340 V341	M226-I337 HydrophobicContact CE-CG2 4.45Å; M226-I337 HydrophobicContact SD-CG2 4.32Å; I235-I337 HydrophobicContact CG2-CD1 3.58Å; V238-I337 HydrophobicContact CG1-CD1 4.29Å; L239-I337 HydrophobicContact CB-CD1 4.32Å; L239-I337 HydrophobicContact CB-CG1 3.84Å; L239-I337 HydrophobicContact CD1-CG1 4Å; L239-I337 HydrophobicContact CG-CG1 4.43Å; L242-I337 HydrophobicContact CD1-CB 4.42Å; L242-I337 HydrophobicContact CD1-CG1 4.3Å; L242-I337 HydrophobicContact CD1-CG2 3.81Å; V333-I337 HydrophobicContact CG1-CD1 4.31Å; V333-I337 WeakPolarHBondContact O-CG1 3.33Å; V333-I337 PolarHBondContact O-N 3.48Å; I334-I337 WeakPolarHBondContact O-CB 3.16Å; I334-I337 PolarHBondContact O-N 2.87Å; I337-K339 VanDerWaalsContact C-N 3.26Å; I337-K339 PolarHBondContact O-N 2.8Å; I337-E340 PolarHBondContact O-N 3.17Å; I337-E340 VanDerWaalsContact O-N 3.11Å; I337-V341 HydrophobicContact CG2-CG2 4.28Å; I337-V341 VanDerWaalsContact O-CG2 3.31Å; I337-V341 WeakPolarHBondContact O-CG2 3.39Å; I337-V341 PolarHBondContact O-N 3.24Å
338	M	90.5	Very high	86.9	Confident	51 Å²	51	60.6 Å²	60.6	25%	0.251	32%	0.321	S	S	.	.	H	α-helix	trans	-59.4	-39.9	179.9	-66.4	-63.1	-70.3	0	0	111.9	R218 I334 E335 E336 S342	R218-M338 WeakPolarHBondContact O-CE 3.26Å; I334-M338 VanDerWaalsContact O-CG 3.29Å; I334-M338 WeakPolarHBondContact O-CG 3.33Å; I334-M338 PolarHBondContact O-N 3.3Å; E335-M338 PolarHBondContact O-N 3.1Å; E336-M338 PolarHBondContact O-N 2.82Å; M338-S342 WeakPolarHBondContact O-CB 3.41Å; M338-S342 PolarHBondContact O-N 3.32Å
339	K	90.6	Very high	86.9	Confident	101 Å²	101	59.8 Å²	59.8	44%	0.439	31%	0.313	S	S	.	.	H	α-helix	trans	-69.8	-33.2	176.3	179.8	-175.6	173.8	-171.5	0	113	E335 E336 I337 S342 K343	E335-K339 WeakPolarHBondContact O-CB 3.48Å; E335-K339 PolarHBondContact O-N 3.24Å; E336-K339 PolarHBondContact O-N 2.96Å; E336-K339 WeakPolarHBondContact OE1-CD 3.05Å; E336-K339 IonicContact OE1-NZ 2.66Å; E336-K339 PolarHBondContact OE1-NZ 3.38Å; I337-K339 VanDerWaalsContact C-N 3.26Å; I337-K339 PolarHBondContact O-N 2.8Å; K339-S342 PolarHBondContact O-OG 3.42Å; K339-K343 WeakPolarHBondContact O-CD 3.17Å; K339-K343 WeakPolarHBondContact O-CE 3.16Å; K339-K343 WeakPolarHBondContact O-CG 3.17Å
340	E	88.9	Confident	86.8	Confident	3 Å²	3	63 Å²	63	1%	0.014	33%	0.329	C	S	.	.	H	α-helix	trans	-71.7	-45.2	173.9	-71	-49.7	126.2	0	0	111.1	L239 L242 R243 R246 E336 I337 S342 K343 M344	L239-E340 HydrophobicContact CD1-CG 3.96Å; L242-E340 HydrophobicContact CB-CB 4.25Å; R243-E340 HydrophobicContact CG-CG 4Å; R246-E340 VanDerWaalsContact CD-OE2 3.29Å; R246-E340 WeakPolarHBondContact CD-OE2 3.38Å; R246-E340 IonicContact CZ-OE1 2.81Å; R246-E340 IonicContact CZ-OE2 3.47Å; R246-E340 VanDerWaalsContact CZ-OE2 3.24Å; R246-E340 IonicContact NE-OE2 3.88Å; R246-E340 PolarHBondContact NE-OE2 3.48Å; R246-E340 IonicContact NH1-OE1 3.42Å; R246-E340 PolarHBondContact NH1-OE1 3.24Å; R246-E340 IonicContact NH1-OE2 3.94Å; R246-E340 PolarHBondContact NH1-OE2 3.22Å; E336-E340 WeakPolarHBondContact O-CG 3.2Å; E336-E340 PolarHBondContact O-N 3.16Å; I337-E340 PolarHBondContact O-N 3.17Å; I337-E340 VanDerWaalsContact O-N 3.11Å; E340-S342 VanDerWaalsContact C-N 3.3Å; E340-S342 PolarHBondContact O-N 2.67Å; E340-K343 PolarHBondContact O-N 3.44Å; E340-K343 IonicContact OE1-NZ 2.66Å; E340-K343 PolarHBondContact OE1-NZ 2.85Å; E340-K343 IonicContact OE2-NZ 2.77Å; E340-M344 HydrophobicContact CB-CE 4.49Å; E340-M344 WeakPolarHBondContact O-CG 3.44Å
341	V	87.2	Confident	86.7	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-66.2	-32.3	178.7	-178.4	0	0	0	0	111.4	C214 L217 R218 L242 I337 K343 M344	C214-V341 HydrophobicContact CB-CG1 4.15Å; C214-V341 WeakPolarHBondContact O-CG1 3.12Å; L217-V341 HydrophobicContact CB-CG1 3.99Å; L217-V341 HydrophobicContact CB-CG2 3.96Å; L217-V341 HydrophobicContact CD1-CG2 3.91Å; R218-V341 HydrophobicContact CG-CB 4.5Å; R218-V341 HydrophobicContact CG-CG1 3.69Å; R218-V341 PolarHBondContact NE-O 3.28Å; R218-V341 PolarHBondContact NH2-O 2.9Å; L242-V341 HydrophobicContact CD1-CG2 3.9Å; L242-V341 HydrophobicContact CD2-CG2 4.27Å; I337-V341 HydrophobicContact CG2-CG2 4.28Å; I337-V341 VanDerWaalsContact O-CG2 3.31Å; I337-V341 WeakPolarHBondContact O-CG2 3.39Å; I337-V341 PolarHBondContact O-N 3.24Å; V341-K343 PolarHBondContact O-N 2.98Å; V341-M344 PolarHBondContact O-N 2.81Å
342	S	84.2	Confident	86.5	Confident	66 Å²	66	58.6 Å²	58.6	46%	0.462	31%	0.305	S	S	.	.	H	α-helix	trans	-64.6	-25.8	177.7	70.1	0	0	0	0	113.5	R218 M338 K339 E340	R218-S342 PolarHBondContact NH2-O 3.28Å; R218-S342 VanDerWaalsContact NH2-O 3.14Å; M338-S342 WeakPolarHBondContact O-CB 3.41Å; M338-S342 PolarHBondContact O-N 3.32Å; K339-S342 PolarHBondContact O-OG 3.42Å; E340-S342 VanDerWaalsContact C-N 3.3Å; E340-S342 PolarHBondContact O-N 2.67Å
343	K	82.6	Confident	86.2	Confident	96 Å²	96	54 Å²	54	42%	0.417	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-9.1	177.6	-61.5	165.1	-171.2	169.4	0	114.1	R246 K339 E340 V341 V345	R246-K343 VanDerWaalsContact NH1-NZ 3.11Å; K339-K343 WeakPolarHBondContact O-CD 3.17Å; K339-K343 WeakPolarHBondContact O-CE 3.16Å; K339-K343 WeakPolarHBondContact O-CG 3.17Å; E340-K343 PolarHBondContact O-N 3.44Å; E340-K343 IonicContact OE1-NZ 2.66Å; E340-K343 PolarHBondContact OE1-NZ 2.85Å; E340-K343 IonicContact OE2-NZ 2.77Å; V341-K343 PolarHBondContact O-N 2.98Å; K343-V345 VanDerWaalsContact C-N 3.34Å
344	M	75.1	Confident	85.7	Confident	31 Å²	31	56.3 Å²	56.3	15%	0.153	29%	0.289	C	S	.	.			trans	-91.5	15.7	-173	-64.8	177.8	-178.4	0	0	114.2	L133 C210 L242 F245 R246 E340 V341	L133-M344 HydrophobicContact CD1-SD 4.08Å; C210-M344 PolarHBondContact SG-O 3.31Å; L242-M344 HydrophobicContact CB-CE 3.85Å; L242-M344 HydrophobicContact CD2-CE 3.74Å; L242-M344 HydrophobicContact CD2-SD 3.97Å; L242-M344 HydrophobicContact CG-CE 4.39Å; L242-M344 WeakPolarHBondContact O-CE 3Å; F245-M344 HydrophobicContact CD1-CE 3.88Å; F245-M344 HydrophobicContact CD1-SD 3.95Å; F245-M344 HydrophobicContact CE1-SD 4.26Å; R246-M344 HydrophobicContact CB-CE 4.22Å; E340-M344 HydrophobicContact CB-CE 4.49Å; E340-M344 WeakPolarHBondContact O-CG 3.44Å; V341-M344 PolarHBondContact O-N 2.81Å
345	V	62.7	Low	85.2	Confident	147 Å²	147	60.9 Å²	60.9	89%	0.891	31%	0.313	S	S	*	.			trans	-129.7	0	170.8	175.5	0	0	0	0	107	K343	K343-V345 VanDerWaalsContact C-N 3.34Å

Retrieved 345 of 345 residues in 210.8 ms (Link to these results)

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