A0A3Q0KUX2_SCHMA Loading...

Phosphodiesterase

AlphaFold DB , UniProt , Accession A0A3Q0KUX2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 517 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	34.5	Very low	52.8	Low	245 Å²	245	121.1 Å²	121.1	100%	1.207	70%	0.698	S	S	*	*				0	114	0	-76.1	177.5	173.3	0	0	107.5	S3	M1-S3 PolarHBondContact O-N 3.32Å
2	G	34.7	Very low	56	Low	77 Å²	77	115.8 Å²	115.8	79%	0.794	67%	0.669	S	S	*	*			trans	-68.3	115.8	172.8	0	0	0	0	0	109.4	V4	G2-V4 PolarHBondContact O-N 3.21Å; G2-V4 VanDerWaalsContact O-N 3.15Å
3	S	38.4	Very low	58.9	Low	108 Å²	108	106.9 Å²	106.9	76%	0.755	62%	0.618	S	S	*	*			trans	-74.7	100.3	164.2	63.2	0	0	0	0	107.1	M1 I5	M1-S3 PolarHBondContact O-N 3.32Å; S3-I5 PolarHBondContact O-N 3.13Å
4	V	39.9	Very low	61.4	Low	134 Å²	134	103.3 Å²	103.3	81%	0.812	59%	0.589	S	S	*	*			trans	-55.8	105.3	166	177.3	0	0	0	0	106.5	G2 S6	G2-V4 PolarHBondContact O-N 3.21Å; G2-V4 VanDerWaalsContact O-N 3.15Å; V4-S6 VanDerWaalsContact C-N 3.32Å; V4-S6 PolarHBondContact O-N 3.46Å
5	I	41.8	Very low	63.6	Low	145 Å²	145	96.4 Å²	96.4	74%	0.744	55%	0.55	S	S	*	*			trans	-60	103.8	166.7	-64	171.4	0	0	0	104.5	S3 K7	S3-I5 PolarHBondContact O-N 3.13Å; I5-K7 PolarHBondContact O-N 3.42Å
6	S	42.9	Very low	65.4	Low	90 Å²	90	93.6 Å²	93.6	63%	0.629	53%	0.532	S	S	*	.			trans	-53.6	113.4	176.7	56.8	0	0	0	0	107	V4 L8	V4-S6 VanDerWaalsContact C-N 3.32Å; V4-S6 PolarHBondContact O-N 3.46Å; S6-L8 PolarHBondContact O-N 2.95Å
7	K	45.6	Very low	66.9	Low	190 Å²	190	88.5 Å²	88.5	83%	0.826	50%	0.503	S	S	*	.			trans	-46.5	118.5	174.8	-73.2	179.9	175.8	-180	0	107.8	I5 T9	I5-K7 PolarHBondContact O-N 3.42Å; K7-T9 PolarHBondContact O-N 2.95Å
8	L	58.3	Low	67.9	Low	94 Å²	94	90.3 Å²	90.3	49%	0.492	51%	0.511	S	S	.	.			trans	-62.2	84.3	176.5	-69	155.1	0	0	0	107.8	S6 P10 L28	S6-L8 PolarHBondContact O-N 2.95Å; L8-P10 WeakPolarHBondContact O-CD 3.13Å; L8-L28 HydrophobicContact CD2-CB 3.53Å; L8-L28 HydrophobicContact CD2-CD1 4.05Å; L8-L28 HydrophobicContact CD2-CG 4.44Å
9	T	73.8	Confident	68.8	Low	103 Å²	103	88.8 Å²	88.8	63%	0.632	52%	0.518	S	S	*	.			trans	-68.3	118.7	179.7	37.3	0	0	0	0	108.6	K7	K7-T9 PolarHBondContact O-N 2.95Å
10	P	84	Confident	69.9	Low	72 Å²	72	89.9 Å²	89.9	47%	0.468	52%	0.521	S	S	.	.			trans	-64.2	144.6	177	28.1	-34.4	0	0	0	110.1	L8 L25 I26 T27	L8-P10 WeakPolarHBondContact O-CD 3.13Å; P10-L25 HydrophobicContact CB-CD1 3.81Å; P10-L25 HydrophobicContact CB-CD2 4.03Å; P10-L25 HydrophobicContact CB-CG 3.85Å; P10-L25 HydrophobicContact CG-CD1 4.49Å; P10-I26 WeakPolarHBondContact CA-O 3.45Å; P10-T27 HydrophobicContact CB-CG2 3.8Å
11	K	87.5	Confident	71	Confident	74 Å²	74	88.1 Å²	88.1	32%	0.322	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	140	-179	-59	177.5	-170.7	172.4	0	109.3	I26 A69	K11-I26 PolarHBondContact N-O 3.49Å; K11-I26 PolarHBondContact O-N 3.15Å; K11-A69 HydrophobicContact CB-CB 4.41Å
12	V	90.8	Very high	73.8	Confident	58 Å²	58	80 Å²	80	35%	0.352	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	130.2	174	-179.5	0	0	0	0	108.7	Y14 R23 I24 L25	V12-Y14 HydrophobicContact CG1-CD2 4.45Å; V12-Y14 HydrophobicContact CG1-CE2 3.94Å; V12-R23 HydrophobicContact CG1-CB 4Å; V12-I24 CarbonylContact C-O 3.55Å; V12-I24 WeakPolarHBondContact CA-O 3.37Å; V12-L25 HydrophobicContact CG2-CD1 3.77Å
13	I	93.1	Very high	76.5	Confident	0 Å²	0	85.2 Å²	85.2	0%	0	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132.4	174.5	-54	-62.3	0	0	0	108.8	L15 R23 I24 I26 M67 L68 N70 Y76	I13-L15 HydrophobicContact CG2-CD2 3.8Å; I13-L15 HydrophobicContact CG2-CG 4.29Å; I13-R23 CarbonylContact O-C 3.59Å; I13-R23 WeakPolarHBondContact O-CA 3.37Å; I13-I24 HydrophobicContact CB-CG1 4Å; I13-I24 PolarHBondContact N-O 3.17Å; I13-I24 PolarHBondContact O-N 3.49Å; I13-I26 HydrophobicContact CB-CD1 4.29Å; I13-I26 HydrophobicContact CG1-CD1 3.66Å; I13-I26 HydrophobicContact CG1-CG1 4.11Å; I13-M67 HydrophobicContact CD1-CB 4.36Å; I13-M67 HydrophobicContact CG2-CE 4.29Å; I13-L68 WeakPolarHBondContact CD1-O 3.48Å; I13-N70 WeakPolarHBondContact CA-OD1 3.4Å; I13-Y76 HydrophobicContact CG2-CD2 3.69Å; I13-Y76 HydrophobicContact CG2-CE2 3.94Å
14	Y	94.1	Very high	79.1	Confident	56 Å²	56	80.5 Å²	80.5	22%	0.22	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	127.4	175.3	-63.9	-92.4	0	0	0	109.8	V12 I21 E22 R23 N70 Y72 P75 Y76	V12-Y14 HydrophobicContact CG1-CD2 4.45Å; V12-Y14 HydrophobicContact CG1-CE2 3.94Å; Y14-I21 HydrophobicContact CD1-CG2 4.04Å; Y14-E22 CarbonylContact C-O 3.28Å; Y14-E22 WeakPolarHBondContact CA-O 3.49Å; Y14-R23 HydrophobicContact CD1-CB 4.04Å; Y14-R23 HydrophobicContact CE1-CB 4.06Å; Y14-N70 WeakPolarHBondContact CD2-O 3.44Å; Y14-N70 PolarHBondContact N-OD1 3.2Å; Y14-N70 PolarHBondContact O-ND2 3.16Å; Y14-Y72 AromaticContact CD1-CD2 3.94Å; Y14-Y72 HydrophobicContact CD1-CD2 3.94Å; Y14-Y72 AromaticContact CE1-CD2 3.95Å; Y14-Y72 HydrophobicContact CE1-CD2 3.95Å; Y14-Y72 HydrophobicContact CE1-CG 4.48Å; Y14-P75 WeakPolarHBondContact O-CA 3.27Å; Y14-Y76 PolarHBondContact O-N 2.94Å
15	L	94.2	Very high	81.5	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	128.1	-176.3	-60.9	180	0	0	0	109.7	I13 I17 I21 E22 I24 I39 Y76 V78	I13-L15 HydrophobicContact CG2-CD2 3.8Å; I13-L15 HydrophobicContact CG2-CG 4.29Å; L15-I17 HydrophobicContact CB-CD1 4.05Å; L15-I17 HydrophobicContact CB-CG1 3.95Å; L15-I17 HydrophobicContact CD1-CD1 4.29Å; L15-I17 PolarHBondContact O-N 3.29Å; L15-I21 CarbonylContact O-C 3.58Å; L15-I21 WeakPolarHBondContact O-CA 3.29Å; L15-E22 PolarHBondContact N-O 2.86Å; L15-E22 PolarHBondContact O-N 3.45Å; L15-I24 HydrophobicContact CD1-CD1 3.61Å; L15-I24 HydrophobicContact CD1-CG1 4.08Å; L15-I24 HydrophobicContact CG-CD1 4.41Å; L15-I24 HydrophobicContact CG-CG1 4.5Å; L15-I39 HydrophobicContact CD1-CD1 3.82Å; L15-I39 HydrophobicContact CD1-CG1 3.62Å; L15-Y76 CarbonylContact C-O 3.29Å; L15-Y76 WeakPolarHBondContact CA-O 3.41Å; L15-Y76 HydrophobicContact CD2-CD2 4.35Å; L15-V78 HydrophobicContact CB-CG2 3.97Å; L15-V78 HydrophobicContact CD1-CG2 4.29Å; L15-V78 HydrophobicContact CD2-CG2 4.11Å; L15-V78 HydrophobicContact CG-CG2 4.36Å
16	L	93.6	Very high	83.8	Confident	51 Å²	51	72.8 Å²	72.8	27%	0.267	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	104.5	169.8	-177.2	70.3	0	0	0	108.4	N20 I21 P75 Y76 T77 V78	L16-N20 CarbonylContact C-O 3.59Å; L16-N20 WeakPolarHBondContact CA-O 3.39Å; L16-I21 HydrophobicContact CD1-CG1 3.86Å; L16-P75 HydrophobicContact CB-CB 4.13Å; L16-P75 HydrophobicContact CB-CG 4.09Å; L16-Y76 PolarHBondContact N-O 3.22Å; L16-T77 HydrophobicContact CD2-CG2 4.47Å; L16-V78 PolarHBondContact O-N 3.03Å
17	I	90.7	Very high	85.8	Confident	7 Å²	7	70.1 Å²	70.1	4%	0.036	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	120.2	-177.6	-57.8	176	0	0	0	108.1	L15 G19 N20 E22 I39 L42 S43 V78	L15-I17 HydrophobicContact CB-CD1 4.05Å; L15-I17 HydrophobicContact CB-CG1 3.95Å; L15-I17 HydrophobicContact CD1-CD1 4.29Å; L15-I17 PolarHBondContact O-N 3.29Å; I17-G19 PolarHBondContact O-N 3.4Å; I17-N20 PolarHBondContact N-O 2.77Å; I17-N20 PolarHBondContact O-N 3.08Å; I17-E22 HydrophobicContact CD1-CB 4.17Å; I17-E22 HydrophobicContact CD1-CG 4.24Å; I17-I39 HydrophobicContact CD1-CG2 4.37Å; I17-L42 HydrophobicContact CD1-CB 3.79Å; I17-L42 HydrophobicContact CD1-CD1 4.26Å; I17-S43 WeakPolarHBondContact CG2-OG 3.36Å; I17-V78 HydrophobicContact CG1-CB 3.97Å; I17-V78 HydrophobicContact CG1-CG1 4.46Å; I17-V78 HydrophobicContact CG1-CG2 3.83Å
18	N	85.3	Confident	87.6	Confident	122 Å²	122	66.3 Å²	66.3	65%	0.652	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	34	179.1	-62.6	-28.2	0	0	0	114.2
19	G	85.2	Confident	88.7	Confident	62 Å²	62	65.7 Å²	65.7	64%	0.639	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.6	-7.4	-178.6	0	0	0	0	0	115.7	I17	I17-G19 PolarHBondContact O-N 3.4Å
20	N	90.6	Very high	89	Confident	109 Å²	109	62.3 Å²	62.3	58%	0.583	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.4	141.9	177.2	-66	-36.4	0	0	0	111.2	L16 I17	L16-N20 CarbonylContact C-O 3.59Å; L16-N20 WeakPolarHBondContact CA-O 3.39Å; I17-N20 PolarHBondContact N-O 2.77Å; I17-N20 PolarHBondContact O-N 3.08Å
21	I	92.2	Very high	89	Confident	54 Å²	54	62.3 Å²	62.3	28%	0.277	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	109.5	175.9	-59.2	175.7	0	0	0	109.2	Y14 L15 L16 Y72 P75	Y14-I21 HydrophobicContact CD1-CG2 4.04Å; L15-I21 CarbonylContact O-C 3.58Å; L15-I21 WeakPolarHBondContact O-CA 3.29Å; L16-I21 HydrophobicContact CD1-CG1 3.86Å; I21-Y72 HydrophobicContact CB-CE2 4.03Å; I21-Y72 HydrophobicContact CD1-CD2 4.44Å; I21-Y72 HydrophobicContact CD1-CE1 4.27Å; I21-Y72 HydrophobicContact CD1-CE2 4.07Å; I21-Y72 HydrophobicContact CG2-CD2 3.91Å; I21-Y72 HydrophobicContact CG2-CE2 3.89Å; I21-P75 HydrophobicContact CD1-CB 4.4Å; I21-P75 HydrophobicContact CD1-CG 3.96Å; I21-P75 HydrophobicContact CG1-CB 4.34Å; I21-P75 HydrophobicContact CG1-CG 4.2Å; I21-P75 HydrophobicContact CG2-CB 4.25Å
22	E	93.2	Very high	88.7	Confident	74 Å²	74	61.9 Å²	61.9	35%	0.346	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	156.1	171.9	-68.7	-61	161	0	0	111.1	Y14 L15 I17 L42	Y14-E22 CarbonylContact C-O 3.28Å; Y14-E22 WeakPolarHBondContact CA-O 3.49Å; L15-E22 PolarHBondContact N-O 2.86Å; L15-E22 PolarHBondContact O-N 3.45Å; I17-E22 HydrophobicContact CD1-CB 4.17Å; I17-E22 HydrophobicContact CD1-CG 4.24Å; E22-L42 HydrophobicContact CB-CD1 4.32Å; E22-L42 HydrophobicContact CG-CD2 4.45Å
23	R	92.4	Very high	88.3	Confident	186 Å²	186	65.4 Å²	65.4	70%	0.702	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.8	131.2	175.1	67.3	-178.4	179.8	-179.2	-2.1	111.1	V12 I13 Y14	V12-R23 HydrophobicContact CG1-CB 4Å; I13-R23 CarbonylContact O-C 3.59Å; I13-R23 WeakPolarHBondContact O-CA 3.37Å; Y14-R23 HydrophobicContact CD1-CB 4.04Å; Y14-R23 HydrophobicContact CE1-CB 4.06Å
24	I	92.1	Very high	88	Confident	9 Å²	9	70.4 Å²	70.4	5%	0.046	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	148.9	177.5	60.7	171.5	0	0	0	110.9	V12 I13 L15 I26 I35 L38 L42	V12-I24 CarbonylContact C-O 3.55Å; V12-I24 WeakPolarHBondContact CA-O 3.37Å; I13-I24 HydrophobicContact CB-CG1 4Å; I13-I24 PolarHBondContact N-O 3.17Å; I13-I24 PolarHBondContact O-N 3.49Å; L15-I24 HydrophobicContact CD1-CD1 3.61Å; L15-I24 HydrophobicContact CD1-CG1 4.08Å; L15-I24 HydrophobicContact CG-CD1 4.41Å; L15-I24 HydrophobicContact CG-CG1 4.5Å; I24-I26 HydrophobicContact CD1-CD1 3.62Å; I24-I26 HydrophobicContact CD1-CG1 3.94Å; I24-I26 HydrophobicContact CG1-CD1 4.11Å; I24-I26 HydrophobicContact CG1-CG1 4.07Å; I24-I35 HydrophobicContact CD1-CG2 4.3Å; I24-L38 HydrophobicContact CB-CD2 3.81Å; I24-L38 HydrophobicContact CD1-CD2 4.33Å; I24-L38 HydrophobicContact CG2-CD2 3.61Å; I24-L38 HydrophobicContact CG2-CG 4.13Å; I24-L42 HydrophobicContact CG2-CD1 3.38Å
25	L	90.7	Very high	87.8	Confident	111 Å²	111	67.9 Å²	67.9	58%	0.581	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	120.3	176.1	-166.9	72.9	0	0	0	108.8	P10 V12	P10-L25 HydrophobicContact CB-CD1 3.81Å; P10-L25 HydrophobicContact CB-CD2 4.03Å; P10-L25 HydrophobicContact CB-CG 3.85Å; P10-L25 HydrophobicContact CG-CD1 4.49Å; V12-L25 HydrophobicContact CG2-CD1 3.77Å
26	I	89.2	Confident	87.5	Confident	6 Å²	6	69.8 Å²	69.8	3%	0.031	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	141.6	-178.6	-53.8	-175.8	0	0	0	109.6	P10 K11 I13 I24 C30 I35 M67	P10-I26 WeakPolarHBondContact CA-O 3.45Å; K11-I26 PolarHBondContact N-O 3.49Å; K11-I26 PolarHBondContact O-N 3.15Å; I13-I26 HydrophobicContact CB-CD1 4.29Å; I13-I26 HydrophobicContact CG1-CD1 3.66Å; I13-I26 HydrophobicContact CG1-CG1 4.11Å; I24-I26 HydrophobicContact CD1-CD1 3.62Å; I24-I26 HydrophobicContact CD1-CG1 3.94Å; I24-I26 HydrophobicContact CG1-CD1 4.11Å; I24-I26 HydrophobicContact CG1-CG1 4.07Å; I26-C30 HydrophobicContact CG2-CB 3.89Å; I26-I35 HydrophobicContact CD1-CD1 4.06Å; I26-I35 HydrophobicContact CD1-CG1 4.18Å; I26-I35 HydrophobicContact CD1-CG2 4.04Å; I26-I35 HydrophobicContact CG2-CD1 3.8Å; I26-I35 HydrophobicContact CG2-CG1 4.32Å; I26-M67 HydrophobicContact CD1-SD 4.21Å
27	T	85.3	Confident	87.2	Confident	35 Å²	35	68.4 Å²	68.4	22%	0.215	37%	0.369	C	S	.	.			trans	-116.4	162.2	169.8	61.2	0	0	0	0	109.8	P10 S29 C30 G65	P10-T27 HydrophobicContact CB-CG2 3.8Å; T27-S29 PolarHBondContact O-N 2.96Å; T27-S29 VanDerWaalsContact O-N 3.14Å; T27-S29 PolarHBondContact OG1-OG 2.88Å; T27-C30 PolarHBondContact N-SG 3.47Å; T27-C30 VanDerWaalsContact O-CB 3.31Å; T27-C30 WeakPolarHBondContact O-CB 3.38Å; T27-C30 PolarHBondContact O-N 3.46Å; T27-C30 PolarHBondContact OG1-SG 3.3Å; T27-G65 WeakPolarHBondContact O-CA 3.41Å
28	L	82.9	Confident	87.2	Confident	109 Å²	109	71.3 Å²	71.3	57%	0.571	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-18.7	174	-84.8	157.1	0	0	0	113.1	L8	L8-L28 HydrophobicContact CD2-CB 3.53Å; L8-L28 HydrophobicContact CD2-CD1 4.05Å; L8-L28 HydrophobicContact CD2-CG 4.44Å
29	S	81	Confident	87.4	Confident	81 Å²	81	65.5 Å²	65.5	57%	0.566	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-13.2	173	41.6	0	0	0	0	114.1	T27 T31	T27-S29 PolarHBondContact O-N 2.96Å; T27-S29 VanDerWaalsContact O-N 3.14Å; T27-S29 PolarHBondContact OG1-OG 2.88Å; S29-T31 PolarHBondContact O-N 2.88Å
30	C	81.4	Confident	87.6	Confident	32 Å²	32	62.6 Å²	62.6	22%	0.216	32%	0.323	C	S	.	.			trans	-67.7	125.8	176.6	-66.6	0	0	0	0	110.1	I26 T27 E34 I35 G65	I26-C30 HydrophobicContact CG2-CB 3.89Å; T27-C30 PolarHBondContact N-SG 3.47Å; T27-C30 VanDerWaalsContact O-CB 3.31Å; T27-C30 WeakPolarHBondContact O-CB 3.38Å; T27-C30 PolarHBondContact O-N 3.46Å; T27-C30 PolarHBondContact OG1-SG 3.3Å; C30-E34 WeakPolarHBondContact CA-OE2 3.37Å; C30-I35 HydrophobicContact CB-CD1 4.1Å; C30-I35 HydrophobicContact CB-CG1 4.08Å; C30-G65 PolarHBondContact O-N 3.26Å
31	T	83.1	Confident	87.5	Confident	72 Å²	72	62.6 Å²	62.6	44%	0.442	32%	0.322	S	S	.	.			trans	-75	156.5	175.7	64.8	0	0	0	0	111	S29 F33 E34 I35	S29-T31 PolarHBondContact O-N 2.88Å; T31-F33 PolarHBondContact O-N 3.09Å; T31-E34 PolarHBondContact N-OE2 3.16Å; T31-E34 PolarHBondContact O-N 2.8Å; T31-E34 VanDerWaalsContact OG1-CG 3.25Å; T31-E34 WeakPolarHBondContact OG1-CG 3.25Å; T31-E34 PolarHBondContact OG1-N 2.83Å; T31-E34 PolarHBondContact OG1-OE2 2.89Å; T31-I35 WeakPolarHBondContact O-CG1 3Å; T31-I35 PolarHBondContact O-N 3.35Å
32	S	82.6	Confident	87.4	Confident	66 Å²	66	63 Å²	63	46%	0.462	32%	0.324	S	S	.	.	H	α-helix	trans	-56.2	-32.7	172.8	-62.8	0	0	0	0	112.5	H36 C63	S32-H36 VanDerWaalsContact O-CB 3.23Å; S32-H36 WeakPolarHBondContact O-CB 3.48Å; S32-H36 PolarHBondContact O-N 3.11Å; S32-C63 WeakPolarHBondContact CA-O 3.42Å; S32-C63 WeakPolarHBondContact CB-O 3.49Å; S32-C63 PolarHBondContact OG-O 2.98Å
33	F	82.5	Confident	87.1	Confident	131 Å²	131	59.7 Å²	59.7	58%	0.575	31%	0.31	S	S	*	.	H	α-helix	trans	-70.3	-43.6	179.5	-164.3	-89	0	0	0	112.1	T31 I35 H36 D37	T31-F33 PolarHBondContact O-N 3.09Å; F33-I35 VanDerWaalsContact C-N 3.35Å; F33-I35 PolarHBondContact O-N 2.87Å; F33-H36 PolarHBondContact O-N 3.47Å; F33-D37 WeakPolarHBondContact CE1-OD2 3.25Å; F33-D37 WeakPolarHBondContact O-CB 3.48Å; F33-D37 PolarHBondContact O-N 2.8Å
34	E	86.8	Confident	86.9	Confident	105 Å²	105	58.1 Å²	58.1	49%	0.491	32%	0.315	S	S	.	.	H	α-helix	trans	-63.7	-40.3	177	-72	164.6	140.9	0	0	112.2	C30 T31 L38	C30-E34 WeakPolarHBondContact CA-OE2 3.37Å; T31-E34 PolarHBondContact N-OE2 3.16Å; T31-E34 PolarHBondContact O-N 2.8Å; T31-E34 VanDerWaalsContact OG1-CG 3.25Å; T31-E34 WeakPolarHBondContact OG1-CG 3.25Å; T31-E34 PolarHBondContact OG1-N 2.83Å; T31-E34 PolarHBondContact OG1-OE2 2.89Å; E34-L38 VanDerWaalsContact O-CB 3.31Å; E34-L38 WeakPolarHBondContact O-CB 3.46Å; E34-L38 PolarHBondContact O-N 3.08Å
35	I	88.5	Confident	86.6	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.021	32%	0.324	C	S	.	.	H	α-helix	trans	-68.8	-43.4	178.1	-59.2	165	0	0	0	109.9	I24 I26 C30 T31 F33 L38 I39 C63 S64 M67	I24-I35 HydrophobicContact CD1-CG2 4.3Å; I26-I35 HydrophobicContact CD1-CD1 4.06Å; I26-I35 HydrophobicContact CD1-CG1 4.18Å; I26-I35 HydrophobicContact CD1-CG2 4.04Å; I26-I35 HydrophobicContact CG2-CD1 3.8Å; I26-I35 HydrophobicContact CG2-CG1 4.32Å; C30-I35 HydrophobicContact CB-CD1 4.1Å; C30-I35 HydrophobicContact CB-CG1 4.08Å; T31-I35 WeakPolarHBondContact O-CG1 3Å; T31-I35 PolarHBondContact O-N 3.35Å; F33-I35 VanDerWaalsContact C-N 3.35Å; F33-I35 PolarHBondContact O-N 2.87Å; I35-L38 PolarHBondContact O-N 3.47Å; I35-I39 HydrophobicContact CG2-CD1 3.97Å; I35-I39 VanDerWaalsContact O-CG1 3.26Å; I35-I39 WeakPolarHBondContact O-CG1 3.36Å; I35-I39 PolarHBondContact O-N 3.25Å; I35-C63 WeakPolarHBondContact CG2-SG 3.49Å; I35-S64 WeakPolarHBondContact CD1-O 3.2Å; I35-M67 HydrophobicContact CG2-SD 4.44Å
36	H	88.5	Confident	86.2	Confident	40 Å²	40	58.1 Å²	58.1	19%	0.185	32%	0.322	C	S	.	.	H	α-helix	trans	-59.5	-50.2	175.3	176.2	-76.9	0	0	0	111.5	S32 F33 L38 I39 C40 K47 S49	S32-H36 VanDerWaalsContact O-CB 3.23Å; S32-H36 WeakPolarHBondContact O-CB 3.48Å; S32-H36 PolarHBondContact O-N 3.11Å; F33-H36 PolarHBondContact O-N 3.47Å; H36-L38 VanDerWaalsContact C-N 3.31Å; H36-L38 PolarHBondContact O-N 3.31Å; H36-I39 PolarHBondContact O-N 2.84Å; H36-I39 VanDerWaalsContact O-N 3.14Å; H36-C40 PolarHBondContact CE1-SG 3.38Å; H36-C40 PolarHBondContact O-N 3.09Å; H36-K47 PolarHBondContact CE1-O 3.02Å; H36-K47 VanDerWaalsContact CE1-O 3.26Å; H36-S49 PolarHBondContact CE1-O 3.5Å; H36-S49 PolarHBondContact NE2-O 3.23Å
37	D	87.8	Confident	85.8	Confident	21 Å²	21	63.6 Å²	63.6	11%	0.112	35%	0.345	C	S	.	.	H	α-helix	trans	-57.6	-43.7	177.5	-96.7	-0.3	0	0	0	111.7	F33 I39 C40 I41 K47	F33-D37 WeakPolarHBondContact CE1-OD2 3.25Å; F33-D37 WeakPolarHBondContact O-CB 3.48Å; F33-D37 PolarHBondContact O-N 2.8Å; D37-I39 PolarHBondContact O-N 3.45Å; D37-C40 WeakPolarHBondContact O-CB 3.49Å; D37-C40 PolarHBondContact O-N 3.48Å; D37-I41 WeakPolarHBondContact O-CD1 3.41Å; D37-I41 VanDerWaalsContact O-CG1 3.24Å; D37-I41 WeakPolarHBondContact O-CG1 3.35Å; D37-I41 PolarHBondContact O-N 3.42Å; D37-K47 VanDerWaalsContact OD1-CD 3.22Å; D37-K47 WeakPolarHBondContact OD1-CD 3.29Å; D37-K47 WeakPolarHBondContact OD1-CG 3.45Å; D37-K47 IonicContact OD1-NZ 3.71Å; D37-K47 WeakPolarHBondContact OD2-CE 3.42Å; D37-K47 IonicContact OD2-NZ 2.71Å; D37-K47 PolarHBondContact OD2-NZ 3.32Å
38	L	89.7	Confident	85.4	Confident	68 Å²	68	64.6 Å²	64.6	36%	0.356	35%	0.353	S	S	.	.	H	α-helix	trans	-62.9	-42.2	178	-175.5	64.3	0	0	0	111.6	I24 E34 I35 H36 I41 L42	I24-L38 HydrophobicContact CB-CD2 3.81Å; I24-L38 HydrophobicContact CD1-CD2 4.33Å; I24-L38 HydrophobicContact CG2-CD2 3.61Å; I24-L38 HydrophobicContact CG2-CG 4.13Å; E34-L38 VanDerWaalsContact O-CB 3.31Å; E34-L38 WeakPolarHBondContact O-CB 3.46Å; E34-L38 PolarHBondContact O-N 3.08Å; I35-L38 PolarHBondContact O-N 3.47Å; H36-L38 VanDerWaalsContact C-N 3.31Å; H36-L38 PolarHBondContact O-N 3.31Å; L38-I41 PolarHBondContact O-N 3.01Å; L38-L42 HydrophobicContact CG-CD1 4.31Å; L38-L42 VanDerWaalsContact O-CG 3.31Å; L38-L42 WeakPolarHBondContact O-CG 3.42Å; L38-L42 PolarHBondContact O-N 3.29Å
39	I	90.7	Very high	85.3	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-67.5	-40.6	176.6	-64.6	169.5	0	0	0	110.8	L15 I17 I35 H36 D37 I41 L42 S43 I51 I53 V78	L15-I39 HydrophobicContact CD1-CD1 3.82Å; L15-I39 HydrophobicContact CD1-CG1 3.62Å; I17-I39 HydrophobicContact CD1-CG2 4.37Å; I35-I39 HydrophobicContact CG2-CD1 3.97Å; I35-I39 VanDerWaalsContact O-CG1 3.26Å; I35-I39 WeakPolarHBondContact O-CG1 3.36Å; I35-I39 PolarHBondContact O-N 3.25Å; H36-I39 PolarHBondContact O-N 2.84Å; H36-I39 VanDerWaalsContact O-N 3.14Å; D37-I39 PolarHBondContact O-N 3.45Å; I39-I41 VanDerWaalsContact C-N 3.31Å; I39-I41 PolarHBondContact O-N 3.32Å; I39-L42 PolarHBondContact O-N 3.16Å; I39-S43 WeakPolarHBondContact O-CB 3.37Å; I39-S43 PolarHBondContact O-N 2.76Å; I39-S43 PolarHBondContact O-OG 3.49Å; I39-I51 HydrophobicContact CB-CD1 3.81Å; I39-I51 HydrophobicContact CG2-CD1 3.6Å; I39-I51 HydrophobicContact CG2-CG1 4.36Å; I39-I51 HydrophobicContact CG2-CG2 4.11Å; I39-I53 HydrophobicContact CD1-CD1 3.59Å; I39-I53 HydrophobicContact CD1-CG1 4.44Å; I39-V78 HydrophobicContact CG2-CG1 3.59Å; I39-V78 HydrophobicContact CG2-CG2 4.32Å
40	C	89.1	Confident	85.5	Confident	1 Å²	1	60 Å²	60	1%	0.007	32%	0.323	C	S	.	.	H	α-helix	trans	-58.2	-43.8	173.9	-85.2	0	0	0	0	111.7	H36 D37 S43 N44 V45 P46 I51	H36-C40 PolarHBondContact CE1-SG 3.38Å; H36-C40 PolarHBondContact O-N 3.09Å; D37-C40 WeakPolarHBondContact O-CB 3.49Å; D37-C40 PolarHBondContact O-N 3.48Å; C40-S43 CarbonylContact O-C 3.6Å; C40-S43 PolarHBondContact O-N 3.21Å; C40-N44 PolarHBondContact O-N 3.36Å; C40-V45 HydrophobicContact CB-CG2 4.13Å; C40-V45 PolarHBondContact O-N 3.12Å; C40-P46 PolarHBondContact SG-O 2.88Å; C40-P46 VanDerWaalsContact SG-O 3.36Å; C40-I51 HydrophobicContact CB-CD1 4.45Å; C40-I51 WeakPolarHBondContact SG-CD1 3.47Å
41	I	88.5	Confident	85.8	Confident	110 Å²	110	59.8 Å²	59.8	56%	0.564	32%	0.32	S	S	*	.	H	α-helix	trans	-62.2	-50.3	176.1	-69	163.8	0	0	0	110.7	D37 L38 I39 S43 N44	D37-I41 WeakPolarHBondContact O-CD1 3.41Å; D37-I41 VanDerWaalsContact O-CG1 3.24Å; D37-I41 WeakPolarHBondContact O-CG1 3.35Å; D37-I41 PolarHBondContact O-N 3.42Å; L38-I41 PolarHBondContact O-N 3.01Å; I39-I41 VanDerWaalsContact C-N 3.31Å; I39-I41 PolarHBondContact O-N 3.32Å; I41-S43 PolarHBondContact O-N 3.03Å; I41-N44 PolarHBondContact O-N 3.32Å; I41-N44 VanDerWaalsContact O-N 3.09Å
42	L	88.9	Confident	86.1	Confident	61 Å²	61	59.4 Å²	59.4	32%	0.319	32%	0.315	S	S	.	.	H	α-helix	trans	-62.5	-30.7	178.8	-71.4	171.6	0	0	0	112.7	I17 E22 I24 L38 I39 N44	I17-L42 HydrophobicContact CD1-CB 3.79Å; I17-L42 HydrophobicContact CD1-CD1 4.26Å; E22-L42 HydrophobicContact CB-CD1 4.32Å; E22-L42 HydrophobicContact CG-CD2 4.45Å; I24-L42 HydrophobicContact CG2-CD1 3.38Å; L38-L42 HydrophobicContact CG-CD1 4.31Å; L38-L42 VanDerWaalsContact O-CG 3.31Å; L38-L42 WeakPolarHBondContact O-CG 3.42Å; L38-L42 PolarHBondContact O-N 3.29Å; I39-L42 PolarHBondContact O-N 3.16Å; L42-N44 VanDerWaalsContact C-N 3.34Å
43	S	88.4	Confident	86.6	Confident	6 Å²	6	56.6 Å²	56.6	4%	0.042	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-6.8	178.7	-52	0	0	0	0	113.8	I17 I39 C40 I41 V45 I80	I17-S43 WeakPolarHBondContact CG2-OG 3.36Å; I39-S43 WeakPolarHBondContact O-CB 3.37Å; I39-S43 PolarHBondContact O-N 2.76Å; I39-S43 PolarHBondContact O-OG 3.49Å; C40-S43 CarbonylContact O-C 3.6Å; C40-S43 PolarHBondContact O-N 3.21Å; I41-S43 PolarHBondContact O-N 3.03Å; S43-V45 VanDerWaalsContact C-N 3.32Å; S43-V45 PolarHBondContact O-N 3.46Å; S43-I80 WeakPolarHBondContact OG-CD1 3.19Å
44	N	86.5	Confident	87	Confident	153 Å²	153	51.3 Å²	51.3	82%	0.818	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	44.5	-173.7	-163.6	39.5	0	0	0	113.5	C40 I41 L42	C40-N44 PolarHBondContact O-N 3.36Å; I41-N44 PolarHBondContact O-N 3.32Å; I41-N44 VanDerWaalsContact O-N 3.09Å; L42-N44 VanDerWaalsContact C-N 3.34Å
45	V	85.7	Confident	87.2	Confident	39 Å²	39	47.6 Å²	47.6	24%	0.236	26%	0.256	C	S	.	.			trans	-120.1	158.3	177.8	-59.8	0	0	0	0	111.2	C40 S43 I80	C40-V45 HydrophobicContact CB-CG2 4.13Å; C40-V45 PolarHBondContact O-N 3.12Å; S43-V45 VanDerWaalsContact C-N 3.32Å; S43-V45 PolarHBondContact O-N 3.46Å; V45-I80 HydrophobicContact CB-CG2 4.49Å; V45-I80 HydrophobicContact CG1-CD1 3.93Å; V45-I80 HydrophobicContact CG1-CG2 4.22Å; V45-I80 HydrophobicContact CG2-CD1 4.18Å; V45-I80 HydrophobicContact CG2-CG2 4.14Å
46	P	83.1	Confident	87.2	Confident	81 Å²	81	51.5 Å²	51.5	53%	0.526	28%	0.28	S	S	.	.			trans	-54.6	145.5	174.5	-25.5	35	0	0	0	112.2	C40 S48 S49	C40-P46 PolarHBondContact SG-O 2.88Å; C40-P46 VanDerWaalsContact SG-O 3.36Å; P46-S48 WeakPolarHBondContact CB-OG 3.37Å; P46-S48 PolarHBondContact O-N 2.89Å; P46-S49 VanDerWaalsContact O-CB 3.28Å; P46-S49 WeakPolarHBondContact O-CB 3.44Å; P46-S49 PolarHBondContact O-N 2.81Å; P46-S49 PolarHBondContact O-OG 3.05Å
47	K	81	Confident	87.1	Confident	121 Å²	121	55.7 Å²	55.7	53%	0.526	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-12.7	172	-65.4	-175.7	168.1	-154.7	0	113.6	H36 D37 S49	H36-K47 PolarHBondContact CE1-O 3.02Å; H36-K47 VanDerWaalsContact CE1-O 3.26Å; D37-K47 VanDerWaalsContact OD1-CD 3.22Å; D37-K47 WeakPolarHBondContact OD1-CD 3.29Å; D37-K47 WeakPolarHBondContact OD1-CG 3.45Å; D37-K47 IonicContact OD1-NZ 3.71Å; D37-K47 WeakPolarHBondContact OD2-CE 3.42Å; D37-K47 IonicContact OD2-NZ 2.71Å; D37-K47 PolarHBondContact OD2-NZ 3.32Å; K47-S49 VanDerWaalsContact C-N 3.35Å
48	S	76.8	Confident	87	Confident	55 Å²	55	56.9 Å²	56.9	39%	0.385	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-3.8	174.1	54.1	0	0	0	0	114.1	P46	P46-S48 WeakPolarHBondContact CB-OG 3.37Å; P46-S48 PolarHBondContact O-N 2.89Å
49	S	81.7	Confident	86.9	Confident	5 Å²	5	58.8 Å²	58.8	4%	0.035	33%	0.331	C	S	.	.	S	Bend	trans	-70.2	141.6	-179.9	-69.3	0	0	0	0	112.1	H36 P46 K47	H36-S49 PolarHBondContact CE1-O 3.5Å; H36-S49 PolarHBondContact NE2-O 3.23Å; P46-S49 VanDerWaalsContact O-CB 3.28Å; P46-S49 WeakPolarHBondContact O-CB 3.44Å; P46-S49 PolarHBondContact O-N 2.81Å; P46-S49 PolarHBondContact O-OG 3.05Å; K47-S49 VanDerWaalsContact C-N 3.35Å
50	N	84.5	Confident	86.8	Confident	89 Å²	89	65.3 Å²	65.3	48%	0.476	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	128.1	173.2	-79.3	-36.9	0	0	0	109.3	I80 T81	N50-I80 WeakPolarHBondContact O-CA 3.41Å; N50-T81 WeakPolarHBondContact CB-OG1 3.5Å; N50-T81 PolarHBondContact N-O 2.77Å; N50-T81 PolarHBondContact O-N 3.4Å; N50-T81 PolarHBondContact O-OG1 3.5Å
51	I	87.7	Confident	86.8	Confident	28 Å²	28	67 Å²	67	14%	0.144	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	126.5	179.4	-67.1	167.1	0	0	0	108.9	I39 C40 I53 V78	I39-I51 HydrophobicContact CB-CD1 3.81Å; I39-I51 HydrophobicContact CG2-CD1 3.6Å; I39-I51 HydrophobicContact CG2-CG1 4.36Å; I39-I51 HydrophobicContact CG2-CG2 4.11Å; C40-I51 HydrophobicContact CB-CD1 4.45Å; C40-I51 WeakPolarHBondContact SG-CD1 3.47Å; I51-I53 HydrophobicContact CG2-CG1 3.94Å; I51-V78 HydrophobicContact CG2-CG1 3.77Å
52	I	89.5	Confident	86.6	Confident	64 Å²	64	66 Å²	66	33%	0.328	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	122.6	172.1	-57.9	176.9	0	0	0	107.6	T54 H60 T79	I52-T54 HydrophobicContact CG2-CG2 4.26Å; I52-H60 VanDerWaalsContact CG2-CE1 3.47Å; I52-H60 WeakPolarHBondContact CG2-CE1 3.39Å; I52-H60 WeakPolarHBondContact CG2-ND1 3.34Å; I52-T79 PolarHBondContact N-O 3.42Å; I52-T79 PolarHBondContact O-N 3.32Å
53	I	92.1	Very high	86.4	Confident	6 Å²	6	64.8 Å²	64.8	3%	0.031	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	128	176.9	-51.7	177.4	0	0	0	107.8	I39 I51 H60 I61 C63 M67 Y76 T77	I39-I53 HydrophobicContact CD1-CD1 3.59Å; I39-I53 HydrophobicContact CD1-CG1 4.44Å; I51-I53 HydrophobicContact CG2-CG1 3.94Å; I53-H60 WeakPolarHBondContact O-CA 3.44Å; I53-I61 HydrophobicContact CB-CB 4.43Å; I53-I61 HydrophobicContact CG2-CB 4.12Å; I53-I61 PolarHBondContact O-N 2.9Å; I53-C63 HydrophobicContact CD1-CB 4.2Å; I53-M67 HydrophobicContact CD1-CE 3.84Å; I53-M67 HydrophobicContact CD1-SD 4.37Å; I53-M67 HydrophobicContact CG2-CE 4.1Å; I53-Y76 HydrophobicContact CG2-CD2 4.34Å; I53-Y76 HydrophobicContact CG2-CG 4.2Å; I53-T77 WeakPolarHBondContact CA-O 3.36Å
54	T	91.9	Very high	86.2	Confident	21 Å²	21	65.5 Å²	65.5	13%	0.129	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	149.6	174	57.4	0	0	0	0	111.4	I52 L59 Y76 T77	I52-T54 HydrophobicContact CG2-CG2 4.26Å; T54-L59 CarbonylContact C-O 3.6Å; T54-L59 WeakPolarHBondContact CA-O 3.37Å; T54-Y76 CarbonylContact O-C 3.34Å; T54-Y76 VanDerWaalsContact O-CA 3.25Å; T54-Y76 WeakPolarHBondContact O-CA 3.29Å; T54-Y76 WeakPolarHBondContact O-CB 3.27Å; T54-T77 PolarHBondContact N-O 2.9Å; T54-T77 PolarHBondContact O-N 2.94Å
55	D	90.6	Very high	85.9	Confident	26 Å²	26	58.7 Å²	58.7	14%	0.139	34%	0.337	C	S	.	.			trans	-74.5	179.1	168	84.9	-15.6	0	0	0	112.2	N57 G58 L59 I61 Y76	D55-N57 PolarHBondContact O-N 2.93Å; D55-N57 VanDerWaalsContact O-N 3.16Å; D55-N57 VanDerWaalsContact OD1-CA 3.3Å; D55-N57 WeakPolarHBondContact OD1-CA 3.4Å; D55-N57 WeakPolarHBondContact OD1-CB 3.3Å; D55-N57 PolarHBondContact OD1-N 3.04Å; D55-N57 PolarHBondContact OD2-ND2 3.24Å; D55-G58 PolarHBondContact O-N 3.08Å; D55-G58 PolarHBondContact OD1-N 3.12Å; D55-L59 PolarHBondContact N-O 2.86Å; D55-L59 WeakPolarHBondContact OD1-CB 3.32Å; D55-L59 PolarHBondContact OD1-N 3.15Å; D55-I61 HydrophobicContact CB-CD1 4.16Å; D55-I61 HydrophobicContact CB-CG1 4.19Å; D55-Y76 HydrophobicContact CB-CD1 4Å; D55-Y76 HydrophobicContact CB-CE1 3.98Å
56	V	88.1	Confident	85.7	Confident	87 Å²	87	60.1 Å²	60.1	53%	0.527	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.7	177.7	-62.7	0	0	0	0	113.9	T74	V56-T74 HydrophobicContact CG1-CG2 4.47Å
57	N	87.9	Confident	85.8	Confident	128 Å²	128	56.6 Å²	56.6	68%	0.684	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	1.1	177	-53.1	-62.7	0	0	0	112.4	D55 L59	D55-N57 PolarHBondContact O-N 2.93Å; D55-N57 VanDerWaalsContact O-N 3.16Å; D55-N57 VanDerWaalsContact OD1-CA 3.3Å; D55-N57 WeakPolarHBondContact OD1-CA 3.4Å; D55-N57 WeakPolarHBondContact OD1-CB 3.3Å; D55-N57 PolarHBondContact OD1-N 3.04Å; D55-N57 PolarHBondContact OD2-ND2 3.24Å; N57-L59 HydrophobicContact CB-CD1 4.33Å
58	G	85.2	Confident	86.1	Confident	45 Å²	45	56.6 Å²	56.6	46%	0.464	33%	0.331	S	S	.	.	S	Bend	trans	81.4	9.6	-176.2	0	0	0	0	0	114.6	D55	D55-G58 PolarHBondContact O-N 3.08Å; D55-G58 PolarHBondContact OD1-N 3.12Å
59	L	88.1	Confident	86.6	Confident	109 Å²	109	57 Å²	57	57%	0.571	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-74.5	130.6	174.8	-76.6	151.2	0	0	0	110.3	T54 D55 N57 I61	T54-L59 CarbonylContact C-O 3.6Å; T54-L59 WeakPolarHBondContact CA-O 3.37Å; D55-L59 PolarHBondContact N-O 2.86Å; D55-L59 WeakPolarHBondContact OD1-CB 3.32Å; D55-L59 PolarHBondContact OD1-N 3.15Å; N57-L59 HydrophobicContact CB-CD1 4.33Å; L59-I61 PolarHBondContact O-N 3.44Å
60	H	88.3	Confident	87	Confident	136 Å²	136	57.6 Å²	57.6	63%	0.63	34%	0.34	S	S	*	.	B	Isolated β-bridge	trans	-67	126.1	177.1	-67.8	-77.3	0	0	0	111.6	I52 I53	I52-H60 VanDerWaalsContact CG2-CE1 3.47Å; I52-H60 WeakPolarHBondContact CG2-CE1 3.39Å; I52-H60 WeakPolarHBondContact CG2-ND1 3.34Å; I53-H60 WeakPolarHBondContact O-CA 3.44Å
61	I	87.9	Confident	87.2	Confident	37 Å²	37	57 Å²	57	19%	0.19	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-101.8	124.2	177.4	-56.7	-58.2	0	0	0	109.1	I53 D55 L59 C63 M67 Y76	I53-I61 HydrophobicContact CB-CB 4.43Å; I53-I61 HydrophobicContact CG2-CB 4.12Å; I53-I61 PolarHBondContact O-N 2.9Å; D55-I61 HydrophobicContact CB-CD1 4.16Å; D55-I61 HydrophobicContact CB-CG1 4.19Å; L59-I61 PolarHBondContact O-N 3.44Å; I61-C63 PolarHBondContact O-N 2.91Å; I61-M67 HydrophobicContact CG2-CE 3.81Å; I61-M67 HydrophobicContact CG2-CG 3.92Å; I61-Y76 HydrophobicContact CG1-CD1 4.3Å; I61-Y76 HydrophobicContact CG1-CE1 4.18Å; I61-Y76 HydrophobicContact CG2-CE2 4.35Å
62	P	84.5	Confident	87.4	Confident	90 Å²	90	62.1 Å²	62.1	58%	0.584	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-67.5	128.2	178	26.5	-32.8	0	0	0	110.8	S64 M67	P62-S64 PolarHBondContact O-N 2.91Å; P62-M67 VanDerWaalsContact O-CG 3.24Å; P62-M67 WeakPolarHBondContact O-CG 3.43Å
63	C	84.9	Confident	87.4	Confident	34 Å²	34	65.7 Å²	65.7	23%	0.23	38%	0.378	C	S	.	.			trans	-67.7	94	175.7	-170.6	0	0	0	0	109.5	S32 I35 I53 I61	S32-C63 WeakPolarHBondContact CA-O 3.42Å; S32-C63 WeakPolarHBondContact CB-O 3.49Å; S32-C63 PolarHBondContact OG-O 2.98Å; I35-C63 WeakPolarHBondContact CG2-SG 3.49Å; I53-C63 HydrophobicContact CD1-CB 4.2Å; I61-C63 PolarHBondContact O-N 2.91Å
64	S	84.1	Confident	87.4	Confident	22 Å²	22	68 Å²	68	15%	0.154	39%	0.393	C	S	.	.	S	Bend	trans	-157.8	160.4	-176.7	68.4	0	0	0	0	111.6	I35 P62 S66 M67	I35-S64 WeakPolarHBondContact CD1-O 3.2Å; P62-S64 PolarHBondContact O-N 2.91Å; S64-S66 PolarHBondContact O-N 3.02Å; S64-S66 PolarHBondContact OG-N 2.82Å; S64-S66 PolarHBondContact OG-OG 2.79Å; S64-M67 WeakPolarHBondContact O-CG 3.47Å; S64-M67 PolarHBondContact O-N 2.93Å
65	G	80.3	Confident	87.4	Confident	9 Å²	9	67.8 Å²	67.8	9%	0.093	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-11.5	173.4	0	0	0	0	0	114.8	T27 C30	T27-G65 WeakPolarHBondContact O-CA 3.41Å; C30-G65 PolarHBondContact O-N 3.26Å
66	S	81.7	Confident	87.6	Confident	69 Å²	69	67.5 Å²	67.5	48%	0.483	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-4	177.6	75.5	0	0	0	0	114.7	S64 L68	S64-S66 PolarHBondContact O-N 3.02Å; S64-S66 PolarHBondContact OG-N 2.82Å; S64-S66 PolarHBondContact OG-OG 2.79Å; S66-L68 PolarHBondContact O-N 2.92Å
67	M	85.6	Confident	87.8	Confident	7 Å²	7	65.7 Å²	65.7	3%	0.034	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-49.3	132	178.5	-74.9	173.8	80.3	0	0	111.7	I13 I26 I35 I53 I61 P62 S64 Y76	I13-M67 HydrophobicContact CD1-CB 4.36Å; I13-M67 HydrophobicContact CG2-CE 4.29Å; I26-M67 HydrophobicContact CD1-SD 4.21Å; I35-M67 HydrophobicContact CG2-SD 4.44Å; I53-M67 HydrophobicContact CD1-CE 3.84Å; I53-M67 HydrophobicContact CD1-SD 4.37Å; I53-M67 HydrophobicContact CG2-CE 4.1Å; I61-M67 HydrophobicContact CG2-CE 3.81Å; I61-M67 HydrophobicContact CG2-CG 3.92Å; P62-M67 VanDerWaalsContact O-CG 3.24Å; P62-M67 WeakPolarHBondContact O-CG 3.43Å; S64-M67 WeakPolarHBondContact O-CG 3.47Å; S64-M67 PolarHBondContact O-N 2.93Å; M67-Y76 HydrophobicContact CE-CD2 3.72Å; M67-Y76 HydrophobicContact CE-CE2 3.99Å
68	L	86	Confident	88	Confident	122 Å²	122	60 Å²	60	64%	0.639	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-71.7	137.8	179.4	-65	177.5	0	0	0	110.1	I13 S66 N70 Y76	I13-L68 WeakPolarHBondContact CD1-O 3.48Å; S66-L68 PolarHBondContact O-N 2.92Å; L68-N70 PolarHBondContact O-N 3.1Å; L68-Y76 WeakPolarHBondContact O-CE2 3.46Å; L68-Y76 PolarHBondContact O-OH 2.98Å
69	A	87.4	Confident	88.2	Confident	64 Å²	64	61.1 Å²	61.1	53%	0.529	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-59.5	129.3	172.9	0	0	0	0	0	110	K11	K11-A69 HydrophobicContact CB-CB 4.41Å
70	N	90.2	Very high	88.1	Confident	17 Å²	17	58 Å²	58	9%	0.091	33%	0.329	C	S	.	.			trans	-114.8	179.6	174.1	65.5	-21.1	0	0	0	110.2	I13 Y14 L68 T74 P75 Y76	I13-N70 WeakPolarHBondContact CA-OD1 3.4Å; Y14-N70 WeakPolarHBondContact CD2-O 3.44Å; Y14-N70 PolarHBondContact N-OD1 3.2Å; Y14-N70 PolarHBondContact O-ND2 3.16Å; L68-N70 PolarHBondContact O-N 3.1Å; N70-T74 WeakPolarHBondContact CB-O 3.16Å; N70-T74 PolarHBondContact ND2-O 3.22Å; N70-P75 WeakPolarHBondContact ND2-CA 3.42Å; N70-Y76 HydrophobicContact CB-CE1 4.05Å; N70-Y76 HydrophobicContact CB-CE2 4.3Å; N70-Y76 PolarHBondContact ND2-N 2.56Å; N70-Y76 VanDerWaalsContact ND2-N 3.15Å
71	T	90	Very high	87.7	Confident	75 Å²	75	54.3 Å²	54.3	46%	0.46	32%	0.316	S	S	.	.			trans	-110.5	163.2	-179.8	73.1	0	0	0	0	111.3	N73 T74	T71-N73 PolarHBondContact O-N 2.91Å; T71-N73 VanDerWaalsContact O-N 3.15Å; T71-N73 PolarHBondContact OG1-N 3.04Å; T71-T74 PolarHBondContact N-OG1 3Å; T71-T74 CarbonylContact O-C 3.51Å; T71-T74 VanDerWaalsContact O-C 3.25Å; T71-T74 PolarHBondContact O-N 3.19Å; T71-T74 PolarHBondContact O-OG1 2.48Å; T71-T74 PolarHBondContact OG1-N 3.42Å; T71-T74 PolarHBondContact OG1-OG1 2.8Å
72	Y	90.4	Very high	86.5	Confident	136 Å²	136	61.2 Å²	61.2	53%	0.533	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-31.7	173.6	-177.2	-93.9	0	0	0	113	Y14 I21 T74	Y14-Y72 AromaticContact CD1-CD2 3.94Å; Y14-Y72 HydrophobicContact CD1-CD2 3.94Å; Y14-Y72 AromaticContact CE1-CD2 3.95Å; Y14-Y72 HydrophobicContact CE1-CD2 3.95Å; Y14-Y72 HydrophobicContact CE1-CG 4.48Å; I21-Y72 HydrophobicContact CB-CE2 4.03Å; I21-Y72 HydrophobicContact CD1-CD2 4.44Å; I21-Y72 HydrophobicContact CD1-CE1 4.27Å; I21-Y72 HydrophobicContact CD1-CE2 4.07Å; I21-Y72 HydrophobicContact CG2-CD2 3.91Å; I21-Y72 HydrophobicContact CG2-CE2 3.89Å; Y72-T74 VanDerWaalsContact C-N 3.34Å
73	N	89.8	Confident	85	Confident	140 Å²	140	60 Å²	60	75%	0.749	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-10.1	179.7	-63.1	-25.1	0	0	0	113.3	T71 P75	T71-N73 PolarHBondContact O-N 2.91Å; T71-N73 VanDerWaalsContact O-N 3.15Å; T71-N73 PolarHBondContact OG1-N 3.04Å; N73-P75 VanDerWaalsContact C-CD 3.41Å
74	T	91.9	Very high	83.4	Confident	54 Å²	54	62.9 Å²	62.9	33%	0.331	36%	0.36	S	S	.	.	S	Bend	trans	-130.4	55.5	179.6	62.8	0	0	0	0	110.1	V56 N70 T71 Y72	V56-T74 HydrophobicContact CG1-CG2 4.47Å; N70-T74 WeakPolarHBondContact CB-O 3.16Å; N70-T74 PolarHBondContact ND2-O 3.22Å; T71-T74 PolarHBondContact N-OG1 3Å; T71-T74 CarbonylContact O-C 3.51Å; T71-T74 VanDerWaalsContact O-C 3.25Å; T71-T74 PolarHBondContact O-N 3.19Å; T71-T74 PolarHBondContact O-OG1 2.48Å; T71-T74 PolarHBondContact OG1-N 3.42Å; T71-T74 PolarHBondContact OG1-OG1 2.8Å; Y72-T74 VanDerWaalsContact C-N 3.34Å
75	P	93.4	Very high	81.9	Confident	16 Å²	16	70.6 Å²	70.6	10%	0.104	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-66.9	148.8	-177.9	32.4	-36	0	0	0	109.9	Y14 L16 I21 N70 N73	Y14-P75 WeakPolarHBondContact O-CA 3.27Å; L16-P75 HydrophobicContact CB-CB 4.13Å; L16-P75 HydrophobicContact CB-CG 4.09Å; I21-P75 HydrophobicContact CD1-CB 4.4Å; I21-P75 HydrophobicContact CD1-CG 3.96Å; I21-P75 HydrophobicContact CG1-CB 4.34Å; I21-P75 HydrophobicContact CG1-CG 4.2Å; I21-P75 HydrophobicContact CG2-CB 4.25Å; N70-P75 WeakPolarHBondContact ND2-CA 3.42Å; N73-P75 VanDerWaalsContact C-CD 3.41Å
76	Y	94.1	Very high	80.6	Confident	20 Å²	20	74 Å²	74	8%	0.078	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	132.5	169.9	-60.5	-36.6	0	0	0	109.3	I13 Y14 L15 L16 I53 T54 D55 I61 M67 L68 N70	I13-Y76 HydrophobicContact CG2-CD2 3.69Å; I13-Y76 HydrophobicContact CG2-CE2 3.94Å; Y14-Y76 PolarHBondContact O-N 2.94Å; L15-Y76 CarbonylContact C-O 3.29Å; L15-Y76 WeakPolarHBondContact CA-O 3.41Å; L15-Y76 HydrophobicContact CD2-CD2 4.35Å; L16-Y76 PolarHBondContact N-O 3.22Å; I53-Y76 HydrophobicContact CG2-CD2 4.34Å; I53-Y76 HydrophobicContact CG2-CG 4.2Å; T54-Y76 CarbonylContact O-C 3.34Å; T54-Y76 VanDerWaalsContact O-CA 3.25Å; T54-Y76 WeakPolarHBondContact O-CA 3.29Å; T54-Y76 WeakPolarHBondContact O-CB 3.27Å; D55-Y76 HydrophobicContact CB-CD1 4Å; D55-Y76 HydrophobicContact CB-CE1 3.98Å; I61-Y76 HydrophobicContact CG1-CD1 4.3Å; I61-Y76 HydrophobicContact CG1-CE1 4.18Å; I61-Y76 HydrophobicContact CG2-CE2 4.35Å; M67-Y76 HydrophobicContact CE-CD2 3.72Å; M67-Y76 HydrophobicContact CE-CE2 3.99Å; L68-Y76 WeakPolarHBondContact O-CE2 3.46Å; L68-Y76 PolarHBondContact O-OH 2.98Å; N70-Y76 HydrophobicContact CB-CE1 4.05Å; N70-Y76 HydrophobicContact CB-CE2 4.3Å; N70-Y76 PolarHBondContact ND2-N 2.56Å; N70-Y76 VanDerWaalsContact ND2-N 3.15Å
77	T	92.9	Very high	79.4	Confident	49 Å²	49	74.1 Å²	74.1	30%	0.301	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	126.4	179	-53.7	0	0	0	0	110.1	L16 I53 T54	L16-T77 HydrophobicContact CD2-CG2 4.47Å; I53-T77 WeakPolarHBondContact CA-O 3.36Å; T54-T77 PolarHBondContact N-O 2.9Å; T54-T77 PolarHBondContact O-N 2.94Å
78	V	92.3	Very high	78.3	Confident	10 Å²	10	81.6 Å²	81.6	6%	0.061	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	114.3	176.7	-180	0	0	0	0	108.4	L15 L16 I17 I39 I51 I80	L15-V78 HydrophobicContact CB-CG2 3.97Å; L15-V78 HydrophobicContact CD1-CG2 4.29Å; L15-V78 HydrophobicContact CD2-CG2 4.11Å; L15-V78 HydrophobicContact CG-CG2 4.36Å; L16-V78 PolarHBondContact O-N 3.03Å; I17-V78 HydrophobicContact CG1-CB 3.97Å; I17-V78 HydrophobicContact CG1-CG1 4.46Å; I17-V78 HydrophobicContact CG1-CG2 3.83Å; I39-V78 HydrophobicContact CG2-CG1 3.59Å; I39-V78 HydrophobicContact CG2-CG2 4.32Å; I51-V78 HydrophobicContact CG2-CG1 3.77Å; V78-I80 HydrophobicContact CG1-CG1 4.18Å
79	T	89.2	Confident	77.5	Confident	67 Å²	67	81.6 Å²	81.6	41%	0.411	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	125.2	173.2	-52.1	0	0	0	0	108.9	I52	I52-T79 PolarHBondContact N-O 3.42Å; I52-T79 PolarHBondContact O-N 3.32Å
80	I	86.3	Confident	76.4	Confident	44 Å²	44	80.8 Å²	80.8	23%	0.226	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	119.3	-178.5	-53.5	166.2	0	0	0	107.9	S43 V45 N50 V78	S43-I80 WeakPolarHBondContact OG-CD1 3.19Å; V45-I80 HydrophobicContact CB-CG2 4.49Å; V45-I80 HydrophobicContact CG1-CD1 3.93Å; V45-I80 HydrophobicContact CG1-CG2 4.22Å; V45-I80 HydrophobicContact CG2-CD1 4.18Å; V45-I80 HydrophobicContact CG2-CG2 4.14Å; N50-I80 WeakPolarHBondContact O-CA 3.41Å; V78-I80 HydrophobicContact CG1-CG1 4.18Å
81	T	79.5	Confident	75.4	Confident	59 Å²	59	84.8 Å²	84.8	36%	0.362	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	131.2	171.9	46.1	0	0	0	0	109.1	N50	N50-T81 WeakPolarHBondContact CB-OG1 3.5Å; N50-T81 PolarHBondContact N-O 2.77Å; N50-T81 PolarHBondContact O-N 3.4Å; N50-T81 PolarHBondContact O-OG1 3.5Å
82	Q	61.8	Low	74.6	Confident	181 Å²	181	85.2 Å²	85.2	85%	0.846	46%	0.459	S	S	*	.			trans	-60	139.8	174.5	-75.6	-172.6	-11.5	0	0	109.3	S84	Q82-S84 PolarHBondContact O-N 3.46Å
83	P	53	Low	73.9	Confident	64 Å²	64	82.1 Å²	82.1	42%	0.416	45%	0.454	S	S	.	.			trans	-63.6	112.3	-178.3	24.4	-30.6	0	0	0	109
84	S	51.6	Low	73.1	Confident	95 Å²	95	82.3 Å²	82.3	66%	0.664	44%	0.444	S	S	*	.			trans	-55.3	140.1	154.7	49.6	0	0	0	0	107.6	Q82	Q82-S84 PolarHBondContact O-N 3.46Å
85	E	52.9	Low	72.4	Confident	184 Å²	184	85.3 Å²	85.3	86%	0.86	46%	0.456	S	S	*	.			trans	-38.6	131.4	-179.9	-75	-178.2	155.6	0	0	111.1	S87	E85-S87 PolarHBondContact O-N 3.1Å
86	P	52.1	Low	71.7	Confident	82 Å²	82	90.6 Å²	90.6	53%	0.532	48%	0.478	S	S	.	.			trans	-59.1	115.6	-172.9	23	-31.3	0	0	0	108.6
87	S	56.4	Low	71	Confident	71 Å²	71	95.1 Å²	95.1	50%	0.497	50%	0.5	S	S	.	.			trans	-57.7	148.9	172.4	63.2	0	0	0	0	109	E85 I89 S90 L91	E85-S87 PolarHBondContact O-N 3.1Å; S87-I89 PolarHBondContact O-N 3.15Å; S87-S90 WeakPolarHBondContact O-CB 3.5Å; S87-S90 PolarHBondContact O-N 3.41Å; S87-L91 PolarHBondContact O-N 3.04Å
88	E	64.1	Low	70.3	Confident	164 Å²	164	96.2 Å²	96.2	77%	0.766	51%	0.51	S	S	*	.	H	α-helix	trans	-47.7	-34.3	176.7	-77.3	178.1	142.6	0	0	112.1	S90 L91 I92	E88-S90 PolarHBondContact O-N 2.94Å; E88-L91 WeakPolarHBondContact O-CB 3.44Å; E88-L91 PolarHBondContact O-N 3.25Å; E88-I92 VanDerWaalsContact O-CG1 3.29Å; E88-I92 WeakPolarHBondContact O-CG1 3.33Å; E88-I92 PolarHBondContact O-N 3.46Å
89	I	67.7	Low	69.6	Low	122 Å²	122	99.6 Å²	99.6	63%	0.626	53%	0.526	S	S	*	.	H	α-helix	trans	-59.9	-42.5	176.1	-58.5	175.2	0	0	0	111.8	S87 L91 I92 V93	S87-I89 PolarHBondContact O-N 3.15Å; I89-L91 VanDerWaalsContact C-N 3.34Å; I89-L91 PolarHBondContact O-N 3.33Å; I89-I92 PolarHBondContact O-N 3.46Å; I89-V93 WeakPolarHBondContact O-CG2 3.45Å; I89-V93 PolarHBondContact O-N 3.02Å
90	S	65.1	Low	69.1	Low	46 Å²	46	100.9 Å²	100.9	32%	0.322	53%	0.53	S	S	.	.	H	α-helix	trans	-66.4	-36.1	178.5	178.5	0	0	0	0	112.4	S87 E88 R94	S87-S90 WeakPolarHBondContact O-CB 3.5Å; S87-S90 PolarHBondContact O-N 3.41Å; E88-S90 PolarHBondContact O-N 2.94Å; S90-R94 PolarHBondContact O-N 2.89Å; S90-R94 VanDerWaalsContact O-N 3.17Å
91	L	68.9	Low	68.7	Low	101 Å²	101	105.3 Å²	105.3	53%	0.529	55%	0.547	S	S	.	.	H	α-helix	trans	-64.9	-44.4	174.3	-105.5	140.2	0	0	0	110.9	S87 E88 I89 V93 R94 M95	S87-L91 PolarHBondContact O-N 3.04Å; E88-L91 WeakPolarHBondContact O-CB 3.44Å; E88-L91 PolarHBondContact O-N 3.25Å; I89-L91 VanDerWaalsContact C-N 3.34Å; I89-L91 PolarHBondContact O-N 3.33Å; L91-V93 PolarHBondContact O-N 3.31Å; L91-R94 PolarHBondContact O-N 3.23Å; L91-M95 WeakPolarHBondContact O-CG 3.37Å; L91-M95 PolarHBondContact O-N 2.99Å
92	I	73.1	Confident	68.5	Low	85 Å²	85	108.5 Å²	108.5	44%	0.436	56%	0.558	S	S	.	*	H	α-helix	trans	-60.5	-45.3	176.4	-69.9	167.7	0	0	0	111	E88 I89 R94 M95 F96	E88-I92 VanDerWaalsContact O-CG1 3.29Å; E88-I92 WeakPolarHBondContact O-CG1 3.33Å; E88-I92 PolarHBondContact O-N 3.46Å; I89-I92 PolarHBondContact O-N 3.46Å; I92-R94 PolarHBondContact O-N 2.89Å; I92-M95 WeakPolarHBondContact O-CB 3.38Å; I92-M95 PolarHBondContact O-N 3.45Å; I92-F96 HydrophobicContact CG2-CD2 3.62Å; I92-F96 HydrophobicContact CG2-CE2 3.41Å; I92-F96 VanDerWaalsContact CG2-CE2 3.41Å; I92-F96 WeakPolarHBondContact O-CD2 3.34Å; I92-F96 PolarHBondContact O-N 2.92Å
93	V	75.4	Confident	68.9	Low	70 Å²	70	103.9 Å²	103.9	42%	0.424	54%	0.538	S	S	.	.	H	α-helix	trans	-61.4	-43.9	178.7	171.9	0	0	0	0	111.6	I89 L91 M95 F96 E97	I89-V93 WeakPolarHBondContact O-CG2 3.45Å; I89-V93 PolarHBondContact O-N 3.02Å; L91-V93 PolarHBondContact O-N 3.31Å; V93-M95 VanDerWaalsContact C-N 3.32Å; V93-M95 PolarHBondContact O-N 3.09Å; V93-F96 PolarHBondContact O-N 2.8Å; V93-E97 HydrophobicContact CG1-CG 4.49Å; V93-E97 WeakPolarHBondContact O-CG 3.46Å; V93-E97 PolarHBondContact O-N 3.35Å
94	R	74.1	Confident	69.8	Low	144 Å²	144	105.3 Å²	105.3	54%	0.543	54%	0.543	S	S	.	.	H	α-helix	trans	-63.8	-36.8	176.4	-74.1	-174.9	-175.4	171.2	4.7	112.8	S90 L91 I92 E97 S98	S90-R94 PolarHBondContact O-N 2.89Å; S90-R94 VanDerWaalsContact O-N 3.17Å; L91-R94 PolarHBondContact O-N 3.23Å; I92-R94 PolarHBondContact O-N 2.89Å; R94-E97 PolarHBondContact O-N 2.95Å; R94-S98 WeakPolarHBondContact O-CB 3.32Å; R94-S98 PolarHBondContact O-N 3.11Å
95	M	75.7	Confident	70.6	Confident	118 Å²	118	105.3 Å²	105.3	58%	0.581	54%	0.535	S	S	*	.	H	α-helix	trans	-62.2	-45.3	173.4	-72.7	179.3	66.4	0	0	111	L91 I92 V93 S98 I99	L91-M95 WeakPolarHBondContact O-CG 3.37Å; L91-M95 PolarHBondContact O-N 2.99Å; I92-M95 WeakPolarHBondContact O-CB 3.38Å; I92-M95 PolarHBondContact O-N 3.45Å; V93-M95 VanDerWaalsContact C-N 3.32Å; V93-M95 PolarHBondContact O-N 3.09Å; M95-S98 PolarHBondContact O-N 2.99Å; M95-I99 VanDerWaalsContact O-CG1 3.28Å; M95-I99 WeakPolarHBondContact O-CG1 3.27Å; M95-I99 PolarHBondContact O-N 3.28Å
96	F	78.6	Confident	71.4	Confident	127 Å²	127	102.2 Å²	102.2	56%	0.557	53%	0.529	S	S	*	.	H	α-helix	trans	-62.7	-43.3	176.3	-81	-66.3	0	0	0	112.7	I92 V93 S98 I99 I100	I92-F96 HydrophobicContact CG2-CD2 3.62Å; I92-F96 HydrophobicContact CG2-CE2 3.41Å; I92-F96 VanDerWaalsContact CG2-CE2 3.41Å; I92-F96 WeakPolarHBondContact O-CD2 3.34Å; I92-F96 PolarHBondContact O-N 2.92Å; V93-F96 PolarHBondContact O-N 2.8Å; F96-S98 VanDerWaalsContact C-N 3.34Å; F96-S98 PolarHBondContact O-N 2.78Å; F96-I99 PolarHBondContact O-N 3.43Å; F96-I100 WeakPolarHBondContact O-CB 3.34Å; F96-I100 VanDerWaalsContact O-CG1 3.23Å; F96-I100 WeakPolarHBondContact O-CG1 3.35Å; F96-I100 PolarHBondContact O-N 3.18Å
97	E	79.8	Confident	71.8	Confident	114 Å²	114	103.4 Å²	103.4	53%	0.533	53%	0.529	S	S	.	.	H	α-helix	trans	-61.5	-41.5	176.6	-73.5	176.4	164.9	0	0	112.2	V93 R94 I100 K101	V93-E97 HydrophobicContact CG1-CG 4.49Å; V93-E97 WeakPolarHBondContact O-CG 3.46Å; V93-E97 PolarHBondContact O-N 3.35Å; R94-E97 PolarHBondContact O-N 2.95Å; E97-I100 PolarHBondContact O-N 3.49Å; E97-K101 WeakPolarHBondContact O-CB 3.41Å; E97-K101 PolarHBondContact O-N 3.2Å
98	S	78	Confident	72.3	Confident	73 Å²	73	105.4 Å²	105.4	51%	0.51	53%	0.528	S	S	.	.	H	α-helix	trans	-63.5	-43.4	175.5	-172.6	0	0	0	0	111.7	R94 M95 F96 K101 Q102	R94-S98 WeakPolarHBondContact O-CB 3.32Å; R94-S98 PolarHBondContact O-N 3.11Å; M95-S98 PolarHBondContact O-N 2.99Å; F96-S98 VanDerWaalsContact C-N 3.34Å; F96-S98 PolarHBondContact O-N 2.78Å; S98-K101 PolarHBondContact O-N 3.24Å; S98-Q102 WeakPolarHBondContact O-CB 3.4Å; S98-Q102 PolarHBondContact O-N 3.23Å
99	I	78.8	Confident	72.5	Confident	80 Å²	80	103 Å²	103	41%	0.41	52%	0.519	S	S	.	.	H	α-helix	trans	-64	-44.9	177.3	-69.3	166.2	0	0	0	110.4	M95 F96 K101 Q102 I103	M95-I99 VanDerWaalsContact O-CG1 3.28Å; M95-I99 WeakPolarHBondContact O-CG1 3.27Å; M95-I99 PolarHBondContact O-N 3.28Å; F96-I99 PolarHBondContact O-N 3.43Å; I99-K101 VanDerWaalsContact C-N 3.32Å; I99-K101 PolarHBondContact O-N 3.46Å; I99-Q102 PolarHBondContact O-N 3.44Å; I99-I103 HydrophobicContact CG2-CD1 3.73Å; I99-I103 HydrophobicContact CG2-CG1 4.34Å; I99-I103 VanDerWaalsContact O-CG1 3.29Å; I99-I103 WeakPolarHBondContact O-CG1 3.38Å; I99-I103 PolarHBondContact O-N 3.13Å
100	I	78.6	Confident	72.9	Confident	95 Å²	95	100.3 Å²	100.3	49%	0.487	51%	0.512	S	S	.	.	H	α-helix	trans	-60.1	-43.6	177.2	-70.6	165.3	0	0	0	110.7	F96 E97 I103 N104	F96-I100 WeakPolarHBondContact O-CB 3.34Å; F96-I100 VanDerWaalsContact O-CG1 3.23Å; F96-I100 WeakPolarHBondContact O-CG1 3.35Å; F96-I100 PolarHBondContact O-N 3.18Å; E97-I100 PolarHBondContact O-N 3.49Å; I100-I103 PolarHBondContact O-N 3.15Å; I100-N104 WeakPolarHBondContact O-CB 3.42Å; I100-N104 PolarHBondContact O-N 2.95Å; I100-N104 PolarHBondContact O-ND2 2.91Å
101	K	76.5	Confident	73.4	Confident	136 Å²	136	102 Å²	102	59%	0.591	52%	0.517	S	S	*	.	H	α-helix	trans	-61.9	-45.5	175.8	-174.4	-179.6	176	-175.3	0	111.3	E97 S98 I99 I103 N104 D105	E97-K101 WeakPolarHBondContact O-CB 3.41Å; E97-K101 PolarHBondContact O-N 3.2Å; S98-K101 PolarHBondContact O-N 3.24Å; I99-K101 VanDerWaalsContact C-N 3.32Å; I99-K101 PolarHBondContact O-N 3.46Å; K101-I103 VanDerWaalsContact C-N 3.33Å; K101-I103 PolarHBondContact O-N 2.88Å; K101-N104 PolarHBondContact O-N 3.21Å; K101-D105 WeakPolarHBondContact O-CB 3.42Å; K101-D105 VanDerWaalsContact O-CG 3.32Å; K101-D105 PolarHBondContact O-N 2.88Å
102	Q	75.7	Confident	73.7	Confident	126 Å²	126	101.6 Å²	101.6	59%	0.589	52%	0.515	S	S	*	.	H	α-helix	trans	-63.1	-39.8	179	-133.3	174.4	3.1	0	0	112.1	S98 I99 T106	S98-Q102 WeakPolarHBondContact O-CB 3.4Å; S98-Q102 PolarHBondContact O-N 3.23Å; I99-Q102 PolarHBondContact O-N 3.44Å; Q102-T106 VanDerWaalsContact O-CB 3.25Å; Q102-T106 WeakPolarHBondContact O-CB 3.48Å; Q102-T106 PolarHBondContact O-N 3.07Å; Q102-T106 PolarHBondContact O-OG1 3.49Å
103	I	71.6	Confident	73.9	Confident	84 Å²	84	104.3 Å²	104.3	43%	0.431	52%	0.524	S	S	.	.	H	α-helix	trans	-63.3	-46.6	174.3	-69.8	169.3	0	0	0	110.1	I99 I100 K101 T106 M107	I99-I103 HydrophobicContact CG2-CD1 3.73Å; I99-I103 HydrophobicContact CG2-CG1 4.34Å; I99-I103 VanDerWaalsContact O-CG1 3.29Å; I99-I103 WeakPolarHBondContact O-CG1 3.38Å; I99-I103 PolarHBondContact O-N 3.13Å; I100-I103 PolarHBondContact O-N 3.15Å; K101-I103 VanDerWaalsContact C-N 3.33Å; K101-I103 PolarHBondContact O-N 2.88Å; I103-T106 PolarHBondContact O-N 3.06Å; I103-M107 HydrophobicContact CG2-CG 4.41Å; I103-M107 HydrophobicContact CG2-SD 3.84Å; I103-M107 WeakPolarHBondContact O-CA 3.32Å; I103-M107 WeakPolarHBondContact O-CB 3.44Å; I103-M107 WeakPolarHBondContact O-CG 3.3Å; I103-M107 PolarHBondContact O-N 3.28Å
104	N	71.1	Confident	74.2	Confident	95 Å²	95	105.6 Å²	105.6	51%	0.508	53%	0.528	S	S	.	.	H	α-helix	trans	-66.8	-37.2	178.9	-76.2	-26.2	0	0	0	113.1	I100 K101 M107 K108	I100-N104 WeakPolarHBondContact O-CB 3.42Å; I100-N104 PolarHBondContact O-N 2.95Å; I100-N104 PolarHBondContact O-ND2 2.91Å; K101-N104 PolarHBondContact O-N 3.21Å; N104-M107 CarbonylContact O-C 3.41Å; N104-M107 VanDerWaalsContact O-C 3.29Å; N104-K108 PolarHBondContact O-N 3.25Å
105	D	69.1	Low	74.6	Confident	95 Å²	95	102.9 Å²	102.9	51%	0.508	52%	0.522	S	S	.	.	H	α-helix	trans	-71.8	-34.4	178.1	-73.5	-18.3	0	0	0	111.7	K101	K101-D105 WeakPolarHBondContact O-CB 3.42Å; K101-D105 VanDerWaalsContact O-CG 3.32Å; K101-D105 PolarHBondContact O-N 2.88Å
106	T	68.4	Low	75	Confident	118 Å²	118	102.8 Å²	102.8	72%	0.724	52%	0.518	S	S	*	.	H	α-helix	trans	-80.2	-40.9	177.6	-52.4	0	0	0	0	111.3	Q102 I103 K108	Q102-T106 VanDerWaalsContact O-CB 3.25Å; Q102-T106 WeakPolarHBondContact O-CB 3.48Å; Q102-T106 PolarHBondContact O-N 3.07Å; Q102-T106 PolarHBondContact O-OG1 3.49Å; I103-T106 PolarHBondContact O-N 3.06Å; T106-K108 PolarHBondContact O-N 2.95Å
107	M	60.8	Low	75.5	Confident	107 Å²	107	99.8 Å²	99.8	53%	0.527	51%	0.51	S	S	.	.			trans	-96.7	63.3	175	-58	-177.4	64.8	0	0	109.1	I103 N104 I109	I103-M107 HydrophobicContact CG2-CG 4.41Å; I103-M107 HydrophobicContact CG2-SD 3.84Å; I103-M107 WeakPolarHBondContact O-CA 3.32Å; I103-M107 WeakPolarHBondContact O-CB 3.44Å; I103-M107 WeakPolarHBondContact O-CG 3.3Å; I103-M107 PolarHBondContact O-N 3.28Å; N104-M107 CarbonylContact O-C 3.41Å; N104-M107 VanDerWaalsContact O-C 3.29Å; M107-I109 WeakPolarHBondContact O-CG1 3.48Å; M107-I109 PolarHBondContact O-N 3.31Å
108	K	67.3	Low	75.9	Confident	113 Å²	113	100.3 Å²	100.3	49%	0.491	51%	0.513	S	S	.	.			trans	-62.1	85.1	163.5	-74.6	-178.7	-178.3	178.3	0	108	N104 T106 S110 D111 L112	N104-K108 PolarHBondContact O-N 3.25Å; T106-K108 PolarHBondContact O-N 2.95Å; K108-S110 PolarHBondContact O-N 2.78Å; K108-D111 HydrophobicContact CB-CB 4.04Å; K108-D111 WeakPolarHBondContact CB-OD2 3.35Å; K108-D111 WeakPolarHBondContact CD-OD2 3.35Å; K108-D111 PolarHBondContact O-N 3.03Å; K108-L112 PolarHBondContact O-N 3.04Å; K108-L112 VanDerWaalsContact O-N 3.14Å
109	I	69.1	Low	76.5	Confident	113 Å²	113	103.8 Å²	103.8	58%	0.579	52%	0.515	S	S	*	.	H	α-helix	trans	-55.5	-27.2	-178.6	-72.9	159.5	0	0	0	109.8	M107 K113	M107-I109 WeakPolarHBondContact O-CG1 3.48Å; M107-I109 PolarHBondContact O-N 3.31Å; I109-K113 WeakPolarHBondContact O-CB 3.12Å; I109-K113 PolarHBondContact O-N 3.36Å
110	S	74.4	Confident	77	Confident	67 Å²	67	104.1 Å²	104.1	47%	0.469	52%	0.517	S	S	.	.	H	α-helix	trans	-60	-46.4	170.7	55.5	0	0	0	0	113.1	K108 K113 N114	K108-S110 PolarHBondContact O-N 2.78Å; S110-K113 PolarHBondContact O-N 3.33Å; S110-N114 WeakPolarHBondContact O-CB 3.44Å; S110-N114 PolarHBondContact O-N 3.38Å; S110-N114 PolarHBondContact O-ND2 3.23Å; S110-N114 PolarHBondContact O-OD1 2.73Å
111	D	76.1	Confident	77.5	Confident	82 Å²	82	104.9 Å²	104.9	44%	0.439	52%	0.518	S	S	.	.	H	α-helix	trans	-72.6	-43.1	-174.7	-60.1	0.1	0	0	0	108.8	K108 K113 N114 E115	K108-D111 HydrophobicContact CB-CB 4.04Å; K108-D111 WeakPolarHBondContact CB-OD2 3.35Å; K108-D111 WeakPolarHBondContact CD-OD2 3.35Å; K108-D111 PolarHBondContact O-N 3.03Å; D111-K113 VanDerWaalsContact C-N 3.35Å; D111-K113 PolarHBondContact O-N 2.99Å; D111-N114 PolarHBondContact O-N 3.5Å; D111-E115 WeakPolarHBondContact O-CB 3.39Å; D111-E115 PolarHBondContact O-N 3.07Å
112	L	75.6	Confident	78.1	Confident	91 Å²	91	103.7 Å²	103.7	48%	0.476	52%	0.518	S	S	.	.	H	α-helix	trans	-58.6	-46.3	171.7	-129.9	86	0	0	0	111.1	K108 N114 E115 F116	K108-L112 PolarHBondContact O-N 3.04Å; K108-L112 VanDerWaalsContact O-N 3.14Å; L112-N114 VanDerWaalsContact C-N 3.34Å; L112-N114 PolarHBondContact O-N 3.15Å; L112-E115 PolarHBondContact O-N 3.03Å; L112-F116 HydrophobicContact CB-CD2 4.49Å; L112-F116 HydrophobicContact CD2-CD2 4.28Å; L112-F116 HydrophobicContact CD2-CE2 3.68Å; L112-F116 HydrophobicContact CG-CD2 4.16Å; L112-F116 HydrophobicContact CG-CE2 3.85Å; L112-F116 WeakPolarHBondContact O-CB 2.96Å; L112-F116 WeakPolarHBondContact O-CD2 3.22Å; L112-F116 PolarHBondContact O-N 3.25Å
113	K	78.4	Confident	78.5	Confident	143 Å²	143	102.5 Å²	102.5	62%	0.622	52%	0.515	S	S	*	.	H	α-helix	trans	-62.4	-40.6	178.6	-178.3	-179.2	176.9	-176.4	0	111.6	I109 S110 D111 T117	I109-K113 WeakPolarHBondContact O-CB 3.12Å; I109-K113 PolarHBondContact O-N 3.36Å; S110-K113 PolarHBondContact O-N 3.33Å; D111-K113 VanDerWaalsContact C-N 3.35Å; D111-K113 PolarHBondContact O-N 2.99Å; K113-T117 WeakPolarHBondContact O-CB 3.37Å; K113-T117 PolarHBondContact O-N 2.86Å; K113-T117 PolarHBondContact O-OG1 3.05Å
114	N	80.1	Confident	79.2	Confident	97 Å²	97	104.3 Å²	104.3	52%	0.519	52%	0.521	S	S	.	.	H	α-helix	trans	-65.5	-47.4	176.8	-69.1	-16.1	0	0	0	110.8	S110 D111 L112 F116 T117 E118	S110-N114 WeakPolarHBondContact O-CB 3.44Å; S110-N114 PolarHBondContact O-N 3.38Å; S110-N114 PolarHBondContact O-ND2 3.23Å; S110-N114 PolarHBondContact O-OD1 2.73Å; D111-N114 PolarHBondContact O-N 3.5Å; L112-N114 VanDerWaalsContact C-N 3.34Å; L112-N114 PolarHBondContact O-N 3.15Å; N114-F116 PolarHBondContact O-N 3.27Å; N114-T117 PolarHBondContact O-N 2.91Å; N114-T117 VanDerWaalsContact O-N 3.14Å; N114-E118 PolarHBondContact O-N 3.47Å
115	E	82.7	Confident	79.9	Confident	87 Å²	87	105.7 Å²	105.7	41%	0.407	53%	0.525	S	S	.	.	H	α-helix	trans	-59.9	-45.6	176.5	-172	-172.9	168.9	0	0	111.7	D111 L112 T117 E118 R119	D111-E115 WeakPolarHBondContact O-CB 3.39Å; D111-E115 PolarHBondContact O-N 3.07Å; L112-E115 PolarHBondContact O-N 3.03Å; E115-T117 VanDerWaalsContact C-N 3.31Å; E115-T117 PolarHBondContact O-N 3.44Å; E115-E118 PolarHBondContact O-N 2.88Å; E115-R119 WeakPolarHBondContact O-CG 3.48Å; E115-R119 PolarHBondContact O-N 2.84Å; E115-R119 IonicContact OE1-CZ 3.21Å; E115-R119 VanDerWaalsContact OE1-CZ 3.26Å; E115-R119 IonicContact OE1-NE 3.49Å; E115-R119 PolarHBondContact OE1-NE 3.33Å; E115-R119 IonicContact OE1-NH2 3.26Å; E115-R119 PolarHBondContact OE1-NH2 3.34Å
116	F	85.4	Confident	80.5	Confident	116 Å²	116	109.8 Å²	109.8	51%	0.509	53%	0.533	S	S	.	.	H	α-helix	trans	-62.6	-38.1	175.6	-84.6	-64.9	0	0	0	112	L112 N114 R119 I120	L112-F116 HydrophobicContact CB-CD2 4.49Å; L112-F116 HydrophobicContact CD2-CD2 4.28Å; L112-F116 HydrophobicContact CD2-CE2 3.68Å; L112-F116 HydrophobicContact CG-CD2 4.16Å; L112-F116 HydrophobicContact CG-CE2 3.85Å; L112-F116 WeakPolarHBondContact O-CB 2.96Å; L112-F116 WeakPolarHBondContact O-CD2 3.22Å; L112-F116 PolarHBondContact O-N 3.25Å; N114-F116 PolarHBondContact O-N 3.27Å; F116-R119 PolarHBondContact O-N 2.83Å; F116-I120 WeakPolarHBondContact O-CB 3.03Å; F116-I120 WeakPolarHBondContact O-CD1 3.45Å; F116-I120 WeakPolarHBondContact O-CG1 3.44Å; F116-I120 PolarHBondContact O-N 3.09Å
117	T	87.2	Confident	81.3	Confident	63 Å²	63	108.8 Å²	108.8	39%	0.387	53%	0.527	S	S	.	.	H	α-helix	trans	-65.6	-43.6	178	-56.3	0	0	0	0	111.2	K113 N114 E115 I120 Q121	K113-T117 WeakPolarHBondContact O-CB 3.37Å; K113-T117 PolarHBondContact O-N 2.86Å; K113-T117 PolarHBondContact O-OG1 3.05Å; N114-T117 PolarHBondContact O-N 2.91Å; N114-T117 VanDerWaalsContact O-N 3.14Å; E115-T117 VanDerWaalsContact C-N 3.31Å; E115-T117 PolarHBondContact O-N 3.44Å; T117-I120 PolarHBondContact O-N 3.08Å; T117-Q121 WeakPolarHBondContact O-CG 3.13Å; T117-Q121 PolarHBondContact O-N 3.4Å
118	E	89.7	Confident	82.1	Confident	125 Å²	125	109.8 Å²	109.8	58%	0.584	53%	0.531	S	S	*	.	H	α-helix	trans	-63.7	-44.4	175.5	-74.9	-178.6	176.9	0	0	112	N114 E115 I120 Q121 L122	N114-E118 PolarHBondContact O-N 3.47Å; E115-E118 PolarHBondContact O-N 2.88Å; E118-I120 VanDerWaalsContact C-N 3.34Å; E118-I120 PolarHBondContact O-N 3.08Å; E118-Q121 PolarHBondContact O-N 3.05Å; E118-L122 WeakPolarHBondContact O-CG 3.5Å; E118-L122 PolarHBondContact O-N 3.11Å
119	R	89.3	Confident	82.7	Confident	147 Å²	147	108 Å²	108	56%	0.555	53%	0.53	S	S	*	.	H	α-helix	trans	-63	-39.3	176.6	-73.2	-173.6	-174.9	-154	5.7	112.3	E115 F116 L122 L123	E115-R119 WeakPolarHBondContact O-CG 3.48Å; E115-R119 PolarHBondContact O-N 2.84Å; E115-R119 IonicContact OE1-CZ 3.21Å; E115-R119 VanDerWaalsContact OE1-CZ 3.26Å; E115-R119 IonicContact OE1-NE 3.49Å; E115-R119 PolarHBondContact OE1-NE 3.33Å; E115-R119 IonicContact OE1-NH2 3.26Å; E115-R119 PolarHBondContact OE1-NH2 3.34Å; F116-R119 PolarHBondContact O-N 2.83Å; R119-L122 PolarHBondContact O-N 3.15Å; R119-L123 WeakPolarHBondContact O-CG 3.36Å; R119-L123 PolarHBondContact O-N 3.17Å
120	I	90.2	Very high	83	Confident	87 Å²	87	107.2 Å²	107.2	45%	0.446	52%	0.524	S	S	.	.	H	α-helix	trans	-64.1	-44.8	176	-73.1	167.1	0	0	0	110.5	F116 T117 E118 L122 L123 E124	F116-I120 WeakPolarHBondContact O-CB 3.03Å; F116-I120 WeakPolarHBondContact O-CD1 3.45Å; F116-I120 WeakPolarHBondContact O-CG1 3.44Å; F116-I120 PolarHBondContact O-N 3.09Å; T117-I120 PolarHBondContact O-N 3.08Å; E118-I120 VanDerWaalsContact C-N 3.34Å; E118-I120 PolarHBondContact O-N 3.08Å; I120-L122 VanDerWaalsContact C-N 3.35Å; I120-L122 PolarHBondContact O-N 2.45Å; I120-L123 PolarHBondContact O-N 2.67Å; I120-L123 VanDerWaalsContact O-N 3.17Å; I120-E124 HydrophobicContact CG2-CG 4.35Å; I120-E124 WeakPolarHBondContact O-CG 3.38Å; I120-E124 PolarHBondContact O-N 2.95Å
121	Q	88.4	Confident	83.2	Confident	110 Å²	110	106.8 Å²	106.8	51%	0.514	52%	0.521	S	S	.	.	H	α-helix	trans	-61	-41.1	177	-76.5	179.1	-10.9	0	0	112.7	T117 E118 L123 E124 Q125	T117-Q121 WeakPolarHBondContact O-CG 3.13Å; T117-Q121 PolarHBondContact O-N 3.4Å; E118-Q121 PolarHBondContact O-N 3.05Å; Q121-L123 VanDerWaalsContact C-N 3.35Å; Q121-E124 PolarHBondContact O-N 3.29Å; Q121-Q125 WeakPolarHBondContact O-CG 3.47Å; Q121-Q125 PolarHBondContact O-N 3.43Å
122	L	89.1	Confident	83.1	Confident	112 Å²	112	107.1 Å²	107.1	59%	0.586	52%	0.523	S	S	*	.	H	α-helix	trans	-65	-38	175.2	-73.9	171	0	0	0	112.4	E118 R119 I120 R126	E118-L122 WeakPolarHBondContact O-CG 3.5Å; E118-L122 PolarHBondContact O-N 3.11Å; R119-L122 PolarHBondContact O-N 3.15Å; I120-L122 VanDerWaalsContact C-N 3.35Å; I120-L122 PolarHBondContact O-N 2.45Å; L122-R126 PolarHBondContact O-N 2.72Å
123	L	84.7	Confident	83.1	Confident	101 Å²	101	109 Å²	109	53%	0.529	52%	0.523	S	S	.	.	H	α-helix	trans	-67.6	-42.8	175.3	-76.6	169.1	0	0	0	111.7	R119 I120 Q121 Q125 R126 V127	R119-L123 WeakPolarHBondContact O-CG 3.36Å; R119-L123 PolarHBondContact O-N 3.17Å; I120-L123 PolarHBondContact O-N 2.67Å; I120-L123 VanDerWaalsContact O-N 3.17Å; Q121-L123 VanDerWaalsContact C-N 3.35Å; L123-Q125 VanDerWaalsContact C-N 3.34Å; L123-Q125 PolarHBondContact O-N 2.77Å; L123-R126 PolarHBondContact O-N 3.49Å; L123-V127 WeakPolarHBondContact O-CB 3.4Å; L123-V127 VanDerWaalsContact O-CG2 3.29Å; L123-V127 WeakPolarHBondContact O-CG2 3.36Å; L123-V127 PolarHBondContact O-N 2.83Å
124	E	86.7	Confident	82.9	Confident	121 Å²	121	109.4 Å²	109.4	57%	0.565	52%	0.522	S	S	*	.	H	α-helix	trans	-59	-44.2	175.2	-74	175.7	165.9	0	0	111.5	I120 Q121 R126 V127 M128	I120-E124 HydrophobicContact CG2-CG 4.35Å; I120-E124 WeakPolarHBondContact O-CG 3.38Å; I120-E124 PolarHBondContact O-N 2.95Å; Q121-E124 PolarHBondContact O-N 3.29Å; E124-R126 PolarHBondContact O-N 3.18Å; E124-V127 PolarHBondContact O-N 3.48Å; E124-M128 PolarHBondContact O-N 2.86Å
125	Q	84.5	Confident	82.7	Confident	124 Å²	124	108.7 Å²	108.7	58%	0.579	52%	0.518	S	S	*	.	H	α-helix	trans	-61.4	-43.2	174.4	-74.4	179.7	4.2	0	0	112.3	Q121 L123 M128 V129	Q121-Q125 WeakPolarHBondContact O-CG 3.47Å; Q121-Q125 PolarHBondContact O-N 3.43Å; L123-Q125 VanDerWaalsContact C-N 3.34Å; L123-Q125 PolarHBondContact O-N 2.77Å; Q125-M128 PolarHBondContact O-N 3.13Å; Q125-V129 WeakPolarHBondContact O-CG2 3.23Å; Q125-V129 PolarHBondContact O-N 2.96Å; Q125-V129 VanDerWaalsContact O-N 3.1Å
126	R	82.8	Confident	82.4	Confident	181 Å²	181	109.3 Å²	109.3	68%	0.683	52%	0.524	S	S	*	.	H	α-helix	trans	-66.5	-39.6	178.7	-162.9	-176.4	-75.2	-174.8	-4.1	111.5	L122 L123 E124 V129 E130	L122-R126 PolarHBondContact O-N 2.72Å; L123-R126 PolarHBondContact O-N 3.49Å; E124-R126 PolarHBondContact O-N 3.18Å; R126-V129 PolarHBondContact O-N 3.04Å; R126-E130 WeakPolarHBondContact O-CG 3.4Å; R126-E130 PolarHBondContact O-N 3.45Å
127	V	84.3	Confident	82	Confident	98 Å²	98	107.7 Å²	107.7	59%	0.594	52%	0.52	S	S	*	.	H	α-helix	trans	-65.5	-37.8	175.4	170.7	0	0	0	0	111.4	L123 E124 E130 S131	L123-V127 WeakPolarHBondContact O-CB 3.4Å; L123-V127 VanDerWaalsContact O-CG2 3.29Å; L123-V127 WeakPolarHBondContact O-CG2 3.36Å; L123-V127 PolarHBondContact O-N 2.83Å; E124-V127 PolarHBondContact O-N 3.48Å; V127-E130 PolarHBondContact O-N 2.82Å; V127-S131 WeakPolarHBondContact O-CB 3.25Å; V127-S131 PolarHBondContact O-N 2.87Å
128	M	78.6	Confident	81.5	Confident	127 Å²	127	107.5 Å²	107.5	63%	0.626	52%	0.517	S	S	*	.	H	α-helix	trans	-60.4	-48.7	172.4	-83.8	-176.2	59.1	0	0	111.8	E124 Q125 E130 S131 D132	E124-M128 PolarHBondContact O-N 2.86Å; Q125-M128 PolarHBondContact O-N 3.13Å; M128-E130 VanDerWaalsContact C-N 3.32Å; M128-E130 PolarHBondContact O-N 3.45Å; M128-S131 WeakPolarHBondContact O-CB 3.32Å; M128-S131 PolarHBondContact O-N 3.37Å; M128-S131 VanDerWaalsContact O-N 3.15Å; M128-D132 PolarHBondContact O-N 3.42Å
129	V	78.5	Confident	81	Confident	76 Å²	76	105 Å²	105	46%	0.461	51%	0.51	S	S	.	.	H	α-helix	trans	-61.2	-40.7	178.1	173.7	0	0	0	0	111.6	Q125 R126 D132 R133	Q125-V129 WeakPolarHBondContact O-CG2 3.23Å; Q125-V129 PolarHBondContact O-N 2.96Å; Q125-V129 VanDerWaalsContact O-N 3.1Å; R126-V129 PolarHBondContact O-N 3.04Å; V129-D132 PolarHBondContact O-N 2.97Å; V129-R133 VanDerWaalsContact O-CG 3.3Å; V129-R133 WeakPolarHBondContact O-CG 3.16Å; V129-R133 PolarHBondContact O-N 3.35Å
130	E	76.6	Confident	80.4	Confident	96 Å²	96	102.2 Å²	102.2	45%	0.449	51%	0.505	S	S	.	.	H	α-helix	trans	-69.5	-33.5	175.5	-72.9	-59.8	140.8	0	0	112.9	R126 V127 M128 R133 Y134	R126-E130 WeakPolarHBondContact O-CG 3.4Å; R126-E130 PolarHBondContact O-N 3.45Å; V127-E130 PolarHBondContact O-N 2.82Å; M128-E130 VanDerWaalsContact C-N 3.32Å; M128-E130 PolarHBondContact O-N 3.45Å; E130-R133 PolarHBondContact O-N 2.96Å; E130-R133 IonicContact OE1-CZ 2.72Å; E130-R133 IonicContact OE1-NE 3.51Å; E130-R133 IonicContact OE1-NH1 2.67Å; E130-R133 PolarHBondContact OE1-NH1 3.49Å; E130-Y134 WeakPolarHBondContact O-CB 3.38Å; E130-Y134 PolarHBondContact O-N 2.95Å
131	S	77.5	Confident	80	Confident	58 Å²	58	103.9 Å²	103.9	41%	0.406	51%	0.509	S	S	.	.	H	α-helix	trans	-65.8	-41.4	173.1	-175.1	0	0	0	0	111.6	V127 M128 Y134 N135	V127-S131 WeakPolarHBondContact O-CB 3.25Å; V127-S131 PolarHBondContact O-N 2.87Å; M128-S131 WeakPolarHBondContact O-CB 3.32Å; M128-S131 PolarHBondContact O-N 3.37Å; M128-S131 VanDerWaalsContact O-N 3.15Å; S131-Y134 PolarHBondContact O-N 2.88Å; S131-N135 VanDerWaalsContact O-CG 3.25Å; S131-N135 PolarHBondContact O-N 2.93Å; S131-N135 PolarHBondContact O-ND2 3.08Å
132	D	74	Confident	79.6	Confident	90 Å²	90	104.7 Å²	104.7	48%	0.481	51%	0.511	S	S	.	.	H	α-helix	trans	-64.5	-42.3	175.9	-70.5	-20.8	0	0	0	110.6	M128 V129 Y134 N135 D136	M128-D132 PolarHBondContact O-N 3.42Å; V129-D132 PolarHBondContact O-N 2.97Å; D132-Y134 VanDerWaalsContact C-N 3.34Å; D132-Y134 PolarHBondContact O-N 3.37Å; D132-N135 WeakPolarHBondContact O-CB 3.36Å; D132-N135 PolarHBondContact O-N 3.09Å; D132-D136 PolarHBondContact O-N 3.31Å
133	R	76.5	Confident	79.4	Confident	130 Å²	130	104.8 Å²	104.8	49%	0.491	51%	0.508	S	S	.	.	H	α-helix	trans	-59.9	-41.2	171.7	-72.5	171.8	175.4	-167.1	-9.6	112.8	V129 E130 N135 D136 I137	V129-R133 VanDerWaalsContact O-CG 3.3Å; V129-R133 WeakPolarHBondContact O-CG 3.16Å; V129-R133 PolarHBondContact O-N 3.35Å; E130-R133 PolarHBondContact O-N 2.96Å; E130-R133 IonicContact OE1-CZ 2.72Å; E130-R133 IonicContact OE1-NE 3.51Å; E130-R133 IonicContact OE1-NH1 2.67Å; E130-R133 PolarHBondContact OE1-NH1 3.49Å; R133-N135 VanDerWaalsContact C-N 3.34Å; R133-D136 PolarHBondContact O-N 2.81Å; R133-I137 VanDerWaalsContact O-CG1 3.29Å; R133-I137 WeakPolarHBondContact O-CG1 3.32Å; R133-I137 PolarHBondContact O-N 2.81Å
134	Y	74.6	Confident	79.1	Confident	151 Å²	151	104.4 Å²	104.4	59%	0.592	51%	0.506	S	S	*	.	H	α-helix	trans	-64.7	-40.1	176.8	-174.4	-91.2	0	0	0	111.6	E130 S131 D132 I137 D138	E130-Y134 WeakPolarHBondContact O-CB 3.38Å; E130-Y134 PolarHBondContact O-N 2.95Å; S131-Y134 PolarHBondContact O-N 2.88Å; D132-Y134 VanDerWaalsContact C-N 3.34Å; D132-Y134 PolarHBondContact O-N 3.37Å; Y134-I137 PolarHBondContact O-N 3.29Å; Y134-D138 PolarHBondContact O-N 3.45Å
135	N	74.7	Confident	78.9	Confident	83 Å²	83	105.5 Å²	105.5	44%	0.444	51%	0.509	S	S	.	.	H	α-helix	trans	-62.2	-44	174.3	-69.9	-31.4	0	0	0	111.1	S131 D132 R133 I137 D138 V139	S131-N135 VanDerWaalsContact O-CG 3.25Å; S131-N135 PolarHBondContact O-N 2.93Å; S131-N135 PolarHBondContact O-ND2 3.08Å; D132-N135 WeakPolarHBondContact O-CB 3.36Å; D132-N135 PolarHBondContact O-N 3.09Å; R133-N135 VanDerWaalsContact C-N 3.34Å; N135-I137 PolarHBondContact O-N 2.76Å; N135-D138 PolarHBondContact O-N 3.38Å; N135-V139 WeakPolarHBondContact O-CG2 3.31Å; N135-V139 PolarHBondContact O-N 3.3Å
136	D	77.5	Confident	78.5	Confident	100 Å²	100	104.4 Å²	104.4	54%	0.535	50%	0.504	S	S	.	.	H	α-helix	trans	-61.4	-43.1	175.4	-69	-20.8	0	0	0	111.5	D132 R133 D138 V139 I140	D132-D136 PolarHBondContact O-N 3.31Å; R133-D136 PolarHBondContact O-N 2.81Å; D136-D138 VanDerWaalsContact C-N 3.33Å; D136-D138 PolarHBondContact O-N 2.65Å; D136-V139 PolarHBondContact O-N 3.06Å; D136-I140 WeakPolarHBondContact O-CB 3.37Å; D136-I140 VanDerWaalsContact O-CG1 3.23Å; D136-I140 WeakPolarHBondContact O-CG1 3.37Å; D136-I140 PolarHBondContact O-N 2.97Å
137	I	76.2	Confident	78.3	Confident	81 Å²	81	100 Å²	100	42%	0.415	49%	0.494	S	S	.	.	H	α-helix	trans	-62	-39.5	174.9	-70.4	167.3	0	0	0	111.4	R133 Y134 N135 I140 K141	R133-I137 VanDerWaalsContact O-CG1 3.29Å; R133-I137 WeakPolarHBondContact O-CG1 3.32Å; R133-I137 PolarHBondContact O-N 2.81Å; Y134-I137 PolarHBondContact O-N 3.29Å; N135-I137 PolarHBondContact O-N 2.76Å; I137-I140 PolarHBondContact O-N 2.86Å; I137-K141 HydrophobicContact CG2-CD 3.97Å; I137-K141 HydrophobicContact CG2-CG 4.34Å; I137-K141 WeakPolarHBondContact O-CB 3.38Å; I137-K141 VanDerWaalsContact O-CG 3.25Å; I137-K141 WeakPolarHBondContact O-CG 3.19Å; I137-K141 PolarHBondContact O-N 3.31Å
138	D	76.6	Confident	77.9	Confident	60 Å²	60	102.5 Å²	102.5	32%	0.321	50%	0.496	S	S	.	.	H	α-helix	trans	-68.7	-37.4	177.9	-166.9	51.5	0	0	0	111.8	Y134 N135 D136 K141 K142	Y134-D138 PolarHBondContact O-N 3.45Å; N135-D138 PolarHBondContact O-N 3.38Å; D136-D138 VanDerWaalsContact C-N 3.33Å; D136-D138 PolarHBondContact O-N 2.65Å; D138-K141 PolarHBondContact O-N 2.92Å; D138-K142 WeakPolarHBondContact O-CG 3.41Å; D138-K142 PolarHBondContact O-N 3.34Å; D138-K142 WeakPolarHBondContact OD2-CE 3.32Å; D138-K142 IonicContact OD2-NZ 3.15Å; D138-K142 PolarHBondContact OD2-NZ 3.14Å
139	V	80.1	Confident	77.6	Confident	73 Å²	73	99.6 Å²	99.6	44%	0.442	48%	0.483	S	S	.	.	H	α-helix	trans	-61.6	-51	171	173.6	0	0	0	0	110.3	N135 D136 K141 K142 E143	N135-V139 WeakPolarHBondContact O-CG2 3.31Å; N135-V139 PolarHBondContact O-N 3.3Å; D136-V139 PolarHBondContact O-N 3.06Å; V139-K141 VanDerWaalsContact C-N 3.31Å; V139-K141 PolarHBondContact O-N 3.43Å; V139-K142 WeakPolarHBondContact O-CB 3.37Å; V139-K142 PolarHBondContact O-N 2.97Å; V139-K142 VanDerWaalsContact O-N 3.09Å; V139-E143 WeakPolarHBondContact O-CG 3.4Å; V139-E143 PolarHBondContact O-N 3.04Å
140	I	77.3	Confident	77.4	Confident	87 Å²	87	99.9 Å²	99.9	45%	0.446	48%	0.479	S	S	.	.	H	α-helix	trans	-59.8	-41.5	177.9	-67.8	164.4	0	0	0	110.9	D136 I137 K142 E143 L144	D136-I140 WeakPolarHBondContact O-CB 3.37Å; D136-I140 VanDerWaalsContact O-CG1 3.23Å; D136-I140 WeakPolarHBondContact O-CG1 3.37Å; D136-I140 PolarHBondContact O-N 2.97Å; I137-I140 PolarHBondContact O-N 2.86Å; I140-K142 VanDerWaalsContact C-N 3.34Å; I140-K142 PolarHBondContact O-N 3.5Å; I140-E143 PolarHBondContact O-N 3.43Å; I140-L144 HydrophobicContact CG2-CD1 3.94Å; I140-L144 HydrophobicContact CG2-CG 4.24Å; I140-L144 WeakPolarHBondContact O-CB 3.36Å; I140-L144 VanDerWaalsContact O-CG 3.27Å; I140-L144 WeakPolarHBondContact O-CG 3.15Å; I140-L144 PolarHBondContact O-N 3.47Å
141	K	80.1	Confident	77.2	Confident	123 Å²	123	99.5 Å²	99.5	54%	0.535	48%	0.479	S	S	.	.	H	α-helix	trans	-63	-39.4	176.2	-80.3	173.6	-179.9	171.7	0	112.1	I137 D138 V139 K145	I137-K141 HydrophobicContact CG2-CD 3.97Å; I137-K141 HydrophobicContact CG2-CG 4.34Å; I137-K141 WeakPolarHBondContact O-CB 3.38Å; I137-K141 VanDerWaalsContact O-CG 3.25Å; I137-K141 WeakPolarHBondContact O-CG 3.19Å; I137-K141 PolarHBondContact O-N 3.31Å; D138-K141 PolarHBondContact O-N 2.92Å; V139-K141 VanDerWaalsContact C-N 3.31Å; V139-K141 PolarHBondContact O-N 3.43Å; K141-K145 WeakPolarHBondContact O-CB 3.25Å; K141-K145 PolarHBondContact O-N 3.45Å
142	K	81.3	Confident	76.8	Confident	126 Å²	126	102.4 Å²	102.4	55%	0.548	49%	0.486	S	S	.	.	H	α-helix	trans	-65.8	-44.2	174.7	-74.9	169.5	-171	157	0	111.2	D138 V139 I140 K145 Q146	D138-K142 WeakPolarHBondContact O-CG 3.41Å; D138-K142 PolarHBondContact O-N 3.34Å; D138-K142 WeakPolarHBondContact OD2-CE 3.32Å; D138-K142 IonicContact OD2-NZ 3.15Å; D138-K142 PolarHBondContact OD2-NZ 3.14Å; V139-K142 WeakPolarHBondContact O-CB 3.37Å; V139-K142 PolarHBondContact O-N 2.97Å; V139-K142 VanDerWaalsContact O-N 3.09Å; I140-K142 VanDerWaalsContact C-N 3.34Å; I140-K142 PolarHBondContact O-N 3.5Å; K142-K145 WeakPolarHBondContact O-CB 3.46Å; K142-K145 PolarHBondContact O-N 2.85Å; K142-Q146 PolarHBondContact O-N 3.29Å
143	E	84	Confident	76.6	Confident	115 Å²	115	103.7 Å²	103.7	54%	0.537	49%	0.489	S	S	.	.	H	α-helix	trans	-62.1	-44.1	175.4	-71	-177.9	168	0	0	111.7	V139 I140 K145 Q146 L147	V139-E143 WeakPolarHBondContact O-CG 3.4Å; V139-E143 PolarHBondContact O-N 3.04Å; I140-E143 PolarHBondContact O-N 3.43Å; E143-K145 VanDerWaalsContact C-N 3.33Å; E143-K145 PolarHBondContact O-N 3.28Å; E143-Q146 PolarHBondContact O-N 2.95Å; E143-L147 WeakPolarHBondContact O-CB 3.37Å; E143-L147 PolarHBondContact O-N 3.45Å
144	L	78.9	Confident	75.8	Confident	92 Å²	92	106 Å²	106	48%	0.482	50%	0.498	S	S	.	.	H	α-helix	trans	-62.6	-38	174.5	-75.2	174.6	0	0	0	112.3	I140 K148	I140-L144 HydrophobicContact CG2-CD1 3.94Å; I140-L144 HydrophobicContact CG2-CG 4.24Å; I140-L144 WeakPolarHBondContact O-CB 3.36Å; I140-L144 VanDerWaalsContact O-CG 3.27Å; I140-L144 WeakPolarHBondContact O-CG 3.15Å; I140-L144 PolarHBondContact O-N 3.47Å; L144-K148 WeakPolarHBondContact O-CB 3.36Å; L144-K148 VanDerWaalsContact O-CG 3.32Å; L144-K148 WeakPolarHBondContact O-CG 3.36Å; L144-K148 PolarHBondContact O-N 2.98Å
145	K	81.7	Confident	74.8	Confident	145 Å²	145	104.7 Å²	104.7	63%	0.63	50%	0.495	S	S	*	.	H	α-helix	trans	-65.8	-41.8	174.3	-169.8	177.4	-179	-179.2	0	110.7	K141 K142 E143 K148 I149	K141-K145 WeakPolarHBondContact O-CB 3.25Å; K141-K145 PolarHBondContact O-N 3.45Å; K142-K145 WeakPolarHBondContact O-CB 3.46Å; K142-K145 PolarHBondContact O-N 2.85Å; E143-K145 VanDerWaalsContact C-N 3.33Å; E143-K145 PolarHBondContact O-N 3.28Å; K145-K148 PolarHBondContact O-N 3.5Å; K145-I149 WeakPolarHBondContact O-CG1 3.03Å; K145-I149 PolarHBondContact O-N 2.73Å
146	Q	76.8	Confident	73.9	Confident	101 Å²	101	104.5 Å²	104.5	47%	0.472	50%	0.498	S	S	.	.	H	α-helix	trans	-66.3	-43	176.8	-164.3	61.5	32.5	0	0	111.7	K142 E143 K148 I149 Q150	K142-Q146 PolarHBondContact O-N 3.29Å; E143-Q146 PolarHBondContact O-N 2.95Å; Q146-K148 PolarHBondContact O-N 3.06Å; Q146-I149 PolarHBondContact O-N 2.92Å; Q146-Q150 WeakPolarHBondContact O-CG 3.36Å; Q146-Q150 PolarHBondContact O-N 2.97Å
147	L	77.8	Confident	72.5	Confident	88 Å²	88	102.7 Å²	102.7	46%	0.461	50%	0.502	S	S	.	.	H	α-helix	trans	-60.3	-42.4	173	-90.5	156.3	0	0	0	111.6	E143 I149 Q150 I151	E143-L147 WeakPolarHBondContact O-CB 3.37Å; E143-L147 PolarHBondContact O-N 3.45Å; L147-I149 VanDerWaalsContact C-N 3.34Å; L147-I149 PolarHBondContact O-N 2.89Å; L147-Q150 PolarHBondContact O-N 3.35Å; L147-I151 WeakPolarHBondContact O-CB 3.49Å; L147-I151 WeakPolarHBondContact O-CG1 3.38Å; L147-I151 PolarHBondContact O-N 2.97Å
148	K	76.1	Confident	70.8	Confident	150 Å²	150	104.9 Å²	104.9	65%	0.652	51%	0.514	S	S	*	.	H	α-helix	trans	-60.8	-41.4	174.2	-80.7	179.1	-179.8	-178.7	0	112.1	L144 K145 Q146 I151 H152	L144-K148 WeakPolarHBondContact O-CB 3.36Å; L144-K148 VanDerWaalsContact O-CG 3.32Å; L144-K148 WeakPolarHBondContact O-CG 3.36Å; L144-K148 PolarHBondContact O-N 2.98Å; K145-K148 PolarHBondContact O-N 3.5Å; Q146-K148 PolarHBondContact O-N 3.06Å; K148-I151 PolarHBondContact O-N 2.91Å; K148-H152 WeakPolarHBondContact O-CB 3.42Å; K148-H152 PolarHBondContact O-N 2.84Å
149	I	73.8	Confident	68.9	Low	67 Å²	67	107.6 Å²	107.6	34%	0.344	53%	0.533	S	S	.	.	H	α-helix	trans	-63.6	-48.7	175	-67.7	165.5	0	0	0	110	K145 Q146 L147 I151 H152 E153	K145-I149 WeakPolarHBondContact O-CG1 3.03Å; K145-I149 PolarHBondContact O-N 2.73Å; Q146-I149 PolarHBondContact O-N 2.92Å; L147-I149 VanDerWaalsContact C-N 3.34Å; L147-I149 PolarHBondContact O-N 2.89Å; I149-I151 VanDerWaalsContact C-N 3.32Å; I149-I151 PolarHBondContact O-N 3Å; I149-H152 CarbonylContact O-C 3.59Å; I149-H152 PolarHBondContact O-N 2.63Å; I149-H152 VanDerWaalsContact O-N 3.08Å; I149-E153 HydrophobicContact CG2-CG 4.26Å; I149-E153 WeakPolarHBondContact O-CB 3.49Å; I149-E153 WeakPolarHBondContact O-CG 3.43Å; I149-E153 PolarHBondContact O-N 3.22Å
150	Q	73.8	Confident	66.7	Low	82 Å²	82	110.7 Å²	110.7	38%	0.383	55%	0.547	S	S	.	.	H	α-helix	trans	-60.7	-38.7	177.7	-70.6	176.9	10.2	0	0	112.7	Q146 L147 R154	Q146-Q150 WeakPolarHBondContact O-CG 3.36Å; Q146-Q150 PolarHBondContact O-N 2.97Å; L147-Q150 PolarHBondContact O-N 3.35Å; Q150-R154 WeakPolarHBondContact O-CB 3.31Å; Q150-R154 WeakPolarHBondContact O-CG 3.38Å; Q150-R154 PolarHBondContact O-N 3.2Å
151	I	72	Confident	64.6	Low	87 Å²	87	114.9 Å²	114.9	45%	0.446	57%	0.568	S	S	.	*	H	α-helix	trans	-66.3	-41.7	174.5	-70.7	165.5	0	0	0	110.3	L147 K148 I149 R154 K155	L147-I151 WeakPolarHBondContact O-CB 3.49Å; L147-I151 WeakPolarHBondContact O-CG1 3.38Å; L147-I151 PolarHBondContact O-N 2.97Å; K148-I151 PolarHBondContact O-N 2.91Å; I149-I151 VanDerWaalsContact C-N 3.32Å; I149-I151 PolarHBondContact O-N 3Å; I151-R154 PolarHBondContact O-N 2.97Å; I151-K155 HydrophobicContact CG2-CD 4.49Å; I151-K155 WeakPolarHBondContact O-CB 3.34Å; I151-K155 WeakPolarHBondContact O-CG 3.24Å; I151-K155 PolarHBondContact O-N 3.17Å
152	H	69.2	Low	62.4	Low	120 Å²	120	111.9 Å²	111.9	56%	0.556	57%	0.573	S	S	*	*	H	α-helix	trans	-66.6	-43.6	177.6	-171.6	75	0	0	0	111.9	K148 I149 R154 K155 T156	K148-H152 WeakPolarHBondContact O-CB 3.42Å; K148-H152 PolarHBondContact O-N 2.84Å; I149-H152 CarbonylContact O-C 3.59Å; I149-H152 PolarHBondContact O-N 2.63Å; I149-H152 VanDerWaalsContact O-N 3.08Å; H152-R154 VanDerWaalsContact C-N 3.33Å; H152-R154 PolarHBondContact O-N 3.28Å; H152-K155 CarbonylContact O-C 3.55Å; H152-K155 WeakPolarHBondContact O-CA 3.43Å; H152-K155 WeakPolarHBondContact O-CB 3.44Å; H152-K155 PolarHBondContact O-N 3.3Å; H152-K155 VanDerWaalsContact O-N 3.09Å; H152-T156 WeakPolarHBondContact O-CG2 3.41Å; H152-T156 PolarHBondContact O-N 2.86Å; H152-T156 PolarHBondContact O-OG1 3.37Å
153	E	69.4	Low	60.3	Low	117 Å²	117	111.6 Å²	111.6	55%	0.547	59%	0.586	S	S	.	*	H	α-helix	trans	-61.6	-38.9	174.1	-72.3	174.6	169.8	0	0	112	I149 T156 G157	I149-E153 HydrophobicContact CG2-CG 4.26Å; I149-E153 WeakPolarHBondContact O-CB 3.49Å; I149-E153 WeakPolarHBondContact O-CG 3.43Å; I149-E153 PolarHBondContact O-N 3.22Å; E153-T156 WeakPolarHBondContact CA-OG1 2.96Å; E153-T156 PolarHBondContact O-N 3.42Å; E153-T156 PolarHBondContact O-OG1 3.47Å; E153-T156 VanDerWaalsContact O-OG1 3.13Å; E153-G157 PolarHBondContact O-N 2.92Å
154	R	59.7	Low	57.9	Low	178 Å²	178	113.7 Å²	113.7	67%	0.672	60%	0.596	S	S	*	*	H	α-helix	trans	-65.9	-39.7	170.8	-78.7	-179.3	-180	164.5	2.4	112.1	Q150 I151 H152 G157 L158	Q150-R154 WeakPolarHBondContact O-CB 3.31Å; Q150-R154 WeakPolarHBondContact O-CG 3.38Å; Q150-R154 PolarHBondContact O-N 3.2Å; I151-R154 PolarHBondContact O-N 2.97Å; H152-R154 VanDerWaalsContact C-N 3.33Å; H152-R154 PolarHBondContact O-N 3.28Å; R154-G157 PolarHBondContact O-N 3.45Å; R154-L158 WeakPolarHBondContact O-CD1 3.47Å; R154-L158 PolarHBondContact O-N 2.87Å; R154-L158 VanDerWaalsContact O-N 3.15Å
155	K	54.1	Low	55.6	Low	123 Å²	123	121 Å²	121	54%	0.535	62%	0.618	S	S	.	*	H	α-helix	trans	-66.6	-36.9	176.4	-80.4	-172.9	175.2	-168.8	0	112.2	I151 H152 E164	I151-K155 HydrophobicContact CG2-CD 4.49Å; I151-K155 WeakPolarHBondContact O-CB 3.34Å; I151-K155 WeakPolarHBondContact O-CG 3.24Å; I151-K155 PolarHBondContact O-N 3.17Å; H152-K155 CarbonylContact O-C 3.55Å; H152-K155 WeakPolarHBondContact O-CA 3.43Å; H152-K155 WeakPolarHBondContact O-CB 3.44Å; H152-K155 PolarHBondContact O-N 3.3Å; H152-K155 VanDerWaalsContact O-N 3.09Å; K155-E164 IonicContact NZ-OE1 3.68Å
156	T	55.9	Low	53.4	Low	80 Å²	80	118.6 Å²	118.6	49%	0.491	62%	0.615	S	S	.	*	H	α-helix	trans	-78.9	-26.7	177.4	55.4	0	0	0	0	112.9	H152 E153	H152-T156 WeakPolarHBondContact O-CG2 3.41Å; H152-T156 PolarHBondContact O-N 2.86Å; H152-T156 PolarHBondContact O-OG1 3.37Å; E153-T156 WeakPolarHBondContact CA-OG1 2.96Å; E153-T156 PolarHBondContact O-N 3.42Å; E153-T156 PolarHBondContact O-OG1 3.47Å; E153-T156 VanDerWaalsContact O-OG1 3.13Å
157	G	48.3	Very low	51.9	Low	61 Å²	61	123.7 Å²	123.7	63%	0.629	63%	0.631	S	S	*	*	H	α-helix	trans	-75.6	-21.3	172	0	0	0	0	0	114.7	E153 R154	E153-G157 PolarHBondContact O-N 2.92Å; R154-G157 PolarHBondContact O-N 3.45Å
158	L	40.3	Very low	50.4	Low	128 Å²	128	125 Å²	125	67%	0.67	64%	0.639	S	S	*	*			trans	-108.7	67.4	177.4	-79.1	91.6	0	0	0	111	R154 N160	R154-L158 WeakPolarHBondContact O-CD1 3.47Å; R154-L158 PolarHBondContact O-N 2.87Å; R154-L158 VanDerWaalsContact O-N 3.15Å; L158-N160 PolarHBondContact O-N 3.27Å; L158-N160 VanDerWaalsContact O-N 3.08Å
159	T	36.1	Very low	49.1	Very low	117 Å²	117	120.7 Å²	120.7	72%	0.718	64%	0.636	S	S	*	*			trans	-75.5	21.9	173.2	51.6	0	0	0	0	114.3
160	N	34.5	Very low	48.6	Very low	138 Å²	138	120.7 Å²	120.7	74%	0.738	64%	0.637	S	S	*	*	S	Bend	trans	-146.9	131.3	171.5	-89.3	-33	0	0	0	110	L158	L158-N160 PolarHBondContact O-N 3.27Å; L158-N160 VanDerWaalsContact O-N 3.08Å
161	I	33.6	Very low	48.4	Very low	174 Å²	174	119.2 Å²	119.2	89%	0.892	63%	0.631	S	S	*	*	S	Bend	trans	95.4	105.1	-178.3	-50.7	163.8	0	0	0	112.8
162	G	33.8	Very low	48.7	Very low	61 Å²	61	122.1 Å²	122.1	63%	0.629	64%	0.637	S	S	*	*			trans	-82.6	-177.6	-171.2	0	0	0	0	0	116.7
163	S	35.9	Very low	49.2	Very low	119 Å²	119	121.7 Å²	121.7	83%	0.832	64%	0.638	S	S	*	*	S	Bend	trans	67.3	125.1	176.5	72	0	0	0	0	116.4	R165	S163-R165 PolarHBondContact O-N 2.96Å; S163-R165 VanDerWaalsContact O-N 3.09Å
164	E	33.5	Very low	49.6	Very low	159 Å²	159	116.7 Å²	116.7	74%	0.743	62%	0.616	S	S	*	*			trans	-60.1	105.6	-178.1	-64.5	178.3	131.7	0	0	111	K155 T166	K155-E164 IonicContact NZ-OE1 3.68Å; E164-T166 VanDerWaalsContact C-N 3.31Å; E164-T166 PolarHBondContact O-N 3.19Å
165	R	30.4	Very low	50.4	Low	247 Å²	247	116.5 Å²	116.5	93%	0.932	63%	0.628	S	S	*	*			trans	-68.6	87.8	167.8	-78	-178.5	172.5	-179.5	-2.9	109.4	S163	S163-R165 PolarHBondContact O-N 2.96Å; S163-R165 VanDerWaalsContact O-N 3.09Å
166	T	36.3	Very low	51.5	Low	94 Å²	94	114.7 Å²	114.7	58%	0.577	62%	0.624	S	S	*	*			trans	-69.6	150.1	152.8	49.3	0	0	0	0	108.5	E164 L168 G169	E164-T166 VanDerWaalsContact C-N 3.31Å; E164-T166 PolarHBondContact O-N 3.19Å; T166-L168 PolarHBondContact O-N 2.76Å; T166-G169 PolarHBondContact O-N 2.93Å
167	Y	45	Very low	52.6	Low	207 Å²	207	113.1 Å²	113.1	81%	0.812	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.2	-11.8	-175.8	-68.4	-89.2	0	0	0	115.2
168	L	47.2	Very low	54.1	Low	117 Å²	117	110.4 Å²	110.4	61%	0.613	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	1.1	178.8	-61.2	167.1	0	0	0	113.9	T166 N170 I171	T166-L168 PolarHBondContact O-N 2.76Å; L168-N170 PolarHBondContact O-N 3.33Å; L168-I171 HydrophobicContact CB-CD1 4.08Å; L168-I171 HydrophobicContact CD2-CD1 3.55Å; L168-I171 HydrophobicContact CG-CD1 4.41Å; L168-I171 PolarHBondContact O-N 3.34Å
169	G	47.9	Very low	56	Low	59 Å²	59	107.9 Å²	107.9	61%	0.608	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-12.2	-172.4	0	0	0	0	0	116.8	T166	T166-G169 PolarHBondContact O-N 2.93Å
170	N	64.7	Low	57.9	Low	67 Å²	67	102.9 Å²	102.9	36%	0.358	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	30.5	-178.6	-65.2	-9.7	0	0	0	112.7	L168 R172 E182	L168-N170 PolarHBondContact O-N 3.33Å; N170-R172 PolarHBondContact O-N 2.92Å; N170-E182 HydrophobicContact CB-CB 4.19Å; N170-E182 PolarHBondContact O-N 3.04Å
171	I	68.6	Low	59.7	Low	51 Å²	51	98.3 Å²	98.3	26%	0.262	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	112.5	172.9	-65.4	175.4	0	0	0	109	L168 K179 I180 L181 A250	L168-I171 HydrophobicContact CB-CD1 4.08Å; L168-I171 HydrophobicContact CD2-CD1 3.55Å; L168-I171 HydrophobicContact CG-CD1 4.41Å; L168-I171 PolarHBondContact O-N 3.34Å; I171-K179 HydrophobicContact CG2-CB 3.59Å; I171-K179 HydrophobicContact CG2-CG 3.86Å; I171-I180 CarbonylContact C-O 3.6Å; I171-I180 WeakPolarHBondContact CA-O 3.43Å; I171-L181 HydrophobicContact CG1-CD1 3.73Å; I171-A250 HydrophobicContact CD1-CB 4.38Å
172	R	78.9	Confident	61.1	Low	147 Å²	147	94.1 Å²	94.1	56%	0.555	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	131.9	165.9	177.4	176.9	171.8	-173	-3.1	108.9	N170 I180 E182	N170-R172 PolarHBondContact O-N 2.92Å; R172-I180 PolarHBondContact N-O 2.9Å; R172-I180 PolarHBondContact O-N 2.95Å; R172-E182 HydrophobicContact CB-CG 4.11Å
173	L	79.8	Confident	62.3	Low	111 Å²	111	92.3 Å²	92.3	58%	0.581	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	124.9	164.7	-69.9	165.5	0	0	0	108.5	V178 K179	L173-V178 WeakPolarHBondContact CA-O 3.37Å; L173-K179 HydrophobicContact CD2-CG 3.6Å
174	S	77.2	Confident	63.3	Low	12 Å²	12	94.9 Å²	94.9	8%	0.084	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-72.7	168.6	169.1	63.1	0	0	0	0	110.9	D176 G177 V178	S174-D176 WeakPolarHBondContact CB-OD1 3.46Å; S174-D176 PolarHBondContact O-N 3.2Å; S174-D176 PolarHBondContact OG-OD1 3.17Å; S174-G177 PolarHBondContact O-N 2.9Å; S174-V178 PolarHBondContact N-O 2.79Å; S174-V178 WeakPolarHBondContact OG-CA 3.29Å; S174-V178 VanDerWaalsContact OG-CB 3.27Å; S174-V178 WeakPolarHBondContact OG-CB 3.44Å; S174-V178 PolarHBondContact OG-N 3.09Å; S174-V178 PolarHBondContact OG-O 2.96Å
175	N	75.8	Confident	64.2	Low	175 Å²	175	93.2 Å²	93.2	94%	0.936	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-24.1	-179.2	-69	-10.6	0	0	0	113.3
176	D	77.2	Confident	65.2	Low	85 Å²	85	84.4 Å²	84.4	46%	0.455	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	8.7	175.1	52.9	-7.5	0	0	0	113.1	S174 S337 H341	S174-D176 WeakPolarHBondContact CB-OD1 3.46Å; S174-D176 PolarHBondContact O-N 3.2Å; S174-D176 PolarHBondContact OG-OD1 3.17Å; D176-S337 PolarHBondContact OD2-OG 3.17Å; D176-H341 IonicContact OD1-NE2 3.75Å
177	G	79.2	Confident	65.8	Low	47 Å²	47	82.9 Å²	82.9	49%	0.485	43%	0.433	S	S	.	.			trans	86.8	1	172.1	0	0	0	0	0	115.4	S174 K179	S174-G177 PolarHBondContact O-N 2.9Å; G177-K179 PolarHBondContact O-N 3.41Å
178	V	79.5	Confident	66	Low	4 Å²	4	81.2 Å²	81.2	2%	0.024	44%	0.437	C	S	.	.			trans	-66.9	131.3	175.6	174.9	0	0	0	0	110.4	L173 S174 I180 S337 I338	L173-V178 WeakPolarHBondContact CA-O 3.37Å; S174-V178 PolarHBondContact N-O 2.79Å; S174-V178 WeakPolarHBondContact OG-CA 3.29Å; S174-V178 VanDerWaalsContact OG-CB 3.27Å; S174-V178 WeakPolarHBondContact OG-CB 3.44Å; S174-V178 PolarHBondContact OG-N 3.09Å; S174-V178 PolarHBondContact OG-O 2.96Å; V178-I180 HydrophobicContact CG1-CG1 3.96Å; V178-I180 PolarHBondContact O-N 3.27Å; V178-S337 WeakPolarHBondContact CG2-OG 3.4Å; V178-I338 HydrophobicContact CB-CG1 4.49Å; V178-I338 HydrophobicContact CG1-CD1 4.49Å; V178-I338 HydrophobicContact CG1-CG1 3.52Å; V178-I338 HydrophobicContact CG2-CG1 4.08Å
179	K	80.7	Confident	66.2	Low	74 Å²	74	79.3 Å²	79.3	32%	0.322	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	112.2	171	-68.7	167.3	-176.7	170.6	0	109.5	I171 L173 G177 S247 A250 N251	I171-K179 HydrophobicContact CG2-CB 3.59Å; I171-K179 HydrophobicContact CG2-CG 3.86Å; L173-K179 HydrophobicContact CD2-CG 3.6Å; G177-K179 PolarHBondContact O-N 3.41Å; K179-S247 PolarHBondContact O-OG 2.98Å; K179-S247 VanDerWaalsContact O-OG 3.1Å; K179-A250 HydrophobicContact CB-CB 4.16Å; K179-A250 WeakPolarHBondContact CD-O 3.4Å; K179-N251 PolarHBondContact N-OD1 2.87Å; K179-N251 PolarHBondContact O-ND2 3.41Å
180	I	77.2	Confident	66.4	Low	13 Å²	13	85.4 Å²	85.4	7%	0.067	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	122.1	177.4	-54.6	179.4	0	0	0	108.4	I171 R172 V178 E182 H341 L344	I171-I180 CarbonylContact C-O 3.6Å; I171-I180 WeakPolarHBondContact CA-O 3.43Å; R172-I180 PolarHBondContact N-O 2.9Å; R172-I180 PolarHBondContact O-N 2.95Å; V178-I180 HydrophobicContact CG1-CG1 3.96Å; V178-I180 PolarHBondContact O-N 3.27Å; I180-E182 PolarHBondContact O-N 3.27Å; I180-H341 VanDerWaalsContact CD1-CE1 3.44Å; I180-H341 WeakPolarHBondContact CD1-CE1 3.28Å; I180-H341 WeakPolarHBondContact CD1-ND1 3.48Å; I180-L344 HydrophobicContact CD1-CD1 4.34Å; I180-L344 HydrophobicContact CG1-CD1 4.04Å; I180-L344 HydrophobicContact CG2-CD1 4.18Å
181	L	70.8	Confident	66.1	Low	41 Å²	41	91.3 Å²	91.3	22%	0.215	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	121.9	174	-167.3	72.1	0	0	0	110.2	I171 L183 L246	I171-L181 HydrophobicContact CG1-CD1 3.73Å; L181-L183 HydrophobicContact CD2-CD2 4.27Å; L181-L183 PolarHBondContact O-N 2.8Å; L181-L246 HydrophobicContact CD2-CB 4.28Å; L181-L246 HydrophobicContact CD2-CD1 4.16Å; L181-L246 HydrophobicContact CD2-CD2 4.35Å
182	E	62.8	Low	66.1	Low	86 Å²	86	93.9 Å²	93.9	40%	0.402	47%	0.466	S	S	.	.			trans	-76.5	108.7	174	-64.3	-169	164.2	0	0	110.8	N170 R172 I180 Q184	N170-E182 HydrophobicContact CB-CB 4.19Å; N170-E182 PolarHBondContact O-N 3.04Å; R172-E182 HydrophobicContact CB-CG 4.11Å; I180-E182 PolarHBondContact O-N 3.27Å; E182-Q184 VanDerWaalsContact C-N 3.28Å; E182-Q184 PolarHBondContact O-N 2.75Å
183	L	60.5	Low	65.9	Low	24 Å²	24	92.5 Å²	92.5	13%	0.126	47%	0.474	C	S	.	.	G	3₁₀ helix	trans	-85.4	13.1	-172.1	-68.8	157.6	0	0	0	114.7	L181 N185 L186 R243 L246	L181-L183 HydrophobicContact CD2-CD2 4.27Å; L181-L183 PolarHBondContact O-N 2.8Å; L183-N185 PolarHBondContact O-N 2.9Å; L183-L186 HydrophobicContact CB-CG 4.28Å; L183-L186 HydrophobicContact CD2-CD1 4Å; L183-L186 HydrophobicContact CD2-CD2 3.36Å; L183-L186 HydrophobicContact CD2-CG 3.49Å; L183-L186 VanDerWaalsContact CD2-CG 3.49Å; L183-L186 HydrophobicContact CG-CG 4.48Å; L183-L186 PolarHBondContact O-N 3.4Å; L183-R243 HydrophobicContact CD1-CB 3.46Å; L183-R243 VanDerWaalsContact CD1-CB 3.46Å; L183-R243 HydrophobicContact CD1-CG 3.11Å; L183-L246 HydrophobicContact CD2-CD1 3.75Å
184	Q	57.4	Low	66.2	Low	173 Å²	173	88.6 Å²	88.6	81%	0.808	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-58.5	-18.6	176	-69.2	-173.1	8	0	0	112.3	E182	E182-Q184 VanDerWaalsContact C-N 3.28Å; E182-Q184 PolarHBondContact O-N 2.75Å
185	N	51.2	Low	66.9	Low	124 Å²	124	91.4 Å²	91.4	66%	0.663	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-131.7	59.8	177	-62.5	-59.9	0	0	0	111.5	L183 P187	L183-N185 PolarHBondContact O-N 2.9Å; N185-P187 WeakPolarHBondContact O-CD 3.4Å
186	L	52.5	Low	67.7	Low	62 Å²	62	88.6 Å²	88.6	33%	0.325	45%	0.451	S	S	.	.			trans	-58.5	127.3	167.2	-91.5	169.2	0	0	0	109	L183 I188 F189 L239 L246	L183-L186 HydrophobicContact CB-CG 4.28Å; L183-L186 HydrophobicContact CD2-CD1 4Å; L183-L186 HydrophobicContact CD2-CD2 3.36Å; L183-L186 HydrophobicContact CD2-CG 3.49Å; L183-L186 VanDerWaalsContact CD2-CG 3.49Å; L183-L186 HydrophobicContact CG-CG 4.48Å; L183-L186 PolarHBondContact O-N 3.4Å; L186-I188 PolarHBondContact O-N 3.25Å; L186-F189 HydrophobicContact CD2-CE2 4.21Å; L186-L239 HydrophobicContact CD1-CD1 4.1Å; L186-L246 HydrophobicContact CD2-CD1 4.39Å
187	P	48.1	Very low	68.5	Low	61 Å²	61	88.5 Å²	88.5	40%	0.396	46%	0.457	S	S	.	.			trans	-54.3	133.7	155.4	-17	30	0	0	0	107.3	N185 F189	N185-P187 WeakPolarHBondContact O-CD 3.4Å; P187-F189 HydrophobicContact CB-CD1 4.38Å; P187-F189 HydrophobicContact CB-CD2 4.34Å; P187-F189 HydrophobicContact CB-CE1 4.06Å; P187-F189 HydrophobicContact CB-CE2 4.03Å; P187-F189 HydrophobicContact CB-CZ 3.89Å; P187-F189 HydrophobicContact CG-CE1 4.21Å; P187-F189 HydrophobicContact CG-CE2 3.96Å; P187-F189 HydrophobicContact CG-CZ 3.66Å; P187-F189 VanDerWaalsContact O-CD2 3.25Å; P187-F189 WeakPolarHBondContact O-CD2 3.23Å; P187-F189 PolarHBondContact O-N 2.82Å
188	I	48.7	Very low	69.3	Low	173 Å²	173	87.4 Å²	87.4	89%	0.887	44%	0.441	S	S	*	.			trans	-66.3	86.5	165.1	-57.1	167.5	0	0	0	104.9	L186 E190	L186-I188 PolarHBondContact O-N 3.25Å; I188-E190 PolarHBondContact O-N 2.78Å
189	F	52.5	Low	70	Confident	77 Å²	77	88.1 Å²	88.1	34%	0.338	44%	0.444	S	S	.	.			trans	-65.3	132.8	170.4	-63.7	-74.7	0	0	0	107	L186 P187 K191	L186-F189 HydrophobicContact CD2-CE2 4.21Å; P187-F189 HydrophobicContact CB-CD1 4.38Å; P187-F189 HydrophobicContact CB-CD2 4.34Å; P187-F189 HydrophobicContact CB-CE1 4.06Å; P187-F189 HydrophobicContact CB-CE2 4.03Å; P187-F189 HydrophobicContact CB-CZ 3.89Å; P187-F189 HydrophobicContact CG-CE1 4.21Å; P187-F189 HydrophobicContact CG-CE2 3.96Å; P187-F189 HydrophobicContact CG-CZ 3.66Å; P187-F189 VanDerWaalsContact O-CD2 3.25Å; P187-F189 WeakPolarHBondContact O-CD2 3.23Å; P187-F189 PolarHBondContact O-N 2.82Å; F189-K191 PolarHBondContact O-N 3.25Å
190	E	52.4	Low	70.8	Confident	187 Å²	187	88 Å²	88	87%	0.874	45%	0.448	S	S	*	.			trans	-52.8	133.9	166.9	-76.8	-174.2	164.6	0	0	108.1	I188 Y192	I188-E190 PolarHBondContact O-N 2.78Å; E190-Y192 VanDerWaalsContact C-N 3.34Å; E190-Y192 PolarHBondContact O-N 3.37Å
191	K	57.3	Low	71.7	Confident	190 Å²	190	90.6 Å²	90.6	83%	0.826	46%	0.458	S	S	*	.			trans	-63.6	101.3	177.4	-173.6	-179.9	-179.8	-177.3	0	107	F189 T193	F189-K191 PolarHBondContact O-N 3.25Å; K191-T193 PolarHBondContact O-N 3.04Å; K191-T193 PolarHBondContact O-OG1 3.45Å
192	Y	68.3	Low	73	Confident	106 Å²	106	88.6 Å²	88.6	42%	0.416	45%	0.448	S	S	.	.			trans	-60.7	113.3	178.8	-158.3	-85.5	0	0	0	108	E190 L194 W212 E216	E190-Y192 VanDerWaalsContact C-N 3.34Å; E190-Y192 PolarHBondContact O-N 3.37Å; Y192-L194 HydrophobicContact CD1-CD2 3.53Å; Y192-L194 HydrophobicContact CD1-CG 4.21Å; Y192-L194 HydrophobicContact CE1-CD2 3.6Å; Y192-W212 HydrophobicContact CE1-CZ3 4.39Å; Y192-E216 HydrophobicContact CD2-CG 4.41Å; Y192-E216 HydrophobicContact CE2-CG 3.83Å; Y192-E216 VanDerWaalsContact CE2-OE1 3.27Å; Y192-E216 WeakPolarHBondContact CE2-OE1 3.44Å; Y192-E216 PolarHBondContact OH-OE1 3.29Å
193	T	75.7	Confident	74.7	Confident	117 Å²	117	86.1 Å²	86.1	72%	0.718	44%	0.436	S	S	*	.			trans	-94.5	103.3	179.6	-59.1	0	0	0	0	107.1	K191 T195	K191-T193 PolarHBondContact O-N 3.04Å; K191-T193 PolarHBondContact O-OG1 3.45Å; T193-T195 PolarHBondContact O-N 3.04Å
194	L	86.2	Confident	76.4	Confident	29 Å²	29	90 Å²	90	15%	0.152	45%	0.452	C	S	.	.			trans	-66.8	127.1	177.8	-62	172.8	0	0	0	109.7	Y192 T198 I199 L220 H223	Y192-L194 HydrophobicContact CD1-CD2 3.53Å; Y192-L194 HydrophobicContact CD1-CG 4.21Å; Y192-L194 HydrophobicContact CE1-CD2 3.6Å; L194-T198 HydrophobicContact CD2-CG2 3.84Å; L194-I199 HydrophobicContact CB-CD1 4.24Å; L194-I199 HydrophobicContact CB-CG1 4.02Å; L194-L220 HydrophobicContact CD1-CD2 3.92Å; L194-L220 HydrophobicContact CD2-CD2 3.44Å; L194-L220 VanDerWaalsContact CD2-CD2 3.44Å; L194-L220 HydrophobicContact CD2-CG 4.29Å; L194-L220 HydrophobicContact CG-CD2 4.36Å; L194-H223 HydrophobicContact CD1-CB 3.39Å
195	T	91.6	Very high	78.3	Confident	71 Å²	71	82.3 Å²	82.3	44%	0.436	42%	0.417	S	S	.	.			trans	-70	155.3	172.1	70.4	0	0	0	0	110.2	T193 S197 T198 I199	T193-T195 PolarHBondContact O-N 3.04Å; T195-S197 PolarHBondContact O-N 3.33Å; T195-S197 PolarHBondContact OG1-OG 3.22Å; T195-T198 WeakPolarHBondContact O-CB 3.5Å; T195-T198 PolarHBondContact O-N 2.91Å; T195-T198 WeakPolarHBondContact OG1-CB 3.38Å; T195-T198 PolarHBondContact OG1-N 3Å; T195-T198 VanDerWaalsContact OG1-N 3.09Å; T195-T198 PolarHBondContact OG1-OG1 3.3Å; T195-I199 PolarHBondContact O-N 3.4Å; T195-I199 VanDerWaalsContact O-N 3.08Å
196	Q	92	Very high	80.4	Confident	117 Å²	117	79.1 Å²	79.1	55%	0.547	40%	0.402	S	S	.	.	H	α-helix	trans	-58.6	-38.5	175	-171.6	60.4	48.6	0	0	111.6	T198 I199 D200	Q196-T198 VanDerWaalsContact C-N 3.3Å; Q196-T198 PolarHBondContact O-N 2.99Å; Q196-I199 PolarHBondContact O-N 3.49Å; Q196-I199 VanDerWaalsContact O-N 3.17Å; Q196-D200 PolarHBondContact NE2-OD1 2.9Å; Q196-D200 PolarHBondContact O-N 3.27Å
197	S	94.7	Very high	82.6	Confident	83 Å²	83	76.1 Å²	76.1	58%	0.58	39%	0.386	S	S	*	.	H	α-helix	trans	-59.9	-38.1	174.6	40.2	0	0	0	0	113.1	T195 F201	T195-S197 PolarHBondContact O-N 3.33Å; T195-S197 PolarHBondContact OG1-OG 3.22Å; S197-F201 VanDerWaalsContact O-CB 3.31Å; S197-F201 WeakPolarHBondContact O-CB 3.48Å; S197-F201 PolarHBondContact O-N 3.19Å
198	T	94.7	Very high	84.9	Confident	23 Å²	23	74.2 Å²	74.2	14%	0.141	37%	0.373	C	S	.	.	H	α-helix	trans	-65.1	-45.1	174.8	-59.9	0	0	0	0	111	L194 T195 Q196 F201 L202 W212 L220	L194-T198 HydrophobicContact CD2-CG2 3.84Å; T195-T198 WeakPolarHBondContact O-CB 3.5Å; T195-T198 PolarHBondContact O-N 2.91Å; T195-T198 WeakPolarHBondContact OG1-CB 3.38Å; T195-T198 PolarHBondContact OG1-N 3Å; T195-T198 VanDerWaalsContact OG1-N 3.09Å; T195-T198 PolarHBondContact OG1-OG1 3.3Å; Q196-T198 VanDerWaalsContact C-N 3.3Å; Q196-T198 PolarHBondContact O-N 2.99Å; T198-F201 PolarHBondContact O-N 3.12Å; T198-L202 WeakPolarHBondContact O-CB 3.22Å; T198-L202 PolarHBondContact O-N 2.7Å; T198-W212 HydrophobicContact CG2-CH2 3.35Å; T198-W212 HydrophobicContact CG2-CZ2 3.95Å; T198-W212 HydrophobicContact CG2-CZ3 4.27Å; T198-L220 HydrophobicContact CG2-CD2 3.91Å
199	I	94.7	Very high	87.2	Confident	19 Å²	19	66 Å²	66	10%	0.097	33%	0.33	C	S	.	.	H	α-helix	trans	-62.6	-44.4	178.9	-65.4	168.2	0	0	0	110.6	L194 T195 Q196 F201 L202 K203 H223	L194-I199 HydrophobicContact CB-CD1 4.24Å; L194-I199 HydrophobicContact CB-CG1 4.02Å; T195-I199 PolarHBondContact O-N 3.4Å; T195-I199 VanDerWaalsContact O-N 3.08Å; Q196-I199 PolarHBondContact O-N 3.49Å; Q196-I199 VanDerWaalsContact O-N 3.17Å; I199-F201 VanDerWaalsContact C-N 3.31Å; I199-F201 PolarHBondContact O-N 3.46Å; I199-L202 WeakPolarHBondContact O-CB 3.48Å; I199-L202 PolarHBondContact O-N 3.06Å; I199-K203 PolarHBondContact O-N 2.88Å; I199-H223 WeakPolarHBondContact CG2-NE2 3.19Å
200	D	97	Very high	89.3	Confident	72 Å²	72	66.3 Å²	66.3	39%	0.385	33%	0.329	S	S	.	.	H	α-helix	trans	-66.9	-34.3	178.3	-64.3	-18.1	0	0	0	111.7	Q196 K203	Q196-D200 PolarHBondContact NE2-OD1 2.9Å; Q196-D200 PolarHBondContact O-N 3.27Å; D200-K203 PolarHBondContact O-N 3.13Å
201	F	97.1	Very high	91.3	Very high	67 Å²	67	63.9 Å²	63.9	29%	0.294	32%	0.318	S	S	.	.	H	α-helix	trans	-69.8	-37.1	174.2	-173.7	-135.4	0	0	0	112.2	S197 T198 I199 K203 K204 T206 F207 D208	S197-F201 VanDerWaalsContact O-CB 3.31Å; S197-F201 WeakPolarHBondContact O-CB 3.48Å; S197-F201 PolarHBondContact O-N 3.19Å; T198-F201 PolarHBondContact O-N 3.12Å; I199-F201 VanDerWaalsContact C-N 3.31Å; I199-F201 PolarHBondContact O-N 3.46Å; F201-K203 PolarHBondContact O-N 3.07Å; F201-K203 VanDerWaalsContact O-N 3.13Å; F201-K204 HydrophobicContact CD2-CD 4.48Å; F201-K204 WeakPolarHBondContact O-CB 3.45Å; F201-K204 PolarHBondContact O-N 3.39Å; F201-T206 WeakPolarHBondContact CE2-O 3.23Å; F201-T206 WeakPolarHBondContact CZ-O 3.44Å; F201-F207 AromaticContact CD1-CD2 3.51Å; F201-F207 HydrophobicContact CD1-CD2 3.51Å; F201-F207 AromaticContact CD1-CE2 3.84Å; F201-F207 HydrophobicContact CD1-CE2 3.84Å; F201-F207 HydrophobicContact CD1-CG 4.45Å; F201-F207 AromaticContact CE1-CD2 3.78Å; F201-F207 HydrophobicContact CE1-CD2 3.78Å; F201-F207 HydrophobicContact CE1-CE2 4.21Å; F201-F207 HydrophobicContact CE1-CG 4.32Å; F201-F207 AromaticContact CG-CD2 3.99Å; F201-F207 HydrophobicContact CG-CD2 3.99Å; F201-F207 HydrophobicContact CZ-CD2 4.46Å; F201-D208 HydrophobicContact CZ-CB 4.25Å; F201-D208 VanDerWaalsContact CZ-N 3.35Å
202	L	97.4	Very high	93	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-59.2	-23.8	177.1	-165.7	66.6	0	0	0	112.9	T198 I199 F207 L220 M224 F264 Q268 Y271	T198-L202 WeakPolarHBondContact O-CB 3.22Å; T198-L202 PolarHBondContact O-N 2.7Å; I199-L202 WeakPolarHBondContact O-CB 3.48Å; I199-L202 PolarHBondContact O-N 3.06Å; L202-F207 HydrophobicContact CB-CE2 4.41Å; L202-F207 HydrophobicContact CD1-CD2 4.05Å; L202-F207 HydrophobicContact CD1-CE1 4.5Å; L202-F207 HydrophobicContact CD1-CE2 3.59Å; L202-F207 HydrophobicContact CD1-CZ 3.83Å; L202-L220 HydrophobicContact CD1-CB 4.34Å; L202-L220 HydrophobicContact CD1-CD1 4.16Å; L202-L220 HydrophobicContact CD1-CD2 4.1Å; L202-L220 HydrophobicContact CD1-CG 4.45Å; L202-L220 HydrophobicContact CD2-CB 4.41Å; L202-L220 HydrophobicContact CD2-CD2 4.01Å; L202-M224 HydrophobicContact CD1-CE 3.53Å; L202-M224 HydrophobicContact CD2-CE 3.72Å; L202-M224 HydrophobicContact CD2-CG 3.95Å; L202-M224 HydrophobicContact CG-CE 3.73Å; L202-F264 HydrophobicContact CD1-CZ 3.94Å; L202-Q268 HydrophobicContact CD1-CG 3.77Å; L202-Q268 HydrophobicContact CG-CG 4.41Å; L202-Q268 PolarHBondContact O-NE2 2.94Å; L202-Y271 HydrophobicContact CB-CE1 4.02Å; L202-Y271 HydrophobicContact CD2-CD1 4.34Å; L202-Y271 HydrophobicContact CD2-CE1 3.77Å; L202-Y271 HydrophobicContact CG-CD1 4.04Å; L202-Y271 HydrophobicContact CG-CE1 3.69Å; L202-Y271 WeakPolarHBondContact O-CD1 3.14Å
203	K	97.9	Very high	94.2	Very high	34 Å²	34	56.9 Å²	56.9	15%	0.148	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	1.3	178.1	-65.1	170.9	-173.6	167.3	0	113.9	I199 D200 F201 E227 Y271 G272 Y275	I199-K203 PolarHBondContact O-N 2.88Å; D200-K203 PolarHBondContact O-N 3.13Å; F201-K203 PolarHBondContact O-N 3.07Å; F201-K203 VanDerWaalsContact O-N 3.13Å; K203-E227 WeakPolarHBondContact CE-OE2 3.36Å; K203-E227 VanDerWaalsContact NZ-CD 3.33Å; K203-E227 IonicContact NZ-OE1 3.94Å; K203-E227 PolarHBondContact NZ-OE1 3.27Å; K203-E227 IonicContact NZ-OE2 3.52Å; K203-E227 PolarHBondContact NZ-OE2 3.44Å; K203-E227 VanDerWaalsContact NZ-OE2 3.15Å; K203-Y271 HydrophobicContact CB-CE1 4.37Å; K203-Y271 HydrophobicContact CD-CE1 4.46Å; K203-Y271 WeakPolarHBondContact CE-OH 3.49Å; K203-Y271 HydrophobicContact CG-CD1 4.2Å; K203-Y271 HydrophobicContact CG-CE1 3.38Å; K203-G272 WeakPolarHBondContact O-CA 3.35Å; K203-Y275 HydrophobicContact CD-CD1 4.15Å; K203-Y275 HydrophobicContact CD-CD2 4.22Å; K203-Y275 HydrophobicContact CD-CG 3.94Å; K203-Y275 HydrophobicContact CG-CD2 4.18Å; K203-Y275 HydrophobicContact CG-CG 4.23Å
204	K	97.2	Very high	94.9	Very high	106 Å²	106	53.2 Å²	53.2	46%	0.461	27%	0.269	S	S	.	.	S	Bend	trans	-105.4	145.7	-175.6	-63.1	-178.8	-176.7	-178.9	0	112.2	F201 T206 F207 Q268	F201-K204 HydrophobicContact CD2-CD 4.48Å; F201-K204 WeakPolarHBondContact O-CB 3.45Å; F201-K204 PolarHBondContact O-N 3.39Å; K204-T206 PolarHBondContact O-N 3.38Å; K204-F207 WeakPolarHBondContact O-CB 3.44Å; K204-F207 PolarHBondContact O-N 2.83Å; K204-Q268 PolarHBondContact O-NE2 3.11Å
205	P	96.9	Very high	95.1	Very high	10 Å²	10	56 Å²	56	7%	0.065	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-22.1	171.9	25.8	-34.6	0	0	0	112.2	F207 M269 V414 R415 M486	P205-F207 PolarHBondContact O-N 3.27Å; P205-M269 HydrophobicContact CB-CE 3.95Å; P205-M269 HydrophobicContact CB-SD 4.23Å; P205-V414 HydrophobicContact CB-CG1 4.14Å; P205-R415 WeakPolarHBondContact O-CG 3.44Å; P205-R415 PolarHBondContact O-NH1 2.94Å; P205-M486 HydrophobicContact CB-CE 3.93Å; P205-M486 HydrophobicContact CB-CG 4.46Å; P205-M486 HydrophobicContact CG-CE 4.16Å
206	T	96.5	Very high	95.2	Very high	57 Å²	57	54.6 Å²	54.6	35%	0.35	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	6.5	177.9	61.3	0	0	0	0	114	F201 K204 D208 P416	F201-T206 WeakPolarHBondContact CE2-O 3.23Å; F201-T206 WeakPolarHBondContact CZ-O 3.44Å; K204-T206 PolarHBondContact O-N 3.38Å; T206-D208 PolarHBondContact O-N 3.42Å; T206-P416 HydrophobicContact CG2-CG 3.88Å
207	F	97.6	Very high	95.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.247	C	C	.	.			trans	-56.5	124.1	177.9	-174.2	-90.4	0	0	0	110.4	F201 L202 K204 P205 I209 W212 L220 F264 Q268 R415	F201-F207 AromaticContact CD1-CD2 3.51Å; F201-F207 HydrophobicContact CD1-CD2 3.51Å; F201-F207 AromaticContact CD1-CE2 3.84Å; F201-F207 HydrophobicContact CD1-CE2 3.84Å; F201-F207 HydrophobicContact CD1-CG 4.45Å; F201-F207 AromaticContact CE1-CD2 3.78Å; F201-F207 HydrophobicContact CE1-CD2 3.78Å; F201-F207 HydrophobicContact CE1-CE2 4.21Å; F201-F207 HydrophobicContact CE1-CG 4.32Å; F201-F207 AromaticContact CG-CD2 3.99Å; F201-F207 HydrophobicContact CG-CD2 3.99Å; F201-F207 HydrophobicContact CZ-CD2 4.46Å; L202-F207 HydrophobicContact CB-CE2 4.41Å; L202-F207 HydrophobicContact CD1-CD2 4.05Å; L202-F207 HydrophobicContact CD1-CE1 4.5Å; L202-F207 HydrophobicContact CD1-CE2 3.59Å; L202-F207 HydrophobicContact CD1-CZ 3.83Å; K204-F207 WeakPolarHBondContact O-CB 3.44Å; K204-F207 PolarHBondContact O-N 2.83Å; P205-F207 PolarHBondContact O-N 3.27Å; F207-I209 HydrophobicContact CE1-CD1 4.06Å; F207-W212 AromaticContact CE1-CD1 3.72Å; F207-W212 HydrophobicContact CE1-CG 4.42Å; F207-W212 AromaticContact CE1-NE1 3.67Å; F207-W212 AromaticContact CE2-CE2 3.92Å; F207-W212 HydrophobicContact CE2-CZ2 4.04Å; F207-W212 AromaticContact CE2-NE1 3.72Å; F207-W212 AromaticContact CZ-CD1 3.57Å; F207-W212 HydrophobicContact CZ-CD2 4.05Å; F207-W212 AromaticContact CZ-CE2 3.46Å; F207-W212 VanDerWaalsContact CZ-CE2 3.46Å; F207-W212 HydrophobicContact CZ-CG 4.1Å; F207-W212 HydrophobicContact CZ-CZ2 4.02Å; F207-W212 AromaticContact CZ-NE1 3.13Å; F207-L220 HydrophobicContact CZ-CD1 3.86Å; F207-F264 HydrophobicContact CD1-CE1 4.19Å; F207-F264 AromaticContact CE1-CE1 3.53Å; F207-F264 HydrophobicContact CE1-CE1 3.53Å; F207-F264 HydrophobicContact CE1-CZ 4.16Å; F207-F264 HydrophobicContact CZ-CE1 4.1Å; F207-F264 HydrophobicContact CZ-CZ 4.27Å; F207-Q268 HydrophobicContact CB-CG 4.29Å; F207-Q268 HydrophobicContact CD1-CG 4.03Å; F207-Q268 HydrophobicContact CG-CG 4.06Å; F207-R415 PolarHBondContact O-NH1 3.12Å
208	D	97.5	Very high	95.5	Very high	21 Å²	21	45.7 Å²	45.7	11%	0.112	22%	0.222	C	C	.	.			trans	-95.5	108.9	-179.7	-170.1	-22.5	0	0	0	109.4	F201 T206 W210 H211 W212 V419	F201-D208 HydrophobicContact CZ-CB 4.25Å; F201-D208 VanDerWaalsContact CZ-N 3.35Å; T206-D208 PolarHBondContact O-N 3.42Å; D208-W210 WeakPolarHBondContact OD1-CB 3.33Å; D208-W210 PolarHBondContact OD1-N 3.43Å; D208-H211 IonicContact OD1-CD2 2.81Å; D208-H211 IonicContact OD2-CD2 3.72Å; D208-H211 PolarHBondContact OD2-CD2 3.29Å; D208-H211 IonicContact OD2-NE2 3.72Å; D208-W212 PolarHBondContact O-NE1 2.94Å; D208-W212 VanDerWaalsContact O-NE1 3.17Å; D208-V419 HydrophobicContact CB-CG2 3.81Å
209	I	97	Very high	95.5	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-76.6	-21.9	-177.1	-170.3	53	0	0	0	113.3	F207 H211 W212 M217 R261 F264 V419 W423	F207-I209 HydrophobicContact CE1-CD1 4.06Å; I209-H211 PolarHBondContact O-N 2.99Å; I209-W212 HydrophobicContact CD1-CB 4.34Å; I209-W212 PolarHBondContact O-N 3.5Å; I209-M217 HydrophobicContact CD1-CG 4.04Å; I209-M217 HydrophobicContact CD1-SD 3.6Å; I209-M217 HydrophobicContact CG1-SD 4.31Å; I209-R261 HydrophobicContact CD1-CG 4.27Å; I209-R261 HydrophobicContact CG1-CG 3.37Å; I209-R261 HydrophobicContact CG2-CG 4.34Å; I209-R261 PolarHBondContact O-NH1 3.01Å; I209-F264 HydrophobicContact CD1-CD1 3.17Å; I209-F264 HydrophobicContact CD1-CE1 3.52Å; I209-F264 HydrophobicContact CD1-CG 3.98Å; I209-F264 HydrophobicContact CG1-CD1 4.18Å; I209-V419 HydrophobicContact CG2-CG1 4.27Å; I209-W423 HydrophobicContact CG2-CZ2 4.14Å
210	W	96.6	Very high	95.6	Very high	83 Å²	83	44.7 Å²	44.7	31%	0.314	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-70.9	-16.9	-171.7	-59	112.9	0	0	0	112.8	D208 W212 V419 P422 W423	D208-W210 WeakPolarHBondContact OD1-CB 3.33Å; D208-W210 PolarHBondContact OD1-N 3.43Å; W210-W212 VanDerWaalsContact C-N 3.35Å; W210-V419 PolarHBondContact NE1-O 2.93Å; W210-P422 HydrophobicContact CH2-CB 4.23Å; W210-P422 HydrophobicContact CZ2-CB 3.6Å; W210-W423 HydrophobicContact CH2-CD2 4.08Å; W210-W423 AromaticContact CH2-CE2 4Å; W210-W423 HydrophobicContact CH2-CE3 4.32Å; W210-W423 HydrophobicContact CH2-CH2 4.38Å; W210-W423 HydrophobicContact CH2-CZ2 4.16Å; W210-W423 HydrophobicContact CH2-CZ3 4.46Å; W210-W423 AromaticContact CZ2-CD1 3.79Å; W210-W423 AromaticContact CZ2-CD2 3.76Å; W210-W423 HydrophobicContact CZ2-CD2 3.76Å; W210-W423 AromaticContact CZ2-CE2 3.63Å; W210-W423 HydrophobicContact CZ2-CE3 4.42Å; W210-W423 AromaticContact CZ2-CG 3.87Å; W210-W423 HydrophobicContact CZ2-CG 3.87Å; W210-W423 HydrophobicContact CZ2-CZ2 4.19Å; W210-W423 AromaticContact CZ2-NE1 3.64Å
211	H	92.5	Very high	95.7	Very high	136 Å²	136	41.2 Å²	41.2	63%	0.63	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-86.6	1.8	176.4	-66.6	-55.9	0	0	0	114.8	D208 I209	D208-H211 IonicContact OD1-CD2 2.81Å; D208-H211 IonicContact OD2-CD2 3.72Å; D208-H211 PolarHBondContact OD2-CD2 3.29Å; D208-H211 IonicContact OD2-NE2 3.72Å; I209-H211 PolarHBondContact O-N 2.99Å
212	W	94.7	Very high	95.7	Very high	24 Å²	24	40.1 Å²	40.1	9%	0.091	20%	0.196	C	C	.	.			trans	-115.8	127.8	-173.1	-61	85.7	0	0	0	112.3	Y192 T198 F207 D208 I209 W210 E216 M217 L220 R261	Y192-W212 HydrophobicContact CE1-CZ3 4.39Å; T198-W212 HydrophobicContact CG2-CH2 3.35Å; T198-W212 HydrophobicContact CG2-CZ2 3.95Å; T198-W212 HydrophobicContact CG2-CZ3 4.27Å; F207-W212 AromaticContact CE1-CD1 3.72Å; F207-W212 HydrophobicContact CE1-CG 4.42Å; F207-W212 AromaticContact CE1-NE1 3.67Å; F207-W212 AromaticContact CE2-CE2 3.92Å; F207-W212 HydrophobicContact CE2-CZ2 4.04Å; F207-W212 AromaticContact CE2-NE1 3.72Å; F207-W212 AromaticContact CZ-CD1 3.57Å; F207-W212 HydrophobicContact CZ-CD2 4.05Å; F207-W212 AromaticContact CZ-CE2 3.46Å; F207-W212 VanDerWaalsContact CZ-CE2 3.46Å; F207-W212 HydrophobicContact CZ-CG 4.1Å; F207-W212 HydrophobicContact CZ-CZ2 4.02Å; F207-W212 AromaticContact CZ-NE1 3.13Å; D208-W212 PolarHBondContact O-NE1 2.94Å; D208-W212 VanDerWaalsContact O-NE1 3.17Å; I209-W212 HydrophobicContact CD1-CB 4.34Å; I209-W212 PolarHBondContact O-N 3.5Å; W210-W212 VanDerWaalsContact C-N 3.35Å; W212-E216 HydrophobicContact CE3-CB 3.67Å; W212-E216 HydrophobicContact CE3-CG 4.48Å; W212-E216 HydrophobicContact CZ3-CB 4.25Å; W212-M217 HydrophobicContact CB-CG 4.1Å; W212-L220 HydrophobicContact CD2-CD1 3.76Å; W212-L220 HydrophobicContact CE3-CD1 3.55Å; W212-L220 HydrophobicContact CE3-CG 4.43Å; W212-L220 HydrophobicContact CG-CD1 4.4Å; W212-L220 HydrophobicContact CH2-CD1 4.24Å; W212-L220 HydrophobicContact CZ2-CD1 4.42Å; W212-L220 HydrophobicContact CZ3-CD1 3.81Å; W212-L220 HydrophobicContact CZ3-CD2 4.41Å; W212-L220 HydrophobicContact CZ3-CG 4.33Å; W212-R261 PolarHBondContact O-NH1 3.41Å; W212-R261 PolarHBondContact O-NH2 3.27Å
213	E	93.5	Very high	95.6	Very high	125 Å²	125	41.9 Å²	41.9	58%	0.584	20%	0.204	S	C	*	.			trans	-78.2	157.2	173.9	-70.4	-62.1	155.1	0	0	111.4	N215 E216 M217	E213-N215 VanDerWaalsContact C-N 3.27Å; E213-N215 PolarHBondContact O-N 2.88Å; E213-N215 VanDerWaalsContact O-N 3.15Å; E213-E216 HydrophobicContact CB-CG 4.35Å; E213-E216 PolarHBondContact N-OE2 2.81Å; E213-E216 PolarHBondContact O-N 3.12Å; E213-M217 PolarHBondContact O-N 2.88Å
214	P	90.4	Very high	95.7	Very high	40 Å²	40	40.3 Å²	40.3	26%	0.26	20%	0.197	S	C	.	.	H	α-helix	trans	-56.2	-35.4	-177	-25.7	33.5	0	0	0	115.4	E216 M217 L218	P214-E216 VanDerWaalsContact C-N 3.32Å; P214-E216 PolarHBondContact O-N 3.34Å; P214-M217 HydrophobicContact CB-CE 4.04Å; P214-M217 HydrophobicContact CG-CE 4.12Å; P214-M217 PolarHBondContact O-N 3.08Å; P214-L218 WeakPolarHBondContact O-CG 3.47Å; P214-L218 PolarHBondContact O-N 3.26Å; P214-L218 VanDerWaalsContact O-N 3.08Å
215	N	90.2	Very high	95.7	Very high	87 Å²	87	35.2 Å²	35.2	47%	0.465	18%	0.175	S	C	.	.	H	α-helix	trans	-68.7	-32.2	176.5	-69.4	-27.9	0	0	0	112.7	E213 A219	E213-N215 VanDerWaalsContact C-N 3.27Å; E213-N215 PolarHBondContact O-N 2.88Å; E213-N215 VanDerWaalsContact O-N 3.15Å; N215-A219 PolarHBondContact O-N 2.86Å
216	E	93.5	Very high	95.8	Very high	42 Å²	42	38.9 Å²	38.9	20%	0.196	19%	0.194	C	C	.	.	H	α-helix	trans	-75.8	-38.2	176.8	-54.1	176.5	117.6	0	0	110.4	Y192 W212 E213 P214 L218 A219 L220	Y192-E216 HydrophobicContact CD2-CG 4.41Å; Y192-E216 HydrophobicContact CE2-CG 3.83Å; Y192-E216 VanDerWaalsContact CE2-OE1 3.27Å; Y192-E216 WeakPolarHBondContact CE2-OE1 3.44Å; Y192-E216 PolarHBondContact OH-OE1 3.29Å; W212-E216 HydrophobicContact CE3-CB 3.67Å; W212-E216 HydrophobicContact CE3-CG 4.48Å; W212-E216 HydrophobicContact CZ3-CB 4.25Å; E213-E216 HydrophobicContact CB-CG 4.35Å; E213-E216 PolarHBondContact N-OE2 2.81Å; E213-E216 PolarHBondContact O-N 3.12Å; P214-E216 VanDerWaalsContact C-N 3.32Å; P214-E216 PolarHBondContact O-N 3.34Å; E216-L218 VanDerWaalsContact C-N 3.28Å; E216-L218 PolarHBondContact O-N 3.39Å; E216-A219 PolarHBondContact O-N 3.29Å; E216-A219 VanDerWaalsContact O-N 3.11Å; E216-L220 VanDerWaalsContact O-CG 3.32Å; E216-L220 WeakPolarHBondContact O-CG 3.33Å; E216-L220 PolarHBondContact O-N 2.96Å
217	M	96.2	Very high	95.8	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.015	19%	0.193	C	C	.	.	H	α-helix	trans	-55.7	-42.9	170.6	-68.5	-166.8	-74.2	0	0	111.6	I209 W212 E213 P214 L220 L221 F260 R261 F264	I209-M217 HydrophobicContact CD1-CG 4.04Å; I209-M217 HydrophobicContact CD1-SD 3.6Å; I209-M217 HydrophobicContact CG1-SD 4.31Å; W212-M217 HydrophobicContact CB-CG 4.1Å; E213-M217 PolarHBondContact O-N 2.88Å; P214-M217 HydrophobicContact CB-CE 4.04Å; P214-M217 HydrophobicContact CG-CE 4.12Å; P214-M217 PolarHBondContact O-N 3.08Å; M217-L220 PolarHBondContact O-N 2.75Å; M217-L221 WeakPolarHBondContact O-CG 3.29Å; M217-L221 PolarHBondContact O-N 3.08Å; M217-F260 HydrophobicContact CB-CE1 4.11Å; M217-F260 HydrophobicContact CE-CD1 3.83Å; M217-F260 HydrophobicContact CE-CE1 4.12Å; M217-R261 HydrophobicContact CE-CB 4.4Å; M217-R261 HydrophobicContact SD-CB 4.42Å; M217-R261 HydrophobicContact SD-CG 4.15Å; M217-F264 HydrophobicContact CB-CD2 3.65Å; M217-F264 HydrophobicContact CB-CE2 4.04Å; M217-F264 HydrophobicContact CB-CG 4.19Å; M217-F264 HydrophobicContact CG-CD2 3.99Å; M217-F264 HydrophobicContact CG-CE2 4.35Å; M217-F264 HydrophobicContact CG-CG 4.08Å; M217-F264 WeakPolarHBondContact O-CE2 3.35Å; M217-F264 HydrophobicContact SD-CB 3.85Å; M217-F264 HydrophobicContact SD-CD1 4.4Å; M217-F264 HydrophobicContact SD-CD2 4.37Å; M217-F264 HydrophobicContact SD-CG 3.93Å
218	L	95.8	Very high	95.9	Very high	10 Å²	10	39.5 Å²	39.5	5%	0.052	19%	0.193	C	C	.	.	H	α-helix	trans	-61	-45.6	174.1	-68.3	169.7	0	0	0	112.2	P214 E216 L220 L221 E222 L245 L246 Q249 F260	P214-L218 WeakPolarHBondContact O-CG 3.47Å; P214-L218 PolarHBondContact O-N 3.26Å; P214-L218 VanDerWaalsContact O-N 3.08Å; E216-L218 VanDerWaalsContact C-N 3.28Å; E216-L218 PolarHBondContact O-N 3.39Å; L218-L220 VanDerWaalsContact C-N 3.32Å; L218-L220 PolarHBondContact O-N 3.3Å; L218-L221 PolarHBondContact O-N 3.12Å; L218-E222 WeakPolarHBondContact O-CG 3.25Å; L218-E222 PolarHBondContact O-N 3.34Å; L218-L245 HydrophobicContact CD2-CB 3.7Å; L218-L246 HydrophobicContact CD1-CD2 3.57Å; L218-L246 HydrophobicContact CD1-CG 4.3Å; L218-Q249 HydrophobicContact CD2-CB 4.41Å; L218-F260 HydrophobicContact CD2-CE1 4.35Å; L218-F260 HydrophobicContact CD2-CZ 3.78Å; L218-F260 HydrophobicContact CG-CE1 4.49Å; L218-F260 HydrophobicContact CG-CZ 4.36Å
219	A	94.8	Very high	95.9	Very high	21 Å²	21	39.2 Å²	39.2	17%	0.174	20%	0.195	C	C	.	.	H	α-helix	trans	-63.6	-37.4	178.4	0	0	0	0	0	112.4	N215 E216 E222 H223	N215-A219 PolarHBondContact O-N 2.86Å; E216-A219 PolarHBondContact O-N 3.29Å; E216-A219 VanDerWaalsContact O-N 3.11Å; A219-E222 PolarHBondContact O-N 3.48Å; A219-H223 PolarHBondContact O-N 3.09Å
220	L	97.2	Very high	96	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.6	-41	174	-69.7	172.7	0	0	0	111.7	L194 T198 L202 F207 W212 E216 M217 L218 H223 M224 F264	L194-L220 HydrophobicContact CD1-CD2 3.92Å; L194-L220 HydrophobicContact CD2-CD2 3.44Å; L194-L220 VanDerWaalsContact CD2-CD2 3.44Å; L194-L220 HydrophobicContact CD2-CG 4.29Å; L194-L220 HydrophobicContact CG-CD2 4.36Å; T198-L220 HydrophobicContact CG2-CD2 3.91Å; L202-L220 HydrophobicContact CD1-CB 4.34Å; L202-L220 HydrophobicContact CD1-CD1 4.16Å; L202-L220 HydrophobicContact CD1-CD2 4.1Å; L202-L220 HydrophobicContact CD1-CG 4.45Å; L202-L220 HydrophobicContact CD2-CB 4.41Å; L202-L220 HydrophobicContact CD2-CD2 4.01Å; F207-L220 HydrophobicContact CZ-CD1 3.86Å; W212-L220 HydrophobicContact CD2-CD1 3.76Å; W212-L220 HydrophobicContact CE3-CD1 3.55Å; W212-L220 HydrophobicContact CE3-CG 4.43Å; W212-L220 HydrophobicContact CG-CD1 4.4Å; W212-L220 HydrophobicContact CH2-CD1 4.24Å; W212-L220 HydrophobicContact CZ2-CD1 4.42Å; W212-L220 HydrophobicContact CZ3-CD1 3.81Å; W212-L220 HydrophobicContact CZ3-CD2 4.41Å; W212-L220 HydrophobicContact CZ3-CG 4.33Å; E216-L220 VanDerWaalsContact O-CG 3.32Å; E216-L220 WeakPolarHBondContact O-CG 3.33Å; E216-L220 PolarHBondContact O-N 2.96Å; M217-L220 PolarHBondContact O-N 2.75Å; L218-L220 VanDerWaalsContact C-N 3.32Å; L218-L220 PolarHBondContact O-N 3.3Å; L220-H223 WeakPolarHBondContact O-CB 3.16Å; L220-H223 PolarHBondContact O-N 2.82Å; L220-M224 WeakPolarHBondContact O-CG 3.27Å; L220-M224 PolarHBondContact O-N 3.29Å; L220-F264 HydrophobicContact CB-CE2 3.66Å; L220-F264 HydrophobicContact CB-CZ 3.82Å; L220-F264 HydrophobicContact CD1-CE2 4.16Å; L220-F264 HydrophobicContact CD1-CZ 3.66Å; L220-F264 HydrophobicContact CG-CZ 4.41Å
221	L	98.4	Very high	96	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.9	-45.7	172.9	-70.9	171.4	0	0	0	111.3	M217 L218 H223 M224 Y225 L245 F260 F264 A267 V296	M217-L221 WeakPolarHBondContact O-CG 3.29Å; M217-L221 PolarHBondContact O-N 3.08Å; L218-L221 PolarHBondContact O-N 3.12Å; L221-H223 PolarHBondContact O-N 3.41Å; L221-M224 HydrophobicContact CD2-SD 4.05Å; L221-M224 PolarHBondContact O-N 3.14Å; L221-M224 VanDerWaalsContact O-N 3.13Å; L221-Y225 WeakPolarHBondContact O-CD2 3.45Å; L221-Y225 PolarHBondContact O-N 3.44Å; L221-Y225 VanDerWaalsContact O-N 3.09Å; L221-L245 HydrophobicContact CB-CD1 4.13Å; L221-L245 HydrophobicContact CB-CD2 3.97Å; L221-L245 HydrophobicContact CD1-CD2 3.99Å; L221-F260 HydrophobicContact CD1-CE2 4.26Å; L221-F260 HydrophobicContact CD1-CZ 3.87Å; L221-F264 HydrophobicContact CD1-CD2 4.17Å; L221-F264 HydrophobicContact CD2-CD2 4Å; L221-F264 HydrophobicContact CD2-CE2 4.26Å; L221-F264 HydrophobicContact CG-CD2 3.78Å; L221-F264 HydrophobicContact CG-CE2 4.01Å; L221-A267 HydrophobicContact CD2-CB 3.81Å; L221-V296 HydrophobicContact CD2-CG2 4.05Å
222	E	97	Very high	96.3	Very high	44 Å²	44	34.1 Å²	34.1	21%	0.206	19%	0.187	C	C	.	.	H	α-helix	trans	-54.2	-42.6	173.5	-72.7	-176.2	-129.8	0	0	110.7	L218 A219 Y225 N226 L241 K242 L245	L218-E222 WeakPolarHBondContact O-CG 3.25Å; L218-E222 PolarHBondContact O-N 3.34Å; A219-E222 PolarHBondContact O-N 3.48Å; E222-Y225 PolarHBondContact O-N 2.71Å; E222-N226 PolarHBondContact O-N 3.43Å; E222-N226 VanDerWaalsContact O-N 3.15Å; E222-N226 PolarHBondContact O-ND2 3.38Å; E222-L241 HydrophobicContact CG-CD2 4.38Å; E222-K242 WeakPolarHBondContact OE1-CE 3.35Å; E222-K242 IonicContact OE1-NZ 3.94Å; E222-L245 HydrophobicContact CB-CD1 4.38Å; E222-L245 HydrophobicContact CG-CD1 3.43Å; E222-L245 VanDerWaalsContact CG-CD1 3.43Å
223	H	96.9	Very high	96.5	Very high	37 Å²	37	37.7 Å²	37.7	17%	0.171	21%	0.205	C	C	.	.	H	α-helix	trans	-62.5	-46.8	175.6	175.2	78.1	0	0	0	112.9	L194 I199 A219 L220 L221 Y225 N226 E227	L194-H223 HydrophobicContact CD1-CB 3.39Å; I199-H223 WeakPolarHBondContact CG2-NE2 3.19Å; A219-H223 PolarHBondContact O-N 3.09Å; L220-H223 WeakPolarHBondContact O-CB 3.16Å; L220-H223 PolarHBondContact O-N 2.82Å; L221-H223 PolarHBondContact O-N 3.41Å; H223-Y225 VanDerWaalsContact C-N 3.31Å; H223-Y225 PolarHBondContact O-N 2.93Å; H223-N226 PolarHBondContact O-N 2.98Å; H223-N226 VanDerWaalsContact O-N 3.1Å; H223-E227 IonicContact NE2-OE2 3.47Å; H223-E227 PolarHBondContact O-N 3.5Å
224	M	98.6	Very high	96.7	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-57.1	-43.8	178.2	-65.5	175	-162.7	0	0	111.9	L202 L220 L221 N226 E227 L228 F264 Q268 Y271 L292	L202-M224 HydrophobicContact CD1-CE 3.53Å; L202-M224 HydrophobicContact CD2-CE 3.72Å; L202-M224 HydrophobicContact CD2-CG 3.95Å; L202-M224 HydrophobicContact CG-CE 3.73Å; L220-M224 WeakPolarHBondContact O-CG 3.27Å; L220-M224 PolarHBondContact O-N 3.29Å; L221-M224 HydrophobicContact CD2-SD 4.05Å; L221-M224 PolarHBondContact O-N 3.14Å; L221-M224 VanDerWaalsContact O-N 3.13Å; M224-N226 VanDerWaalsContact C-N 3.34Å; M224-N226 PolarHBondContact O-N 3.34Å; M224-E227 PolarHBondContact O-N 3.49Å; M224-L228 WeakPolarHBondContact O-CB 3.49Å; M224-L228 WeakPolarHBondContact O-CG 3.24Å; M224-L228 PolarHBondContact O-N 3.17Å; M224-F264 HydrophobicContact CE-CE2 4.01Å; M224-F264 HydrophobicContact CE-CZ 3.86Å; M224-Q268 HydrophobicContact CE-CB 3.79Å; M224-Q268 HydrophobicContact CE-CG 4.09Å; M224-Y271 HydrophobicContact CB-CD2 3.95Å; M224-Y271 HydrophobicContact CB-CE2 4.22Å; M224-Y271 HydrophobicContact CB-CG 4.41Å; M224-Y271 HydrophobicContact CE-CD1 4.47Å; M224-Y271 HydrophobicContact CG-CD1 4.1Å; M224-Y271 HydrophobicContact CG-CD2 3.75Å; M224-Y271 HydrophobicContact CG-CE1 4.34Å; M224-Y271 HydrophobicContact CG-CE2 4.02Å; M224-Y271 HydrophobicContact CG-CG 3.78Å; M224-Y271 HydrophobicContact SD-CD1 4.45Å; M224-Y271 HydrophobicContact SD-CG 4.09Å; M224-L292 HydrophobicContact CB-CD2 3.87Å; M224-L292 HydrophobicContact SD-CD1 4.19Å
225	Y	98.6	Very high	97	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.3	-39.4	176.6	-89.6	-93.7	0	0	0	112.6	L221 E222 H223 V230 V231 I236 L241 W244 L292 T293 V296 I346	L221-Y225 WeakPolarHBondContact O-CD2 3.45Å; L221-Y225 PolarHBondContact O-N 3.44Å; L221-Y225 VanDerWaalsContact O-N 3.09Å; E222-Y225 PolarHBondContact O-N 2.71Å; H223-Y225 VanDerWaalsContact C-N 3.31Å; H223-Y225 PolarHBondContact O-N 2.93Å; Y225-V230 HydrophobicContact CD1-CB 3.94Å; Y225-V230 HydrophobicContact CD1-CG1 3.59Å; Y225-V230 HydrophobicContact CE1-CG1 3.89Å; Y225-V230 WeakPolarHBondContact O-CB 3.27Å; Y225-V230 PolarHBondContact O-N 3.4Å; Y225-V231 PolarHBondContact O-N 3.07Å; Y225-I236 HydrophobicContact CD1-CD1 4.35Å; Y225-L241 HydrophobicContact CD1-CD1 4.17Å; Y225-L241 HydrophobicContact CD2-CD1 4.33Å; Y225-L241 HydrophobicContact CG-CD1 4.08Å; Y225-W244 HydrophobicContact CE2-CH2 4.48Å; Y225-W244 AromaticContact CE2-CZ3 3.94Å; Y225-W244 HydrophobicContact CE2-CZ3 3.94Å; Y225-W244 AromaticContact CZ-CH2 3.98Å; Y225-W244 AromaticContact CZ-CZ3 3.69Å; Y225-W244 WeakPolarHBondContact OH-CH2 3.28Å; Y225-W244 WeakPolarHBondContact OH-CZ3 3.17Å; Y225-L292 HydrophobicContact CD1-CD2 4.38Å; Y225-L292 HydrophobicContact CD2-CD2 3.51Å; Y225-L292 HydrophobicContact CD2-CG 4.33Å; Y225-L292 HydrophobicContact CE1-CD2 4.43Å; Y225-L292 HydrophobicContact CE2-CD2 3.58Å; Y225-L292 HydrophobicContact CE2-CG 3.89Å; Y225-L292 HydrophobicContact CG-CD2 3.93Å; Y225-T293 VanDerWaalsContact OH-CA 3.25Å; Y225-T293 WeakPolarHBondContact OH-CA 3.36Å; Y225-T293 WeakPolarHBondContact OH-CB 3.49Å; Y225-T293 PolarHBondContact OH-OG1 3.25Å; Y225-V296 HydrophobicContact CE2-CG2 4.47Å; Y225-I346 HydrophobicContact CE1-CD1 4.08Å
226	N	97.7	Very high	97.4	Very high	86 Å²	86	31.3 Å²	31.3	46%	0.46	17%	0.172	S	C	.	.	H	α-helix	trans	-71.1	-47.8	177.4	-79.6	-76.2	0	0	0	111.7	E222 H223 M224 G229	E222-N226 PolarHBondContact O-N 3.43Å; E222-N226 VanDerWaalsContact O-N 3.15Å; E222-N226 PolarHBondContact O-ND2 3.38Å; H223-N226 PolarHBondContact O-N 2.98Å; H223-N226 VanDerWaalsContact O-N 3.1Å; M224-N226 VanDerWaalsContact C-N 3.34Å; M224-N226 PolarHBondContact O-N 3.34Å; N226-G229 PolarHBondContact O-N 2.83Å
227	E	97.6	Very high	97.4	Very high	67 Å²	67	33.2 Å²	33.2	31%	0.313	18%	0.184	S	C	.	.	H	α-helix	trans	-70.2	-36.2	-173.6	-157.3	-168.3	-146.9	0	0	112.7	K203 H223 M224 G229 Y271 Y275	K203-E227 WeakPolarHBondContact CE-OE2 3.36Å; K203-E227 VanDerWaalsContact NZ-CD 3.33Å; K203-E227 IonicContact NZ-OE1 3.94Å; K203-E227 PolarHBondContact NZ-OE1 3.27Å; K203-E227 IonicContact NZ-OE2 3.52Å; K203-E227 PolarHBondContact NZ-OE2 3.44Å; K203-E227 VanDerWaalsContact NZ-OE2 3.15Å; H223-E227 IonicContact NE2-OE2 3.47Å; H223-E227 PolarHBondContact O-N 3.5Å; M224-E227 PolarHBondContact O-N 3.49Å; E227-G229 PolarHBondContact O-N 2.95Å; E227-Y271 WeakPolarHBondContact OE2-CE2 3.32Å; E227-Y271 VanDerWaalsContact OE2-CZ 3.27Å; E227-Y271 PolarHBondContact OE2-OH 2.93Å; E227-Y275 WeakPolarHBondContact CG-OH 3.48Å; E227-Y275 PolarHBondContact OE2-OH 3.15Å; E227-Y275 VanDerWaalsContact OE2-OH 3.11Å
228	L	98.4	Very high	97.3	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.016	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-3.4	172	-69.5	178.4	0	0	0	113.2	M224 V230 Y271 L274 Y275 N280 R285 L288 L292	M224-L228 WeakPolarHBondContact O-CB 3.49Å; M224-L228 WeakPolarHBondContact O-CG 3.24Å; M224-L228 PolarHBondContact O-N 3.17Å; L228-V230 VanDerWaalsContact C-N 3.27Å; L228-V230 HydrophobicContact CB-CG2 3.86Å; L228-V230 PolarHBondContact O-N 3.42Å; L228-Y271 HydrophobicContact CD1-CD2 4.12Å; L228-Y271 HydrophobicContact CD2-CD2 4.28Å; L228-Y271 HydrophobicContact CG-CD2 4.05Å; L228-Y271 HydrophobicContact CG-CE2 4.34Å; L228-L274 HydrophobicContact CD1-CD1 4.11Å; L228-L274 HydrophobicContact CD2-CD1 4.36Å; L228-Y275 HydrophobicContact CD2-CE2 3.62Å; L228-Y275 HydrophobicContact CG-CE2 4.49Å; L228-N280 HydrophobicContact CD2-CB 4.4Å; L228-R285 WeakPolarHBondContact O-CD 3.29Å; L228-L288 HydrophobicContact CD2-CD1 4.38Å; L228-L288 HydrophobicContact CD2-CD2 4.44Å; L228-L292 HydrophobicContact CD1-CB 4.38Å; L228-L292 HydrophobicContact CD1-CD2 3.96Å
229	G	98.1	Very high	97.1	Very high	15 Å²	15	40.2 Å²	40.2	16%	0.155	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	12.1	-179.6	0	0	0	0	0	114.5	N226 E227 S232 E233	N226-G229 PolarHBondContact O-N 2.83Å; E227-G229 PolarHBondContact O-N 2.95Å; G229-S232 PolarHBondContact O-N 3.5Å; G229-E233 WeakPolarHBondContact O-CB 3.14Å; G229-E233 PolarHBondContact O-N 2.82Å
230	V	98.5	Very high	97	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-67.1	-38.8	-177	-178.5	0	0	0	0	111.1	Y225 L228 S232 E233 F234 I236	Y225-V230 HydrophobicContact CD1-CB 3.94Å; Y225-V230 HydrophobicContact CD1-CG1 3.59Å; Y225-V230 HydrophobicContact CE1-CG1 3.89Å; Y225-V230 WeakPolarHBondContact O-CB 3.27Å; Y225-V230 PolarHBondContact O-N 3.4Å; L228-V230 VanDerWaalsContact C-N 3.27Å; L228-V230 HydrophobicContact CB-CG2 3.86Å; L228-V230 PolarHBondContact O-N 3.42Å; V230-S232 VanDerWaalsContact C-N 3.33Å; V230-S232 PolarHBondContact O-N 2.9Å; V230-E233 PolarHBondContact O-N 3.13Å; V230-F234 HydrophobicContact CG1-CD2 3.57Å; V230-F234 HydrophobicContact CG1-CE2 3.68Å; V230-F234 PolarHBondContact O-N 2.97Å; V230-F234 VanDerWaalsContact O-N 3.13Å; V230-I236 HydrophobicContact CG1-CD1 4.09Å
231	V	98.3	Very high	97	Very high	14 Å²	14	40.3 Å²	40.3	9%	0.085	22%	0.224	C	C	.	.	H	α-helix	trans	-58.4	-46.1	175.1	174.9	0	0	0	0	111.2	Y225 N235 I236 L241	Y225-V231 PolarHBondContact O-N 3.07Å; V231-N235 CarbonylContact O-C 3.59Å; V231-N235 WeakPolarHBondContact O-CA 3.44Å; V231-N235 PolarHBondContact O-N 3.02Å; V231-N235 VanDerWaalsContact O-N 3.16Å; V231-I236 HydrophobicContact CG1-CB 4.26Å; V231-I236 PolarHBondContact O-N 3.48Å; V231-L241 HydrophobicContact CG2-CD2 3.92Å
232	S	98.1	Very high	96.8	Very high	99 Å²	99	43.2 Å²	43.2	69%	0.692	24%	0.237	S	C	*	.	H	α-helix	trans	-70.5	-44.4	-179.6	-51.3	0	0	0	0	112	G229 V230 F234 N235	G229-S232 PolarHBondContact O-N 3.5Å; V230-S232 VanDerWaalsContact C-N 3.33Å; V230-S232 PolarHBondContact O-N 2.9Å; S232-F234 PolarHBondContact O-N 3.4Å; S232-N235 PolarHBondContact O-N 3.38Å
233	E	98.1	Very high	96.6	Very high	98 Å²	98	44.7 Å²	44.7	46%	0.458	24%	0.241	S	C	.	.	H	α-helix	trans	-58.5	-46.2	-178.8	-179.3	63.6	-162.7	0	0	112.5	G229 V230 R285	G229-E233 WeakPolarHBondContact O-CB 3.14Å; G229-E233 PolarHBondContact O-N 2.82Å; V230-E233 PolarHBondContact O-N 3.13Å; E233-R285 HydrophobicContact CB-CB 3.72Å; E233-R285 HydrophobicContact CG-CB 3.6Å; E233-R285 WeakPolarHBondContact OE2-CB 3.33Å
234	F	98.2	Very high	96.5	Very high	3 Å²	3	42.9 Å²	42.9	1%	0.013	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	7.4	-177.2	-57.2	-43	0	0	0	113.8	V230 S232 I236 E286 F347 V350 V354 I358	V230-F234 HydrophobicContact CG1-CD2 3.57Å; V230-F234 HydrophobicContact CG1-CE2 3.68Å; V230-F234 PolarHBondContact O-N 2.97Å; V230-F234 VanDerWaalsContact O-N 3.13Å; S232-F234 PolarHBondContact O-N 3.4Å; F234-I236 VanDerWaalsContact C-N 3.26Å; F234-I236 HydrophobicContact CB-CD1 4.2Å; F234-I236 HydrophobicContact CB-CG1 3.73Å; F234-I236 HydrophobicContact CD2-CD1 4.31Å; F234-I236 PolarHBondContact O-N 3.31Å; F234-E286 HydrophobicContact CE1-CB 4.27Å; F234-E286 HydrophobicContact CE1-CG 4.08Å; F234-E286 HydrophobicContact CZ-CB 4.31Å; F234-E286 HydrophobicContact CZ-CG 4.11Å; F234-F347 HydrophobicContact CB-CD1 4.27Å; F234-F347 AromaticContact CD2-CD1 3.69Å; F234-F347 HydrophobicContact CD2-CD1 3.69Å; F234-F347 AromaticContact CD2-CE1 3.45Å; F234-F347 HydrophobicContact CD2-CE1 3.45Å; F234-F347 VanDerWaalsContact CD2-CE1 3.45Å; F234-F347 HydrophobicContact CE2-CD1 4.08Å; F234-F347 AromaticContact CE2-CE1 3.53Å; F234-F347 HydrophobicContact CE2-CE1 3.53Å; F234-F347 AromaticContact CG-CD1 3.98Å; F234-F347 HydrophobicContact CG-CD1 3.98Å; F234-F347 HydrophobicContact CG-CE1 4.21Å; F234-F347 HydrophobicContact CZ-CE1 4.37Å; F234-V350 HydrophobicContact CB-CG1 3.71Å; F234-V350 HydrophobicContact CD1-CG1 3.65Å; F234-V350 HydrophobicContact CG-CG1 3.98Å; F234-V354 HydrophobicContact CD1-CG1 4.49Å; F234-V354 HydrophobicContact CE1-CG1 4.16Å; F234-I358 HydrophobicContact CD1-CD1 4.19Å; F234-I358 HydrophobicContact CE1-CD1 3.67Å; F234-I358 HydrophobicContact CE1-CG1 4.38Å; F234-I358 HydrophobicContact CE2-CD1 4.28Å; F234-I358 HydrophobicContact CZ-CD1 3.7Å; F234-I358 HydrophobicContact CZ-CG1 4.14Å
235	N	97.6	Very high	96.5	Very high	109 Å²	109	43 Å²	43	58%	0.583	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.6	47.6	-175.2	-172.5	31.7	0	0	0	111.7	V231 S232 N237 N349	V231-N235 CarbonylContact O-C 3.59Å; V231-N235 WeakPolarHBondContact O-CA 3.44Å; V231-N235 PolarHBondContact O-N 3.02Å; V231-N235 VanDerWaalsContact O-N 3.16Å; S232-N235 PolarHBondContact O-N 3.38Å; N235-N237 PolarHBondContact O-N 3.49Å; N235-N349 HydrophobicContact CB-CB 3.97Å; N235-N349 PolarHBondContact O-ND2 3.28Å
236	I	97.8	Very high	96.3	Very high	6 Å²	6	43.8 Å²	43.8	3%	0.031	24%	0.237	C	C	.	.			trans	-72.2	123.8	-174.2	-48.2	-175.3	0	0	0	109.1	Y225 V230 V231 F234 P238 L241 I346	Y225-I236 HydrophobicContact CD1-CD1 4.35Å; V230-I236 HydrophobicContact CG1-CD1 4.09Å; V231-I236 HydrophobicContact CG1-CB 4.26Å; V231-I236 PolarHBondContact O-N 3.48Å; F234-I236 VanDerWaalsContact C-N 3.26Å; F234-I236 HydrophobicContact CB-CD1 4.2Å; F234-I236 HydrophobicContact CB-CG1 3.73Å; F234-I236 HydrophobicContact CD2-CD1 4.31Å; F234-I236 PolarHBondContact O-N 3.31Å; I236-P238 WeakPolarHBondContact O-CD 3.46Å; I236-L241 HydrophobicContact CG2-CB 3.93Å; I236-I346 HydrophobicContact CD1-CB 4.26Å; I236-I346 WeakPolarHBondContact CG1-O 3.44Å; I236-I346 HydrophobicContact CG2-CB 3.87Å; I236-I346 HydrophobicContact CG2-CG2 4.03Å
237	N	94.3	Very high	96.1	Very high	83 Å²	83	39.7 Å²	39.7	44%	0.444	22%	0.215	S	C	.	.			trans	-64.7	124.5	170.8	-178.3	-50.5	0	0	0	109.2	N235 L239 T240 L241	N235-N237 PolarHBondContact O-N 3.49Å; N237-L239 PolarHBondContact O-N 2.88Å; N237-L239 VanDerWaalsContact O-N 3.17Å; N237-L239 WeakPolarHBondContact OD1-CA 3.3Å; N237-L239 VanDerWaalsContact OD1-CB 3.29Å; N237-L239 WeakPolarHBondContact OD1-CB 3.49Å; N237-L239 PolarHBondContact OD1-N 3.43Å; N237-T240 WeakPolarHBondContact O-CA 3.32Å; N237-T240 WeakPolarHBondContact O-CB 3.44Å; N237-T240 PolarHBondContact O-N 3.01Å; N237-T240 PolarHBondContact OD1-N 3.18Å; N237-L241 PolarHBondContact O-N 2.93Å
238	P	92.5	Very high	96.1	Very high	87 Å²	87	36.5 Å²	36.5	57%	0.565	20%	0.2	S	C	*	.	H	α-helix	trans	-57.5	-33.5	-177.5	-27.7	35.4	0	0	0	114	I236 K242	I236-P238 WeakPolarHBondContact O-CD 3.46Å; P238-K242 PolarHBondContact O-N 3.21Å; P238-K242 VanDerWaalsContact O-N 3.12Å
239	L	91.8	Very high	96	Very high	72 Å²	72	38.8 Å²	38.8	38%	0.377	21%	0.211	S	C	.	.	H	α-helix	trans	-67.9	-45	175.1	-175.4	59.8	0	0	0	110.5	L186 N237 L241 K242 R243	L186-L239 HydrophobicContact CD1-CD1 4.1Å; N237-L239 PolarHBondContact O-N 2.88Å; N237-L239 VanDerWaalsContact O-N 3.17Å; N237-L239 WeakPolarHBondContact OD1-CA 3.3Å; N237-L239 VanDerWaalsContact OD1-CB 3.29Å; N237-L239 WeakPolarHBondContact OD1-CB 3.49Å; N237-L239 PolarHBondContact OD1-N 3.43Å; L239-L241 VanDerWaalsContact C-N 3.33Å; L239-L241 PolarHBondContact O-N 2.76Å; L239-K242 WeakPolarHBondContact O-CB 3.38Å; L239-K242 PolarHBondContact O-N 3.26Å; L239-K242 VanDerWaalsContact O-N 3.16Å; L239-R243 HydrophobicContact CG-CG 4.41Å; L239-R243 WeakPolarHBondContact O-CG 3.49Å; L239-R243 PolarHBondContact O-N 3.2Å
240	T	93.8	Very high	95.8	Very high	22 Å²	22	39 Å²	39	14%	0.135	21%	0.211	C	C	.	.	H	α-helix	trans	-58.2	-43.3	175.3	-59.5	0	0	0	0	111.6	N237 K242 R243 W244 I346	N237-T240 WeakPolarHBondContact O-CA 3.32Å; N237-T240 WeakPolarHBondContact O-CB 3.44Å; N237-T240 PolarHBondContact O-N 3.01Å; N237-T240 PolarHBondContact OD1-N 3.18Å; T240-K242 VanDerWaalsContact C-N 3.33Å; T240-K242 PolarHBondContact O-N 3.21Å; T240-R243 PolarHBondContact O-N 3.36Å; T240-W244 VanDerWaalsContact O-CB 3.3Å; T240-W244 WeakPolarHBondContact O-CB 3.35Å; T240-W244 PolarHBondContact O-N 3.13Å; T240-I346 HydrophobicContact CG2-CG2 4.31Å
241	L	96.2	Very high	95.7	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-56.4	-47.8	173.9	179.3	61.3	0	0	0	111.4	E222 Y225 V231 I236 N237 L239 R243 W244 L245 I346	E222-L241 HydrophobicContact CG-CD2 4.38Å; Y225-L241 HydrophobicContact CD1-CD1 4.17Å; Y225-L241 HydrophobicContact CD2-CD1 4.33Å; Y225-L241 HydrophobicContact CG-CD1 4.08Å; V231-L241 HydrophobicContact CG2-CD2 3.92Å; I236-L241 HydrophobicContact CG2-CB 3.93Å; N237-L241 PolarHBondContact O-N 2.93Å; L239-L241 VanDerWaalsContact C-N 3.33Å; L239-L241 PolarHBondContact O-N 2.76Å; L241-R243 PolarHBondContact O-N 2.87Å; L241-W244 HydrophobicContact CD1-CE3 4.1Å; L241-W244 HydrophobicContact CD1-CZ3 4.48Å; L241-W244 PolarHBondContact O-N 3.23Å; L241-L245 HydrophobicContact CD1-CD1 4.14Å; L241-L245 HydrophobicContact CD1-CG 4.23Å; L241-L245 HydrophobicContact CG-CD1 4.1Å; L241-L245 WeakPolarHBondContact O-CG 3.26Å; L241-L245 PolarHBondContact O-N 2.77Å; L241-I346 HydrophobicContact CD1-CG2 4.22Å
242	K	93.8	Very high	95.7	Very high	61 Å²	61	39.3 Å²	39.3	27%	0.265	21%	0.212	S	C	.	.	H	α-helix	trans	-62.7	-42.6	177.3	-175.3	166.5	-126	163.6	0	112.5	E222 P238 L239 T240 W244 L246	E222-K242 WeakPolarHBondContact OE1-CE 3.35Å; E222-K242 IonicContact OE1-NZ 3.94Å; P238-K242 PolarHBondContact O-N 3.21Å; P238-K242 VanDerWaalsContact O-N 3.12Å; L239-K242 WeakPolarHBondContact O-CB 3.38Å; L239-K242 PolarHBondContact O-N 3.26Å; L239-K242 VanDerWaalsContact O-N 3.16Å; T240-K242 VanDerWaalsContact C-N 3.33Å; T240-K242 PolarHBondContact O-N 3.21Å; K242-W244 VanDerWaalsContact C-N 3.32Å; K242-W244 PolarHBondContact O-N 3.29Å; K242-L246 HydrophobicContact CG-CD1 4.03Å; K242-L246 WeakPolarHBondContact O-CB 3.43Å; K242-L246 WeakPolarHBondContact O-CD1 3.5Å; K242-L246 VanDerWaalsContact O-CG 3.32Å; K242-L246 WeakPolarHBondContact O-CG 3.49Å; K242-L246 PolarHBondContact O-N 3.35Å
243	R	93	Very high	95.5	Very high	74 Å²	74	39.2 Å²	39.2	28%	0.279	20%	0.196	S	C	.	.	H	α-helix	trans	-61.1	-45.6	176.4	-41.7	-155.6	149.9	147.5	-7	110.9	L183 L239 T240 L241 L246 S247 E343 L344	L183-R243 HydrophobicContact CD1-CB 3.46Å; L183-R243 VanDerWaalsContact CD1-CB 3.46Å; L183-R243 HydrophobicContact CD1-CG 3.11Å; L239-R243 HydrophobicContact CG-CG 4.41Å; L239-R243 WeakPolarHBondContact O-CG 3.49Å; L239-R243 PolarHBondContact O-N 3.2Å; T240-R243 PolarHBondContact O-N 3.36Å; L241-R243 PolarHBondContact O-N 2.87Å; R243-L246 PolarHBondContact O-N 3.34Å; R243-S247 WeakPolarHBondContact O-CB 3.44Å; R243-S247 PolarHBondContact O-N 3.42Å; R243-E343 VanDerWaalsContact CD-O 3.29Å; R243-E343 WeakPolarHBondContact CD-O 3.48Å; R243-L344 HydrophobicContact CB-CD2 3.53Å
244	W	96.3	Very high	95.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.8	-51	179.9	178.5	75.9	0	0	0	111	Y225 T240 L241 K242 L246 S247 I248 T293 V296 L344 I346	Y225-W244 HydrophobicContact CE2-CH2 4.48Å; Y225-W244 AromaticContact CE2-CZ3 3.94Å; Y225-W244 HydrophobicContact CE2-CZ3 3.94Å; Y225-W244 AromaticContact CZ-CH2 3.98Å; Y225-W244 AromaticContact CZ-CZ3 3.69Å; Y225-W244 WeakPolarHBondContact OH-CH2 3.28Å; Y225-W244 WeakPolarHBondContact OH-CZ3 3.17Å; T240-W244 VanDerWaalsContact O-CB 3.3Å; T240-W244 WeakPolarHBondContact O-CB 3.35Å; T240-W244 PolarHBondContact O-N 3.13Å; L241-W244 HydrophobicContact CD1-CE3 4.1Å; L241-W244 HydrophobicContact CD1-CZ3 4.48Å; L241-W244 PolarHBondContact O-N 3.23Å; K242-W244 VanDerWaalsContact C-N 3.32Å; K242-W244 PolarHBondContact O-N 3.29Å; W244-L246 VanDerWaalsContact C-N 3.34Å; W244-L246 PolarHBondContact O-N 3.23Å; W244-S247 CarbonylContact O-C 3.53Å; W244-S247 WeakPolarHBondContact O-CA 3.36Å; W244-S247 VanDerWaalsContact O-CB 3.3Å; W244-S247 WeakPolarHBondContact O-CB 3.45Å; W244-S247 PolarHBondContact O-N 3.33Å; W244-I248 HydrophobicContact CD2-CG1 3.94Å; W244-I248 HydrophobicContact CE3-CG1 4.35Å; W244-I248 HydrophobicContact CG-CG1 4.44Å; W244-I248 HydrophobicContact CH2-CD1 4.46Å; W244-I248 HydrophobicContact CH2-CG1 4.16Å; W244-I248 HydrophobicContact CZ2-CD1 3.7Å; W244-I248 HydrophobicContact CZ2-CG1 3.74Å; W244-I248 HydrophobicContact CZ3-CG1 4.46Å; W244-I248 VanDerWaalsContact O-CG1 3.32Å; W244-I248 WeakPolarHBondContact O-CG1 3.3Å; W244-I248 PolarHBondContact O-N 2.98Å; W244-T293 HydrophobicContact CH2-CG2 3.86Å; W244-T293 HydrophobicContact CZ2-CG2 3.78Å; W244-V296 HydrophobicContact CH2-CB 4.14Å; W244-V296 HydrophobicContact CH2-CG1 3.58Å; W244-V296 HydrophobicContact CZ2-CG1 4.31Å; W244-V296 HydrophobicContact CZ3-CG1 4.17Å; W244-L344 WeakPolarHBondContact CB-O 3.31Å; W244-I346 HydrophobicContact CB-CG2 3.55Å; W244-I346 HydrophobicContact CD2-CD1 4.05Å; W244-I346 HydrophobicContact CD2-CG1 4.38Å; W244-I346 HydrophobicContact CD2-CG2 3.87Å; W244-I346 HydrophobicContact CE3-CD1 4.04Å; W244-I346 HydrophobicContact CE3-CG2 4.08Å; W244-I346 HydrophobicContact CG-CG2 3.64Å; W244-I346 HydrophobicContact CH2-CD1 4.17Å; W244-I346 HydrophobicContact CZ2-CD1 4.16Å; W244-I346 HydrophobicContact CZ3-CD1 4.1Å
245	L	97	Very high	95.4	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-60	-40.5	178.1	-72.1	172.4	0	0	0	112.8	L218 L221 E222 L241 S247 I248 Q249	L218-L245 HydrophobicContact CD2-CB 3.7Å; L221-L245 HydrophobicContact CB-CD1 4.13Å; L221-L245 HydrophobicContact CB-CD2 3.97Å; L221-L245 HydrophobicContact CD1-CD2 3.99Å; E222-L245 HydrophobicContact CB-CD1 4.38Å; E222-L245 HydrophobicContact CG-CD1 3.43Å; E222-L245 VanDerWaalsContact CG-CD1 3.43Å; L241-L245 HydrophobicContact CD1-CD1 4.14Å; L241-L245 HydrophobicContact CD1-CG 4.23Å; L241-L245 HydrophobicContact CG-CD1 4.1Å; L241-L245 WeakPolarHBondContact O-CG 3.26Å; L241-L245 PolarHBondContact O-N 2.77Å; L245-S247 VanDerWaalsContact C-N 3.33Å; L245-I248 WeakPolarHBondContact O-CB 3.36Å; L245-I248 PolarHBondContact O-N 2.88Å; L245-Q249 PolarHBondContact O-N 2.94Å
246	L	94.3	Very high	95.4	Very high	17 Å²	17	39.6 Å²	39.6	9%	0.089	20%	0.203	C	C	.	.	H	α-helix	trans	-63.6	-39.2	173.3	-74.7	165.1	0	0	0	112	L181 L183 L186 L218 K242 R243 W244 A250	L181-L246 HydrophobicContact CD2-CB 4.28Å; L181-L246 HydrophobicContact CD2-CD1 4.16Å; L181-L246 HydrophobicContact CD2-CD2 4.35Å; L183-L246 HydrophobicContact CD2-CD1 3.75Å; L186-L246 HydrophobicContact CD2-CD1 4.39Å; L218-L246 HydrophobicContact CD1-CD2 3.57Å; L218-L246 HydrophobicContact CD1-CG 4.3Å; K242-L246 HydrophobicContact CG-CD1 4.03Å; K242-L246 WeakPolarHBondContact O-CB 3.43Å; K242-L246 WeakPolarHBondContact O-CD1 3.5Å; K242-L246 VanDerWaalsContact O-CG 3.32Å; K242-L246 WeakPolarHBondContact O-CG 3.49Å; K242-L246 PolarHBondContact O-N 3.35Å; R243-L246 PolarHBondContact O-N 3.34Å; W244-L246 VanDerWaalsContact C-N 3.34Å; W244-L246 PolarHBondContact O-N 3.23Å; L246-A250 WeakPolarHBondContact O-CB 3.47Å; L246-A250 PolarHBondContact O-N 2.83Å
247	S	95	Very high	95.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.4	-43.3	174	-165	0	0	0	0	111.2	K179 R243 W244 L245 A250 N251 L344	K179-S247 PolarHBondContact O-OG 2.98Å; K179-S247 VanDerWaalsContact O-OG 3.1Å; R243-S247 WeakPolarHBondContact O-CB 3.44Å; R243-S247 PolarHBondContact O-N 3.42Å; W244-S247 CarbonylContact O-C 3.53Å; W244-S247 WeakPolarHBondContact O-CA 3.36Å; W244-S247 VanDerWaalsContact O-CB 3.3Å; W244-S247 WeakPolarHBondContact O-CB 3.45Å; W244-S247 PolarHBondContact O-N 3.33Å; L245-S247 VanDerWaalsContact C-N 3.33Å; S247-A250 PolarHBondContact O-N 2.85Å; S247-N251 PolarHBondContact O-N 2.7Å; S247-N251 VanDerWaalsContact O-N 3.07Å; S247-N251 PolarHBondContact O-ND2 2.95Å; S247-L344 WeakPolarHBondContact OG-CD1 3.09Å
248	I	97.1	Very high	95.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-56.2	-53.9	175.4	-69.1	-66.9	0	0	0	109.6	W244 L245 A250 N251 Y252 F260 V296 L300 I338	W244-I248 HydrophobicContact CD2-CG1 3.94Å; W244-I248 HydrophobicContact CE3-CG1 4.35Å; W244-I248 HydrophobicContact CG-CG1 4.44Å; W244-I248 HydrophobicContact CH2-CD1 4.46Å; W244-I248 HydrophobicContact CH2-CG1 4.16Å; W244-I248 HydrophobicContact CZ2-CD1 3.7Å; W244-I248 HydrophobicContact CZ2-CG1 3.74Å; W244-I248 HydrophobicContact CZ3-CG1 4.46Å; W244-I248 VanDerWaalsContact O-CG1 3.32Å; W244-I248 WeakPolarHBondContact O-CG1 3.3Å; W244-I248 PolarHBondContact O-N 2.98Å; L245-I248 WeakPolarHBondContact O-CB 3.36Å; L245-I248 PolarHBondContact O-N 2.88Å; I248-A250 VanDerWaalsContact C-N 3.28Å; I248-A250 PolarHBondContact O-N 2.81Å; I248-N251 PolarHBondContact O-N 3.32Å; I248-Y252 HydrophobicContact CG2-CD2 3.98Å; I248-Y252 HydrophobicContact CG2-CE2 3.71Å; I248-Y252 WeakPolarHBondContact O-CD2 3.43Å; I248-Y252 PolarHBondContact O-N 3.47Å; I248-Y252 VanDerWaalsContact O-N 3.14Å; I248-F260 HydrophobicContact CG2-CE2 4.18Å; I248-V296 HydrophobicContact CG1-CG1 4.31Å; I248-V296 HydrophobicContact CG2-CG1 3.7Å; I248-L300 HydrophobicContact CD1-CD1 3.78Å; I248-L300 HydrophobicContact CD1-CD2 3.95Å; I248-L300 HydrophobicContact CD1-CG 4.39Å; I248-L300 HydrophobicContact CG2-CD2 4.2Å; I248-I338 HydrophobicContact CD1-CD1 3.99Å
249	Q	96.5	Very high	95.9	Very high	51 Å²	51	34.7 Å²	34.7	24%	0.238	17%	0.17	C	C	.	.	H	α-helix	trans	-53.7	-44.7	177.3	-177.8	-168.3	14.8	0	0	112.2	L218 L245 N251 Y252 F260	L218-Q249 HydrophobicContact CD2-CB 4.41Å; L245-Q249 PolarHBondContact O-N 2.94Å; Q249-N251 VanDerWaalsContact C-N 3.25Å; Q249-N251 PolarHBondContact O-N 3.47Å; Q249-Y252 PolarHBondContact O-N 3Å; Q249-F260 HydrophobicContact CB-CD1 4.29Å; Q249-F260 HydrophobicContact CB-CD2 3.97Å; Q249-F260 HydrophobicContact CB-CE1 4.19Å; Q249-F260 HydrophobicContact CB-CE2 3.87Å; Q249-F260 HydrophobicContact CB-CG 4.17Å; Q249-F260 HydrophobicContact CB-CZ 3.98Å; Q249-F260 HydrophobicContact CG-CB 4.47Å; Q249-F260 HydrophobicContact CG-CD1 3.74Å; Q249-F260 HydrophobicContact CG-CD2 4.2Å; Q249-F260 HydrophobicContact CG-CE1 3.94Å; Q249-F260 HydrophobicContact CG-CE2 4.38Å; Q249-F260 HydrophobicContact CG-CG 3.87Å; Q249-F260 HydrophobicContact CG-CZ 4.26Å
250	A	94	Very high	96.2	Very high	20 Å²	20	32 Å²	32	17%	0.165	16%	0.155	C	C	.	.	H	α-helix	trans	-66.8	-24.7	-179.4	0	0	0	0	0	113.8	I171 K179 L246 S247 I248	I171-A250 HydrophobicContact CD1-CB 4.38Å; K179-A250 HydrophobicContact CB-CB 4.16Å; K179-A250 WeakPolarHBondContact CD-O 3.4Å; L246-A250 WeakPolarHBondContact O-CB 3.47Å; L246-A250 PolarHBondContact O-N 2.83Å; S247-A250 PolarHBondContact O-N 2.85Å; I248-A250 VanDerWaalsContact C-N 3.28Å; I248-A250 PolarHBondContact O-N 2.81Å
251	N	96	Very high	96.4	Very high	7 Å²	7	33.2 Å²	33.2	4%	0.037	16%	0.157	C	C	.	.	H	α-helix	trans	-95.3	-2.8	178.9	-70.5	-82.8	0	0	0	113.2	K179 S247 I248 Q249 L300 D301 V334 I338	K179-N251 PolarHBondContact N-OD1 2.87Å; K179-N251 PolarHBondContact O-ND2 3.41Å; S247-N251 PolarHBondContact O-N 2.7Å; S247-N251 VanDerWaalsContact O-N 3.07Å; S247-N251 PolarHBondContact O-ND2 2.95Å; I248-N251 PolarHBondContact O-N 3.32Å; Q249-N251 VanDerWaalsContact C-N 3.25Å; Q249-N251 PolarHBondContact O-N 3.47Å; N251-L300 HydrophobicContact CB-CD2 4.04Å; N251-D301 VanDerWaalsContact O-CA 3.24Å; N251-D301 WeakPolarHBondContact O-CA 3.43Å; N251-D301 PolarHBondContact O-N 3.32Å; N251-V334 HydrophobicContact CB-CG1 4.48Å; N251-I338 HydrophobicContact CB-CD1 4.23Å
252	Y	97.7	Very high	96.6	Very high	14 Å²	14	33.1 Å²	33.1	6%	0.055	16%	0.157	C	C	.	.	S	Bend	trans	-80.3	129.5	160.6	-85.6	-82.4	0	0	0	110.2	I248 Q249 F260 C263 V296 D299 L300	I248-Y252 HydrophobicContact CG2-CD2 3.98Å; I248-Y252 HydrophobicContact CG2-CE2 3.71Å; I248-Y252 WeakPolarHBondContact O-CD2 3.43Å; I248-Y252 PolarHBondContact O-N 3.47Å; I248-Y252 VanDerWaalsContact O-N 3.14Å; Q249-Y252 PolarHBondContact O-N 3Å; Y252-F260 HydrophobicContact CD2-CB 4.42Å; Y252-F260 AromaticContact CD2-CD2 3.8Å; Y252-F260 HydrophobicContact CD2-CD2 3.8Å; Y252-F260 HydrophobicContact CE2-CD2 4.39Å; Y252-F260 HydrophobicContact CG-CB 4.16Å; Y252-F260 HydrophobicContact CG-CD2 4.38Å; Y252-C263 HydrophobicContact CD1-CB 4.29Å; Y252-C263 HydrophobicContact CD2-CB 4.26Å; Y252-C263 HydrophobicContact CE1-CB 3.67Å; Y252-C263 HydrophobicContact CE2-CB 3.64Å; Y252-C263 WeakPolarHBondContact CE2-SG 3.34Å; Y252-C263 VanDerWaalsContact CZ-SG 3.59Å; Y252-C263 WeakPolarHBondContact OH-CB 3.47Å; Y252-C263 PolarHBondContact OH-SG 3.23Å; Y252-V296 WeakPolarHBondContact CE2-O 3.43Å; Y252-V296 PolarHBondContact OH-O 3.11Å; Y252-D299 VanDerWaalsContact CE1-C 3.41Å; Y252-D299 HydrophobicContact CE1-CB 3.62Å; Y252-D299 VanDerWaalsContact CE1-O 3.25Å; Y252-D299 WeakPolarHBondContact CE1-O 3.34Å; Y252-D299 PolarHBondContact OH-N 2.87Å; Y252-L300 HydrophobicContact CD2-CD2 3.88Å; Y252-L300 HydrophobicContact CE2-CD2 3.62Å; Y252-L300 HydrophobicContact CE2-CG 4.04Å
253	R	95.5	Very high	96.8	Very high	97 Å²	97	30.2 Å²	30.2	37%	0.366	14%	0.144	S	C	.	.			trans	-76	157.5	175.4	-58.2	-167	-172.8	174.2	4.9	110.3	N255 N259 D301 H302	R253-N255 PolarHBondContact O-N 3.4Å; R253-N255 VanDerWaalsContact O-N 3.08Å; R253-N259 WeakPolarHBondContact O-CA 3.46Å; R253-N259 WeakPolarHBondContact O-CB 3.48Å; R253-D301 IonicContact CZ-OD1 3.72Å; R253-D301 VanDerWaalsContact CZ-OD1 3.28Å; R253-D301 IonicContact CZ-OD2 3.67Å; R253-D301 IonicContact NE-OD1 3.57Å; R253-D301 PolarHBondContact NE-OD1 3.21Å; R253-D301 IonicContact NH2-OD1 3.28Å; R253-D301 PolarHBondContact NH2-OD1 3.14Å; R253-D301 IonicContact NH2-OD2 2.64Å; R253-D301 PolarHBondContact NH2-OD2 3.46Å; R253-H302 VanDerWaalsContact CD-O 3.27Å; R253-H302 WeakPolarHBondContact CD-O 3.34Å
254	N	95.3	Very high	97.1	Very high	163 Å²	163	26.7 Å²	26.7	87%	0.872	13%	0.131	S	C	*	.			trans	-86.4	57.9	175.9	-167.2	55.7	0	0	0	110.8
255	N	97.4	Very high	97.2	Very high	23 Å²	23	26.7 Å²	26.7	12%	0.123	13%	0.131	C	C	.	.			trans	-78	158.6	173.1	-53.8	-38.8	0	0	0	110	R253 F257 H258 N259 H302 E430	R253-N255 PolarHBondContact O-N 3.4Å; R253-N255 VanDerWaalsContact O-N 3.08Å; N255-F257 VanDerWaalsContact C-N 3.34Å; N255-F257 PolarHBondContact O-N 3.37Å; N255-H258 PolarHBondContact ND2-O 2.99Å; N255-N259 WeakPolarHBondContact O-CB 3.39Å; N255-N259 PolarHBondContact O-ND2 3.34Å; N255-H302 PolarHBondContact ND2-O 3.48Å; N255-E430 WeakPolarHBondContact CB-OE2 3.34Å
256	P	98	Very high	97.3	Very high	31 Å²	31	26.7 Å²	26.7	20%	0.201	13%	0.131	C	C	.	.	S	Bend	trans	-54.9	-46.6	175.5	-25.6	34.9	0	0	0	112.9	N259 C426 E429 E430	P256-N259 PolarHBondContact O-ND2 3.32Å; P256-N259 VanDerWaalsContact O-ND2 3.12Å; P256-C426 WeakPolarHBondContact CB-O 3.1Å; P256-C426 VanDerWaalsContact O-CB 3.32Å; P256-C426 WeakPolarHBondContact O-CB 3.37Å; P256-E429 HydrophobicContact CB-CB 4.09Å; P256-E429 HydrophobicContact CB-CG 4.12Å; P256-E429 HydrophobicContact CG-CB 4.4Å; P256-E429 HydrophobicContact CG-CG 3.96Å; P256-E430 HydrophobicContact CB-CB 4.18Å; P256-E430 HydrophobicContact CG-CB 4.27Å
257	F	98.5	Very high	97.5	Very high	19 Å²	19	25.9 Å²	25.9	8%	0.083	13%	0.127	C	C	.	.	S	Bend	trans	-108.4	-61	-177.6	-173.5	-91.2	0	0	0	112.8	N255 N259 H262 N412 W423 C426 L427 E430	N255-F257 VanDerWaalsContact C-N 3.34Å; N255-F257 PolarHBondContact O-N 3.37Å; F257-N259 VanDerWaalsContact C-N 3.28Å; F257-N259 PolarHBondContact O-N 3.41Å; F257-N259 PolarHBondContact O-ND2 3.4Å; F257-H262 AromaticContact CE1-CE1 3.88Å; F257-H262 AromaticContact CE1-ND1 3.98Å; F257-H262 VanDerWaalsContact O-CB 3.29Å; F257-H262 WeakPolarHBondContact O-CB 3.32Å; F257-N412 WeakPolarHBondContact CZ-ND2 3.43Å; F257-W423 AromaticContact CD2-CE3 3.71Å; F257-W423 HydrophobicContact CD2-CE3 3.71Å; F257-W423 HydrophobicContact CD2-CZ3 4.21Å; F257-W423 HydrophobicContact CE2-CB 4.45Å; F257-W423 HydrophobicContact CE2-CD2 4.5Å; F257-W423 AromaticContact CE2-CE3 3.81Å; F257-W423 HydrophobicContact CE2-CE3 3.81Å; F257-W423 HydrophobicContact CE2-CZ3 4.49Å; F257-C426 HydrophobicContact CB-CB 4.4Å; F257-C426 HydrophobicContact CD2-CB 4.33Å; F257-L427 HydrophobicContact CB-CD1 4.38Å; F257-L427 HydrophobicContact CD1-CD1 3.97Å; F257-L427 HydrophobicContact CD2-CB 3.64Å; F257-L427 HydrophobicContact CD2-CD1 3.94Å; F257-L427 HydrophobicContact CD2-CG 4.36Å; F257-L427 HydrophobicContact CE1-CD1 4.19Å; F257-L427 HydrophobicContact CE2-CB 4.01Å; F257-L427 HydrophobicContact CE2-CD1 4.16Å; F257-L427 HydrophobicContact CG-CB 4.24Å; F257-L427 HydrophobicContact CG-CD1 3.83Å; F257-L427 HydrophobicContact CZ-CD1 4.28Å; F257-E430 WeakPolarHBondContact CA-OE2 3.49Å; F257-E430 HydrophobicContact CB-CB 4.37Å; F257-E430 WeakPolarHBondContact CB-OE2 2.84Å; F257-E430 PolarHBondContact N-OE2 3.32Å
258	H	98.6	Very high	97.7	Very high	33 Å²	33	25.9 Å²	25.9	15%	0.153	13%	0.127	C	C	.	.	S	Bend	trans	-78.5	74.8	-173.2	-59.2	87	0	0	0	111.3	N255 D299 H302 E430	N255-H258 PolarHBondContact ND2-O 2.99Å; H258-D299 IonicContact CD2-OD2 2.97Å; H258-D299 PolarHBondContact CD2-OD2 3.31Å; H258-D299 VanDerWaalsContact CD2-OD2 3.28Å; H258-H302 HydrophobicContact CB-CB 3.79Å; H258-H302 VanDerWaalsContact CB-ND1 3.33Å; H258-H302 WeakPolarHBondContact CB-ND1 3.29Å; H258-H302 AromaticContact CD2-CD2 3.85Å; H258-H302 AromaticContact CD2-CE1 3.87Å; H258-H302 AromaticContact CD2-NE2 3.76Å; H258-H302 AromaticContact CE1-CE1 3.8Å; H258-H302 AromaticContact CG-CD2 3.98Å; H258-H302 AromaticContact CG-CE1 3.51Å; H258-H302 AromaticContact CG-CG 3.78Å; H258-H302 AromaticContact CG-ND1 3.46Å; H258-H302 AromaticContact CG-NE2 3.87Å; H258-H302 AromaticContact ND1-CE1 3.46Å; H258-H302 PolarHBondContact ND1-CE1 3.01Å; H258-H302 AromaticContact ND1-ND1 3.73Å; H258-H302 AromaticContact NE2-NE2 3.94Å; H258-E430 IonicContact CE1-OE1 3.4Å; H258-E430 PolarHBondContact CE1-OE1 3.14Å; H258-E430 IonicContact CG-OE1 3.61Å; H258-E430 PolarHBondContact N-OE2 2.97Å; H258-E430 VanDerWaalsContact N-OE2 3.09Å; H258-E430 IonicContact ND1-OE1 2.84Å; H258-E430 PolarHBondContact ND1-OE1 3.1Å; H258-E430 IonicContact ND1-OE2 3.96Å
259	N	98.2	Very high	97.7	Very high	22 Å²	22	25.9 Å²	25.9	12%	0.118	13%	0.127	C	C	.	.	S	Bend	trans	-130.9	-179	-176.6	63.8	50.6	0	0	0	111.9	R253 N255 P256 F257 R261 H262 C263	R253-N259 WeakPolarHBondContact O-CA 3.46Å; R253-N259 WeakPolarHBondContact O-CB 3.48Å; N255-N259 WeakPolarHBondContact O-CB 3.39Å; N255-N259 PolarHBondContact O-ND2 3.34Å; P256-N259 PolarHBondContact O-ND2 3.32Å; P256-N259 VanDerWaalsContact O-ND2 3.12Å; F257-N259 VanDerWaalsContact C-N 3.28Å; F257-N259 PolarHBondContact O-N 3.41Å; F257-N259 PolarHBondContact O-ND2 3.4Å; N259-R261 PolarHBondContact O-N 3.08Å; N259-R261 WeakPolarHBondContact OD1-CA 3.4Å; N259-R261 VanDerWaalsContact OD1-CB 3.23Å; N259-R261 WeakPolarHBondContact OD1-CB 3.4Å; N259-R261 PolarHBondContact OD1-N 3.21Å; N259-H262 WeakPolarHBondContact O-CB 3.25Å; N259-H262 PolarHBondContact O-N 3.09Å; N259-H262 VanDerWaalsContact O-N 3.13Å; N259-H262 PolarHBondContact OD1-N 2.89Å; N259-C263 PolarHBondContact O-N 3.24Å; N259-C263 VanDerWaalsContact O-N 3.12Å
260	F	98.3	Very high	97.9	Very high	15 Å²	15	23.5 Å²	23.5	7%	0.066	12%	0.116	C	C	.	.	H	α-helix	trans	-61.4	-27.4	-177.5	-176.3	-114.4	0	0	0	113.8	M217 L218 L221 I248 Q249 Y252 C263 F264	M217-F260 HydrophobicContact CB-CE1 4.11Å; M217-F260 HydrophobicContact CE-CD1 3.83Å; M217-F260 HydrophobicContact CE-CE1 4.12Å; L218-F260 HydrophobicContact CD2-CE1 4.35Å; L218-F260 HydrophobicContact CD2-CZ 3.78Å; L218-F260 HydrophobicContact CG-CE1 4.49Å; L218-F260 HydrophobicContact CG-CZ 4.36Å; L221-F260 HydrophobicContact CD1-CE2 4.26Å; L221-F260 HydrophobicContact CD1-CZ 3.87Å; I248-F260 HydrophobicContact CG2-CE2 4.18Å; Q249-F260 HydrophobicContact CB-CD1 4.29Å; Q249-F260 HydrophobicContact CB-CD2 3.97Å; Q249-F260 HydrophobicContact CB-CE1 4.19Å; Q249-F260 HydrophobicContact CB-CE2 3.87Å; Q249-F260 HydrophobicContact CB-CG 4.17Å; Q249-F260 HydrophobicContact CB-CZ 3.98Å; Q249-F260 HydrophobicContact CG-CB 4.47Å; Q249-F260 HydrophobicContact CG-CD1 3.74Å; Q249-F260 HydrophobicContact CG-CD2 4.2Å; Q249-F260 HydrophobicContact CG-CE1 3.94Å; Q249-F260 HydrophobicContact CG-CE2 4.38Å; Q249-F260 HydrophobicContact CG-CG 3.87Å; Q249-F260 HydrophobicContact CG-CZ 4.26Å; Y252-F260 HydrophobicContact CD2-CB 4.42Å; Y252-F260 AromaticContact CD2-CD2 3.8Å; Y252-F260 HydrophobicContact CD2-CD2 3.8Å; Y252-F260 HydrophobicContact CE2-CD2 4.39Å; Y252-F260 HydrophobicContact CG-CB 4.16Å; Y252-F260 HydrophobicContact CG-CD2 4.38Å; F260-C263 HydrophobicContact CD2-CB 4.46Å; F260-C263 WeakPolarHBondContact O-CB 3.33Å; F260-F264 PolarHBondContact O-N 3.44Å
261	R	98.5	Very high	98.1	Very high	47 Å²	47	22.5 Å²	22.5	18%	0.177	11%	0.108	C	C	.	.	H	α-helix	trans	-71.8	-37.7	177.6	-169.5	-179.5	-66.1	-72.9	-2	111.2	I209 W212 M217 N259 F264 C265 W423	I209-R261 HydrophobicContact CD1-CG 4.27Å; I209-R261 HydrophobicContact CG1-CG 3.37Å; I209-R261 HydrophobicContact CG2-CG 4.34Å; I209-R261 PolarHBondContact O-NH1 3.01Å; W212-R261 PolarHBondContact O-NH1 3.41Å; W212-R261 PolarHBondContact O-NH2 3.27Å; M217-R261 HydrophobicContact CE-CB 4.4Å; M217-R261 HydrophobicContact SD-CB 4.42Å; M217-R261 HydrophobicContact SD-CG 4.15Å; N259-R261 PolarHBondContact O-N 3.08Å; N259-R261 WeakPolarHBondContact OD1-CA 3.4Å; N259-R261 VanDerWaalsContact OD1-CB 3.23Å; N259-R261 WeakPolarHBondContact OD1-CB 3.4Å; N259-R261 PolarHBondContact OD1-N 3.21Å; R261-F264 PolarHBondContact O-N 3.43Å; R261-C265 PolarHBondContact O-N 3.5Å; R261-C265 PolarHBondContact O-SG 2.61Å; R261-W423 HydrophobicContact CB-CH2 4.02Å; R261-W423 HydrophobicContact CB-CZ2 4.39Å; R261-W423 HydrophobicContact CG-CH2 4.02Å; R261-W423 HydrophobicContact CG-CZ2 3.9Å
262	H	98.7	Very high	98.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.5	-49.1	172.5	173.5	57.4	0	0	0	110.3	F257 N259 F264 C265 V266 H298 D299 D409 W423	F257-H262 AromaticContact CE1-CE1 3.88Å; F257-H262 AromaticContact CE1-ND1 3.98Å; F257-H262 VanDerWaalsContact O-CB 3.29Å; F257-H262 WeakPolarHBondContact O-CB 3.32Å; N259-H262 WeakPolarHBondContact O-CB 3.25Å; N259-H262 PolarHBondContact O-N 3.09Å; N259-H262 VanDerWaalsContact O-N 3.13Å; N259-H262 PolarHBondContact OD1-N 2.89Å; H262-F264 VanDerWaalsContact C-N 3.28Å; H262-F264 PolarHBondContact O-N 2.85Å; H262-C265 WeakPolarHBondContact O-CA 3.33Å; H262-C265 WeakPolarHBondContact O-CB 3.35Å; H262-C265 PolarHBondContact O-N 3.21Å; H262-V266 WeakPolarHBondContact O-CG2 3.25Å; H262-V266 PolarHBondContact O-N 2.9Å; H262-H298 AromaticContact CD2-CE1 4Å; H262-H298 AromaticContact CD2-NE2 3.86Å; H262-H298 AromaticContact NE2-CE1 3.77Å; H262-H298 AromaticContact NE2-NE2 3.32Å; H262-H298 PolarHBondContact NE2-NE2 2.64Å; H262-D299 IonicContact CD2-OD2 2.73Å; H262-D299 PolarHBondContact CD2-OD2 3.28Å; H262-D299 IonicContact NE2-OD2 2.92Å; H262-D299 PolarHBondContact NE2-OD2 2.77Å; H262-D409 PolarHBondContact CE1-O 3.46Å; H262-D409 IonicContact CE1-OD1 2.98Å; H262-D409 IonicContact NE2-OD1 3.28Å; H262-D409 PolarHBondContact NE2-OD1 3.09Å; H262-W423 HydrophobicContact CB-CH2 3.83Å; H262-W423 HydrophobicContact CB-CZ3 4.05Å
263	C	98.7	Very high	98.3	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-47	-49.6	171.2	164.8	0	0	0	0	113	Y252 N259 F260 C265 V266 A267 V296	Y252-C263 HydrophobicContact CD1-CB 4.29Å; Y252-C263 HydrophobicContact CD2-CB 4.26Å; Y252-C263 HydrophobicContact CE1-CB 3.67Å; Y252-C263 HydrophobicContact CE2-CB 3.64Å; Y252-C263 WeakPolarHBondContact CE2-SG 3.34Å; Y252-C263 VanDerWaalsContact CZ-SG 3.59Å; Y252-C263 WeakPolarHBondContact OH-CB 3.47Å; Y252-C263 PolarHBondContact OH-SG 3.23Å; N259-C263 PolarHBondContact O-N 3.24Å; N259-C263 VanDerWaalsContact O-N 3.12Å; F260-C263 HydrophobicContact CD2-CB 4.46Å; F260-C263 WeakPolarHBondContact O-CB 3.33Å; C263-C265 VanDerWaalsContact C-N 3.35Å; C263-C265 PolarHBondContact O-N 2.99Å; C263-V266 PolarHBondContact O-N 3.06Å; C263-A267 PolarHBondContact O-N 3.35Å; C263-V296 PolarHBondContact SG-O 3.08Å
264	F	98.8	Very high	98.4	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-60.2	-43.8	176.6	-179.6	-82.7	0	0	0	112	L202 F207 I209 M217 L220 L221 M224 F260 R261 H262 V266 A267 Q268	L202-F264 HydrophobicContact CD1-CZ 3.94Å; F207-F264 HydrophobicContact CD1-CE1 4.19Å; F207-F264 AromaticContact CE1-CE1 3.53Å; F207-F264 HydrophobicContact CE1-CE1 3.53Å; F207-F264 HydrophobicContact CE1-CZ 4.16Å; F207-F264 HydrophobicContact CZ-CE1 4.1Å; F207-F264 HydrophobicContact CZ-CZ 4.27Å; I209-F264 HydrophobicContact CD1-CD1 3.17Å; I209-F264 HydrophobicContact CD1-CE1 3.52Å; I209-F264 HydrophobicContact CD1-CG 3.98Å; I209-F264 HydrophobicContact CG1-CD1 4.18Å; M217-F264 HydrophobicContact CB-CD2 3.65Å; M217-F264 HydrophobicContact CB-CE2 4.04Å; M217-F264 HydrophobicContact CB-CG 4.19Å; M217-F264 HydrophobicContact CG-CD2 3.99Å; M217-F264 HydrophobicContact CG-CE2 4.35Å; M217-F264 HydrophobicContact CG-CG 4.08Å; M217-F264 WeakPolarHBondContact O-CE2 3.35Å; M217-F264 HydrophobicContact SD-CB 3.85Å; M217-F264 HydrophobicContact SD-CD1 4.4Å; M217-F264 HydrophobicContact SD-CD2 4.37Å; M217-F264 HydrophobicContact SD-CG 3.93Å; L220-F264 HydrophobicContact CB-CE2 3.66Å; L220-F264 HydrophobicContact CB-CZ 3.82Å; L220-F264 HydrophobicContact CD1-CE2 4.16Å; L220-F264 HydrophobicContact CD1-CZ 3.66Å; L220-F264 HydrophobicContact CG-CZ 4.41Å; L221-F264 HydrophobicContact CD1-CD2 4.17Å; L221-F264 HydrophobicContact CD2-CD2 4Å; L221-F264 HydrophobicContact CD2-CE2 4.26Å; L221-F264 HydrophobicContact CG-CD2 3.78Å; L221-F264 HydrophobicContact CG-CE2 4.01Å; M224-F264 HydrophobicContact CE-CE2 4.01Å; M224-F264 HydrophobicContact CE-CZ 3.86Å; F260-F264 PolarHBondContact O-N 3.44Å; R261-F264 PolarHBondContact O-N 3.43Å; H262-F264 VanDerWaalsContact C-N 3.28Å; H262-F264 PolarHBondContact O-N 2.85Å; F264-V266 VanDerWaalsContact C-N 3.31Å; F264-V266 PolarHBondContact O-N 3.36Å; F264-A267 PolarHBondContact O-N 3.02Å; F264-Q268 HydrophobicContact CD1-CB 4.17Å; F264-Q268 HydrophobicContact CE1-CB 3.76Å; F264-Q268 HydrophobicContact CE1-CG 4.08Å; F264-Q268 HydrophobicContact CZ-CB 4.28Å; F264-Q268 VanDerWaalsContact O-CB 3.23Å; F264-Q268 WeakPolarHBondContact O-CB 3.36Å; F264-Q268 PolarHBondContact O-N 3.25Å
265	C	98.7	Very high	98.5	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-60.2	-40.9	179.3	-69.7	0	0	0	0	112.3	R261 H262 C263 M269 R415	R261-C265 PolarHBondContact O-N 3.5Å; R261-C265 PolarHBondContact O-SG 2.61Å; H262-C265 WeakPolarHBondContact O-CA 3.33Å; H262-C265 WeakPolarHBondContact O-CB 3.35Å; H262-C265 PolarHBondContact O-N 3.21Å; C263-C265 VanDerWaalsContact C-N 3.35Å; C263-C265 PolarHBondContact O-N 2.99Å; C265-M269 VanDerWaalsContact O-CB 3.3Å; C265-M269 WeakPolarHBondContact O-CB 3.12Å; C265-M269 PolarHBondContact O-N 3.03Å; C265-R415 PolarHBondContact O-NH2 3.35Å; C265-R415 VanDerWaalsContact O-NH2 3.11Å
266	V	98.9	Very high	98.5	Very high	1 Å²	1	12.9 Å²	12.9	1%	0.006	6%	0.061	C	C	.	.	H	α-helix	trans	-65.9	-46.4	177	-178	0	0	0	0	110.6	H262 C263 F264 M269 M270 A295 H298 C408	H262-V266 WeakPolarHBondContact O-CG2 3.25Å; H262-V266 PolarHBondContact O-N 2.9Å; C263-V266 PolarHBondContact O-N 3.06Å; F264-V266 VanDerWaalsContact C-N 3.31Å; F264-V266 PolarHBondContact O-N 3.36Å; V266-M269 PolarHBondContact O-N 2.77Å; V266-M270 WeakPolarHBondContact O-CB 3.45Å; V266-M270 PolarHBondContact O-N 2.68Å; V266-A295 HydrophobicContact CG1-CB 3.99Å; V266-H298 VanDerWaalsContact CG2-CE1 3.48Å; V266-H298 WeakPolarHBondContact CG2-CE1 3.37Å; V266-C408 HydrophobicContact CG1-CB 3.78Å
267	A	98.9	Very high	98.5	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-62.5	-43	176.4	0	0	0	0	0	112.5	L221 C263 F264 M270 Y271 L292 A295 V296	L221-A267 HydrophobicContact CD2-CB 3.81Å; C263-A267 PolarHBondContact O-N 3.35Å; F264-A267 PolarHBondContact O-N 3.02Å; A267-M270 PolarHBondContact O-N 3.05Å; A267-Y271 WeakPolarHBondContact O-CB 3.46Å; A267-Y271 PolarHBondContact O-N 3.05Å; A267-L292 HydrophobicContact CB-CD1 4.01Å; A267-A295 HydrophobicContact CB-CB 4.33Å; A267-V296 HydrophobicContact CB-CG2 3.78Å
268	Q	98.7	Very high	98.5	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-65.8	-42	177.4	-177.6	-83	-45.2	0	0	111.8	L202 K204 F207 M224 F264 Y271 G272 R415	L202-Q268 HydrophobicContact CD1-CG 3.77Å; L202-Q268 HydrophobicContact CG-CG 4.41Å; L202-Q268 PolarHBondContact O-NE2 2.94Å; K204-Q268 PolarHBondContact O-NE2 3.11Å; F207-Q268 HydrophobicContact CB-CG 4.29Å; F207-Q268 HydrophobicContact CD1-CG 4.03Å; F207-Q268 HydrophobicContact CG-CG 4.06Å; M224-Q268 HydrophobicContact CE-CB 3.79Å; M224-Q268 HydrophobicContact CE-CG 4.09Å; F264-Q268 HydrophobicContact CD1-CB 4.17Å; F264-Q268 HydrophobicContact CE1-CB 3.76Å; F264-Q268 HydrophobicContact CE1-CG 4.08Å; F264-Q268 HydrophobicContact CZ-CB 4.28Å; F264-Q268 VanDerWaalsContact O-CB 3.23Å; F264-Q268 WeakPolarHBondContact O-CB 3.36Å; F264-Q268 PolarHBondContact O-N 3.25Å; Q268-Y271 PolarHBondContact O-N 2.88Å; Q268-G272 PolarHBondContact O-N 3.2Å; Q268-R415 VanDerWaalsContact OE1-CZ 3.3Å
269	M	98.8	Very high	98.5	Very high	1 Å²	1	10.6 Å²	10.6	1%	0.005	6%	0.055	C	C	.	.	H	α-helix	trans	-64.9	-42.1	176.6	-175.5	62.4	63.4	0	0	111.1	P205 C265 V266 Y271 G272 I273 C408 S411 R415 M486	P205-M269 HydrophobicContact CB-CE 3.95Å; P205-M269 HydrophobicContact CB-SD 4.23Å; C265-M269 VanDerWaalsContact O-CB 3.3Å; C265-M269 WeakPolarHBondContact O-CB 3.12Å; C265-M269 PolarHBondContact O-N 3.03Å; V266-M269 PolarHBondContact O-N 2.77Å; M269-Y271 PolarHBondContact O-N 2.92Å; M269-G272 PolarHBondContact O-N 2.99Å; M269-I273 HydrophobicContact CG-CD1 3.93Å; M269-I273 HydrophobicContact CG-CG1 4.39Å; M269-I273 WeakPolarHBondContact O-CG1 3.31Å; M269-I273 PolarHBondContact O-N 3.23Å; M269-I273 HydrophobicContact SD-CD1 4.18Å; M269-I273 HydrophobicContact SD-CG1 4.21Å; M269-C408 HydrophobicContact CB-CB 4.16Å; M269-C408 HydrophobicContact CG-CB 4.23Å; M269-S411 WeakPolarHBondContact CG-OG 3.43Å; M269-R415 HydrophobicContact CE-CG 4.49Å; M269-M486 HydrophobicContact SD-CE 3.86Å; M269-M486 HydrophobicContact SD-SD 4.34Å
270	M	98.9	Very high	98.4	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-56.8	-51.6	173.9	179.1	63.2	71.9	0	0	110.4	V266 A267 G272 I273 L274 L291 A295 L404 I405 C408	V266-M270 WeakPolarHBondContact O-CB 3.45Å; V266-M270 PolarHBondContact O-N 2.68Å; A267-M270 PolarHBondContact O-N 3.05Å; M270-G272 PolarHBondContact O-N 3.02Å; M270-I273 PolarHBondContact O-N 2.92Å; M270-L274 HydrophobicContact CG-CD1 4.04Å; M270-L274 HydrophobicContact CG-CG 4.49Å; M270-L274 WeakPolarHBondContact O-CB 3.38Å; M270-L274 WeakPolarHBondContact O-CG 3.28Å; M270-L274 PolarHBondContact O-N 2.91Å; M270-L274 HydrophobicContact SD-CD1 4.39Å; M270-L274 HydrophobicContact SD-CG 4.35Å; M270-L291 HydrophobicContact CE-CB 4.36Å; M270-L291 HydrophobicContact CE-CD2 3.82Å; M270-L291 HydrophobicContact CG-CB 4.26Å; M270-L291 HydrophobicContact SD-CB 4.02Å; M270-L291 HydrophobicContact SD-CD1 4.44Å; M270-L291 HydrophobicContact SD-CD2 4.03Å; M270-L291 HydrophobicContact SD-CG 4.41Å; M270-A295 HydrophobicContact CB-CB 4.39Å; M270-L404 HydrophobicContact CE-CB 4.15Å; M270-L404 HydrophobicContact SD-CB 4.41Å; M270-I405 HydrophobicContact CE-CB 3.99Å; M270-I405 HydrophobicContact CE-CG1 4.44Å; M270-C408 WeakPolarHBondContact CA-SG 3.3Å; M270-C408 HydrophobicContact CB-CB 4.49Å; M270-C408 PolarHBondContact N-SG 3.21Å
271	Y	98.8	Very high	98.4	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-57.5	-45	176.3	171.1	-99.2	0	0	0	112.4	L202 K203 M224 E227 L228 A267 Q268 M269 L274 Y275	L202-Y271 HydrophobicContact CB-CE1 4.02Å; L202-Y271 HydrophobicContact CD2-CD1 4.34Å; L202-Y271 HydrophobicContact CD2-CE1 3.77Å; L202-Y271 HydrophobicContact CG-CD1 4.04Å; L202-Y271 HydrophobicContact CG-CE1 3.69Å; L202-Y271 WeakPolarHBondContact O-CD1 3.14Å; K203-Y271 HydrophobicContact CB-CE1 4.37Å; K203-Y271 HydrophobicContact CD-CE1 4.46Å; K203-Y271 WeakPolarHBondContact CE-OH 3.49Å; K203-Y271 HydrophobicContact CG-CD1 4.2Å; K203-Y271 HydrophobicContact CG-CE1 3.38Å; M224-Y271 HydrophobicContact CB-CD2 3.95Å; M224-Y271 HydrophobicContact CB-CE2 4.22Å; M224-Y271 HydrophobicContact CB-CG 4.41Å; M224-Y271 HydrophobicContact CE-CD1 4.47Å; M224-Y271 HydrophobicContact CG-CD1 4.1Å; M224-Y271 HydrophobicContact CG-CD2 3.75Å; M224-Y271 HydrophobicContact CG-CE1 4.34Å; M224-Y271 HydrophobicContact CG-CE2 4.02Å; M224-Y271 HydrophobicContact CG-CG 3.78Å; M224-Y271 HydrophobicContact SD-CD1 4.45Å; M224-Y271 HydrophobicContact SD-CG 4.09Å; E227-Y271 WeakPolarHBondContact OE2-CE2 3.32Å; E227-Y271 VanDerWaalsContact OE2-CZ 3.27Å; E227-Y271 PolarHBondContact OE2-OH 2.93Å; L228-Y271 HydrophobicContact CD1-CD2 4.12Å; L228-Y271 HydrophobicContact CD2-CD2 4.28Å; L228-Y271 HydrophobicContact CG-CD2 4.05Å; L228-Y271 HydrophobicContact CG-CE2 4.34Å; A267-Y271 WeakPolarHBondContact O-CB 3.46Å; A267-Y271 PolarHBondContact O-N 3.05Å; Q268-Y271 PolarHBondContact O-N 2.88Å; M269-Y271 PolarHBondContact O-N 2.92Å; Y271-L274 WeakPolarHBondContact O-CB 3.35Å; Y271-L274 PolarHBondContact O-N 3.33Å; Y271-Y275 HydrophobicContact CD2-CD2 4.12Å; Y271-Y275 AromaticContact CD2-CE2 3.75Å; Y271-Y275 HydrophobicContact CD2-CE2 3.75Å; Y271-Y275 AromaticContact CE2-CD2 3.91Å; Y271-Y275 HydrophobicContact CE2-CD2 3.91Å; Y271-Y275 AromaticContact CE2-CE2 3.3Å; Y271-Y275 HydrophobicContact CE2-CE2 3.3Å; Y271-Y275 AromaticContact CZ-CE2 3.85Å; Y271-Y275 WeakPolarHBondContact O-CD2 3.45Å; Y271-Y275 PolarHBondContact O-N 3.29Å
272	G	98.5	Very high	98.3	Very high	1 Å²	1	17 Å²	17	1%	0.01	9%	0.094	C	C	.	.	H	α-helix	trans	-60.5	-50.2	176.1	0	0	0	0	0	113.2	K203 Q268 M269 M270 L274 Y275 L276	K203-G272 WeakPolarHBondContact O-CA 3.35Å; Q268-G272 PolarHBondContact O-N 3.2Å; M269-G272 PolarHBondContact O-N 2.99Å; M270-G272 PolarHBondContact O-N 3.02Å; G272-L274 VanDerWaalsContact C-N 3.26Å; G272-L274 PolarHBondContact O-N 3.01Å; G272-Y275 PolarHBondContact O-N 3.45Å; G272-L276 WeakPolarHBondContact O-CB 3.5Å; G272-L276 VanDerWaalsContact O-CG 3.26Å; G272-L276 WeakPolarHBondContact O-CG 3.5Å; G272-L276 PolarHBondContact O-N 2.93Å
273	I	98.6	Very high	98.3	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-59.9	-39.4	177.8	-69.3	172.6	0	0	0	110.9	M269 M270 Y275 L276 C277 L279 L404 I482 M486	M269-I273 HydrophobicContact CG-CD1 3.93Å; M269-I273 HydrophobicContact CG-CG1 4.39Å; M269-I273 WeakPolarHBondContact O-CG1 3.31Å; M269-I273 PolarHBondContact O-N 3.23Å; M269-I273 HydrophobicContact SD-CD1 4.18Å; M269-I273 HydrophobicContact SD-CG1 4.21Å; M270-I273 PolarHBondContact O-N 2.92Å; I273-Y275 VanDerWaalsContact C-N 3.3Å; I273-Y275 PolarHBondContact O-N 3.02Å; I273-L276 PolarHBondContact O-N 3.36Å; I273-C277 WeakPolarHBondContact O-CB 3.41Å; I273-C277 PolarHBondContact O-N 3.29Å; I273-L279 HydrophobicContact CG2-CD1 4.36Å; I273-L404 HydrophobicContact CG2-CD2 3.8Å; I273-I482 HydrophobicContact CG1-CD1 4.42Å; I273-I482 HydrophobicContact CG2-CD1 4.47Å; I273-M486 HydrophobicContact CD1-CE 4.19Å; I273-M486 HydrophobicContact CD1-SD 4.28Å; I273-M486 HydrophobicContact CG1-CE 3.53Å; I273-M486 HydrophobicContact CG1-SD 4.23Å
274	L	98.7	Very high	98.2	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-58.3	-41.8	178.8	-74.2	169.9	0	0	0	112.5	L228 M270 Y271 G272 G278 L279 N280 F283 L288 L291	L228-L274 HydrophobicContact CD1-CD1 4.11Å; L228-L274 HydrophobicContact CD2-CD1 4.36Å; M270-L274 HydrophobicContact CG-CD1 4.04Å; M270-L274 HydrophobicContact CG-CG 4.49Å; M270-L274 WeakPolarHBondContact O-CB 3.38Å; M270-L274 WeakPolarHBondContact O-CG 3.28Å; M270-L274 PolarHBondContact O-N 2.91Å; M270-L274 HydrophobicContact SD-CD1 4.39Å; M270-L274 HydrophobicContact SD-CG 4.35Å; Y271-L274 WeakPolarHBondContact O-CB 3.35Å; Y271-L274 PolarHBondContact O-N 3.33Å; G272-L274 VanDerWaalsContact C-N 3.26Å; G272-L274 PolarHBondContact O-N 3.01Å; L274-G278 CarbonylContact O-C 3.54Å; L274-G278 PolarHBondContact O-N 3.35Å; L274-L279 HydrophobicContact CD2-CB 3.74Å; L274-L279 HydrophobicContact CD2-CD1 4.41Å; L274-L279 WeakPolarHBondContact O-CA 3.44Å; L274-L279 PolarHBondContact O-N 3.2Å; L274-N280 PolarHBondContact O-N 3.22Å; L274-N280 PolarHBondContact O-OD1 3.41Å; L274-F283 HydrophobicContact CD2-CD2 3.62Å; L274-F283 HydrophobicContact CD2-CE2 3.93Å; L274-L288 HydrophobicContact CD1-CD2 3.77Å; L274-L288 HydrophobicContact CD2-CD2 3.61Å; L274-L288 HydrophobicContact CG-CD2 4.21Å; L274-L291 HydrophobicContact CD2-CD1 4.12Å
275	Y	98.3	Very high	98.2	Very high	55 Å²	55	24.5 Å²	24.5	22%	0.216	13%	0.131	C	C	.	.	H	α-helix	trans	-79.5	-41.6	177.3	-80.7	-87.4	0	0	0	113	K203 E227 L228 Y271 G272 I273 C277 G278 N280	K203-Y275 HydrophobicContact CD-CD1 4.15Å; K203-Y275 HydrophobicContact CD-CD2 4.22Å; K203-Y275 HydrophobicContact CD-CG 3.94Å; K203-Y275 HydrophobicContact CG-CD2 4.18Å; K203-Y275 HydrophobicContact CG-CG 4.23Å; E227-Y275 WeakPolarHBondContact CG-OH 3.48Å; E227-Y275 PolarHBondContact OE2-OH 3.15Å; E227-Y275 VanDerWaalsContact OE2-OH 3.11Å; L228-Y275 HydrophobicContact CD2-CE2 3.62Å; L228-Y275 HydrophobicContact CG-CE2 4.49Å; Y271-Y275 HydrophobicContact CD2-CD2 4.12Å; Y271-Y275 AromaticContact CD2-CE2 3.75Å; Y271-Y275 HydrophobicContact CD2-CE2 3.75Å; Y271-Y275 AromaticContact CE2-CD2 3.91Å; Y271-Y275 HydrophobicContact CE2-CD2 3.91Å; Y271-Y275 AromaticContact CE2-CE2 3.3Å; Y271-Y275 HydrophobicContact CE2-CE2 3.3Å; Y271-Y275 AromaticContact CZ-CE2 3.85Å; Y271-Y275 WeakPolarHBondContact O-CD2 3.45Å; Y271-Y275 PolarHBondContact O-N 3.29Å; G272-Y275 PolarHBondContact O-N 3.45Å; I273-Y275 VanDerWaalsContact C-N 3.3Å; I273-Y275 PolarHBondContact O-N 3.02Å; Y275-C277 VanDerWaalsContact C-N 3.3Å; Y275-C277 PolarHBondContact O-N 3.1Å; Y275-G278 PolarHBondContact O-N 3.35Å; Y275-G278 VanDerWaalsContact O-N 3.13Å; Y275-N280 HydrophobicContact CD1-CB 4.43Å; Y275-N280 HydrophobicContact CE1-CB 4.33Å; Y275-N280 HydrophobicContact CE2-CB 4.5Å
276	L	97.4	Very high	98.2	Very high	44 Å²	44	25.8 Å²	25.8	23%	0.23	14%	0.137	C	C	.	.	H	α-helix	trans	-60.8	-40.2	-179.1	-72.7	171	0	0	0	112.2	G272 I273 G278 I481 L485 M486	G272-L276 WeakPolarHBondContact O-CB 3.5Å; G272-L276 VanDerWaalsContact O-CG 3.26Å; G272-L276 WeakPolarHBondContact O-CG 3.5Å; G272-L276 PolarHBondContact O-N 2.93Å; I273-L276 PolarHBondContact O-N 3.36Å; L276-G278 VanDerWaalsContact C-N 3.34Å; L276-I481 HydrophobicContact CD2-CD1 4.42Å; L276-L485 HydrophobicContact CD1-CD1 4.13Å; L276-L485 HydrophobicContact CD2-CD1 3.73Å; L276-L485 HydrophobicContact CG-CD1 4.49Å; L276-M486 HydrophobicContact CD1-CE 3.92Å
277	C	97.7	Very high	98.2	Very high	13 Å²	13	27 Å²	27	9%	0.088	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-0.9	179.3	-64.5	0	0	0	0	113.4	I273 Y275 L279 Y479	I273-C277 WeakPolarHBondContact O-CB 3.41Å; I273-C277 PolarHBondContact O-N 3.29Å; Y275-C277 VanDerWaalsContact C-N 3.3Å; Y275-C277 PolarHBondContact O-N 3.1Å; C277-L279 HydrophobicContact CB-CD1 3.7Å; C277-L279 HydrophobicContact CB-CG 3.7Å; C277-L279 PolarHBondContact O-N 3.49Å; C277-Y479 HydrophobicContact CB-CD1 3.61Å; C277-Y479 HydrophobicContact CB-CD2 4.19Å; C277-Y479 HydrophobicContact CB-CE1 4Å; C277-Y479 HydrophobicContact CB-CG 3.72Å; C277-Y479 WeakPolarHBondContact O-CD1 3.48Å; C277-Y479 WeakPolarHBondContact O-CE1 3.45Å; C277-Y479 VanDerWaalsContact SG-CB 3.56Å
278	G	97.8	Very high	98.2	Very high	23 Å²	23	27 Å²	27	24%	0.237	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	68	9.7	-173.3	0	0	0	0	0	114.5	L274 Y275 L276 N280 N281 D282	L274-G278 CarbonylContact O-C 3.54Å; L274-G278 PolarHBondContact O-N 3.35Å; Y275-G278 PolarHBondContact O-N 3.35Å; Y275-G278 VanDerWaalsContact O-N 3.13Å; L276-G278 VanDerWaalsContact C-N 3.34Å; G278-N280 WeakPolarHBondContact CA-OD1 3.18Å; G278-N280 PolarHBondContact O-N 2.85Å; G278-N281 WeakPolarHBondContact O-CB 3.46Å; G278-N281 PolarHBondContact O-N 3.11Å; G278-D282 PolarHBondContact O-N 3.05Å
279	L	98	Very high	98.2	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64	-21.3	-179.8	-70.9	167.7	0	0	0	112.9	I273 L274 C277 N281 D282 F283 M391 F400 L404 Y479	I273-L279 HydrophobicContact CG2-CD1 4.36Å; L274-L279 HydrophobicContact CD2-CB 3.74Å; L274-L279 HydrophobicContact CD2-CD1 4.41Å; L274-L279 WeakPolarHBondContact O-CA 3.44Å; L274-L279 PolarHBondContact O-N 3.2Å; C277-L279 HydrophobicContact CB-CD1 3.7Å; C277-L279 HydrophobicContact CB-CG 3.7Å; C277-L279 PolarHBondContact O-N 3.49Å; L279-N281 PolarHBondContact O-N 2.84Å; L279-D282 HydrophobicContact CD2-CB 4.41Å; L279-D282 PolarHBondContact O-N 3.44Å; L279-F283 HydrophobicContact CB-CD2 3.82Å; L279-F283 HydrophobicContact CB-CE2 3.91Å; L279-F283 HydrophobicContact CD1-CE2 4.04Å; L279-F283 HydrophobicContact CD2-CD2 4.22Å; L279-F283 HydrophobicContact CD2-CE2 3.7Å; L279-F283 HydrophobicContact CD2-CZ 3.99Å; L279-F283 HydrophobicContact CG-CD2 4.49Å; L279-F283 HydrophobicContact CG-CE2 4.11Å; L279-F283 WeakPolarHBondContact O-CB 3.35Å; L279-F283 PolarHBondContact O-N 2.97Å; L279-M391 HydrophobicContact CD2-CE 4.01Å; L279-F400 HydrophobicContact CD1-CE1 3.99Å; L279-F400 HydrophobicContact CD1-CZ 4.49Å; L279-F400 HydrophobicContact CD2-CE1 4.05Å; L279-L404 HydrophobicContact CD1-CD1 4.02Å; L279-L404 HydrophobicContact CD1-CD2 4.47Å; L279-Y479 HydrophobicContact CD1-CE2 4.44Å; L279-Y479 HydrophobicContact CD2-CE1 4.42Å; L279-Y479 HydrophobicContact CD2-CE2 3.87Å; L279-Y479 WeakPolarHBondContact CD2-OH 3.25Å; L279-Y479 HydrophobicContact CG-CE2 4.32Å
280	N	97.7	Very high	98.2	Very high	23 Å²	23	27.4 Å²	27.4	12%	0.123	14%	0.144	C	C	.	.	H	α-helix	trans	-60.3	-19.2	169.9	69	-64.8	0	0	0	113	L228 L274 Y275 G278 R285	L228-N280 HydrophobicContact CD2-CB 4.4Å; L274-N280 PolarHBondContact O-N 3.22Å; L274-N280 PolarHBondContact O-OD1 3.41Å; Y275-N280 HydrophobicContact CD1-CB 4.43Å; Y275-N280 HydrophobicContact CE1-CB 4.33Å; Y275-N280 HydrophobicContact CE2-CB 4.5Å; G278-N280 WeakPolarHBondContact CA-OD1 3.18Å; G278-N280 PolarHBondContact O-N 2.85Å; N280-R285 PolarHBondContact O-NH1 3.23Å
281	N	97.3	Very high	98.2	Very high	119 Å²	119	27.4 Å²	27.4	64%	0.636	14%	0.144	S	C	*	.	H	α-helix	trans	-98	-30.1	172.2	-58.5	-50.4	0	0	0	112.6	G278 L279	G278-N281 WeakPolarHBondContact O-CB 3.46Å; G278-N281 PolarHBondContact O-N 3.11Å; L279-N281 PolarHBondContact O-N 2.84Å
282	D	96.4	Very high	98.2	Very high	77 Å²	77	27.4 Å²	27.4	41%	0.412	14%	0.144	S	C	.	.	H	α-helix	trans	-82.9	-30.7	-177.4	-64.5	-19.7	0	0	0	113.6	G278 L279 R397 Y479	G278-D282 PolarHBondContact O-N 3.05Å; L279-D282 HydrophobicContact CD2-CB 4.41Å; L279-D282 PolarHBondContact O-N 3.44Å; D282-R397 PolarHBondContact O-NH1 2.71Å; D282-R397 PolarHBondContact O-NH2 2.99Å; D282-Y479 PolarHBondContact OD2-OH 3.24Å
283	F	98.1	Very high	98.2	Very high	5 Å²	5	27.3 Å²	27.3	2%	0.022	14%	0.144	C	C	.	.	S	Bend	trans	-85.6	139.3	174.8	-70.4	-49.1	0	0	0	111.7	L274 L279 E287 L288 L291 M391 R397 F400 K401 L404	L274-F283 HydrophobicContact CD2-CD2 3.62Å; L274-F283 HydrophobicContact CD2-CE2 3.93Å; L279-F283 HydrophobicContact CB-CD2 3.82Å; L279-F283 HydrophobicContact CB-CE2 3.91Å; L279-F283 HydrophobicContact CD1-CE2 4.04Å; L279-F283 HydrophobicContact CD2-CD2 4.22Å; L279-F283 HydrophobicContact CD2-CE2 3.7Å; L279-F283 HydrophobicContact CD2-CZ 3.99Å; L279-F283 HydrophobicContact CG-CD2 4.49Å; L279-F283 HydrophobicContact CG-CE2 4.11Å; L279-F283 WeakPolarHBondContact O-CB 3.35Å; L279-F283 PolarHBondContact O-N 2.97Å; F283-E287 HydrophobicContact CB-CB 4.12Å; F283-E287 HydrophobicContact CD1-CB 4.36Å; F283-E287 HydrophobicContact CG-CB 4.45Å; F283-L288 HydrophobicContact CB-CD2 3.7Å; F283-L288 HydrophobicContact CB-CG 3.83Å; F283-L288 HydrophobicContact CD2-CD2 4.16Å; F283-L288 HydrophobicContact CG-CD2 4.42Å; F283-L291 HydrophobicContact CD2-CD1 3.8Å; F283-L291 HydrophobicContact CE2-CD1 3.77Å; F283-L291 HydrophobicContact CG-CD1 4.43Å; F283-L291 HydrophobicContact CZ-CD1 4.44Å; F283-M391 HydrophobicContact CE1-SD 4.11Å; F283-M391 HydrophobicContact CZ-SD 4.44Å; F283-R397 VanDerWaalsContact CD1-NH2 3.35Å; F283-R397 HydrophobicContact CE1-CG 3.99Å; F283-F400 HydrophobicContact CZ-CD1 4.16Å; F283-F400 HydrophobicContact CZ-CE1 4.46Å; F283-K401 HydrophobicContact CE1-CD 4.13Å; F283-K401 HydrophobicContact CE1-CG 4.02Å; F283-K401 HydrophobicContact CZ-CD 4.4Å; F283-K401 HydrophobicContact CZ-CG 3.86Å; F283-L404 HydrophobicContact CE2-CD1 3.9Å; F283-L404 HydrophobicContact CZ-CD1 4.15Å
284	S	98	Very high	98.2	Very high	55 Å²	55	27.3 Å²	27.3	39%	0.385	14%	0.143	S	C	.	.			trans	-63	156.2	169.2	62.6	0	0	0	0	110.2	E286 E287 L288	S284-E286 PolarHBondContact O-N 3.06Å; S284-E287 PolarHBondContact N-OE2 3.22Å; S284-E287 VanDerWaalsContact N-OE2 3.09Å; S284-E287 PolarHBondContact O-N 3.33Å; S284-E287 WeakPolarHBondContact OG-CB 3.48Å; S284-E287 VanDerWaalsContact OG-CG 3.22Å; S284-E287 WeakPolarHBondContact OG-CG 3.41Å; S284-E287 PolarHBondContact OG-N 3.44Å; S284-E287 PolarHBondContact OG-OE2 3.21Å; S284-L288 WeakPolarHBondContact O-CG 3.29Å; S284-L288 PolarHBondContact O-N 3.24Å
285	R	98.4	Very high	98.2	Very high	97 Å²	97	27.3 Å²	27.3	37%	0.366	14%	0.143	S	C	.	.	H	α-helix	trans	-59.8	-34.9	177.1	-57.4	-66.3	170.6	-117.3	4.4	111.8	L228 E233 N280 L288 G289	L228-R285 WeakPolarHBondContact O-CD 3.29Å; E233-R285 HydrophobicContact CB-CB 3.72Å; E233-R285 HydrophobicContact CG-CB 3.6Å; E233-R285 WeakPolarHBondContact OE2-CB 3.33Å; N280-R285 PolarHBondContact O-NH1 3.23Å; R285-L288 VanDerWaalsContact NH1-CD1 3.25Å; R285-L288 PolarHBondContact O-N 3.33Å; R285-G289 PolarHBondContact O-N 3.42Å
286	E	98.5	Very high	98.3	Very high	27 Å²	27	24.7 Å²	24.7	13%	0.126	13%	0.133	C	C	.	.	H	α-helix	trans	-58	-48.2	171.6	-174.7	-179.4	125.4	0	0	111.4	F234 S284 G289 I290 R357	F234-E286 HydrophobicContact CE1-CB 4.27Å; F234-E286 HydrophobicContact CE1-CG 4.08Å; F234-E286 HydrophobicContact CZ-CB 4.31Å; F234-E286 HydrophobicContact CZ-CG 4.11Å; S284-E286 PolarHBondContact O-N 3.06Å; E286-G289 PolarHBondContact O-N 3.42Å; E286-I290 HydrophobicContact CG-CD1 4.09Å; E286-I290 VanDerWaalsContact O-CG1 3.31Å; E286-I290 WeakPolarHBondContact O-CG1 3.1Å; E286-I290 PolarHBondContact O-N 3.33Å; E286-R357 WeakPolarHBondContact OE1-CB 3.24Å; E286-R357 IonicContact OE1-CZ 3.65Å; E286-R357 IonicContact OE1-NE 3.21Å; E286-R357 PolarHBondContact OE1-NE 2.68Å; E286-R357 IonicContact OE1-NH2 3.08Å; E286-R357 IonicContact OE2-CZ 3.81Å; E286-R357 IonicContact OE2-NE 3.34Å; E286-R357 PolarHBondContact OE2-NE 2.93Å; E286-R357 IonicContact OE2-NH2 3.24Å; E286-R357 PolarHBondContact OE2-NH2 3.18Å
287	E	98.6	Very high	98.3	Very high	26 Å²	26	22.6 Å²	22.6	12%	0.121	12%	0.122	C	C	.	.	H	α-helix	trans	-67.5	-39.5	179.9	-72.7	172.1	112.1	0	0	113.4	F283 S284 G289 I290 L291 R397 K401	F283-E287 HydrophobicContact CB-CB 4.12Å; F283-E287 HydrophobicContact CD1-CB 4.36Å; F283-E287 HydrophobicContact CG-CB 4.45Å; S284-E287 PolarHBondContact N-OE2 3.22Å; S284-E287 VanDerWaalsContact N-OE2 3.09Å; S284-E287 PolarHBondContact O-N 3.33Å; S284-E287 WeakPolarHBondContact OG-CB 3.48Å; S284-E287 VanDerWaalsContact OG-CG 3.22Å; S284-E287 WeakPolarHBondContact OG-CG 3.41Å; S284-E287 PolarHBondContact OG-N 3.44Å; S284-E287 PolarHBondContact OG-OE2 3.21Å; E287-G289 VanDerWaalsContact C-N 3.3Å; E287-G289 PolarHBondContact O-N 2.86Å; E287-I290 PolarHBondContact O-N 3.21Å; E287-L291 WeakPolarHBondContact O-CB 3.41Å; E287-L291 WeakPolarHBondContact O-CG 3.49Å; E287-L291 PolarHBondContact O-N 3.33Å; E287-R397 IonicContact OE1-CZ 2.93Å; E287-R397 IonicContact OE1-NE 3.79Å; E287-R397 PolarHBondContact OE1-NE 2.91Å; E287-R397 IonicContact OE1-NH2 3.38Å; E287-R397 IonicContact OE2-CZ 2.77Å; E287-R397 IonicContact OE2-NE 3.45Å; E287-R397 PolarHBondContact OE2-NE 2.98Å; E287-R397 IonicContact OE2-NH2 2.76Å; E287-R397 PolarHBondContact OE2-NH2 3.25Å; E287-K401 IonicContact OE1-NZ 3.75Å; E287-K401 PolarHBondContact OE1-NZ 3.37Å
288	L	98.8	Very high	98.4	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.9	-42.5	173.9	-65.9	172.2	0	0	0	110.8	L228 L274 F283 S284 R285 L291 L292	L228-L288 HydrophobicContact CD2-CD1 4.38Å; L228-L288 HydrophobicContact CD2-CD2 4.44Å; L274-L288 HydrophobicContact CD1-CD2 3.77Å; L274-L288 HydrophobicContact CD2-CD2 3.61Å; L274-L288 HydrophobicContact CG-CD2 4.21Å; F283-L288 HydrophobicContact CB-CD2 3.7Å; F283-L288 HydrophobicContact CB-CG 3.83Å; F283-L288 HydrophobicContact CD2-CD2 4.16Å; F283-L288 HydrophobicContact CG-CD2 4.42Å; S284-L288 WeakPolarHBondContact O-CG 3.29Å; S284-L288 PolarHBondContact O-N 3.24Å; R285-L288 VanDerWaalsContact NH1-CD1 3.25Å; R285-L288 PolarHBondContact O-N 3.33Å; L288-L291 PolarHBondContact O-N 2.84Å; L288-L292 WeakPolarHBondContact O-CB 3.35Å; L288-L292 PolarHBondContact O-N 3.44Å
289	G	98.7	Very high	98.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.1	-40.4	175.1	0	0	0	0	0	113	R285 E286 E287 T293	R285-G289 PolarHBondContact O-N 3.42Å; E286-G289 PolarHBondContact O-N 3.42Å; E287-G289 VanDerWaalsContact C-N 3.3Å; E287-G289 PolarHBondContact O-N 2.86Å; G289-T293 WeakPolarHBondContact O-CB 3.25Å; G289-T293 PolarHBondContact O-N 3.13Å; G289-T293 PolarHBondContact O-OG1 3.1Å
290	I	98.9	Very high	98.5	Very high	9 Å²	9	21.2 Å²	21.2	5%	0.046	11%	0.109	C	C	.	.	H	α-helix	trans	-64.4	-47.4	175.1	-71.2	167.5	0	0	0	111.2	E286 E287 A294 I358 M362 L365	E286-I290 HydrophobicContact CG-CD1 4.09Å; E286-I290 VanDerWaalsContact O-CG1 3.31Å; E286-I290 WeakPolarHBondContact O-CG1 3.1Å; E286-I290 PolarHBondContact O-N 3.33Å; E287-I290 PolarHBondContact O-N 3.21Å; I290-A294 WeakPolarHBondContact O-CB 3.48Å; I290-A294 PolarHBondContact O-N 3.32Å; I290-I358 HydrophobicContact CD1-CG1 4.3Å; I290-I358 HydrophobicContact CG1-CB 4.35Å; I290-I358 HydrophobicContact CG1-CG1 4.12Å; I290-I358 HydrophobicContact CG1-CG2 4.4Å; I290-M362 HydrophobicContact CG2-CG 4.39Å; I290-L365 HydrophobicContact CG2-CD1 3.77Å
291	L	98.9	Very high	98.4	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-61	-49.8	179.8	-77.1	165.8	0	0	0	111.8	M270 L274 F283 E287 L288 A295 L365 K401	M270-L291 HydrophobicContact CE-CB 4.36Å; M270-L291 HydrophobicContact CE-CD2 3.82Å; M270-L291 HydrophobicContact CG-CB 4.26Å; M270-L291 HydrophobicContact SD-CB 4.02Å; M270-L291 HydrophobicContact SD-CD1 4.44Å; M270-L291 HydrophobicContact SD-CD2 4.03Å; M270-L291 HydrophobicContact SD-CG 4.41Å; L274-L291 HydrophobicContact CD2-CD1 4.12Å; F283-L291 HydrophobicContact CD2-CD1 3.8Å; F283-L291 HydrophobicContact CE2-CD1 3.77Å; F283-L291 HydrophobicContact CG-CD1 4.43Å; F283-L291 HydrophobicContact CZ-CD1 4.44Å; E287-L291 WeakPolarHBondContact O-CB 3.41Å; E287-L291 WeakPolarHBondContact O-CG 3.49Å; E287-L291 PolarHBondContact O-N 3.33Å; L288-L291 PolarHBondContact O-N 2.84Å; L291-A295 WeakPolarHBondContact O-CB 3.3Å; L291-A295 PolarHBondContact O-N 3.15Å; L291-L365 HydrophobicContact CD2-CD1 3.87Å; L291-L365 HydrophobicContact CD2-CD2 4.41Å; L291-L365 HydrophobicContact CG-CD1 4.45Å; L291-K401 HydrophobicContact CD1-CD 4.32Å; L291-K401 HydrophobicContact CD1-CG 4.3Å; L291-K401 HydrophobicContact CD2-CB 3.96Å; L291-K401 HydrophobicContact CD2-CD 4.31Å; L291-K401 HydrophobicContact CD2-CG 3.99Å; L291-K401 HydrophobicContact CG-CD 4.37Å; L291-K401 HydrophobicContact CG-CG 4.47Å
292	L	98.9	Very high	98.5	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-66.1	-44.6	-179.7	-176.8	62.7	0	0	0	111.4	M224 Y225 L228 A267 L288 A294 A295 V296	M224-L292 HydrophobicContact CB-CD2 3.87Å; M224-L292 HydrophobicContact SD-CD1 4.19Å; Y225-L292 HydrophobicContact CD1-CD2 4.38Å; Y225-L292 HydrophobicContact CD2-CD2 3.51Å; Y225-L292 HydrophobicContact CD2-CG 4.33Å; Y225-L292 HydrophobicContact CE1-CD2 4.43Å; Y225-L292 HydrophobicContact CE2-CD2 3.58Å; Y225-L292 HydrophobicContact CE2-CG 3.89Å; Y225-L292 HydrophobicContact CG-CD2 3.93Å; L228-L292 HydrophobicContact CD1-CB 4.38Å; L228-L292 HydrophobicContact CD1-CD2 3.96Å; A267-L292 HydrophobicContact CB-CD1 4.01Å; L288-L292 WeakPolarHBondContact O-CB 3.35Å; L288-L292 PolarHBondContact O-N 3.44Å; L292-A294 PolarHBondContact O-N 2.97Å; L292-A295 PolarHBondContact O-N 3.39Å; L292-V296 WeakPolarHBondContact O-CG2 3.19Å; L292-V296 PolarHBondContact O-N 3.15Å
293	T	98.9	Very high	98.5	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-68.5	-36.2	-179.3	-49.6	0	0	0	0	111.7	Y225 W244 G289 V296 C297 I346 F347 M362	Y225-T293 VanDerWaalsContact OH-CA 3.25Å; Y225-T293 WeakPolarHBondContact OH-CA 3.36Å; Y225-T293 WeakPolarHBondContact OH-CB 3.49Å; Y225-T293 PolarHBondContact OH-OG1 3.25Å; W244-T293 HydrophobicContact CH2-CG2 3.86Å; W244-T293 HydrophobicContact CZ2-CG2 3.78Å; G289-T293 WeakPolarHBondContact O-CB 3.25Å; G289-T293 PolarHBondContact O-N 3.13Å; G289-T293 PolarHBondContact O-OG1 3.1Å; T293-V296 PolarHBondContact O-N 3.43Å; T293-C297 WeakPolarHBondContact O-CB 3.44Å; T293-C297 PolarHBondContact O-N 3.25Å; T293-C297 PolarHBondContact O-SG 2.93Å; T293-I346 HydrophobicContact CG2-CD1 4.28Å; T293-F347 HydrophobicContact CG2-CE2 4.2Å; T293-F347 HydrophobicContact CG2-CZ 3.96Å; T293-M362 HydrophobicContact CG2-CE 3.55Å; T293-M362 HydrophobicContact CG2-SD 3.82Å
294	A	98.9	Very high	98.5	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-62.9	-45.3	172.9	0	0	0	0	0	111.5	I290 L292 V296 C297 H298 L365 I366 I405	I290-A294 WeakPolarHBondContact O-CB 3.48Å; I290-A294 PolarHBondContact O-N 3.32Å; L292-A294 PolarHBondContact O-N 2.97Å; A294-V296 VanDerWaalsContact C-N 3.34Å; A294-V296 PolarHBondContact O-N 2.87Å; A294-C297 CarbonylContact O-C 3.56Å; A294-C297 PolarHBondContact O-N 3.09Å; A294-C297 VanDerWaalsContact O-N 3.11Å; A294-H298 WeakPolarHBondContact O-CB 3.43Å; A294-H298 PolarHBondContact O-N 3.35Å; A294-L365 HydrophobicContact CB-CB 3.74Å; A294-L365 HydrophobicContact CB-CD1 3.71Å; A294-L365 HydrophobicContact CB-CG 4.4Å; A294-I366 HydrophobicContact CB-CG1 4.25Å; A294-I405 HydrophobicContact CB-CD1 3.93Å
295	A	98.9	Very high	98.5	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-59.1	-42.8	175.9	0	0	0	0	0	112.4	V266 A267 M270 L291 L292 C297 H298	V266-A295 HydrophobicContact CG1-CB 3.99Å; A267-A295 HydrophobicContact CB-CB 4.33Å; M270-A295 HydrophobicContact CB-CB 4.39Å; L291-A295 WeakPolarHBondContact O-CB 3.3Å; L291-A295 PolarHBondContact O-N 3.15Å; L292-A295 PolarHBondContact O-N 3.39Å; A295-C297 VanDerWaalsContact C-N 3.27Å; A295-C297 PolarHBondContact O-N 3.35Å; A295-H298 PolarHBondContact O-ND1 3.43Å
296	V	98.9	Very high	98.4	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-64.9	-31	176.3	171.7	0	0	0	0	112.1	L221 Y225 W244 I248 Y252 C263 A267 L292 T293 A294	L221-V296 HydrophobicContact CD2-CG2 4.05Å; Y225-V296 HydrophobicContact CE2-CG2 4.47Å; W244-V296 HydrophobicContact CH2-CB 4.14Å; W244-V296 HydrophobicContact CH2-CG1 3.58Å; W244-V296 HydrophobicContact CZ2-CG1 4.31Å; W244-V296 HydrophobicContact CZ3-CG1 4.17Å; I248-V296 HydrophobicContact CG1-CG1 4.31Å; I248-V296 HydrophobicContact CG2-CG1 3.7Å; Y252-V296 WeakPolarHBondContact CE2-O 3.43Å; Y252-V296 PolarHBondContact OH-O 3.11Å; C263-V296 PolarHBondContact SG-O 3.08Å; A267-V296 HydrophobicContact CB-CG2 3.78Å; L292-V296 WeakPolarHBondContact O-CG2 3.19Å; L292-V296 PolarHBondContact O-N 3.15Å; T293-V296 PolarHBondContact O-N 3.43Å; A294-V296 VanDerWaalsContact C-N 3.34Å; A294-V296 PolarHBondContact O-N 2.87Å
297	C	98.9	Very high	98.4	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-98.4	-7.6	-174.3	-70	0	0	0	0	115.3	T293 A294 A295 D299 L300 A335 M362 I366	T293-C297 WeakPolarHBondContact O-CB 3.44Å; T293-C297 PolarHBondContact O-N 3.25Å; T293-C297 PolarHBondContact O-SG 2.93Å; A294-C297 CarbonylContact O-C 3.56Å; A294-C297 PolarHBondContact O-N 3.09Å; A294-C297 VanDerWaalsContact O-N 3.11Å; A295-C297 VanDerWaalsContact C-N 3.27Å; A295-C297 PolarHBondContact O-N 3.35Å; C297-D299 VanDerWaalsContact C-N 3.25Å; C297-D299 PolarHBondContact O-N 2.89Å; C297-D299 VanDerWaalsContact O-N 3.12Å; C297-L300 HydrophobicContact CB-CD1 3.75Å; C297-L300 HydrophobicContact CB-CG 4.48Å; C297-L300 PolarHBondContact O-N 2.99Å; C297-A335 HydrophobicContact CB-CB 3.82Å; C297-M362 HydrophobicContact CB-CE 4.44Å; C297-I366 HydrophobicContact CB-CD1 3.95Å
298	H	98.8	Very high	98.4	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-27.2	-161.6	79.9	-72.2	0	0	0	115.2	H262 V266 A294 A295 H331 I366 T369 D409	H262-H298 AromaticContact CD2-CE1 4Å; H262-H298 AromaticContact CD2-NE2 3.86Å; H262-H298 AromaticContact NE2-CE1 3.77Å; H262-H298 AromaticContact NE2-NE2 3.32Å; H262-H298 PolarHBondContact NE2-NE2 2.64Å; V266-H298 VanDerWaalsContact CG2-CE1 3.48Å; V266-H298 WeakPolarHBondContact CG2-CE1 3.37Å; A294-H298 WeakPolarHBondContact O-CB 3.43Å; A294-H298 PolarHBondContact O-N 3.35Å; A295-H298 PolarHBondContact O-ND1 3.43Å; H298-H331 WeakPolarHBondContact O-CB 3.38Å; H298-H331 PolarHBondContact O-CD2 2.87Å; H298-I366 HydrophobicContact CB-CG1 4.4Å; H298-T369 HydrophobicContact CB-CG2 4.24Å; H298-D409 IonicContact CD2-OD1 3.86Å; H298-D409 IonicContact NE2-OD1 2.91Å; H298-D409 PolarHBondContact NE2-OD1 3.48Å
299	D	98.7	Very high	98.3	Very high	8 Å²	8	12.4 Å²	12.4	4%	0.043	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.3	21.7	-175.7	-86.8	-8.9	0	0	0	113	Y252 H258 H262 C297 D301 H302 H331	Y252-D299 VanDerWaalsContact CE1-C 3.41Å; Y252-D299 HydrophobicContact CE1-CB 3.62Å; Y252-D299 VanDerWaalsContact CE1-O 3.25Å; Y252-D299 WeakPolarHBondContact CE1-O 3.34Å; Y252-D299 PolarHBondContact OH-N 2.87Å; H258-D299 IonicContact CD2-OD2 2.97Å; H258-D299 PolarHBondContact CD2-OD2 3.31Å; H258-D299 VanDerWaalsContact CD2-OD2 3.28Å; H262-D299 IonicContact CD2-OD2 2.73Å; H262-D299 PolarHBondContact CD2-OD2 3.28Å; H262-D299 IonicContact NE2-OD2 2.92Å; H262-D299 PolarHBondContact NE2-OD2 2.77Å; C297-D299 VanDerWaalsContact C-N 3.25Å; C297-D299 PolarHBondContact O-N 2.89Å; C297-D299 VanDerWaalsContact O-N 3.12Å; D299-D301 PolarHBondContact O-N 3.4Å; D299-H302 HydrophobicContact CB-CB 4.48Å; D299-H302 WeakPolarHBondContact O-CB 3.45Å; D299-H302 PolarHBondContact O-N 3.25Å; D299-H302 VanDerWaalsContact O-N 3.08Å; D299-H331 IonicContact OD1-NE2 2.75Å
300	L	98.6	Very high	98.3	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	128	-178.2	-85.7	169.3	0	0	0	112.4	I248 N251 Y252 C297 H302 H331 V334 A335 I338	I248-L300 HydrophobicContact CD1-CD1 3.78Å; I248-L300 HydrophobicContact CD1-CD2 3.95Å; I248-L300 HydrophobicContact CD1-CG 4.39Å; I248-L300 HydrophobicContact CG2-CD2 4.2Å; N251-L300 HydrophobicContact CB-CD2 4.04Å; Y252-L300 HydrophobicContact CD2-CD2 3.88Å; Y252-L300 HydrophobicContact CE2-CD2 3.62Å; Y252-L300 HydrophobicContact CE2-CG 4.04Å; C297-L300 HydrophobicContact CB-CD1 3.75Å; C297-L300 HydrophobicContact CB-CG 4.48Å; C297-L300 PolarHBondContact O-N 2.99Å; L300-H302 PolarHBondContact O-N 3.1Å; L300-H331 PolarHBondContact O-ND1 3.46Å; L300-V334 HydrophobicContact CB-CB 4.17Å; L300-V334 HydrophobicContact CB-CG1 3.96Å; L300-V334 HydrophobicContact CD1-CG1 4.36Å; L300-A335 HydrophobicContact CD1-CB 3.75Å; L300-I338 HydrophobicContact CD1-CD1 4.2Å; L300-I338 HydrophobicContact CD2-CD1 4.3Å
301	D	97.5	Very high	98.3	Very high	29 Å²	29	15 Å²	15	16%	0.155	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	28.2	-177.8	-163.5	47.6	0	0	0	114.6	N251 R253 D299 H330 V334	N251-D301 VanDerWaalsContact O-CA 3.24Å; N251-D301 WeakPolarHBondContact O-CA 3.43Å; N251-D301 PolarHBondContact O-N 3.32Å; R253-D301 IonicContact CZ-OD1 3.72Å; R253-D301 VanDerWaalsContact CZ-OD1 3.28Å; R253-D301 IonicContact CZ-OD2 3.67Å; R253-D301 IonicContact NE-OD1 3.57Å; R253-D301 PolarHBondContact NE-OD1 3.21Å; R253-D301 IonicContact NH2-OD1 3.28Å; R253-D301 PolarHBondContact NH2-OD1 3.14Å; R253-D301 IonicContact NH2-OD2 2.64Å; R253-D301 PolarHBondContact NH2-OD2 3.46Å; D299-D301 PolarHBondContact O-N 3.4Å; D301-H330 IonicContact OD2-CD2 3.86Å; D301-H330 IonicContact OD2-CE1 3.96Å; D301-H330 IonicContact OD2-NE2 3.8Å; D301-H330 PolarHBondContact OD2-NE2 3.3Å; D301-V334 HydrophobicContact CB-CG1 4.46Å; D301-V334 HydrophobicContact CB-CG2 4.06Å
302	H	98.5	Very high	98.3	Very high	8 Å²	8	18.2 Å²	18.2	4%	0.037	10%	0.103	C	C	.	.			trans	-54.7	128.8	173.9	-166	-83.1	0	0	0	111.5	R253 N255 H258 D299 L300 G304 H331 E430	R253-H302 VanDerWaalsContact CD-O 3.27Å; R253-H302 WeakPolarHBondContact CD-O 3.34Å; N255-H302 PolarHBondContact ND2-O 3.48Å; H258-H302 HydrophobicContact CB-CB 3.79Å; H258-H302 VanDerWaalsContact CB-ND1 3.33Å; H258-H302 WeakPolarHBondContact CB-ND1 3.29Å; H258-H302 AromaticContact CD2-CD2 3.85Å; H258-H302 AromaticContact CD2-CE1 3.87Å; H258-H302 AromaticContact CD2-NE2 3.76Å; H258-H302 AromaticContact CE1-CE1 3.8Å; H258-H302 AromaticContact CG-CD2 3.98Å; H258-H302 AromaticContact CG-CE1 3.51Å; H258-H302 AromaticContact CG-CG 3.78Å; H258-H302 AromaticContact CG-ND1 3.46Å; H258-H302 AromaticContact CG-NE2 3.87Å; H258-H302 AromaticContact ND1-CE1 3.46Å; H258-H302 PolarHBondContact ND1-CE1 3.01Å; H258-H302 AromaticContact ND1-ND1 3.73Å; H258-H302 AromaticContact NE2-NE2 3.94Å; D299-H302 HydrophobicContact CB-CB 4.48Å; D299-H302 WeakPolarHBondContact O-CB 3.45Å; D299-H302 PolarHBondContact O-N 3.25Å; D299-H302 VanDerWaalsContact O-N 3.08Å; L300-H302 PolarHBondContact O-N 3.1Å; H302-G304 VanDerWaalsContact C-N 3.32Å; H302-G304 PolarHBondContact ND1-N 3.43Å; H302-G304 PolarHBondContact O-N 3.46Å; H302-H331 AromaticContact CD2-CE1 3.75Å; H302-H331 AromaticContact CD2-NE2 3.57Å; H302-E430 IonicContact CE1-OE1 3.29Å; H302-E430 IonicContact ND1-OE1 2.71Å
303	P	97	Very high	98.2	Very high	19 Å²	19	19.8 Å²	19.8	12%	0.123	12%	0.116	C	C	.	.			trans	-83.3	-5.2	-172.8	33	-35.8	0	0	0	114.6	Y305 Q310 L327	P303-Y305 HydrophobicContact CB-CD2 4.27Å; P303-Q310 VanDerWaalsContact CG-NE2 3.33Å; P303-L327 VanDerWaalsContact CD-CD2 3.42Å; P303-L327 HydrophobicContact CG-CD2 3.68Å
304	G	97.7	Very high	98.1	Very high	6 Å²	6	29.5 Å²	29.5	6%	0.062	15%	0.153	C	C	.	.	S	Bend	trans	85.7	18.9	-175.8	0	0	0	0	0	113.9	H302 E430	H302-G304 VanDerWaalsContact C-N 3.32Å; H302-G304 PolarHBondContact ND1-N 3.43Å; H302-G304 PolarHBondContact O-N 3.46Å; G304-E430 VanDerWaalsContact CA-OE1 3.25Å; G304-E430 WeakPolarHBondContact CA-OE1 3.37Å
305	Y	97.3	Very high	98.1	Very high	47 Å²	47	31 Å²	31	18%	0.184	16%	0.162	C	C	.	.	S	Bend	trans	-141.9	136.8	-178.7	-54.8	-66.7	0	0	0	110.4	P303 Y309 Q310 L327 Q434 R437	P303-Y305 HydrophobicContact CB-CD2 4.27Å; Y305-Y309 VanDerWaalsContact CB-CD1 3.43Å; Y305-Y309 HydrophobicContact CD1-CD1 4.24Å; Y305-Y309 HydrophobicContact CD1-CE1 4.35Å; Y305-Y309 HydrophobicContact CD1-CG 4.36Å; Y305-Y309 HydrophobicContact CD2-CD1 4.17Å; Y305-Y309 AromaticContact CD2-CE1 3.99Å; Y305-Y309 HydrophobicContact CD2-CE1 3.99Å; Y305-Y309 AromaticContact CG-CD1 3.71Å; Y305-Y309 HydrophobicContact CG-CD1 3.71Å; Y305-Y309 AromaticContact CG-CE1 3.89Å; Y305-Y309 HydrophobicContact CG-CE1 3.89Å; Y305-Y309 HydrophobicContact CG-CG 4.19Å; Y305-Q310 PolarHBondContact O-NE2 3.28Å; Y305-L327 WeakPolarHBondContact O-CD1 3.44Å; Y305-Q434 HydrophobicContact CD1-CB 3.85Å; Y305-Q434 HydrophobicContact CD1-CG 3.86Å; Y305-Q434 HydrophobicContact CE1-CB 4.35Å; Y305-R437 WeakPolarHBondContact OH-CD 3.32Å; Y305-R437 PolarHBondContact OH-NH1 3.27Å
306	S	97.6	Very high	98	Very high	29 Å²	29	37.2 Å²	37.2	20%	0.203	19%	0.191	C	C	.	.			trans	-64.8	163.1	-177.7	67.3	0	0	0	0	114.6	S308 Y309 Q310 Q434	S306-S308 PolarHBondContact O-N 2.91Å; S306-Y309 WeakPolarHBondContact O-CB 3.47Å; S306-Y309 PolarHBondContact O-N 3.45Å; S306-Y309 PolarHBondContact OG-N 2.91Å; S306-Q310 WeakPolarHBondContact O-CG 3.25Å; S306-Q310 PolarHBondContact O-N 3.32Å; S306-Q434 PolarHBondContact OG-NE2 3.01Å; S306-Q434 PolarHBondContact OG-OE1 2.83Å; S306-Q434 VanDerWaalsContact OG-OE1 3.1Å
307	N	98.2	Very high	97.9	Very high	24 Å²	24	38.3 Å²	38.3	13%	0.128	20%	0.197	C	C	.	.	H	α-helix	trans	-53.2	-38.8	172.4	-81.5	-30.3	0	0	0	112.4	Y309 Q310 I311 P326 L327 E328	N307-Y309 VanDerWaalsContact C-N 3.35Å; N307-Y309 PolarHBondContact O-N 2.9Å; N307-Q310 PolarHBondContact O-N 3.14Å; N307-I311 VanDerWaalsContact O-CG1 3.28Å; N307-I311 WeakPolarHBondContact O-CG1 3.4Å; N307-I311 PolarHBondContact O-N 3.15Å; N307-P326 VanDerWaalsContact OD1-CD 3.28Å; N307-P326 WeakPolarHBondContact OD1-CD 3.42Å; N307-L327 VanDerWaalsContact OD1-CB 3.31Å; N307-L327 WeakPolarHBondContact OD1-CB 3.4Å; N307-L327 WeakPolarHBondContact OD1-CD1 3.48Å; N307-L327 WeakPolarHBondContact OD1-CG 3.32Å; N307-L327 PolarHBondContact OD1-N 2.86Å; N307-E328 PolarHBondContact ND2-OE1 3.22Å; N307-E328 PolarHBondContact ND2-OE2 2.98Å
308	S	97.6	Very high	97.9	Very high	75 Å²	75	38.3 Å²	38.3	52%	0.524	20%	0.197	S	C	.	.	H	α-helix	trans	-61.4	-41.5	176.8	-59.6	0	0	0	0	112.5	S306 N312	S306-S308 PolarHBondContact O-N 2.91Å; S308-N312 WeakPolarHBondContact O-CB 3.35Å; S308-N312 VanDerWaalsContact O-CG 3.22Å; S308-N312 PolarHBondContact O-N 3.43Å; S308-N312 PolarHBondContact O-ND2 3.36Å
309	Y	98	Very high	97.9	Very high	7 Å²	7	43.8 Å²	43.8	3%	0.027	23%	0.225	C	C	.	.	H	α-helix	trans	-62.7	-48.6	173	176.8	-90.2	0	0	0	111	Y305 S306 N307 I311 N312 A313 T315 Q434 R437 E438 E441 L443	Y305-Y309 VanDerWaalsContact CB-CD1 3.43Å; Y305-Y309 HydrophobicContact CD1-CD1 4.24Å; Y305-Y309 HydrophobicContact CD1-CE1 4.35Å; Y305-Y309 HydrophobicContact CD1-CG 4.36Å; Y305-Y309 HydrophobicContact CD2-CD1 4.17Å; Y305-Y309 AromaticContact CD2-CE1 3.99Å; Y305-Y309 HydrophobicContact CD2-CE1 3.99Å; Y305-Y309 AromaticContact CG-CD1 3.71Å; Y305-Y309 HydrophobicContact CG-CD1 3.71Å; Y305-Y309 AromaticContact CG-CE1 3.89Å; Y305-Y309 HydrophobicContact CG-CE1 3.89Å; Y305-Y309 HydrophobicContact CG-CG 4.19Å; S306-Y309 WeakPolarHBondContact O-CB 3.47Å; S306-Y309 PolarHBondContact O-N 3.45Å; S306-Y309 PolarHBondContact OG-N 2.91Å; N307-Y309 VanDerWaalsContact C-N 3.35Å; N307-Y309 PolarHBondContact O-N 2.9Å; Y309-I311 PolarHBondContact O-N 3.46Å; Y309-N312 PolarHBondContact O-N 2.92Å; Y309-A313 HydrophobicContact CD1-CB 4.44Å; Y309-A313 HydrophobicContact CE1-CB 4.06Å; Y309-A313 HydrophobicContact CE2-CB 4.33Å; Y309-A313 WeakPolarHBondContact O-CB 3.36Å; Y309-A313 PolarHBondContact O-N 3.4Å; Y309-T315 HydrophobicContact CE1-CG2 4.4Å; Y309-Q434 HydrophobicContact CD2-CG 4.03Å; Y309-Q434 HydrophobicContact CG-CG 4.28Å; Y309-R437 HydrophobicContact CE2-CG 4.29Å; Y309-R437 WeakPolarHBondContact OH-CD 3.5Å; Y309-R437 PolarHBondContact OH-NE 3.05Å; Y309-E438 HydrophobicContact CD2-CG 3.63Å; Y309-E438 HydrophobicContact CE2-CG 4.05Å; Y309-E441 WeakPolarHBondContact CE2-OE2 3.42Å; Y309-E441 PolarHBondContact OH-OE1 3.26Å; Y309-E441 PolarHBondContact OH-OE2 3.38Å; Y309-L443 HydrophobicContact CD2-CD1 4.26Å; Y309-L443 HydrophobicContact CE2-CD1 3.87Å
310	Q	98.3	Very high	97.8	Very high	8 Å²	8	49.8 Å²	49.8	4%	0.037	25%	0.247	C	C	.	.	H	α-helix	trans	-53.4	-44.4	-179.1	-59.9	-55.1	-38.7	0	0	111.7	P303 Y305 S306 N307 R314 T315 A318 P326 L327	P303-Q310 VanDerWaalsContact CG-NE2 3.33Å; Y305-Q310 PolarHBondContact O-NE2 3.28Å; S306-Q310 WeakPolarHBondContact O-CG 3.25Å; S306-Q310 PolarHBondContact O-N 3.32Å; N307-Q310 PolarHBondContact O-N 3.14Å; Q310-R314 PolarHBondContact O-N 2.98Å; Q310-T315 WeakPolarHBondContact CB-OG1 3.37Å; Q310-T315 PolarHBondContact O-N 2.93Å; Q310-T315 PolarHBondContact O-OG1 2.99Å; Q310-T315 PolarHBondContact OE1-OG1 3.03Å; Q310-A318 HydrophobicContact CB-CB 4.22Å; Q310-A318 WeakPolarHBondContact O-CB 3.41Å; Q310-P326 HydrophobicContact CB-CB 4.4Å; Q310-L327 HydrophobicContact CG-CD2 4.15Å; Q310-L327 HydrophobicContact CG-CG 4.23Å
311	I	98.4	Very high	97.8	Very high	55 Å²	55	51.9 Å²	51.9	28%	0.282	26%	0.255	S	S	.	.	H	α-helix	trans	-70.9	-52	-178.9	-65.1	165.5	0	0	0	111	N307 Y309 A313 R314 A318 D323 P326	N307-I311 VanDerWaalsContact O-CG1 3.28Å; N307-I311 WeakPolarHBondContact O-CG1 3.4Å; N307-I311 PolarHBondContact O-N 3.15Å; Y309-I311 PolarHBondContact O-N 3.46Å; I311-A313 VanDerWaalsContact C-N 3.32Å; I311-A313 PolarHBondContact O-N 3.32Å; I311-R314 PolarHBondContact O-N 2.86Å; I311-A318 HydrophobicContact CG1-CB 4.34Å; I311-D323 HydrophobicContact CD1-CB 3.97Å; I311-D323 HydrophobicContact CG1-CB 3.85Å; I311-D323 HydrophobicContact CG2-CB 4.31Å; I311-P326 HydrophobicContact CG1-CG 4.31Å
312	N	98.1	Very high	97.8	Very high	68 Å²	68	56.4 Å²	56.4	36%	0.364	28%	0.279	S	S	.	.	H	α-helix	trans	-62.7	-39.3	-177.7	-72.4	-24.3	0	0	0	112.1	S308 Y309 R314 L443	S308-N312 WeakPolarHBondContact O-CB 3.35Å; S308-N312 VanDerWaalsContact O-CG 3.22Å; S308-N312 PolarHBondContact O-N 3.43Å; S308-N312 PolarHBondContact O-ND2 3.36Å; Y309-N312 PolarHBondContact O-N 2.92Å; N312-R314 VanDerWaalsContact C-N 3.26Å; N312-R314 PolarHBondContact O-N 2.93Å; N312-L443 HydrophobicContact CB-CD2 4.38Å
313	A	97.5	Very high	97.8	Very high	33 Å²	33	60.1 Å²	60.1	27%	0.273	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-4.2	176.9	0	0	0	0	0	113.5	Y309 I311 T315 L443	Y309-A313 HydrophobicContact CD1-CB 4.44Å; Y309-A313 HydrophobicContact CE1-CB 4.06Å; Y309-A313 HydrophobicContact CE2-CB 4.33Å; Y309-A313 WeakPolarHBondContact O-CB 3.36Å; Y309-A313 PolarHBondContact O-N 3.4Å; I311-A313 VanDerWaalsContact C-N 3.32Å; I311-A313 PolarHBondContact O-N 3.32Å; A313-T315 VanDerWaalsContact C-N 3.26Å; A313-T315 HydrophobicContact CB-CG2 3.97Å; A313-T315 PolarHBondContact O-N 2.56Å; A313-L443 HydrophobicContact CB-CD1 3.69Å
314	R	97.4	Very high	97.9	Very high	203 Å²	203	64.8 Å²	64.8	77%	0.766	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	45.6	-178.1	-56.8	179.3	-179.9	177.6	0.4	112.6	Q310 I311 N312 I319	Q310-R314 PolarHBondContact O-N 2.98Å; I311-R314 PolarHBondContact O-N 2.86Å; N312-R314 VanDerWaalsContact C-N 3.26Å; N312-R314 PolarHBondContact O-N 2.93Å; R314-I319 WeakPolarHBondContact O-CD1 3.32Å
315	T	97.9	Very high	97.9	Very high	32 Å²	32	65.2 Å²	65.2	20%	0.196	33%	0.325	C	S	.	.			trans	-62.9	163.4	178.8	62.4	0	0	0	0	111.7	Y309 Q310 A313 L317 A318 I319	Y309-T315 HydrophobicContact CE1-CG2 4.4Å; Q310-T315 WeakPolarHBondContact CB-OG1 3.37Å; Q310-T315 PolarHBondContact O-N 2.93Å; Q310-T315 PolarHBondContact O-OG1 2.99Å; Q310-T315 PolarHBondContact OE1-OG1 3.03Å; A313-T315 VanDerWaalsContact C-N 3.26Å; A313-T315 HydrophobicContact CB-CG2 3.97Å; A313-T315 PolarHBondContact O-N 2.56Å; T315-L317 PolarHBondContact O-N 3.33Å; T315-A318 PolarHBondContact O-N 3.1Å; T315-A318 PolarHBondContact OG1-N 2.98Å; T315-I319 WeakPolarHBondContact O-CG1 3.38Å; T315-I319 PolarHBondContact O-N 3.35Å
316	E	97.5	Very high	97.9	Very high	131 Å²	131	63 Å²	63	61%	0.612	32%	0.316	S	S	*	.	H	α-helix	trans	-57.1	-36	175.5	-172.9	-174.7	165.6	0	0	112.2	I319 R320	E316-I319 PolarHBondContact O-N 2.85Å; E316-R320 WeakPolarHBondContact O-CB 3.49Å; E316-R320 PolarHBondContact O-N 3.39Å; E316-R320 IonicContact OE1-CZ 3.47Å; E316-R320 IonicContact OE1-NH1 3.99Å; E316-R320 IonicContact OE1-NH2 3.25Å; E316-R320 PolarHBondContact OE1-NH2 3.16Å
317	L	97.5	Very high	98	Very high	23 Å²	23	61.9 Å²	61.9	12%	0.12	31%	0.307	C	S	.	.	H	α-helix	trans	-65.9	-45.9	178	-64.2	-177	0	0	0	111.5	T315 I319 R320 Y321 P326 L327 H330	T315-L317 PolarHBondContact O-N 3.33Å; L317-I319 PolarHBondContact O-N 3.28Å; L317-R320 PolarHBondContact O-N 3.06Å; L317-Y321 HydrophobicContact CD2-CE2 4.29Å; L317-Y321 VanDerWaalsContact O-CD2 3.29Å; L317-Y321 WeakPolarHBondContact O-CD2 3.34Å; L317-Y321 PolarHBondContact O-N 3.05Å; L317-P326 HydrophobicContact CB-CB 4.25Å; L317-L327 HydrophobicContact CD1-CD2 4.41Å; L317-H330 HydrophobicContact CD1-CB 4.32Å; L317-H330 HydrophobicContact CD2-CB 4.09Å
318	A	98	Very high	98	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61.4	-44.5	176.7	0	0	0	0	0	111.8	Q310 I311 T315 N322 D323 P326	Q310-A318 HydrophobicContact CB-CB 4.22Å; Q310-A318 WeakPolarHBondContact O-CB 3.41Å; I311-A318 HydrophobicContact CG1-CB 4.34Å; T315-A318 PolarHBondContact O-N 3.1Å; T315-A318 PolarHBondContact OG1-N 2.98Å; A318-N322 WeakPolarHBondContact O-CA 3.5Å; A318-N322 PolarHBondContact O-N 2.81Å; A318-D323 WeakPolarHBondContact CB-OD1 3.42Å; A318-D323 PolarHBondContact O-N 3.05Å; A318-P326 HydrophobicContact CB-CG 4.39Å
319	I	98	Very high	98.1	Very high	115 Å²	115	60 Å²	60	59%	0.59	29%	0.291	S	S	*	.	H	α-helix	trans	-63.1	-46.4	175.9	-64.6	168.2	0	0	0	111.1	R314 T315 E316 L317 Y321 N322	R314-I319 WeakPolarHBondContact O-CD1 3.32Å; T315-I319 WeakPolarHBondContact O-CG1 3.38Å; T315-I319 PolarHBondContact O-N 3.35Å; E316-I319 PolarHBondContact O-N 2.85Å; L317-I319 PolarHBondContact O-N 3.28Å; I319-Y321 VanDerWaalsContact C-N 3.35Å; I319-Y321 PolarHBondContact O-N 3.24Å; I319-N322 PolarHBondContact O-N 3.32Å
320	R	98	Very high	98.1	Very high	133 Å²	133	60.8 Å²	60.8	50%	0.502	30%	0.295	S	S	.	.	H	α-helix	trans	-62	-40.7	-177.9	174.2	173	-70.4	155.8	5.9	112.4	E316 L317	E316-R320 WeakPolarHBondContact O-CB 3.49Å; E316-R320 PolarHBondContact O-N 3.39Å; E316-R320 IonicContact OE1-CZ 3.47Å; E316-R320 IonicContact OE1-NH1 3.99Å; E316-R320 IonicContact OE1-NH2 3.25Å; E316-R320 PolarHBondContact OE1-NH2 3.16Å; L317-R320 PolarHBondContact O-N 3.06Å
321	Y	97.9	Very high	98.1	Very high	44 Å²	44	60.4 Å²	60.4	17%	0.173	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	11.9	-177.2	-60.8	-63.1	0	0	0	113.4	L317 I319 D323 I324 P326 N329 H330 A333	L317-Y321 HydrophobicContact CD2-CE2 4.29Å; L317-Y321 VanDerWaalsContact O-CD2 3.29Å; L317-Y321 WeakPolarHBondContact O-CD2 3.34Å; L317-Y321 PolarHBondContact O-N 3.05Å; I319-Y321 VanDerWaalsContact C-N 3.35Å; I319-Y321 PolarHBondContact O-N 3.24Å; Y321-D323 VanDerWaalsContact C-N 3.27Å; Y321-D323 PolarHBondContact O-N 3.21Å; Y321-I324 PolarHBondContact O-N 3.44Å; Y321-P326 WeakPolarHBondContact CD2-O 3.43Å; Y321-N329 HydrophobicContact CD1-CB 3.44Å; Y321-N329 VanDerWaalsContact CD1-CB 3.44Å; Y321-N329 HydrophobicContact CD2-CB 3.92Å; Y321-N329 HydrophobicContact CE1-CB 3.52Å; Y321-N329 HydrophobicContact CE2-CB 4Å; Y321-N329 HydrophobicContact CG-CB 3.64Å; Y321-H330 HydrophobicContact CE2-CB 4.02Å; Y321-A333 WeakPolarHBondContact OH-CB 3.29Å
322	N	98	Very high	98.1	Very high	124 Å²	124	58.1 Å²	58.1	66%	0.663	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	44.4	176.5	-50.3	-77.7	0	0	0	112.7	A318 I319 I324	A318-N322 WeakPolarHBondContact O-CA 3.5Å; A318-N322 PolarHBondContact O-N 2.81Å; I319-N322 PolarHBondContact O-N 3.32Å; N322-I324 PolarHBondContact O-N 3.45Å
323	D	98	Very high	98.1	Very high	86 Å²	86	57 Å²	57	46%	0.46	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	6.3	-178.3	-53.8	-28.9	0	0	0	115.6	I311 A318 Y321	I311-D323 HydrophobicContact CD1-CB 3.97Å; I311-D323 HydrophobicContact CG1-CB 3.85Å; I311-D323 HydrophobicContact CG2-CB 4.31Å; A318-D323 WeakPolarHBondContact CB-OD1 3.42Å; A318-D323 PolarHBondContact O-N 3.05Å; Y321-D323 VanDerWaalsContact C-N 3.27Å; Y321-D323 PolarHBondContact O-N 3.21Å
324	I	98	Very high	98.1	Very high	118 Å²	118	56.1 Å²	56.1	61%	0.605	27%	0.273	S	S	*	.	S	Bend	trans	-94.8	106.6	179.5	-59.4	169	0	0	0	109.3	Y321 N322 P326 N329	Y321-I324 PolarHBondContact O-N 3.44Å; N322-I324 PolarHBondContact O-N 3.45Å; I324-P326 VanDerWaalsContact C-CD 3.49Å; I324-N329 PolarHBondContact O-ND2 3.44Å
325	S	98.2	Very high	98.1	Very high	15 Å²	15	46.5 Å²	46.5	11%	0.105	24%	0.237	C	C	.	.	S	Bend	trans	39.6	57.5	-179.1	-47.3	0	0	0	0	112.9	L327 E328 N329 D370	S325-L327 VanDerWaalsContact C-N 3.26Å; S325-L327 PolarHBondContact O-N 3.11Å; S325-E328 WeakPolarHBondContact CB-OE2 3.43Å; S325-E328 PolarHBondContact O-N 3.31Å; S325-N329 WeakPolarHBondContact O-CB 3.22Å; S325-N329 PolarHBondContact O-N 3.24Å; S325-N329 VanDerWaalsContact O-N 3.07Å; S325-N329 PolarHBondContact O-ND2 3.22Å; S325-D370 VanDerWaalsContact CB-OD2 3.3Å; S325-D370 WeakPolarHBondContact CB-OD2 3.35Å; S325-D370 PolarHBondContact OG-OD2 2.94Å
326	P	98.6	Very high	98.1	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.006	23%	0.232	C	C	.	.	H	α-helix	trans	-53.7	-40.2	-172.4	-29.2	35.5	0	0	0	114.3	N307 Q310 I311 L317 A318 Y321 I324 H330	N307-P326 VanDerWaalsContact OD1-CD 3.28Å; N307-P326 WeakPolarHBondContact OD1-CD 3.42Å; Q310-P326 HydrophobicContact CB-CB 4.4Å; I311-P326 HydrophobicContact CG1-CG 4.31Å; L317-P326 HydrophobicContact CB-CB 4.25Å; A318-P326 HydrophobicContact CB-CG 4.39Å; Y321-P326 WeakPolarHBondContact CD2-O 3.43Å; I324-P326 VanDerWaalsContact C-CD 3.49Å; P326-H330 WeakPolarHBondContact O-CB 3.32Å; P326-H330 PolarHBondContact O-N 3.16Å
327	L	98.8	Very high	98.1	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-71.7	-50.5	-178.8	-67.9	170.7	0	0	0	111.7	P303 Y305 N307 Q310 L317 S325 N329 H330 H331	P303-L327 VanDerWaalsContact CD-CD2 3.42Å; P303-L327 HydrophobicContact CG-CD2 3.68Å; Y305-L327 WeakPolarHBondContact O-CD1 3.44Å; N307-L327 VanDerWaalsContact OD1-CB 3.31Å; N307-L327 WeakPolarHBondContact OD1-CB 3.4Å; N307-L327 WeakPolarHBondContact OD1-CD1 3.48Å; N307-L327 WeakPolarHBondContact OD1-CG 3.32Å; N307-L327 PolarHBondContact OD1-N 2.86Å; Q310-L327 HydrophobicContact CG-CD2 4.15Å; Q310-L327 HydrophobicContact CG-CG 4.23Å; L317-L327 HydrophobicContact CD1-CD2 4.41Å; S325-L327 VanDerWaalsContact C-N 3.26Å; S325-L327 PolarHBondContact O-N 3.11Å; L327-N329 VanDerWaalsContact C-N 3.28Å; L327-N329 PolarHBondContact O-N 3.33Å; L327-H330 CarbonylContact O-C 3.52Å; L327-H330 WeakPolarHBondContact O-CA 3.28Å; L327-H330 VanDerWaalsContact O-CB 3.28Å; L327-H330 WeakPolarHBondContact O-CB 3.41Å; L327-H330 PolarHBondContact O-N 3.37Å; L327-H331 VanDerWaalsContact C-CD2 3.45Å; L327-H331 PolarHBondContact O-CD2 3.05Å; L327-H331 PolarHBondContact O-N 3.27Å; L327-H331 PolarHBondContact O-ND1 3.42Å; L327-H331 PolarHBondContact O-NE2 2.88Å
328	E	98.8	Very high	98	Very high	18 Å²	18	39.6 Å²	39.6	8%	0.084	20%	0.204	C	C	.	.	H	α-helix	trans	-66.4	-33	-175.7	-63.4	73.7	-163.2	0	0	112	N307 S325 C332 I366 L367 D370	N307-E328 PolarHBondContact ND2-OE1 3.22Å; N307-E328 PolarHBondContact ND2-OE2 2.98Å; S325-E328 WeakPolarHBondContact CB-OE2 3.43Å; S325-E328 PolarHBondContact O-N 3.31Å; E328-C332 PolarHBondContact O-N 2.87Å; E328-C332 VanDerWaalsContact O-N 3.14Å; E328-C332 PolarHBondContact O-SG 3.02Å; E328-I366 HydrophobicContact CB-CG2 4.45Å; E328-L367 HydrophobicContact CB-CD2 3.91Å; E328-D370 HydrophobicContact CG-CB 3.88Å
329	N	98.6	Very high	97.9	Very high	43 Å²	43	39.7 Å²	39.7	23%	0.23	21%	0.205	C	C	.	.	H	α-helix	trans	-66.9	-39	169.5	-81.4	-72.7	0	0	0	112.3	Y321 I324 S325 L327 C332 A333	Y321-N329 HydrophobicContact CD1-CB 3.44Å; Y321-N329 VanDerWaalsContact CD1-CB 3.44Å; Y321-N329 HydrophobicContact CD2-CB 3.92Å; Y321-N329 HydrophobicContact CE1-CB 3.52Å; Y321-N329 HydrophobicContact CE2-CB 4Å; Y321-N329 HydrophobicContact CG-CB 3.64Å; I324-N329 PolarHBondContact O-ND2 3.44Å; S325-N329 WeakPolarHBondContact O-CB 3.22Å; S325-N329 PolarHBondContact O-N 3.24Å; S325-N329 VanDerWaalsContact O-N 3.07Å; S325-N329 PolarHBondContact O-ND2 3.22Å; L327-N329 VanDerWaalsContact C-N 3.28Å; L327-N329 PolarHBondContact O-N 3.33Å; N329-C332 WeakPolarHBondContact O-CB 3.43Å; N329-A333 WeakPolarHBondContact O-CB 3.46Å; N329-A333 PolarHBondContact O-N 3.06Å
330	H	98.3	Very high	97.8	Very high	22 Å²	22	40.2 Å²	40.2	10%	0.102	21%	0.208	C	C	.	.	H	α-helix	trans	-64.4	-47.4	175.5	-176.8	59	0	0	0	111.7	D301 L317 Y321 P326 L327 C332 A333 V334	D301-H330 IonicContact OD2-CD2 3.86Å; D301-H330 IonicContact OD2-CE1 3.96Å; D301-H330 IonicContact OD2-NE2 3.8Å; D301-H330 PolarHBondContact OD2-NE2 3.3Å; L317-H330 HydrophobicContact CD1-CB 4.32Å; L317-H330 HydrophobicContact CD2-CB 4.09Å; Y321-H330 HydrophobicContact CE2-CB 4.02Å; P326-H330 WeakPolarHBondContact O-CB 3.32Å; P326-H330 PolarHBondContact O-N 3.16Å; L327-H330 CarbonylContact O-C 3.52Å; L327-H330 WeakPolarHBondContact O-CA 3.28Å; L327-H330 VanDerWaalsContact O-CB 3.28Å; L327-H330 WeakPolarHBondContact O-CB 3.41Å; L327-H330 PolarHBondContact O-N 3.37Å; H330-C332 VanDerWaalsContact C-N 3.31Å; H330-C332 PolarHBondContact O-N 2.92Å; H330-A333 WeakPolarHBondContact O-CA 3.39Å; H330-A333 WeakPolarHBondContact O-CB 3.32Å; H330-A333 PolarHBondContact O-N 3.41Å; H330-V334 WeakPolarHBondContact O-CG2 3.48Å; H330-V334 PolarHBondContact O-N 3.45Å
331	H	98.6	Very high	97.6	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-56.8	-45.1	176.8	-55.2	-33.5	0	0	0	111.4	H298 D299 L300 H302 L327 A333 V334 A335 I366	H298-H331 WeakPolarHBondContact O-CB 3.38Å; H298-H331 PolarHBondContact O-CD2 2.87Å; D299-H331 IonicContact OD1-NE2 2.75Å; L300-H331 PolarHBondContact O-ND1 3.46Å; H302-H331 AromaticContact CD2-CE1 3.75Å; H302-H331 AromaticContact CD2-NE2 3.57Å; L327-H331 VanDerWaalsContact C-CD2 3.45Å; L327-H331 PolarHBondContact O-CD2 3.05Å; L327-H331 PolarHBondContact O-N 3.27Å; L327-H331 PolarHBondContact O-ND1 3.42Å; L327-H331 PolarHBondContact O-NE2 2.88Å; H331-A333 PolarHBondContact O-N 3.42Å; H331-V334 PolarHBondContact O-N 3.37Å; H331-A335 WeakPolarHBondContact O-CB 3.34Å; H331-A335 PolarHBondContact O-N 3.04Å; H331-I366 HydrophobicContact CB-CG2 4.05Å
332	C	98.4	Very high	97.3	Very high	7 Å²	7	38.1 Å²	38.1	5%	0.047	22%	0.215	C	C	.	.	H	α-helix	trans	-57.2	-49.3	171.3	-75	0	0	0	0	112.1	E328 N329 H330 V334 A335 F336 I366	E328-C332 PolarHBondContact O-N 2.87Å; E328-C332 VanDerWaalsContact O-N 3.14Å; E328-C332 PolarHBondContact O-SG 3.02Å; N329-C332 WeakPolarHBondContact O-CB 3.43Å; H330-C332 VanDerWaalsContact C-N 3.31Å; H330-C332 PolarHBondContact O-N 2.92Å; C332-V334 VanDerWaalsContact C-N 3.35Å; C332-V334 PolarHBondContact O-N 3.17Å; C332-A335 WeakPolarHBondContact O-CB 3.41Å; C332-A335 PolarHBondContact O-N 3.02Å; C332-F336 HydrophobicContact CB-CE2 4.46Å; C332-F336 WeakPolarHBondContact O-CD2 3.47Å; C332-F336 PolarHBondContact O-N 2.97Å; C332-I366 VanDerWaalsContact SG-CB 3.53Å; C332-I366 WeakPolarHBondContact SG-CG2 3.37Å
333	A	97.7	Very high	96.9	Very high	43 Å²	43	35.6 Å²	35.6	36%	0.355	20%	0.199	S	C	.	.	H	α-helix	trans	-60.4	-44.6	-177.5	0	0	0	0	0	111.7	Y321 N329 H330 H331 F336 S337	Y321-A333 WeakPolarHBondContact OH-CB 3.29Å; N329-A333 WeakPolarHBondContact O-CB 3.46Å; N329-A333 PolarHBondContact O-N 3.06Å; H330-A333 WeakPolarHBondContact O-CA 3.39Å; H330-A333 WeakPolarHBondContact O-CB 3.32Å; H330-A333 PolarHBondContact O-N 3.41Å; H331-A333 PolarHBondContact O-N 3.42Å; A333-F336 PolarHBondContact O-N 3.49Å; A333-S337 VanDerWaalsContact O-CB 3.22Å; A333-S337 WeakPolarHBondContact O-CB 3.4Å; A333-S337 PolarHBondContact O-N 3.34Å
334	V	97.3	Very high	96.8	Very high	16 Å²	16	31.6 Å²	31.6	10%	0.097	18%	0.178	C	C	.	.	H	α-helix	trans	-63.1	-45.7	175.8	177.2	0	0	0	0	111	N251 L300 D301 H330 H331 C332 F336 S337 I338	N251-V334 HydrophobicContact CB-CG1 4.48Å; L300-V334 HydrophobicContact CB-CB 4.17Å; L300-V334 HydrophobicContact CB-CG1 3.96Å; L300-V334 HydrophobicContact CD1-CG1 4.36Å; D301-V334 HydrophobicContact CB-CG1 4.46Å; D301-V334 HydrophobicContact CB-CG2 4.06Å; H330-V334 WeakPolarHBondContact O-CG2 3.48Å; H330-V334 PolarHBondContact O-N 3.45Å; H331-V334 PolarHBondContact O-N 3.37Å; C332-V334 VanDerWaalsContact C-N 3.35Å; C332-V334 PolarHBondContact O-N 3.17Å; V334-F336 VanDerWaalsContact C-N 3.32Å; V334-F336 PolarHBondContact O-N 3.03Å; V334-S337 PolarHBondContact O-N 2.97Å; V334-I338 HydrophobicContact CG1-CD1 4.01Å; V334-I338 WeakPolarHBondContact O-CG1 3.37Å; V334-I338 PolarHBondContact O-N 2.93Å
335	A	98.2	Very high	96.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-55.8	-46.5	177.9	0	0	0	0	0	112.3	C297 L300 H331 C332 L339	C297-A335 HydrophobicContact CB-CB 3.82Å; L300-A335 HydrophobicContact CD1-CB 3.75Å; H331-A335 WeakPolarHBondContact O-CB 3.34Å; H331-A335 PolarHBondContact O-N 3.04Å; C332-A335 WeakPolarHBondContact O-CB 3.41Å; C332-A335 PolarHBondContact O-N 3.02Å; A335-L339 WeakPolarHBondContact O-CG 3.47Å; A335-L339 PolarHBondContact O-N 2.85Å; A335-L339 VanDerWaalsContact O-N 3.08Å
336	F	97.9	Very high	96.8	Very high	20 Å²	20	26.9 Å²	26.9	9%	0.088	15%	0.152	C	C	.	.	H	α-helix	trans	-78.6	-26.7	-179.2	-68.2	-63.9	0	0	0	113.8	C332 A333 V334 L339 N340 R359 M362 T363	C332-F336 HydrophobicContact CB-CE2 4.46Å; C332-F336 WeakPolarHBondContact O-CD2 3.47Å; C332-F336 PolarHBondContact O-N 2.97Å; A333-F336 PolarHBondContact O-N 3.49Å; V334-F336 VanDerWaalsContact C-N 3.32Å; V334-F336 PolarHBondContact O-N 3.03Å; F336-L339 HydrophobicContact CD1-CD1 3.95Å; F336-L339 HydrophobicContact CE1-CD1 4.25Å; F336-L339 PolarHBondContact O-N 3.04Å; F336-N340 WeakPolarHBondContact O-CB 3.43Å; F336-N340 PolarHBondContact O-N 3.34Å; F336-R359 HydrophobicContact CD1-CG 4.38Å; F336-R359 VanDerWaalsContact CD1-NH1 3.34Å; F336-R359 HydrophobicContact CE1-CB 3.89Å; F336-R359 HydrophobicContact CE1-CG 3.73Å; F336-R359 HydrophobicContact CE2-CG 4.18Å; F336-R359 HydrophobicContact CZ-CB 4.05Å; F336-R359 HydrophobicContact CZ-CG 3.62Å; F336-M362 HydrophobicContact CE1-SD 4.38Å; F336-M362 HydrophobicContact CZ-CB 3.98Å; F336-M362 HydrophobicContact CZ-CE 4.5Å; F336-M362 HydrophobicContact CZ-SD 4.5Å; F336-T363 WeakPolarHBondContact CE2-OG1 3.45Å
337	S	96.5	Very high	96.8	Very high	22 Å²	22	27 Å²	27	15%	0.154	15%	0.153	C	C	.	.	H	α-helix	trans	-64.4	-46.1	169.6	164.8	0	0	0	0	110.3	D176 V178 A333 V334 L339 N340 H341	D176-S337 PolarHBondContact OD2-OG 3.17Å; V178-S337 WeakPolarHBondContact CG2-OG 3.4Å; A333-S337 VanDerWaalsContact O-CB 3.22Å; A333-S337 WeakPolarHBondContact O-CB 3.4Å; A333-S337 PolarHBondContact O-N 3.34Å; V334-S337 PolarHBondContact O-N 2.97Å; S337-L339 PolarHBondContact O-N 3.45Å; S337-N340 VanDerWaalsContact O-CB 3.29Å; S337-N340 WeakPolarHBondContact O-CB 3.19Å; S337-N340 PolarHBondContact O-N 3.2Å; S337-H341 PolarHBondContact O-CD2 3.34Å; S337-H341 VanDerWaalsContact O-CD2 3.22Å
338	I	96.2	Very high	96.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-55.6	-49.3	171.1	-68.5	166.7	0	0	0	110.9	V178 I248 N251 L300 V334 N340 H341 L344	V178-I338 HydrophobicContact CB-CG1 4.49Å; V178-I338 HydrophobicContact CG1-CD1 4.49Å; V178-I338 HydrophobicContact CG1-CG1 3.52Å; V178-I338 HydrophobicContact CG2-CG1 4.08Å; I248-I338 HydrophobicContact CD1-CD1 3.99Å; N251-I338 HydrophobicContact CB-CD1 4.23Å; L300-I338 HydrophobicContact CD1-CD1 4.2Å; L300-I338 HydrophobicContact CD2-CD1 4.3Å; V334-I338 HydrophobicContact CG1-CD1 4.01Å; V334-I338 WeakPolarHBondContact O-CG1 3.37Å; V334-I338 PolarHBondContact O-N 2.93Å; I338-N340 PolarHBondContact O-N 2.89Å; I338-H341 WeakPolarHBondContact O-CB 3.25Å; I338-H341 PolarHBondContact O-N 3.12Å; I338-H341 VanDerWaalsContact O-N 3.16Å; I338-L344 HydrophobicContact CG2-CB 4.22Å; I338-L344 HydrophobicContact CG2-CD1 4.03Å
339	L	96.7	Very high	96.6	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-67	-14.3	179.4	-70.4	168.8	0	0	0	113.9	A335 F336 S337 H341 N345 I346 F347 M362	A335-L339 WeakPolarHBondContact O-CG 3.47Å; A335-L339 PolarHBondContact O-N 2.85Å; A335-L339 VanDerWaalsContact O-N 3.08Å; F336-L339 HydrophobicContact CD1-CD1 3.95Å; F336-L339 HydrophobicContact CE1-CD1 4.25Å; F336-L339 PolarHBondContact O-N 3.04Å; S337-L339 PolarHBondContact O-N 3.45Å; L339-H341 VanDerWaalsContact C-N 3.26Å; L339-N345 WeakPolarHBondContact O-CB 3.47Å; L339-N345 PolarHBondContact O-ND2 3.39Å; L339-I346 HydrophobicContact CD2-CG1 3.83Å; L339-F347 HydrophobicContact CD1-CD2 4.07Å; L339-F347 HydrophobicContact CD1-CE2 3.97Å; L339-F347 HydrophobicContact CD2-CD2 3.92Å; L339-F347 HydrophobicContact CD2-CE2 4.12Å; L339-M362 HydrophobicContact CD1-CE 4.39Å
340	N	94.8	Very high	96.5	Very high	125 Å²	125	32.6 Å²	32.6	67%	0.668	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-14.2	176.1	-165.4	53.3	0	0	0	112.4	F336 S337 I338 P342	F336-N340 WeakPolarHBondContact O-CB 3.43Å; F336-N340 PolarHBondContact O-N 3.34Å; S337-N340 VanDerWaalsContact O-CB 3.29Å; S337-N340 WeakPolarHBondContact O-CB 3.19Å; S337-N340 PolarHBondContact O-N 3.2Å; I338-N340 PolarHBondContact O-N 2.89Å; N340-P342 WeakPolarHBondContact O-CD 3.27Å
341	H	93.5	Very high	96.5	Very high	32 Å²	32	36 Å²	36	15%	0.148	21%	0.211	C	C	.	.	S	Bend	trans	-80.8	116.7	172.4	-68.4	-79.1	0	0	0	110.4	D176 I180 S337 I338 L339 E343 L344 N345	D176-H341 IonicContact OD1-NE2 3.75Å; I180-H341 VanDerWaalsContact CD1-CE1 3.44Å; I180-H341 WeakPolarHBondContact CD1-CE1 3.28Å; I180-H341 WeakPolarHBondContact CD1-ND1 3.48Å; S337-H341 PolarHBondContact O-CD2 3.34Å; S337-H341 VanDerWaalsContact O-CD2 3.22Å; I338-H341 WeakPolarHBondContact O-CB 3.25Å; I338-H341 PolarHBondContact O-N 3.12Å; I338-H341 VanDerWaalsContact O-N 3.16Å; L339-H341 VanDerWaalsContact C-N 3.26Å; H341-E343 PolarHBondContact O-N 3.46Å; H341-E343 VanDerWaalsContact O-N 3.11Å; H341-L344 HydrophobicContact CB-CB 4.11Å; H341-L344 HydrophobicContact CB-CD1 3.92Å; H341-L344 HydrophobicContact CB-CG 3.92Å; H341-L344 CarbonylContact O-C 3.25Å; H341-L344 PolarHBondContact O-N 3.12Å; H341-N345 WeakPolarHBondContact O-CB 3.35Å; H341-N345 PolarHBondContact O-N 2.9Å
342	P	91.8	Very high	96.4	Very high	101 Å²	101	44.4 Å²	44.4	66%	0.656	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-33.9	-175.1	-27.8	35.8	0	0	0	114.3	N340 L344	N340-P342 WeakPolarHBondContact O-CD 3.27Å; P342-L344 VanDerWaalsContact C-N 3.29Å; P342-L344 PolarHBondContact O-N 2.87Å
343	E	91	Very high	96.4	Very high	71 Å²	71	49.3 Å²	49.3	33%	0.332	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-13.2	178.7	71.8	-80.2	-164.9	0	0	114.4	R243 H341	R243-E343 VanDerWaalsContact CD-O 3.29Å; R243-E343 WeakPolarHBondContact CD-O 3.48Å; H341-E343 PolarHBondContact O-N 3.46Å; H341-E343 VanDerWaalsContact O-N 3.11Å
344	L	95.1	Very high	96.4	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.016	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-9.4	177.7	-51.2	-178	0	0	0	112.3	I180 R243 W244 S247 I338 H341 P342 I346	I180-L344 HydrophobicContact CD1-CD1 4.34Å; I180-L344 HydrophobicContact CG1-CD1 4.04Å; I180-L344 HydrophobicContact CG2-CD1 4.18Å; R243-L344 HydrophobicContact CB-CD2 3.53Å; W244-L344 WeakPolarHBondContact CB-O 3.31Å; S247-L344 WeakPolarHBondContact OG-CD1 3.09Å; I338-L344 HydrophobicContact CG2-CB 4.22Å; I338-L344 HydrophobicContact CG2-CD1 4.03Å; H341-L344 HydrophobicContact CB-CB 4.11Å; H341-L344 HydrophobicContact CB-CD1 3.92Å; H341-L344 HydrophobicContact CB-CG 3.92Å; H341-L344 CarbonylContact O-C 3.25Å; H341-L344 PolarHBondContact O-N 3.12Å; P342-L344 VanDerWaalsContact C-N 3.29Å; P342-L344 PolarHBondContact O-N 2.87Å; L344-I346 PolarHBondContact O-N 3.42Å
345	N	97.3	Very high	96.5	Very high	31 Å²	31	50.4 Å²	50.4	17%	0.166	27%	0.27	C	S	.	.			trans	-75.6	94.6	-175.6	-172.1	-5.8	0	0	0	111.2	L339 H341 F347 A348	L339-N345 WeakPolarHBondContact O-CB 3.47Å; L339-N345 PolarHBondContact O-ND2 3.39Å; H341-N345 WeakPolarHBondContact O-CB 3.35Å; H341-N345 PolarHBondContact O-N 2.9Å; N345-F347 PolarHBondContact O-N 3.34Å; N345-F347 VanDerWaalsContact O-N 3.15Å; N345-F347 WeakPolarHBondContact OD1-CA 3.23Å; N345-F347 PolarHBondContact OD1-N 3.41Å; N345-A348 HydrophobicContact CB-CB 4.1Å; N345-A348 VanDerWaalsContact O-CB 3.25Å; N345-A348 WeakPolarHBondContact O-CB 3.2Å; N345-A348 PolarHBondContact O-N 2.95Å; N345-A348 VanDerWaalsContact O-N 3.08Å; N345-A348 PolarHBondContact OD1-N 3.17Å
346	I	98.3	Very high	96.5	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.015	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-15.7	175.9	59.4	166.2	0	0	0	113.2	Y225 I236 T240 L241 W244 T293 L339 L344	Y225-I346 HydrophobicContact CE1-CD1 4.08Å; I236-I346 HydrophobicContact CD1-CB 4.26Å; I236-I346 WeakPolarHBondContact CG1-O 3.44Å; I236-I346 HydrophobicContact CG2-CB 3.87Å; I236-I346 HydrophobicContact CG2-CG2 4.03Å; T240-I346 HydrophobicContact CG2-CG2 4.31Å; L241-I346 HydrophobicContact CD1-CG2 4.22Å; W244-I346 HydrophobicContact CB-CG2 3.55Å; W244-I346 HydrophobicContact CD2-CD1 4.05Å; W244-I346 HydrophobicContact CD2-CG1 4.38Å; W244-I346 HydrophobicContact CD2-CG2 3.87Å; W244-I346 HydrophobicContact CE3-CD1 4.04Å; W244-I346 HydrophobicContact CE3-CG2 4.08Å; W244-I346 HydrophobicContact CG-CG2 3.64Å; W244-I346 HydrophobicContact CH2-CD1 4.17Å; W244-I346 HydrophobicContact CZ2-CD1 4.16Å; W244-I346 HydrophobicContact CZ3-CD1 4.1Å; T293-I346 HydrophobicContact CG2-CD1 4.28Å; L339-I346 HydrophobicContact CD2-CG1 3.83Å; L344-I346 PolarHBondContact O-N 3.42Å
347	F	98.2	Very high	96.5	Very high	2 Å²	2	61.2 Å²	61.2	1%	0.009	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	15.1	176.7	-50.9	-57.7	0	0	0	112.6	F234 T293 L339 N345 N349 V350 F355 I358 M362	F234-F347 HydrophobicContact CB-CD1 4.27Å; F234-F347 AromaticContact CD2-CD1 3.69Å; F234-F347 HydrophobicContact CD2-CD1 3.69Å; F234-F347 AromaticContact CD2-CE1 3.45Å; F234-F347 HydrophobicContact CD2-CE1 3.45Å; F234-F347 VanDerWaalsContact CD2-CE1 3.45Å; F234-F347 HydrophobicContact CE2-CD1 4.08Å; F234-F347 AromaticContact CE2-CE1 3.53Å; F234-F347 HydrophobicContact CE2-CE1 3.53Å; F234-F347 AromaticContact CG-CD1 3.98Å; F234-F347 HydrophobicContact CG-CD1 3.98Å; F234-F347 HydrophobicContact CG-CE1 4.21Å; F234-F347 HydrophobicContact CZ-CE1 4.37Å; T293-F347 HydrophobicContact CG2-CE2 4.2Å; T293-F347 HydrophobicContact CG2-CZ 3.96Å; L339-F347 HydrophobicContact CD1-CD2 4.07Å; L339-F347 HydrophobicContact CD1-CE2 3.97Å; L339-F347 HydrophobicContact CD2-CD2 3.92Å; L339-F347 HydrophobicContact CD2-CE2 4.12Å; N345-F347 PolarHBondContact O-N 3.34Å; N345-F347 VanDerWaalsContact O-N 3.15Å; N345-F347 WeakPolarHBondContact OD1-CA 3.23Å; N345-F347 PolarHBondContact OD1-N 3.41Å; F347-N349 PolarHBondContact O-N 3.07Å; F347-V350 HydrophobicContact CB-CG1 4.4Å; F347-V350 HydrophobicContact CB-CG2 4.09Å; F347-V350 WeakPolarHBondContact O-CG2 2.95Å; F347-V350 PolarHBondContact O-N 3.47Å; F347-V350 VanDerWaalsContact O-N 3.12Å; F347-F355 HydrophobicContact CB-CD2 3.98Å; F347-F355 HydrophobicContact CB-CE2 4.28Å; F347-F355 HydrophobicContact CD2-CE2 4.34Å; F347-I358 HydrophobicContact CD1-CD1 3.74Å; F347-I358 HydrophobicContact CD2-CG2 4.01Å; F347-I358 HydrophobicContact CE1-CD1 4.06Å; F347-I358 HydrophobicContact CE1-CG2 4.36Å; F347-I358 HydrophobicContact CE2-CG2 3.68Å; F347-I358 HydrophobicContact CG-CD1 4.04Å; F347-I358 HydrophobicContact CG-CG2 4.47Å; F347-I358 HydrophobicContact CZ-CG2 3.87Å; F347-M362 HydrophobicContact CE2-SD 4.09Å; F347-M362 HydrophobicContact CZ-SD 4.49Å
348	A	96.5	Very high	96.6	Very high	56 Å²	56	60.2 Å²	60.2	46%	0.463	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-25.5	-176.1	0	0	0	0	0	114.3	N345	N345-A348 HydrophobicContact CB-CB 4.1Å; N345-A348 VanDerWaalsContact O-CB 3.25Å; N345-A348 WeakPolarHBondContact O-CB 3.2Å; N345-A348 PolarHBondContact O-N 2.95Å; N345-A348 VanDerWaalsContact O-N 3.08Å; N345-A348 PolarHBondContact OD1-N 3.17Å
349	N	97.2	Very high	96.7	Very high	98 Å²	98	65.9 Å²	65.9	52%	0.524	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	1.3	-176.1	-66	-37.8	0	0	0	113.9	N235 F347	N235-N349 HydrophobicContact CB-CB 3.97Å; N235-N349 PolarHBondContact O-ND2 3.28Å; F347-N349 PolarHBondContact O-N 3.07Å
350	V	97.5	Very high	96.8	Very high	29 Å²	29	71.8 Å²	71.8	18%	0.176	35%	0.352	C	S	.	.	S	Bend	trans	-88.4	154.5	176.3	-44.2	0	0	0	0	110.8	F234 F347 V354 F355 I358	F234-V350 HydrophobicContact CB-CG1 3.71Å; F234-V350 HydrophobicContact CD1-CG1 3.65Å; F234-V350 HydrophobicContact CG-CG1 3.98Å; F347-V350 HydrophobicContact CB-CG1 4.4Å; F347-V350 HydrophobicContact CB-CG2 4.09Å; F347-V350 WeakPolarHBondContact O-CG2 2.95Å; F347-V350 PolarHBondContact O-N 3.47Å; F347-V350 VanDerWaalsContact O-N 3.12Å; V350-V354 HydrophobicContact CB-CB 4.11Å; V350-V354 HydrophobicContact CB-CG1 3.84Å; V350-V354 HydrophobicContact CG1-CG1 4.27Å; V350-V354 HydrophobicContact CG2-CB 4.14Å; V350-V354 HydrophobicContact CG2-CG1 3.95Å; V350-F355 HydrophobicContact CG2-CB 3.83Å; V350-F355 HydrophobicContact CG2-CD2 4.5Å; V350-I358 HydrophobicContact CG2-CD1 4.33Å
351	N	97.2	Very high	97	Very high	93 Å²	93	66.8 Å²	66.8	50%	0.497	33%	0.329	S	S	.	.			trans	-74.7	164.7	175.8	68.4	55.2	0	0	0	112	E353 V354 F355	N351-E353 PolarHBondContact O-N 3.31Å; N351-E353 WeakPolarHBondContact OD1-CB 3.47Å; N351-E353 PolarHBondContact OD1-N 3.35Å; N351-E353 VanDerWaalsContact OD1-N 3.07Å; N351-V354 PolarHBondContact O-N 2.66Å; N351-V354 WeakPolarHBondContact OD1-CG2 3.48Å; N351-V354 PolarHBondContact OD1-N 3.05Å; N351-F355 PolarHBondContact O-N 3.28Å
352	Q	97.3	Very high	97.2	Very high	178 Å²	178	65.2 Å²	65.2	83%	0.832	32%	0.322	S	S	*	.	H	α-helix	trans	-60.3	-32	-175.9	-169.2	177.1	28.1	0	0	113.5	R356	Q352-R356 WeakPolarHBondContact O-CB 3.41Å; Q352-R356 PolarHBondContact O-N 2.91Å
353	E	98.3	Very high	97.6	Very high	111 Å²	111	62.3 Å²	62.3	52%	0.519	30%	0.303	S	S	.	.	H	α-helix	trans	-71	-44.9	179.8	-163.3	-165.5	148	0	0	111.5	N351 R356 R357	N351-E353 PolarHBondContact O-N 3.31Å; N351-E353 WeakPolarHBondContact OD1-CB 3.47Å; N351-E353 PolarHBondContact OD1-N 3.35Å; N351-E353 VanDerWaalsContact OD1-N 3.07Å; E353-R356 WeakPolarHBondContact O-CB 3.38Å; E353-R356 PolarHBondContact O-N 3.19Å; E353-R357 PolarHBondContact O-N 2.93Å; E353-R357 VanDerWaalsContact O-N 3.15Å; E353-R357 IonicContact OE1-NH1 3.81Å; E353-R357 PolarHBondContact OE1-NH1 3.49Å
354	V	98.2	Very high	98	Very high	19 Å²	19	61.4 Å²	61.4	12%	0.115	30%	0.304	C	S	.	.	H	α-helix	trans	-61.6	-47.9	173.9	174.6	0	0	0	0	109.8	F234 V350 N351 R356 R357 I358	F234-V354 HydrophobicContact CD1-CG1 4.49Å; F234-V354 HydrophobicContact CE1-CG1 4.16Å; V350-V354 HydrophobicContact CB-CB 4.11Å; V350-V354 HydrophobicContact CB-CG1 3.84Å; V350-V354 HydrophobicContact CG1-CG1 4.27Å; V350-V354 HydrophobicContact CG2-CB 4.14Å; V350-V354 HydrophobicContact CG2-CG1 3.95Å; N351-V354 PolarHBondContact O-N 2.66Å; N351-V354 WeakPolarHBondContact OD1-CG2 3.48Å; N351-V354 PolarHBondContact OD1-N 3.05Å; V354-R356 VanDerWaalsContact C-N 3.27Å; V354-R356 PolarHBondContact O-N 3.44Å; V354-R357 PolarHBondContact O-N 3.03Å; V354-I358 HydrophobicContact CG1-CD1 3.79Å; V354-I358 HydrophobicContact CG1-CG1 4.3Å; V354-I358 WeakPolarHBondContact O-CG1 3.35Å; V354-I358 PolarHBondContact O-N 2.97Å
355	F	98.3	Very high	98.1	Very high	63 Å²	63	61.6 Å²	61.6	28%	0.276	31%	0.305	S	S	.	.	H	α-helix	trans	-60	-37.5	178.3	-174	-104.7	0	0	0	112.3	F347 V350 N351 R357 I358 R359	F347-F355 HydrophobicContact CB-CD2 3.98Å; F347-F355 HydrophobicContact CB-CE2 4.28Å; F347-F355 HydrophobicContact CD2-CE2 4.34Å; V350-F355 HydrophobicContact CG2-CB 3.83Å; V350-F355 HydrophobicContact CG2-CD2 4.5Å; N351-F355 PolarHBondContact O-N 3.28Å; F355-R357 PolarHBondContact O-N 2.75Å; F355-I358 PolarHBondContact O-N 3.17Å; F355-R359 WeakPolarHBondContact O-CB 3.31Å; F355-R359 PolarHBondContact O-N 3.01Å
356	R	98.4	Very high	98.2	Very high	161 Å²	161	60.1 Å²	60.1	61%	0.608	30%	0.297	S	S	*	.	H	α-helix	trans	-61.6	-42.7	174.5	-175.5	-179.6	65.8	-170.2	-1.8	111.7	Q352 E353 V354 Q360	Q352-R356 WeakPolarHBondContact O-CB 3.41Å; Q352-R356 PolarHBondContact O-N 2.91Å; E353-R356 WeakPolarHBondContact O-CB 3.38Å; E353-R356 PolarHBondContact O-N 3.19Å; V354-R356 VanDerWaalsContact C-N 3.27Å; V354-R356 PolarHBondContact O-N 3.44Å; R356-Q360 WeakPolarHBondContact O-CB 3.43Å; R356-Q360 PolarHBondContact O-N 3.03Å
357	R	98.4	Very high	98.2	Very high	85 Å²	85	61.5 Å²	61.5	32%	0.321	31%	0.305	S	S	.	.	H	α-helix	trans	-67.4	-42.2	176.2	-68.7	-167.2	-58.5	-95.3	1.6	112.1	E286 E353 V354 F355 R359 Q360 G361	E286-R357 WeakPolarHBondContact OE1-CB 3.24Å; E286-R357 IonicContact OE1-CZ 3.65Å; E286-R357 IonicContact OE1-NE 3.21Å; E286-R357 PolarHBondContact OE1-NE 2.68Å; E286-R357 IonicContact OE1-NH2 3.08Å; E286-R357 IonicContact OE2-CZ 3.81Å; E286-R357 IonicContact OE2-NE 3.34Å; E286-R357 PolarHBondContact OE2-NE 2.93Å; E286-R357 IonicContact OE2-NH2 3.24Å; E286-R357 PolarHBondContact OE2-NH2 3.18Å; E353-R357 PolarHBondContact O-N 2.93Å; E353-R357 VanDerWaalsContact O-N 3.15Å; E353-R357 IonicContact OE1-NH1 3.81Å; E353-R357 PolarHBondContact OE1-NH1 3.49Å; V354-R357 PolarHBondContact O-N 3.03Å; F355-R357 PolarHBondContact O-N 2.75Å; R357-R359 PolarHBondContact O-N 3Å; R357-Q360 PolarHBondContact O-N 2.92Å; R357-G361 PolarHBondContact O-N 3.01Å
358	I	98.6	Very high	98.3	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-57.6	-51	174.4	-67.9	169.3	0	0	0	110.3	F234 I290 F347 V350 V354 F355 Q360 G361 M362	F234-I358 HydrophobicContact CD1-CD1 4.19Å; F234-I358 HydrophobicContact CE1-CD1 3.67Å; F234-I358 HydrophobicContact CE1-CG1 4.38Å; F234-I358 HydrophobicContact CE2-CD1 4.28Å; F234-I358 HydrophobicContact CZ-CD1 3.7Å; F234-I358 HydrophobicContact CZ-CG1 4.14Å; I290-I358 HydrophobicContact CD1-CG1 4.3Å; I290-I358 HydrophobicContact CG1-CB 4.35Å; I290-I358 HydrophobicContact CG1-CG1 4.12Å; I290-I358 HydrophobicContact CG1-CG2 4.4Å; F347-I358 HydrophobicContact CD1-CD1 3.74Å; F347-I358 HydrophobicContact CD2-CG2 4.01Å; F347-I358 HydrophobicContact CE1-CD1 4.06Å; F347-I358 HydrophobicContact CE1-CG2 4.36Å; F347-I358 HydrophobicContact CE2-CG2 3.68Å; F347-I358 HydrophobicContact CG-CD1 4.04Å; F347-I358 HydrophobicContact CG-CG2 4.47Å; F347-I358 HydrophobicContact CZ-CG2 3.87Å; V350-I358 HydrophobicContact CG2-CD1 4.33Å; V354-I358 HydrophobicContact CG1-CD1 3.79Å; V354-I358 HydrophobicContact CG1-CG1 4.3Å; V354-I358 WeakPolarHBondContact O-CG1 3.35Å; V354-I358 PolarHBondContact O-N 2.97Å; F355-I358 PolarHBondContact O-N 3.17Å; I358-Q360 PolarHBondContact O-N 3.23Å; I358-G361 PolarHBondContact O-N 3.49Å; I358-M362 HydrophobicContact CG2-CG 4.29Å; I358-M362 HydrophobicContact CG2-SD 3.7Å; I358-M362 WeakPolarHBondContact O-CB 3.02Å; I358-M362 WeakPolarHBondContact O-CG 3.32Å; I358-M362 PolarHBondContact O-N 3.48Å
359	R	98.5	Very high	98.4	Very high	119 Å²	119	59 Å²	59	45%	0.449	28%	0.283	S	S	.	.	H	α-helix	trans	-58.2	-48.5	178.3	178	173.8	177.3	83.4	1.3	111.6	F336 F355 R357 T363	F336-R359 HydrophobicContact CD1-CG 4.38Å; F336-R359 VanDerWaalsContact CD1-NH1 3.34Å; F336-R359 HydrophobicContact CE1-CB 3.89Å; F336-R359 HydrophobicContact CE1-CG 3.73Å; F336-R359 HydrophobicContact CE2-CG 4.18Å; F336-R359 HydrophobicContact CZ-CB 4.05Å; F336-R359 HydrophobicContact CZ-CG 3.62Å; F355-R359 WeakPolarHBondContact O-CB 3.31Å; F355-R359 PolarHBondContact O-N 3.01Å; R357-R359 PolarHBondContact O-N 3Å; R359-T363 WeakPolarHBondContact O-CB 3.33Å; R359-T363 PolarHBondContact O-N 3.46Å; R359-T363 PolarHBondContact O-OG1 3.41Å; R359-T363 VanDerWaalsContact O-OG1 3.06Å
360	Q	98.6	Very high	98.4	Very high	127 Å²	127	55 Å²	55	59%	0.593	26%	0.262	S	S	*	.	H	α-helix	trans	-60.7	-46.4	178.8	-177.7	178.1	2.1	0	0	111.8	R356 R357 I358 S364	R356-Q360 WeakPolarHBondContact O-CB 3.43Å; R356-Q360 PolarHBondContact O-N 3.03Å; R357-Q360 PolarHBondContact O-N 2.92Å; I358-Q360 PolarHBondContact O-N 3.23Å; Q360-S364 WeakPolarHBondContact O-CB 2.99Å; Q360-S364 PolarHBondContact O-N 3.17Å
361	G	98.7	Very high	98.4	Very high	19 Å²	19	57.4 Å²	57.4	20%	0.196	27%	0.272	C	S	.	.	H	α-helix	trans	-64.2	-48.5	179.8	0	0	0	0	0	112.4	R357 I358 T363 S364 L365	R357-G361 PolarHBondContact O-N 3.01Å; I358-G361 PolarHBondContact O-N 3.49Å; G361-T363 PolarHBondContact O-N 3.26Å; G361-S364 PolarHBondContact O-N 3.13Å; G361-L365 VanDerWaalsContact O-CG 3.29Å; G361-L365 WeakPolarHBondContact O-CG 3.42Å; G361-L365 PolarHBondContact O-N 3.34Å
362	M	98.8	Very high	98.4	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.2	-47.6	177.2	-74.1	178.6	63.5	0	0	111.7	I290 T293 C297 F336 L339 F347 I358 S364 L365 I366	I290-M362 HydrophobicContact CG2-CG 4.39Å; T293-M362 HydrophobicContact CG2-CE 3.55Å; T293-M362 HydrophobicContact CG2-SD 3.82Å; C297-M362 HydrophobicContact CB-CE 4.44Å; F336-M362 HydrophobicContact CE1-SD 4.38Å; F336-M362 HydrophobicContact CZ-CB 3.98Å; F336-M362 HydrophobicContact CZ-CE 4.5Å; F336-M362 HydrophobicContact CZ-SD 4.5Å; L339-M362 HydrophobicContact CD1-CE 4.39Å; F347-M362 HydrophobicContact CE2-SD 4.09Å; F347-M362 HydrophobicContact CZ-SD 4.49Å; I358-M362 HydrophobicContact CG2-CG 4.29Å; I358-M362 HydrophobicContact CG2-SD 3.7Å; I358-M362 WeakPolarHBondContact O-CB 3.02Å; I358-M362 WeakPolarHBondContact O-CG 3.32Å; I358-M362 PolarHBondContact O-N 3.48Å; M362-S364 VanDerWaalsContact C-N 3.34Å; M362-S364 PolarHBondContact O-N 3.33Å; M362-L365 PolarHBondContact O-N 2.83Å; M362-I366 WeakPolarHBondContact O-CG1 3.28Å; M362-I366 PolarHBondContact O-N 3.06Å
363	T	98.8	Very high	98.5	Very high	40 Å²	40	52.1 Å²	52.1	25%	0.245	26%	0.257	C	S	.	.	H	α-helix	trans	-59.7	-44.4	176.7	-65.2	0	0	0	0	111.5	F336 R359 G361 L365 L367	F336-T363 WeakPolarHBondContact CE2-OG1 3.45Å; R359-T363 WeakPolarHBondContact O-CB 3.33Å; R359-T363 PolarHBondContact O-N 3.46Å; R359-T363 PolarHBondContact O-OG1 3.41Å; R359-T363 VanDerWaalsContact O-OG1 3.06Å; G361-T363 PolarHBondContact O-N 3.26Å; T363-L365 VanDerWaalsContact C-N 3.32Å; T363-L365 PolarHBondContact O-N 2.98Å; T363-L367 HydrophobicContact CG2-CD1 3.66Å; T363-L367 HydrophobicContact CG2-CG 4.21Å; T363-L367 VanDerWaalsContact O-CB 3.27Å; T363-L367 WeakPolarHBondContact O-CB 3.46Å; T363-L367 VanDerWaalsContact O-CG 3.24Å; T363-L367 WeakPolarHBondContact O-CG 3.48Å; T363-L367 PolarHBondContact O-N 3.44Å
364	S	98.7	Very high	98.5	Very high	52 Å²	52	48 Å²	48	36%	0.364	24%	0.238	S	C	.	.	H	α-helix	trans	-61.4	-40.6	178.6	-172.1	0	0	0	0	112.4	Q360 G361 M362 S368	Q360-S364 WeakPolarHBondContact O-CB 2.99Å; Q360-S364 PolarHBondContact O-N 3.17Å; G361-S364 PolarHBondContact O-N 3.13Å; M362-S364 VanDerWaalsContact C-N 3.34Å; M362-S364 PolarHBondContact O-N 3.33Å; S364-S368 WeakPolarHBondContact O-CB 3.2Å; S364-S368 PolarHBondContact O-N 2.89Å
365	L	98.9	Very high	98.4	Very high	6 Å²	6	49.3 Å²	49.3	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-72.8	-47.7	-178.7	-69.5	175.9	0	0	0	112.1	I290 L291 A294 G361 M362 T363 L367 S368 T369 K401 M402 I405	I290-L365 HydrophobicContact CG2-CD1 3.77Å; L291-L365 HydrophobicContact CD2-CD1 3.87Å; L291-L365 HydrophobicContact CD2-CD2 4.41Å; L291-L365 HydrophobicContact CG-CD1 4.45Å; A294-L365 HydrophobicContact CB-CB 3.74Å; A294-L365 HydrophobicContact CB-CD1 3.71Å; A294-L365 HydrophobicContact CB-CG 4.4Å; G361-L365 VanDerWaalsContact O-CG 3.29Å; G361-L365 WeakPolarHBondContact O-CG 3.42Å; G361-L365 PolarHBondContact O-N 3.34Å; M362-L365 PolarHBondContact O-N 2.83Å; T363-L365 VanDerWaalsContact C-N 3.32Å; T363-L365 PolarHBondContact O-N 2.98Å; L365-L367 PolarHBondContact O-N 3.4Å; L365-S368 WeakPolarHBondContact O-CB 3.39Å; L365-S368 PolarHBondContact O-N 2.85Å; L365-S368 PolarHBondContact O-OG 2.97Å; L365-T369 PolarHBondContact O-N 3.29Å; L365-K401 HydrophobicContact CD2-CB 3.94Å; L365-K401 WeakPolarHBondContact CD2-O 3.31Å; L365-M402 HydrophobicContact CD2-CG 4.37Å; L365-I405 HydrophobicContact CB-CD1 3.89Å; L365-I405 HydrophobicContact CB-CG2 4.28Å; L365-I405 HydrophobicContact CD2-CG2 3.99Å
366	I	98.9	Very high	98.4	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.7	-44.2	178.7	-63	170.9	0	0	0	109.9	A294 C297 H298 E328 H331 C332 M362 S368 T369	A294-I366 HydrophobicContact CB-CG1 4.25Å; C297-I366 HydrophobicContact CB-CD1 3.95Å; H298-I366 HydrophobicContact CB-CG1 4.4Å; E328-I366 HydrophobicContact CB-CG2 4.45Å; H331-I366 HydrophobicContact CB-CG2 4.05Å; C332-I366 VanDerWaalsContact SG-CB 3.53Å; C332-I366 WeakPolarHBondContact SG-CG2 3.37Å; M362-I366 WeakPolarHBondContact O-CG1 3.28Å; M362-I366 PolarHBondContact O-N 3.06Å; I366-S368 PolarHBondContact O-N 3.02Å; I366-T369 PolarHBondContact O-N 3.4Å; I366-T369 VanDerWaalsContact O-N 3.09Å; I366-T369 PolarHBondContact O-OG1 3.31Å
367	L	98.7	Very high	98.5	Very high	33 Å²	33	44.8 Å²	44.8	17%	0.173	24%	0.242	C	C	.	.	H	α-helix	trans	-65	-13.6	174.7	-68.6	178.1	0	0	0	113.9	E328 T363 L365 R373	E328-L367 HydrophobicContact CB-CD2 3.91Å; T363-L367 HydrophobicContact CG2-CD1 3.66Å; T363-L367 HydrophobicContact CG2-CG 4.21Å; T363-L367 VanDerWaalsContact O-CB 3.27Å; T363-L367 WeakPolarHBondContact O-CB 3.46Å; T363-L367 VanDerWaalsContact O-CG 3.24Å; T363-L367 WeakPolarHBondContact O-CG 3.48Å; T363-L367 PolarHBondContact O-N 3.44Å; L365-L367 PolarHBondContact O-N 3.4Å; L367-R373 VanDerWaalsContact O-CD 3.32Å; L367-R373 WeakPolarHBondContact O-CD 3.5Å; L367-R373 PolarHBondContact O-NH1 2.91Å
368	S	98.7	Very high	98.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-87	-14.3	176.8	77.7	0	0	0	0	113.1	S364 L365 I366 D370 I405 K406	S364-S368 WeakPolarHBondContact O-CB 3.2Å; S364-S368 PolarHBondContact O-N 2.89Å; L365-S368 WeakPolarHBondContact O-CB 3.39Å; L365-S368 PolarHBondContact O-N 2.85Å; L365-S368 PolarHBondContact O-OG 2.97Å; I366-S368 PolarHBondContact O-N 3.02Å; S368-D370 VanDerWaalsContact C-N 3.27Å; S368-D370 PolarHBondContact O-N 3.45Å; S368-I405 WeakPolarHBondContact OG-CG2 3.22Å; S368-K406 VanDerWaalsContact O-CD 3.25Å; S368-K406 WeakPolarHBondContact O-CD 3.35Å; S368-K406 WeakPolarHBondContact O-CG 3.41Å; S368-K406 PolarHBondContact O-NZ 2.9Å
369	T	98.7	Very high	98.4	Very high	4 Å²	4	45.3 Å²	45.3	3%	0.025	25%	0.248	C	C	.	.	H	α-helix	trans	-68.6	-28.4	176.3	61.6	0	0	0	0	111.4	H298 L365 I366 M371 I405 K406	H298-T369 HydrophobicContact CB-CG2 4.24Å; L365-T369 PolarHBondContact O-N 3.29Å; I366-T369 PolarHBondContact O-N 3.4Å; I366-T369 VanDerWaalsContact O-N 3.09Å; I366-T369 PolarHBondContact O-OG1 3.31Å; T369-M371 PolarHBondContact O-N 3.15Å; T369-M371 VanDerWaalsContact O-N 3.14Å; T369-I405 HydrophobicContact CG2-CD1 4.02Å; T369-I405 HydrophobicContact CG2-CG1 3.99Å; T369-I405 HydrophobicContact CG2-CG2 4.41Å; T369-K406 PolarHBondContact O-NZ 3.36Å
370	D	98.6	Very high	98.4	Very high	15 Å²	15	41.1 Å²	41.1	8%	0.08	24%	0.235	C	C	.	.			trans	-47.3	120.6	172.4	-173.5	-6.7	0	0	0	111.6	S325 E328 S368 A372 R373 K406	S325-D370 VanDerWaalsContact CB-OD2 3.3Å; S325-D370 WeakPolarHBondContact CB-OD2 3.35Å; S325-D370 PolarHBondContact OG-OD2 2.94Å; E328-D370 HydrophobicContact CG-CB 3.88Å; S368-D370 VanDerWaalsContact C-N 3.27Å; S368-D370 PolarHBondContact O-N 3.45Å; D370-A372 VanDerWaalsContact C-N 3.26Å; D370-A372 PolarHBondContact O-N 2.92Å; D370-A372 WeakPolarHBondContact OD1-CB 3.39Å; D370-A372 PolarHBondContact OD1-N 2.96Å; D370-R373 HydrophobicContact CB-CG 4.38Å; D370-R373 PolarHBondContact O-N 3.47Å; D370-R373 VanDerWaalsContact O-N 3.15Å; D370-K406 PolarHBondContact O-NZ 3.45Å
371	M	97.4	Very high	98.4	Very high	79 Å²	79	35 Å²	35	39%	0.389	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-70.1	-19.9	-179	-72.8	-57.3	-64.1	0	0	113.4	T369 R373 H374 V467	T369-M371 PolarHBondContact O-N 3.15Å; T369-M371 VanDerWaalsContact O-N 3.14Å; M371-R373 PolarHBondContact O-N 3.47Å; M371-H374 HydrophobicContact CE-CB 3.91Å; M371-H374 VanDerWaalsContact O-CB 3.24Å; M371-H374 WeakPolarHBondContact O-CB 3.34Å; M371-H374 PolarHBondContact O-N 3.41Å; M371-H374 VanDerWaalsContact O-N 3.17Å; M371-H374 HydrophobicContact SD-CB 4.28Å; M371-V467 HydrophobicContact CE-CG1 3.81Å
372	A	97.6	Very high	98.4	Very high	89 Å²	89	38.1 Å²	38.1	74%	0.736	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-62.7	-25.6	171.1	0	0	0	0	0	112.5	D370	D370-A372 VanDerWaalsContact C-N 3.26Å; D370-A372 PolarHBondContact O-N 2.92Å; D370-A372 WeakPolarHBondContact OD1-CB 3.39Å; D370-A372 PolarHBondContact OD1-N 2.96Å
373	R	97.8	Very high	98.4	Very high	71 Å²	71	42.5 Å²	42.5	27%	0.268	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-93.1	-4.6	179	-57.9	-174.8	68.1	-158.5	-0.2	113.7	L367 D370 M371 G375 E376 I377	L367-R373 VanDerWaalsContact O-CD 3.32Å; L367-R373 WeakPolarHBondContact O-CD 3.5Å; L367-R373 PolarHBondContact O-NH1 2.91Å; D370-R373 HydrophobicContact CB-CG 4.38Å; D370-R373 PolarHBondContact O-N 3.47Å; D370-R373 VanDerWaalsContact O-N 3.15Å; M371-R373 PolarHBondContact O-N 3.47Å; R373-G375 PolarHBondContact O-N 3.19Å; R373-E376 PolarHBondContact O-N 3.41Å; R373-I377 HydrophobicContact CB-CD1 3.92Å; R373-I377 WeakPolarHBondContact O-CD1 3.43Å; R373-I377 WeakPolarHBondContact O-CG1 3.48Å; R373-I377 PolarHBondContact O-N 3.24Å; R373-I377 VanDerWaalsContact O-N 3.13Å
374	H	98.3	Very high	98.4	Very high	25 Å²	25	41.1 Å²	41.1	12%	0.116	22%	0.22	C	C	.	.	H	α-helix	trans	-55.1	-48	-175.4	174.9	87.9	0	0	0	112.5	M371 E376 I377 L378 K406	M371-H374 HydrophobicContact CE-CB 3.91Å; M371-H374 VanDerWaalsContact O-CB 3.24Å; M371-H374 WeakPolarHBondContact O-CB 3.34Å; M371-H374 PolarHBondContact O-N 3.41Å; M371-H374 VanDerWaalsContact O-N 3.17Å; M371-H374 HydrophobicContact SD-CB 4.28Å; H374-E376 PolarHBondContact O-N 2.95Å; H374-I377 PolarHBondContact O-N 3.4Å; H374-L378 WeakPolarHBondContact O-CB 3.38Å; H374-L378 PolarHBondContact O-N 3.22Å; H374-K406 WeakPolarHBondContact ND1-CE 3.39Å
375	G	97.8	Very high	98.4	Very high	46 Å²	46	40.9 Å²	40.9	47%	0.474	21%	0.214	S	C	.	.	H	α-helix	trans	-61.1	-46	-178.1	0	0	0	0	0	113.2	R373 E379	R373-G375 PolarHBondContact O-N 3.19Å; G375-E379 VanDerWaalsContact O-CB 3.26Å; G375-E379 WeakPolarHBondContact O-CB 3.43Å; G375-E379 PolarHBondContact O-N 3.37Å
376	E	98.2	Very high	98.3	Very high	125 Å²	125	48.2 Å²	48.2	58%	0.584	25%	0.249	S	C	*	.	H	α-helix	trans	-62.8	-46.9	179.6	-176.4	-161.4	161.2	0	0	112.1	R373 H374 T380	R373-E376 PolarHBondContact O-N 3.41Å; H374-E376 PolarHBondContact O-N 2.95Å; E376-T380 WeakPolarHBondContact O-CB 3.41Å; E376-T380 PolarHBondContact O-N 2.96Å; E376-T380 PolarHBondContact O-OG1 3.45Å
377	I	98.6	Very high	98.2	Very high	5 Å²	5	53.8 Å²	53.8	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-64.5	-47	-178.8	-67.4	163.4	0	0	0	110	R373 H374 E379 T380 M381 M402 V403 K406	R373-I377 HydrophobicContact CB-CD1 3.92Å; R373-I377 WeakPolarHBondContact O-CD1 3.43Å; R373-I377 WeakPolarHBondContact O-CG1 3.48Å; R373-I377 PolarHBondContact O-N 3.24Å; R373-I377 VanDerWaalsContact O-N 3.13Å; H374-I377 PolarHBondContact O-N 3.4Å; I377-E379 VanDerWaalsContact C-N 3.34Å; I377-E379 PolarHBondContact O-N 2.84Å; I377-T380 PolarHBondContact O-N 3.38Å; I377-M381 PolarHBondContact O-N 3Å; I377-M402 HydrophobicContact CG2-CB 4.05Å; I377-V403 HydrophobicContact CG2-CG2 4Å; I377-K406 HydrophobicContact CD1-CD 4.1Å
378	L	98.4	Very high	98.1	Very high	7 Å²	7	54.2 Å²	54.2	4%	0.037	29%	0.287	C	S	.	.	H	α-helix	trans	-69.9	-34.4	-176.6	-162.7	64.8	0	0	0	111.9	H374 T380 M381 R382 M471 T474	H374-L378 WeakPolarHBondContact O-CB 3.38Å; H374-L378 PolarHBondContact O-N 3.22Å; L378-T380 VanDerWaalsContact C-N 3.33Å; L378-M381 PolarHBondContact O-N 3.4Å; L378-R382 VanDerWaalsContact CD2-NH1 3.25Å; L378-R382 VanDerWaalsContact CG-NH1 3.26Å; L378-R382 WeakPolarHBondContact O-CG 3.4Å; L378-R382 PolarHBondContact O-N 3.33Å; L378-M471 HydrophobicContact CD1-CB 4.4Å; L378-M471 HydrophobicContact CD1-CG 4.16Å; L378-M471 HydrophobicContact CD2-CB 4.47Å; L378-T474 HydrophobicContact CD1-CG2 3.56Å; L378-T474 HydrophobicContact CG-CG2 4.27Å
379	E	98.5	Very high	98	Very high	90 Å²	90	56.3 Å²	56.3	42%	0.421	30%	0.296	S	S	.	.	H	α-helix	trans	-64.3	-40	172.3	-173.6	56.3	-152.5	0	0	111.9	G375 I377 R382 R383	G375-E379 VanDerWaalsContact O-CB 3.26Å; G375-E379 WeakPolarHBondContact O-CB 3.43Å; G375-E379 PolarHBondContact O-N 3.37Å; I377-E379 VanDerWaalsContact C-N 3.34Å; I377-E379 PolarHBondContact O-N 2.84Å; E379-R382 PolarHBondContact O-N 3.05Å; E379-R382 IonicContact OE2-CZ 2.76Å; E379-R382 VanDerWaalsContact OE2-CZ 3.29Å; E379-R382 IonicContact OE2-NE 2.7Å; E379-R382 PolarHBondContact OE2-NE 3.33Å; E379-R382 IonicContact OE2-NH2 3.93Å; E379-R382 PolarHBondContact OE2-NH2 2.92Å; E379-R383 PolarHBondContact O-N 2.96Å
380	T	98.6	Very high	98	Very high	30 Å²	30	58 Å²	58	18%	0.184	31%	0.308	C	S	.	.	H	α-helix	trans	-65.8	-39.9	174.9	-61.9	0	0	0	0	111.9	E376 I377 L378 R383 H384 T399	E376-T380 WeakPolarHBondContact O-CB 3.41Å; E376-T380 PolarHBondContact O-N 2.96Å; E376-T380 PolarHBondContact O-OG1 3.45Å; I377-T380 PolarHBondContact O-N 3.38Å; L378-T380 VanDerWaalsContact C-N 3.33Å; T380-R383 PolarHBondContact O-N 2.96Å; T380-R383 PolarHBondContact OG1-NH1 2.92Å; T380-R383 PolarHBondContact OG1-NH2 3.26Å; T380-H384 PolarHBondContact O-CD2 2.98Å; T380-H384 VanDerWaalsContact O-CD2 3.28Å; T380-H384 VanDerWaalsContact O-CG 3.31Å; T380-H384 PolarHBondContact O-N 3.28Å; T380-T399 HydrophobicContact CG2-CG2 4.01Å
381	M	98.6	Very high	97.8	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-62.7	-45.2	173.5	-176.8	61.3	-170.5	0	0	111.9	I377 L378 R383 H384 L385 F389 T399 F400 V403 V478	I377-M381 PolarHBondContact O-N 3Å; L378-M381 PolarHBondContact O-N 3.4Å; M381-R383 PolarHBondContact O-N 3.25Å; M381-H384 PolarHBondContact O-N 3.18Å; M381-L385 HydrophobicContact CE-CD1 4.13Å; M381-L385 HydrophobicContact CE-CD2 3.87Å; M381-L385 HydrophobicContact CE-CG 3.92Å; M381-L385 HydrophobicContact CG-CD1 4.36Å; M381-L385 WeakPolarHBondContact O-CG 3.26Å; M381-L385 PolarHBondContact O-N 3.35Å; M381-F389 HydrophobicContact CE-CD2 3.91Å; M381-F389 HydrophobicContact CE-CE2 3.87Å; M381-F389 HydrophobicContact SD-CD2 4.33Å; M381-F389 HydrophobicContact SD-CE2 4.18Å; M381-T399 HydrophobicContact CB-CG2 3.91Å; M381-T399 HydrophobicContact SD-CG2 4.34Å; M381-F400 HydrophobicContact CE-CD2 3.67Å; M381-F400 HydrophobicContact CE-CE2 4.26Å; M381-F400 HydrophobicContact SD-CD2 4.27Å; M381-V403 HydrophobicContact CB-CG2 3.87Å; M381-V403 HydrophobicContact CG-CG2 3.96Å; M381-V478 HydrophobicContact CE-CG2 3.82Å
382	R	98.4	Very high	97.7	Very high	83 Å²	83	62.3 Å²	62.3	31%	0.313	33%	0.332	S	S	.	.	H	α-helix	trans	-58.3	-46.1	176.6	-78	-172.7	-69.6	-94.2	-0.3	112	L378 E379 H384 L385 E386 T474	L378-R382 VanDerWaalsContact CD2-NH1 3.25Å; L378-R382 VanDerWaalsContact CG-NH1 3.26Å; L378-R382 WeakPolarHBondContact O-CG 3.4Å; L378-R382 PolarHBondContact O-N 3.33Å; E379-R382 PolarHBondContact O-N 3.05Å; E379-R382 IonicContact OE2-CZ 2.76Å; E379-R382 VanDerWaalsContact OE2-CZ 3.29Å; E379-R382 IonicContact OE2-NE 2.7Å; E379-R382 PolarHBondContact OE2-NE 3.33Å; E379-R382 IonicContact OE2-NH2 3.93Å; E379-R382 PolarHBondContact OE2-NH2 2.92Å; R382-H384 VanDerWaalsContact C-N 3.34Å; R382-H384 PolarHBondContact O-N 3.47Å; R382-L385 WeakPolarHBondContact O-CB 3.32Å; R382-L385 PolarHBondContact O-N 3Å; R382-L385 VanDerWaalsContact O-N 3.08Å; R382-E386 WeakPolarHBondContact O-CG 3.39Å; R382-E386 PolarHBondContact O-N 3.45Å; R382-T474 HydrophobicContact CG-CG2 4.28Å
383	R	98.5	Very high	97.7	Very high	93 Å²	93	62.6 Å²	62.6	35%	0.351	32%	0.317	S	S	.	.	H	α-helix	trans	-57.2	-46.2	175.2	-166	-170.8	-44.4	108.1	12.5	112	E379 T380 M381 L385 E386 E387	E379-R383 PolarHBondContact O-N 2.96Å; T380-R383 PolarHBondContact O-N 2.96Å; T380-R383 PolarHBondContact OG1-NH1 2.92Å; T380-R383 PolarHBondContact OG1-NH2 3.26Å; M381-R383 PolarHBondContact O-N 3.25Å; R383-L385 VanDerWaalsContact C-N 3.28Å; R383-L385 PolarHBondContact O-N 3.28Å; R383-E386 PolarHBondContact O-N 2.92Å; R383-E387 WeakPolarHBondContact CG-OE1 3.37Å; R383-E387 WeakPolarHBondContact O-CB 3.33Å; R383-E387 VanDerWaalsContact O-CG 3.31Å; R383-E387 WeakPolarHBondContact O-CG 3.39Å; R383-E387 PolarHBondContact O-N 3.4Å
384	H	98.5	Very high	97.7	Very high	10 Å²	10	66.1 Å²	66.1	5%	0.046	33%	0.334	C	S	.	.	H	α-helix	trans	-62.5	-32.7	176.3	-69.6	-31.4	0	0	0	113.5	T380 M381 R382 G388 F389 H396 T399	T380-H384 PolarHBondContact O-CD2 2.98Å; T380-H384 VanDerWaalsContact O-CD2 3.28Å; T380-H384 VanDerWaalsContact O-CG 3.31Å; T380-H384 PolarHBondContact O-N 3.28Å; M381-H384 PolarHBondContact O-N 3.18Å; R382-H384 VanDerWaalsContact C-N 3.34Å; R382-H384 PolarHBondContact O-N 3.47Å; H384-G388 CarbonylContact O-C 3.53Å; H384-F389 HydrophobicContact CB-CD2 4.38Å; H384-F389 VanDerWaalsContact O-CA 3.25Å; H384-F389 WeakPolarHBondContact O-CA 3.45Å; H384-F389 PolarHBondContact O-N 3.08Å; H384-H396 AromaticContact CE1-CD2 3.74Å; H384-H396 AromaticContact CG-CD2 3.72Å; H384-H396 AromaticContact CG-CE1 3.98Å; H384-H396 AromaticContact CG-CG 3.83Å; H384-H396 AromaticContact CG-ND1 3.99Å; H384-H396 AromaticContact CG-NE2 3.88Å; H384-H396 AromaticContact ND1-CD2 3.41Å; H384-H396 PolarHBondContact ND1-CD2 3.37Å; H384-H396 AromaticContact ND1-CE1 3.88Å; H384-H396 AromaticContact ND1-NE2 3.39Å; H384-H396 PolarHBondContact ND1-NE2 2.84Å; H384-H396 PolarHBondContact O-CE1 3.36Å; H384-T399 PolarHBondContact NE2-OG1 3.02Å
385	L	98.2	Very high	97.7	Very high	48 Å²	48	71.3 Å²	71.3	25%	0.251	36%	0.358	S	S	.	.	H	α-helix	trans	-68.2	-46.3	173.9	-70.4	167.9	0	0	0	111.3	M381 R382 R383 E387 G388 F389 T474 S477 V478	M381-L385 HydrophobicContact CE-CD1 4.13Å; M381-L385 HydrophobicContact CE-CD2 3.87Å; M381-L385 HydrophobicContact CE-CG 3.92Å; M381-L385 HydrophobicContact CG-CD1 4.36Å; M381-L385 WeakPolarHBondContact O-CG 3.26Å; M381-L385 PolarHBondContact O-N 3.35Å; R382-L385 WeakPolarHBondContact O-CB 3.32Å; R382-L385 PolarHBondContact O-N 3Å; R382-L385 VanDerWaalsContact O-N 3.08Å; R383-L385 VanDerWaalsContact C-N 3.28Å; R383-L385 PolarHBondContact O-N 3.28Å; L385-E387 VanDerWaalsContact C-N 3.34Å; L385-E387 PolarHBondContact O-N 2.96Å; L385-G388 PolarHBondContact O-N 2.87Å; L385-F389 HydrophobicContact CD2-CB 3.88Å; L385-F389 HydrophobicContact CD2-CG 4.31Å; L385-T474 HydrophobicContact CD1-CG2 4.41Å; L385-S477 WeakPolarHBondContact CD1-OG 3.43Å; L385-S477 VanDerWaalsContact CD2-OG 3.26Å; L385-S477 WeakPolarHBondContact CD2-OG 3.45Å; L385-V478 HydrophobicContact CD2-CG2 3.65Å
386	E	97.5	Very high	97.7	Very high	160 Å²	160	69.4 Å²	69.4	75%	0.748	34%	0.337	S	S	*	.	H	α-helix	trans	-62.7	-38.4	178.4	-70.2	173	-175.6	0	0	112.5	R382 R383 G388	R382-E386 WeakPolarHBondContact O-CG 3.39Å; R382-E386 PolarHBondContact O-N 3.45Å; R383-E386 PolarHBondContact O-N 2.92Å; E386-G388 PolarHBondContact O-N 2.87Å
387	E	96.2	Very high	97.7	Very high	117 Å²	117	65.3 Å²	65.3	55%	0.547	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	0.7	177.6	-69.1	172.4	179.5	0	0	114.1	R383 L385	R383-E387 WeakPolarHBondContact CG-OE1 3.37Å; R383-E387 WeakPolarHBondContact O-CB 3.33Å; R383-E387 VanDerWaalsContact O-CG 3.31Å; R383-E387 WeakPolarHBondContact O-CG 3.39Å; R383-E387 PolarHBondContact O-N 3.4Å; L385-E387 VanDerWaalsContact C-N 3.34Å; L385-E387 PolarHBondContact O-N 2.96Å
388	G	96.8	Very high	97.7	Very high	42 Å²	42	68.8 Å²	68.8	43%	0.433	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	92.3	-171.1	0	0	0	0	0	111.2	H384 L385 E386 S390	H384-G388 CarbonylContact O-C 3.53Å; L385-G388 PolarHBondContact O-N 2.87Å; E386-G388 PolarHBondContact O-N 2.87Å; G388-S390 PolarHBondContact O-N 3.31Å
389	F	97.9	Very high	97.7	Very high	43 Å²	43	68.9 Å²	68.9	19%	0.189	33%	0.333	C	S	.	.			trans	-62.2	134.9	178.8	177.2	-89.7	0	0	0	111.2	M381 H384 L385 M391 H396 F400 V478	M381-F389 HydrophobicContact CE-CD2 3.91Å; M381-F389 HydrophobicContact CE-CE2 3.87Å; M381-F389 HydrophobicContact SD-CD2 4.33Å; M381-F389 HydrophobicContact SD-CE2 4.18Å; H384-F389 HydrophobicContact CB-CD2 4.38Å; H384-F389 VanDerWaalsContact O-CA 3.25Å; H384-F389 WeakPolarHBondContact O-CA 3.45Å; H384-F389 PolarHBondContact O-N 3.08Å; L385-F389 HydrophobicContact CD2-CB 3.88Å; L385-F389 HydrophobicContact CD2-CG 4.31Å; F389-M391 HydrophobicContact CE1-CE 3.88Å; F389-M391 HydrophobicContact CZ-CE 3.86Å; F389-M391 HydrophobicContact CZ-SD 4.41Å; F389-H396 WeakPolarHBondContact CA-ND1 3.16Å; F389-H396 HydrophobicContact CD2-CB 4Å; F389-H396 AromaticContact CD2-ND1 3.81Å; F389-H396 HydrophobicContact CE2-CB 3.85Å; F389-F400 HydrophobicContact CE2-CB 3.97Å; F389-F400 HydrophobicContact CE2-CD2 4.34Å; F389-F400 HydrophobicContact CE2-CG 4.31Å; F389-F400 HydrophobicContact CZ-CB 3.92Å; F389-F400 HydrophobicContact CZ-CD1 4.47Å; F389-F400 HydrophobicContact CZ-CD2 4.09Å; F389-F400 AromaticContact CZ-CG 3.91Å; F389-F400 HydrophobicContact CZ-CG 3.91Å; F389-V478 HydrophobicContact CD1-CG1 3.8Å; F389-V478 HydrophobicContact CD1-CG2 3.89Å; F389-V478 HydrophobicContact CE1-CG1 3.57Å; F389-V478 HydrophobicContact CE1-CG2 4.06Å; F389-V478 HydrophobicContact CG-CG2 4.2Å; F389-V478 HydrophobicContact CZ-CG1 4.45Å
390	S	97.3	Very high	97.7	Very high	39 Å²	39	64.6 Å²	64.6	27%	0.273	31%	0.313	S	S	.	.			trans	-141.4	125.7	175.4	-177.4	0	0	0	0	110.7	G388 N392 K393 H396	G388-S390 PolarHBondContact O-N 3.31Å; S390-N392 PolarHBondContact O-N 3.13Å; S390-N392 VanDerWaalsContact O-N 3.11Å; S390-N392 PolarHBondContact OG-N 3.2Å; S390-K393 PolarHBondContact O-N 3.4Å; S390-H396 PolarHBondContact N-ND1 2.92Å; S390-H396 WeakPolarHBondContact O-CB 3.45Å
391	M	95.3	Very high	97.7	Very high	28 Å²	28	64.5 Å²	64.5	14%	0.138	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-14.4	176.6	-163	56	76	0	0	113.3	L279 F283 F389 R397 F400 Y479	L279-M391 HydrophobicContact CD2-CE 4.01Å; F283-M391 HydrophobicContact CE1-SD 4.11Å; F283-M391 HydrophobicContact CZ-SD 4.44Å; F389-M391 HydrophobicContact CE1-CE 3.88Å; F389-M391 HydrophobicContact CZ-CE 3.86Å; F389-M391 HydrophobicContact CZ-SD 4.41Å; M391-R397 WeakPolarHBondContact O-CD 3.47Å; M391-R397 HydrophobicContact SD-CB 4.32Å; M391-R397 HydrophobicContact SD-CG 3.85Å; M391-F400 HydrophobicContact CE-CD1 3.64Å; M391-F400 HydrophobicContact CE-CE1 3.76Å; M391-F400 HydrophobicContact CE-CG 4.4Å; M391-F400 HydrophobicContact SD-CD1 4.42Å; M391-Y479 HydrophobicContact CE-CE2 4.17Å; M391-Y479 WeakPolarHBondContact CE-OH 3.34Å
392	N	95.8	Very high	97.7	Very high	158 Å²	158	65.7 Å²	65.7	85%	0.845	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-16.9	176.3	-63.8	-34.8	0	0	0	113.3	S390	S390-N392 PolarHBondContact O-N 3.13Å; S390-N392 VanDerWaalsContact O-N 3.11Å; S390-N392 PolarHBondContact OG-N 3.2Å
393	K	97.6	Very high	97.8	Very high	95 Å²	95	61.8 Å²	61.8	41%	0.413	30%	0.302	S	S	.	.	S	Bend	trans	-83.9	121.8	175.7	-71.1	177.4	178.1	175.7	0	108.9	S390 E395 H396 R397	S390-K393 PolarHBondContact O-N 3.4Å; K393-E395 PolarHBondContact O-N 3.22Å; K393-H396 HydrophobicContact CB-CB 3.99Å; K393-H396 VanDerWaalsContact CD-NE2 3.28Å; K393-H396 WeakPolarHBondContact CD-NE2 3.32Å; K393-H396 PolarHBondContact O-N 3.46Å; K393-R397 WeakPolarHBondContact O-CB 3.43Å; K393-R397 PolarHBondContact O-N 3.24Å
394	K	97.1	Very high	97.8	Very high	145 Å²	145	57.4 Å²	57.4	63%	0.63	29%	0.285	S	S	*	.	H	α-helix	trans	-53	-49.9	-176.7	-178.1	-178.8	171.2	-174.7	0	112.7	H396 R397 E398	K394-H396 PolarHBondContact O-N 3Å; K394-R397 PolarHBondContact O-N 3.06Å; K394-E398 WeakPolarHBondContact CE-OE1 3.47Å; K394-E398 HydrophobicContact CG-CG 4.41Å; K394-E398 IonicContact NZ-OE1 3.03Å; K394-E398 WeakPolarHBondContact O-CB 3.49Å; K394-E398 WeakPolarHBondContact O-CG 3.44Å; K394-E398 PolarHBondContact O-N 2.85Å
395	E	97.8	Very high	97.8	Very high	134 Å²	134	56.9 Å²	56.9	63%	0.626	28%	0.283	S	S	*	.	H	α-helix	trans	-63.1	-42.8	-178.5	-65.1	175.3	-177	0	0	112.2	K393 R397 E398 T399	K393-E395 PolarHBondContact O-N 3.22Å; E395-R397 VanDerWaalsContact C-N 3.32Å; E395-R397 PolarHBondContact O-N 2.96Å; E395-E398 PolarHBondContact O-N 3.1Å; E395-T399 WeakPolarHBondContact O-CB 3.43Å; E395-T399 PolarHBondContact O-N 3.02Å; E395-T399 PolarHBondContact O-OG1 3.29Å; E395-T399 VanDerWaalsContact O-OG1 3.09Å
396	H	98.4	Very high	97.8	Very high	6 Å²	6	54.8 Å²	54.8	3%	0.028	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-44.4	176.4	-69.6	-136.3	0	0	0	110.7	H384 F389 S390 K393 K394 F400	H384-H396 AromaticContact CE1-CD2 3.74Å; H384-H396 AromaticContact CG-CD2 3.72Å; H384-H396 AromaticContact CG-CE1 3.98Å; H384-H396 AromaticContact CG-CG 3.83Å; H384-H396 AromaticContact CG-ND1 3.99Å; H384-H396 AromaticContact CG-NE2 3.88Å; H384-H396 AromaticContact ND1-CD2 3.41Å; H384-H396 PolarHBondContact ND1-CD2 3.37Å; H384-H396 AromaticContact ND1-CE1 3.88Å; H384-H396 AromaticContact ND1-NE2 3.39Å; H384-H396 PolarHBondContact ND1-NE2 2.84Å; H384-H396 PolarHBondContact O-CE1 3.36Å; F389-H396 WeakPolarHBondContact CA-ND1 3.16Å; F389-H396 HydrophobicContact CD2-CB 4Å; F389-H396 AromaticContact CD2-ND1 3.81Å; F389-H396 HydrophobicContact CE2-CB 3.85Å; S390-H396 PolarHBondContact N-ND1 2.92Å; S390-H396 WeakPolarHBondContact O-CB 3.45Å; K393-H396 HydrophobicContact CB-CB 3.99Å; K393-H396 VanDerWaalsContact CD-NE2 3.28Å; K393-H396 WeakPolarHBondContact CD-NE2 3.32Å; K393-H396 PolarHBondContact O-N 3.46Å; K394-H396 PolarHBondContact O-N 3Å; H396-F400 VanDerWaalsContact O-CB 3.25Å; H396-F400 WeakPolarHBondContact O-CB 3.44Å; H396-F400 PolarHBondContact O-N 3.02Å
397	R	98	Very high	97.9	Very high	39 Å²	39	47.2 Å²	47.2	15%	0.147	24%	0.236	C	C	.	.	H	α-helix	trans	-66.2	-38.8	179.5	-171.5	177.8	-179.3	100.8	-23.4	112.2	D282 F283 E287 M391 K393 K394 E395 K401	D282-R397 PolarHBondContact O-NH1 2.71Å; D282-R397 PolarHBondContact O-NH2 2.99Å; F283-R397 VanDerWaalsContact CD1-NH2 3.35Å; F283-R397 HydrophobicContact CE1-CG 3.99Å; E287-R397 IonicContact OE1-CZ 2.93Å; E287-R397 IonicContact OE1-NE 3.79Å; E287-R397 PolarHBondContact OE1-NE 2.91Å; E287-R397 IonicContact OE1-NH2 3.38Å; E287-R397 IonicContact OE2-CZ 2.77Å; E287-R397 IonicContact OE2-NE 3.45Å; E287-R397 PolarHBondContact OE2-NE 2.98Å; E287-R397 IonicContact OE2-NH2 2.76Å; E287-R397 PolarHBondContact OE2-NH2 3.25Å; M391-R397 WeakPolarHBondContact O-CD 3.47Å; M391-R397 HydrophobicContact SD-CB 4.32Å; M391-R397 HydrophobicContact SD-CG 3.85Å; K393-R397 WeakPolarHBondContact O-CB 3.43Å; K393-R397 PolarHBondContact O-N 3.24Å; K394-R397 PolarHBondContact O-N 3.06Å; E395-R397 VanDerWaalsContact C-N 3.32Å; E395-R397 PolarHBondContact O-N 2.96Å; R397-K401 WeakPolarHBondContact O-CG 3.38Å; R397-K401 PolarHBondContact O-N 2.88Å; R397-K401 VanDerWaalsContact O-N 3.1Å
398	E	98.5	Very high	98	Very high	77 Å²	77	41.7 Å²	41.7	36%	0.36	21%	0.211	S	C	.	.	H	α-helix	trans	-67.4	-47.1	175.6	-74.4	174.2	163.9	0	0	111.6	K394 E395 F400 K401 M402	K394-E398 WeakPolarHBondContact CE-OE1 3.47Å; K394-E398 HydrophobicContact CG-CG 4.41Å; K394-E398 IonicContact NZ-OE1 3.03Å; K394-E398 WeakPolarHBondContact O-CB 3.49Å; K394-E398 WeakPolarHBondContact O-CG 3.44Å; K394-E398 PolarHBondContact O-N 2.85Å; E395-E398 PolarHBondContact O-N 3.1Å; E398-F400 VanDerWaalsContact C-N 3.32Å; E398-F400 PolarHBondContact O-N 2.77Å; E398-K401 PolarHBondContact O-N 3.29Å; E398-M402 PolarHBondContact O-N 3.15Å; E398-M402 VanDerWaalsContact O-N 3.13Å
399	T	98.7	Very high	98.1	Very high	9 Å²	9	40.7 Å²	40.7	6%	0.055	20%	0.195	C	C	.	.	H	α-helix	trans	-59.7	-42.7	174.1	-59.9	0	0	0	0	111.9	T380 M381 H384 E395 K401 M402 V403	T380-T399 HydrophobicContact CG2-CG2 4.01Å; M381-T399 HydrophobicContact CB-CG2 3.91Å; M381-T399 HydrophobicContact SD-CG2 4.34Å; H384-T399 PolarHBondContact NE2-OG1 3.02Å; E395-T399 WeakPolarHBondContact O-CB 3.43Å; E395-T399 PolarHBondContact O-N 3.02Å; E395-T399 PolarHBondContact O-OG1 3.29Å; E395-T399 VanDerWaalsContact O-OG1 3.09Å; T399-K401 VanDerWaalsContact C-N 3.35Å; T399-K401 PolarHBondContact O-N 3.39Å; T399-M402 WeakPolarHBondContact O-CB 3.44Å; T399-M402 PolarHBondContact O-N 2.75Å; T399-M402 VanDerWaalsContact O-N 3.15Å; T399-V403 PolarHBondContact O-N 3.15Å
400	F	98.7	Very high	98.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.5	-42.4	177.7	-172.1	-113.6	0	0	0	112	L279 F283 M381 F389 M391 H396 E398 M402 V403 L404 V475 V478 Y479	L279-F400 HydrophobicContact CD1-CE1 3.99Å; L279-F400 HydrophobicContact CD1-CZ 4.49Å; L279-F400 HydrophobicContact CD2-CE1 4.05Å; F283-F400 HydrophobicContact CZ-CD1 4.16Å; F283-F400 HydrophobicContact CZ-CE1 4.46Å; M381-F400 HydrophobicContact CE-CD2 3.67Å; M381-F400 HydrophobicContact CE-CE2 4.26Å; M381-F400 HydrophobicContact SD-CD2 4.27Å; F389-F400 HydrophobicContact CE2-CB 3.97Å; F389-F400 HydrophobicContact CE2-CD2 4.34Å; F389-F400 HydrophobicContact CE2-CG 4.31Å; F389-F400 HydrophobicContact CZ-CB 3.92Å; F389-F400 HydrophobicContact CZ-CD1 4.47Å; F389-F400 HydrophobicContact CZ-CD2 4.09Å; F389-F400 AromaticContact CZ-CG 3.91Å; F389-F400 HydrophobicContact CZ-CG 3.91Å; M391-F400 HydrophobicContact CE-CD1 3.64Å; M391-F400 HydrophobicContact CE-CE1 3.76Å; M391-F400 HydrophobicContact CE-CG 4.4Å; M391-F400 HydrophobicContact SD-CD1 4.42Å; H396-F400 VanDerWaalsContact O-CB 3.25Å; H396-F400 WeakPolarHBondContact O-CB 3.44Å; H396-F400 PolarHBondContact O-N 3.02Å; E398-F400 VanDerWaalsContact C-N 3.32Å; E398-F400 PolarHBondContact O-N 2.77Å; F400-M402 VanDerWaalsContact C-N 3.31Å; F400-M402 PolarHBondContact O-N 3.45Å; F400-V403 PolarHBondContact O-N 2.94Å; F400-V403 VanDerWaalsContact O-N 3.15Å; F400-L404 HydrophobicContact CD1-CD1 3.92Å; F400-L404 HydrophobicContact CD1-CG 4.18Å; F400-L404 HydrophobicContact CE1-CD1 3.68Å; F400-L404 HydrophobicContact CE1-CD2 4.05Å; F400-L404 HydrophobicContact CE1-CG 3.93Å; F400-L404 HydrophobicContact CE2-CD2 4.48Å; F400-L404 HydrophobicContact CZ-CD1 4.37Å; F400-L404 HydrophobicContact CZ-CD2 3.9Å; F400-L404 HydrophobicContact CZ-CG 4.18Å; F400-L404 WeakPolarHBondContact O-CG 3.49Å; F400-L404 PolarHBondContact O-N 2.93Å; F400-V475 HydrophobicContact CE2-CG1 4.06Å; F400-V475 HydrophobicContact CE2-CG2 4.48Å; F400-V475 HydrophobicContact CZ-CG1 4.07Å; F400-V478 HydrophobicContact CE2-CB 4.43Å; F400-V478 HydrophobicContact CE2-CG2 4.32Å; F400-Y479 HydrophobicContact CE1-CD2 4.42Å; F400-Y479 AromaticContact CE1-CE2 3.79Å; F400-Y479 HydrophobicContact CE1-CE2 3.79Å; F400-Y479 HydrophobicContact CE2-CD2 4.47Å; F400-Y479 HydrophobicContact CE2-CE2 4.42Å; F400-Y479 AromaticContact CZ-CD2 3.69Å; F400-Y479 HydrophobicContact CZ-CD2 3.69Å; F400-Y479 AromaticContact CZ-CE2 3.49Å; F400-Y479 HydrophobicContact CZ-CE2 3.49Å; F400-Y479 VanDerWaalsContact CZ-CE2 3.49Å
401	K	98.8	Very high	98.1	Very high	28 Å²	28	37.8 Å²	37.8	12%	0.122	18%	0.179	C	C	.	.	H	α-helix	trans	-61.4	-36.7	174.7	-72.9	-176.5	-65.5	-166.1	0	112.7	F283 E287 L291 L365 R397 E398 T399 L404 I405	F283-K401 HydrophobicContact CE1-CD 4.13Å; F283-K401 HydrophobicContact CE1-CG 4.02Å; F283-K401 HydrophobicContact CZ-CD 4.4Å; F283-K401 HydrophobicContact CZ-CG 3.86Å; E287-K401 IonicContact OE1-NZ 3.75Å; E287-K401 PolarHBondContact OE1-NZ 3.37Å; L291-K401 HydrophobicContact CD1-CD 4.32Å; L291-K401 HydrophobicContact CD1-CG 4.3Å; L291-K401 HydrophobicContact CD2-CB 3.96Å; L291-K401 HydrophobicContact CD2-CD 4.31Å; L291-K401 HydrophobicContact CD2-CG 3.99Å; L291-K401 HydrophobicContact CG-CD 4.37Å; L291-K401 HydrophobicContact CG-CG 4.47Å; L365-K401 HydrophobicContact CD2-CB 3.94Å; L365-K401 WeakPolarHBondContact CD2-O 3.31Å; R397-K401 WeakPolarHBondContact O-CG 3.38Å; R397-K401 PolarHBondContact O-N 2.88Å; R397-K401 VanDerWaalsContact O-N 3.1Å; E398-K401 PolarHBondContact O-N 3.29Å; T399-K401 VanDerWaalsContact C-N 3.35Å; T399-K401 PolarHBondContact O-N 3.39Å; K401-L404 PolarHBondContact O-N 3.38Å; K401-I405 PolarHBondContact O-N 2.96Å; K401-I405 VanDerWaalsContact O-N 3.14Å
402	M	98.9	Very high	98.3	Very high	26 Å²	26	36.9 Å²	36.9	13%	0.128	17%	0.174	C	C	.	.	H	α-helix	trans	-64.5	-44.3	172.3	-66.4	-172.3	-70	0	0	111.6	L365 I377 E398 T399 F400 L404 I405 K406	L365-M402 HydrophobicContact CD2-CG 4.37Å; I377-M402 HydrophobicContact CG2-CB 4.05Å; E398-M402 PolarHBondContact O-N 3.15Å; E398-M402 VanDerWaalsContact O-N 3.13Å; T399-M402 WeakPolarHBondContact O-CB 3.44Å; T399-M402 PolarHBondContact O-N 2.75Å; T399-M402 VanDerWaalsContact O-N 3.15Å; F400-M402 VanDerWaalsContact C-N 3.31Å; F400-M402 PolarHBondContact O-N 3.45Å; M402-L404 VanDerWaalsContact C-N 3.31Å; M402-L404 PolarHBondContact O-N 2.96Å; M402-I405 VanDerWaalsContact O-CG2 3.25Å; M402-I405 WeakPolarHBondContact O-CG2 3.39Å; M402-I405 PolarHBondContact O-N 3.14Å; M402-K406 WeakPolarHBondContact O-CG 3.42Å; M402-K406 PolarHBondContact O-N 3.43Å; M402-K406 VanDerWaalsContact O-N 3.14Å
403	V	98.8	Very high	98.3	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.006	14%	0.136	C	C	.	.	H	α-helix	trans	-62.2	-40.1	175.5	175.8	0	0	0	0	111.3	I377 M381 T399 F400 K406 C407 M471 V475	I377-V403 HydrophobicContact CG2-CG2 4Å; M381-V403 HydrophobicContact CB-CG2 3.87Å; M381-V403 HydrophobicContact CG-CG2 3.96Å; T399-V403 PolarHBondContact O-N 3.15Å; F400-V403 PolarHBondContact O-N 2.94Å; F400-V403 VanDerWaalsContact O-N 3.15Å; V403-K406 PolarHBondContact O-N 2.66Å; V403-C407 PolarHBondContact O-N 2.85Å; V403-M471 HydrophobicContact CG1-CG 4.35Å; V403-V475 HydrophobicContact CG1-CG2 3.61Å
404	L	98.8	Very high	98.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-59.8	-49.5	177.5	-71.8	179.1	0	0	0	112.4	M270 I273 L279 F283 F400 K401 M402 K406 C407 C408 V475	M270-L404 HydrophobicContact CE-CB 4.15Å; M270-L404 HydrophobicContact SD-CB 4.41Å; I273-L404 HydrophobicContact CG2-CD2 3.8Å; L279-L404 HydrophobicContact CD1-CD1 4.02Å; L279-L404 HydrophobicContact CD1-CD2 4.47Å; F283-L404 HydrophobicContact CE2-CD1 3.9Å; F283-L404 HydrophobicContact CZ-CD1 4.15Å; F400-L404 HydrophobicContact CD1-CD1 3.92Å; F400-L404 HydrophobicContact CD1-CG 4.18Å; F400-L404 HydrophobicContact CE1-CD1 3.68Å; F400-L404 HydrophobicContact CE1-CD2 4.05Å; F400-L404 HydrophobicContact CE1-CG 3.93Å; F400-L404 HydrophobicContact CE2-CD2 4.48Å; F400-L404 HydrophobicContact CZ-CD1 4.37Å; F400-L404 HydrophobicContact CZ-CD2 3.9Å; F400-L404 HydrophobicContact CZ-CG 4.18Å; F400-L404 WeakPolarHBondContact O-CG 3.49Å; F400-L404 PolarHBondContact O-N 2.93Å; K401-L404 PolarHBondContact O-N 3.38Å; M402-L404 VanDerWaalsContact C-N 3.31Å; M402-L404 PolarHBondContact O-N 2.96Å; L404-K406 VanDerWaalsContact C-N 3.3Å; L404-K406 PolarHBondContact O-N 3.37Å; L404-C407 WeakPolarHBondContact O-CB 3.42Å; L404-C407 PolarHBondContact O-N 3.25Å; L404-C408 PolarHBondContact O-N 3.34Å; L404-C408 PolarHBondContact O-SG 3.28Å; L404-V475 HydrophobicContact CD2-CG1 4.24Å
405	I	98.9	Very high	98.4	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-64.5	-37.6	179.6	-167.8	169.4	0	0	0	111.1	M270 A294 L365 S368 T369 K401 M402 C408 D409	M270-I405 HydrophobicContact CE-CB 3.99Å; M270-I405 HydrophobicContact CE-CG1 4.44Å; A294-I405 HydrophobicContact CB-CD1 3.93Å; L365-I405 HydrophobicContact CB-CD1 3.89Å; L365-I405 HydrophobicContact CB-CG2 4.28Å; L365-I405 HydrophobicContact CD2-CG2 3.99Å; S368-I405 WeakPolarHBondContact OG-CG2 3.22Å; T369-I405 HydrophobicContact CG2-CD1 4.02Å; T369-I405 HydrophobicContact CG2-CG1 3.99Å; T369-I405 HydrophobicContact CG2-CG2 4.41Å; K401-I405 PolarHBondContact O-N 2.96Å; K401-I405 VanDerWaalsContact O-N 3.14Å; M402-I405 VanDerWaalsContact O-CG2 3.25Å; M402-I405 WeakPolarHBondContact O-CG2 3.39Å; M402-I405 PolarHBondContact O-N 3.14Å; I405-C408 PolarHBondContact O-N 3.01Å; I405-D409 WeakPolarHBondContact O-CB 3.47Å; I405-D409 PolarHBondContact O-N 2.89Å
406	K	98.7	Very high	98.3	Very high	4 Å²	4	13.8 Å²	13.8	2%	0.017	7%	0.068	C	C	.	.	H	α-helix	trans	-62.9	-44.5	173.5	-66.8	-167.2	77.1	62.9	0	112.3	S368 T369 D370 H374 I377 M402 V403 L404 C408 D409 I410 M471	S368-K406 VanDerWaalsContact O-CD 3.25Å; S368-K406 WeakPolarHBondContact O-CD 3.35Å; S368-K406 WeakPolarHBondContact O-CG 3.41Å; S368-K406 PolarHBondContact O-NZ 2.9Å; T369-K406 PolarHBondContact O-NZ 3.36Å; D370-K406 PolarHBondContact O-NZ 3.45Å; H374-K406 WeakPolarHBondContact ND1-CE 3.39Å; I377-K406 HydrophobicContact CD1-CD 4.1Å; M402-K406 WeakPolarHBondContact O-CG 3.42Å; M402-K406 PolarHBondContact O-N 3.43Å; M402-K406 VanDerWaalsContact O-N 3.14Å; V403-K406 PolarHBondContact O-N 2.66Å; L404-K406 VanDerWaalsContact C-N 3.3Å; L404-K406 PolarHBondContact O-N 3.37Å; K406-C408 VanDerWaalsContact C-N 3.27Å; K406-C408 PolarHBondContact O-N 3.23Å; K406-D409 PolarHBondContact O-N 2.88Å; K406-I410 WeakPolarHBondContact O-CG1 3.26Å; K406-I410 PolarHBondContact O-N 3.14Å; K406-M471 HydrophobicContact CB-SD 3.72Å
407	C	98.8	Very high	98.1	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.007	8%	0.083	C	C	.	.	H	α-helix	trans	-55.4	-44.7	173.1	-82.8	0	0	0	0	111.5	V403 L404 S411 M471 F472	V403-C407 PolarHBondContact O-N 2.85Å; L404-C407 WeakPolarHBondContact O-CB 3.42Å; L404-C407 PolarHBondContact O-N 3.25Å; C407-S411 WeakPolarHBondContact O-CA 3.44Å; C407-S411 WeakPolarHBondContact O-CB 3.18Å; C407-S411 PolarHBondContact O-N 3.04Å; C407-M471 HydrophobicContact CB-CE 4.36Å; C407-F472 HydrophobicContact CB-CE1 4.01Å; C407-F472 HydrophobicContact CB-CE2 4.15Å; C407-F472 HydrophobicContact CB-CZ 3.75Å; C407-F472 WeakPolarHBondContact O-CZ 3.26Å
408	C	98.8	Very high	97.9	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.007	10%	0.103	C	C	.	.	H	α-helix	trans	-66.3	-42.8	-179.3	-61.5	0	0	0	0	112.4	V266 M269 M270 L404 I405 K406 S411	V266-C408 HydrophobicContact CG1-CB 3.78Å; M269-C408 HydrophobicContact CB-CB 4.16Å; M269-C408 HydrophobicContact CG-CB 4.23Å; M270-C408 WeakPolarHBondContact CA-SG 3.3Å; M270-C408 HydrophobicContact CB-CB 4.49Å; M270-C408 PolarHBondContact N-SG 3.21Å; L404-C408 PolarHBondContact O-N 3.34Å; L404-C408 PolarHBondContact O-SG 3.28Å; I405-C408 PolarHBondContact O-N 3.01Å; K406-C408 VanDerWaalsContact C-N 3.27Å; K406-C408 PolarHBondContact O-N 3.23Å; C408-S411 VanDerWaalsContact O-CB 3.3Å; C408-S411 WeakPolarHBondContact O-CB 3.46Å; C408-S411 PolarHBondContact O-N 3.31Å; C408-S411 PolarHBondContact O-OG 2.98Å
409	D	98.8	Very high	97.9	Very high	20 Å²	20	15.1 Å²	15.1	11%	0.107	9%	0.087	C	C	.	.	H	α-helix	trans	-59.4	-49	-178.2	-174.1	18	0	0	0	111.6	H262 H298 I405 K406 S411	H262-D409 PolarHBondContact CE1-O 3.46Å; H262-D409 IonicContact CE1-OD1 2.98Å; H262-D409 IonicContact NE2-OD1 3.28Å; H262-D409 PolarHBondContact NE2-OD1 3.09Å; H298-D409 IonicContact CD2-OD1 3.86Å; H298-D409 IonicContact NE2-OD1 2.91Å; H298-D409 PolarHBondContact NE2-OD1 3.48Å; I405-D409 WeakPolarHBondContact O-CB 3.47Å; I405-D409 PolarHBondContact O-N 2.89Å; K406-D409 PolarHBondContact O-N 2.88Å; D409-S411 PolarHBondContact O-N 3.22Å
410	I	97.9	Very high	97.8	Very high	22 Å²	22	14.7 Å²	14.7	11%	0.113	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	32.9	179	66.8	-179	0	0	0	113.3	K406 F463 V467 L468 M471	K406-I410 WeakPolarHBondContact O-CG1 3.26Å; K406-I410 PolarHBondContact O-N 3.14Å; I410-F463 HydrophobicContact CB-CE1 4.43Å; I410-F463 HydrophobicContact CB-CZ 3.84Å; I410-F463 HydrophobicContact CD1-CE2 4.21Å; I410-F463 HydrophobicContact CD1-CZ 3.96Å; I410-F463 HydrophobicContact CG1-CZ 4.43Å; I410-F463 HydrophobicContact CG2-CZ 3.93Å; I410-V467 HydrophobicContact CD1-CG1 3.78Å; I410-L468 HydrophobicContact CB-CD1 4.47Å; I410-L468 HydrophobicContact CD1-CD1 3.7Å; I410-L468 HydrophobicContact CD1-CG 4.32Å; I410-L468 HydrophobicContact CG1-CD1 4.11Å; I410-L468 HydrophobicContact CG1-CG 4.34Å; I410-L468 WeakPolarHBondContact O-CD2 3.43Å; I410-M471 HydrophobicContact CD1-CE 3.48Å; I410-M471 VanDerWaalsContact CD1-CE 3.48Å; I410-M471 HydrophobicContact CD1-SD 4.36Å; I410-M471 HydrophobicContact CG1-CE 3.52Å
411	S	98.1	Very high	97.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.1	C	C	.	.			trans	-84.3	-4.2	-176.3	64.4	0	0	0	0	115.4	M269 C407 C408 D409 E413 V414	M269-S411 WeakPolarHBondContact CG-OG 3.43Å; C407-S411 WeakPolarHBondContact O-CA 3.44Å; C407-S411 WeakPolarHBondContact O-CB 3.18Å; C407-S411 PolarHBondContact O-N 3.04Å; C408-S411 VanDerWaalsContact O-CB 3.3Å; C408-S411 WeakPolarHBondContact O-CB 3.46Å; C408-S411 PolarHBondContact O-N 3.31Å; C408-S411 PolarHBondContact O-OG 2.98Å; D409-S411 PolarHBondContact O-N 3.22Å; S411-E413 PolarHBondContact O-N 3.28Å; S411-V414 WeakPolarHBondContact O-CB 3.41Å; S411-V414 PolarHBondContact O-N 2.97Å
412	N	97.9	Very high	97.6	Very high	8 Å²	8	19 Å²	19	4%	0.043	11%	0.108	C	C	.	.	G	3₁₀ helix	trans	-56.5	-38.7	-172.9	-70.3	-30.6	0	0	0	112.6	F257 V414 R415 S420 W423	F257-N412 WeakPolarHBondContact CZ-ND2 3.43Å; N412-V414 PolarHBondContact O-N 2.9Å; N412-R415 VanDerWaalsContact O-CB 3.29Å; N412-R415 WeakPolarHBondContact O-CB 3.38Å; N412-R415 WeakPolarHBondContact O-CG 3.46Å; N412-R415 PolarHBondContact O-N 3.45Å; N412-R415 VanDerWaalsContact O-N 3.12Å; N412-S420 WeakPolarHBondContact O-CB 3.09Å; N412-W423 HydrophobicContact CB-CB 4.07Å; N412-W423 HydrophobicContact CB-CG 4.12Å
413	E	97	Very high	97.6	Very high	9 Å²	9	17.8 Å²	17.8	4%	0.042	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-72.5	-13	178.2	-54.9	-52.8	147.6	0	0	114.7	S411 V424 Q460 I464 L468 L490	S411-E413 PolarHBondContact O-N 3.28Å; E413-V424 WeakPolarHBondContact OE1-CG2 3.49Å; E413-Q460 VanDerWaalsContact OE1-CD 3.28Å; E413-Q460 PolarHBondContact OE1-NE2 3.45Å; E413-Q460 PolarHBondContact OE1-OE1 3.39Å; E413-I464 HydrophobicContact CB-CD1 4.35Å; E413-I464 HydrophobicContact CB-CG1 4.27Å; E413-I464 HydrophobicContact CG-CD1 4.32Å; E413-I464 HydrophobicContact CG-CG1 4.18Å; E413-L468 HydrophobicContact CB-CD2 3.64Å; E413-L468 HydrophobicContact CG-CD2 3.89Å; E413-L490 HydrophobicContact CB-CD2 3.86Å
414	V	97.7	Very high	97.5	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.006	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-71.5	-26.9	171.4	-179.6	0	0	0	0	110.5	P205 S411 N412 F472 M486 Q489 L490	P205-V414 HydrophobicContact CB-CG1 4.14Å; S411-V414 WeakPolarHBondContact O-CB 3.41Å; S411-V414 PolarHBondContact O-N 2.97Å; N412-V414 PolarHBondContact O-N 2.9Å; V414-F472 HydrophobicContact CG2-CE1 3.84Å; V414-F472 HydrophobicContact CG2-CE2 3.94Å; V414-F472 HydrophobicContact CG2-CZ 3.52Å; V414-M486 HydrophobicContact CG1-CB 3.49Å; V414-M486 VanDerWaalsContact CG1-CB 3.49Å; V414-M486 HydrophobicContact CG1-CG 3.57Å; V414-M486 HydrophobicContact CG1-SD 4.1Å; V414-M486 HydrophobicContact CG2-CB 4.48Å; V414-Q489 WeakPolarHBondContact O-CB 3.38Å; V414-L490 HydrophobicContact CG2-CD1 4.11Å; V414-L490 HydrophobicContact CG2-CD2 3.87Å; V414-L490 HydrophobicContact CG2-CG 4Å
415	R	97.8	Very high	97.4	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.008	12%	0.122	C	C	.	.	S	Bend	trans	-73	159.4	-175.8	-52.1	-173.5	177	-89.9	-6.2	110.8	P205 F207 C265 Q268 M269 N412 V419	P205-R415 WeakPolarHBondContact O-CG 3.44Å; P205-R415 PolarHBondContact O-NH1 2.94Å; F207-R415 PolarHBondContact O-NH1 3.12Å; C265-R415 PolarHBondContact O-NH2 3.35Å; C265-R415 VanDerWaalsContact O-NH2 3.11Å; Q268-R415 VanDerWaalsContact OE1-CZ 3.3Å; M269-R415 HydrophobicContact CE-CG 4.49Å; N412-R415 VanDerWaalsContact O-CB 3.29Å; N412-R415 WeakPolarHBondContact O-CB 3.38Å; N412-R415 WeakPolarHBondContact O-CG 3.46Å; N412-R415 PolarHBondContact O-N 3.45Å; N412-R415 VanDerWaalsContact O-N 3.12Å; R415-V419 HydrophobicContact CB-CB 3.97Å; R415-V419 HydrophobicContact CB-CG1 4.19Å
416	P	96.1	Very high	97.3	Very high	36 Å²	36	22.7 Å²	22.7	23%	0.234	13%	0.131	C	C	.	.			trans	-54.8	153.5	171.2	-25.7	34.3	0	0	0	112.1	T206 S418 V419 S420	T206-P416 HydrophobicContact CG2-CG 3.88Å; P416-S418 VanDerWaalsContact C-N 3.29Å; P416-S418 PolarHBondContact O-N 2.94Å; P416-V419 CarbonylContact O-C 3.59Å; P416-V419 WeakPolarHBondContact O-CA 3.25Å; P416-V419 WeakPolarHBondContact O-CB 3.3Å; P416-V419 PolarHBondContact O-N 3.03Å; P416-S420 PolarHBondContact O-N 2.99Å
417	L	93.8	Very high	97.2	Very high	67 Å²	67	23.7 Å²	23.7	35%	0.351	14%	0.136	S	C	.	.	H	α-helix	trans	-51.2	-43.6	-177.3	-102.2	179	0	0	0	115.1	V419 S420 E421 R496	L417-V419 PolarHBondContact O-N 3.42Å; L417-S420 PolarHBondContact O-N 3.11Å; L417-E421 HydrophobicContact CD2-CB 4.22Å; L417-E421 VanDerWaalsContact O-CB 3.27Å; L417-E421 WeakPolarHBondContact O-CB 3.31Å; L417-E421 PolarHBondContact O-N 2.9Å; L417-R496 VanDerWaalsContact CD1-CZ 3.44Å; L417-R496 VanDerWaalsContact CD1-NH1 3.31Å; L417-R496 VanDerWaalsContact CD2-CZ 3.48Å; L417-R496 VanDerWaalsContact CG-NH2 3.35Å
418	S	94.9	Very high	97.1	Very high	81 Å²	81	24.3 Å²	24.3	57%	0.566	14%	0.139	S	C	*	.	H	α-helix	trans	-58.8	-21.2	178.8	56.2	0	0	0	0	112.6	P416	P416-S418 VanDerWaalsContact C-N 3.29Å; P416-S418 PolarHBondContact O-N 2.94Å
419	V	97.3	Very high	97	Very high	1 Å²	1	29 Å²	29	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-101.4	-44.1	178.6	-165.1	0	0	0	0	111.4	D208 I209 W210 R415 P416 L417	D208-V419 HydrophobicContact CB-CG2 3.81Å; I209-V419 HydrophobicContact CG2-CG1 4.27Å; W210-V419 PolarHBondContact NE1-O 2.93Å; R415-V419 HydrophobicContact CB-CB 3.97Å; R415-V419 HydrophobicContact CB-CG1 4.19Å; P416-V419 CarbonylContact O-C 3.59Å; P416-V419 WeakPolarHBondContact O-CA 3.25Å; P416-V419 WeakPolarHBondContact O-CB 3.3Å; P416-V419 PolarHBondContact O-N 3.03Å; L417-V419 PolarHBondContact O-N 3.42Å
420	S	97.6	Very high	96.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-75	-38.1	-174.2	77.6	0	0	0	0	112.9	N412 P416 L417 W423 V424	N412-S420 WeakPolarHBondContact O-CB 3.09Å; P416-S420 PolarHBondContact O-N 2.99Å; L417-S420 PolarHBondContact O-N 3.11Å; S420-W423 VanDerWaalsContact O-CB 3.31Å; S420-W423 WeakPolarHBondContact O-CB 3.36Å; S420-W423 PolarHBondContact O-N 2.93Å; S420-V424 WeakPolarHBondContact O-CG2 3.42Å; S420-V424 PolarHBondContact O-N 3.43Å
421	E	95.8	Very high	96.8	Very high	73 Å²	73	30.2 Å²	30.2	34%	0.341	16%	0.163	S	C	.	.	H	α-helix	trans	-62.5	-45.7	-174.9	178.6	172.2	-146.1	0	0	113.6	L417 W423 V424 D425 K456	L417-E421 HydrophobicContact CD2-CB 4.22Å; L417-E421 VanDerWaalsContact O-CB 3.27Å; L417-E421 WeakPolarHBondContact O-CB 3.31Å; L417-E421 PolarHBondContact O-N 2.9Å; E421-W423 PolarHBondContact O-N 2.85Å; E421-V424 WeakPolarHBondContact O-CB 3.46Å; E421-V424 PolarHBondContact O-N 3.26Å; E421-D425 PolarHBondContact O-N 2.89Å; E421-D425 VanDerWaalsContact O-N 3.17Å; E421-K456 HydrophobicContact CG-CD 4.47Å; E421-K456 IonicContact OE1-NZ 2.9Å; E421-K456 PolarHBondContact OE1-NZ 2.98Å
422	P	97.6	Very high	96.8	Very high	45 Å²	45	31.4 Å²	31.4	29%	0.292	17%	0.168	S	C	.	.	H	α-helix	trans	-59.7	-31.1	174	-24.6	34.6	0	0	0	113.1	W210 V424 D425 C426	W210-P422 HydrophobicContact CH2-CB 4.23Å; W210-P422 HydrophobicContact CZ2-CB 3.6Å; P422-V424 VanDerWaalsContact C-N 3.34Å; P422-D425 PolarHBondContact O-N 2.97Å; P422-C426 PolarHBondContact O-N 3.43Å; P422-C426 PolarHBondContact O-SG 3.36Å
423	W	98.1	Very high	96.7	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.008	18%	0.184	C	C	.	.	H	α-helix	trans	-65.8	-36.6	173.8	-79.9	120	0	0	0	112.5	I209 W210 F257 R261 H262 N412 S420 E421 D425 C426 L427	I209-W423 HydrophobicContact CG2-CZ2 4.14Å; W210-W423 HydrophobicContact CH2-CD2 4.08Å; W210-W423 AromaticContact CH2-CE2 4Å; W210-W423 HydrophobicContact CH2-CE3 4.32Å; W210-W423 HydrophobicContact CH2-CH2 4.38Å; W210-W423 HydrophobicContact CH2-CZ2 4.16Å; W210-W423 HydrophobicContact CH2-CZ3 4.46Å; W210-W423 AromaticContact CZ2-CD1 3.79Å; W210-W423 AromaticContact CZ2-CD2 3.76Å; W210-W423 HydrophobicContact CZ2-CD2 3.76Å; W210-W423 AromaticContact CZ2-CE2 3.63Å; W210-W423 HydrophobicContact CZ2-CE3 4.42Å; W210-W423 AromaticContact CZ2-CG 3.87Å; W210-W423 HydrophobicContact CZ2-CG 3.87Å; W210-W423 HydrophobicContact CZ2-CZ2 4.19Å; W210-W423 AromaticContact CZ2-NE1 3.64Å; F257-W423 AromaticContact CD2-CE3 3.71Å; F257-W423 HydrophobicContact CD2-CE3 3.71Å; F257-W423 HydrophobicContact CD2-CZ3 4.21Å; F257-W423 HydrophobicContact CE2-CB 4.45Å; F257-W423 HydrophobicContact CE2-CD2 4.5Å; F257-W423 AromaticContact CE2-CE3 3.81Å; F257-W423 HydrophobicContact CE2-CE3 3.81Å; F257-W423 HydrophobicContact CE2-CZ3 4.49Å; R261-W423 HydrophobicContact CB-CH2 4.02Å; R261-W423 HydrophobicContact CB-CZ2 4.39Å; R261-W423 HydrophobicContact CG-CH2 4.02Å; R261-W423 HydrophobicContact CG-CZ2 3.9Å; H262-W423 HydrophobicContact CB-CH2 3.83Å; H262-W423 HydrophobicContact CB-CZ3 4.05Å; N412-W423 HydrophobicContact CB-CB 4.07Å; N412-W423 HydrophobicContact CB-CG 4.12Å; S420-W423 VanDerWaalsContact O-CB 3.31Å; S420-W423 WeakPolarHBondContact O-CB 3.36Å; S420-W423 PolarHBondContact O-N 2.93Å; E421-W423 PolarHBondContact O-N 2.85Å; W423-D425 VanDerWaalsContact C-N 3.31Å; W423-C426 HydrophobicContact CE3-CB 4.3Å; W423-C426 PolarHBondContact O-N 3.45Å; W423-L427 WeakPolarHBondContact O-CB 3.08Å; W423-L427 PolarHBondContact O-N 3.35Å
424	V	97	Very high	96.7	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.006	18%	0.184	C	C	.	.	H	α-helix	trans	-64.1	-41	174.6	-171.7	0	0	0	0	110.9	E413 S420 E421 P422 L427 L428 K456 Q460	E413-V424 WeakPolarHBondContact OE1-CG2 3.49Å; S420-V424 WeakPolarHBondContact O-CG2 3.42Å; S420-V424 PolarHBondContact O-N 3.43Å; E421-V424 WeakPolarHBondContact O-CB 3.46Å; E421-V424 PolarHBondContact O-N 3.26Å; P422-V424 VanDerWaalsContact C-N 3.34Å; V424-L427 PolarHBondContact O-N 3.49Å; V424-L428 HydrophobicContact CG1-CD1 4.07Å; V424-L428 HydrophobicContact CG1-CG 4.28Å; V424-L428 WeakPolarHBondContact O-CB 3.43Å; V424-L428 VanDerWaalsContact O-CG 3.31Å; V424-L428 WeakPolarHBondContact O-CG 3.39Å; V424-L428 PolarHBondContact O-N 3.19Å; V424-K456 HydrophobicContact CG1-CD 4.43Å; V424-K456 HydrophobicContact CG1-CG 3.86Å; V424-Q460 HydrophobicContact CG1-CG 3.99Å; V424-Q460 HydrophobicContact CG2-CG 4.24Å; V424-Q460 VanDerWaalsContact CG2-NE2 3.26Å
425	D	96.2	Very high	96.6	Very high	77 Å²	77	34.2 Å²	34.2	41%	0.412	18%	0.183	S	C	.	.	H	α-helix	trans	-63.6	-44.7	177.1	-65.9	-38.5	0	0	0	111.3	E421 P422 W423 L427 L428 E429 K456	E421-D425 PolarHBondContact O-N 2.89Å; E421-D425 VanDerWaalsContact O-N 3.17Å; P422-D425 PolarHBondContact O-N 2.97Å; W423-D425 VanDerWaalsContact C-N 3.31Å; D425-L427 PolarHBondContact O-N 3.02Å; D425-L428 PolarHBondContact O-N 3.45Å; D425-E429 WeakPolarHBondContact O-CB 3.11Å; D425-E429 PolarHBondContact O-N 3.14Å; D425-K456 VanDerWaalsContact CG-NZ 3.25Å; D425-K456 WeakPolarHBondContact OD1-CE 3.38Å; D425-K456 IonicContact OD1-NZ 3.66Å; D425-K456 PolarHBondContact OD1-NZ 3.43Å; D425-K456 IonicContact OD2-NZ 2.75Å; D425-K456 PolarHBondContact OD2-NZ 3.23Å
426	C	98	Very high	96.5	Very high	26 Å²	26	36.9 Å²	36.9	18%	0.176	20%	0.198	C	C	.	.	H	α-helix	trans	-58.5	-44	172.8	-71.4	0	0	0	0	112.7	P256 F257 P422 W423 E429 E430	P256-C426 WeakPolarHBondContact CB-O 3.1Å; P256-C426 VanDerWaalsContact O-CB 3.32Å; P256-C426 WeakPolarHBondContact O-CB 3.37Å; F257-C426 HydrophobicContact CB-CB 4.4Å; F257-C426 HydrophobicContact CD2-CB 4.33Å; P422-C426 PolarHBondContact O-N 3.43Å; P422-C426 PolarHBondContact O-SG 3.36Å; W423-C426 HydrophobicContact CE3-CB 4.3Å; W423-C426 PolarHBondContact O-N 3.45Å; C426-E429 PolarHBondContact O-N 2.71Å; C426-E430 PolarHBondContact O-N 3.21Å; C426-E430 VanDerWaalsContact O-N 3.1Å
427	L	97	Very high	96.5	Very high	25 Å²	25	39.8 Å²	39.8	13%	0.131	20%	0.204	C	C	.	.	H	α-helix	trans	-64.4	-46.9	179.7	-176	63.9	0	0	0	111.5	F257 W423 V424 D425 E430 Y431	F257-L427 HydrophobicContact CB-CD1 4.38Å; F257-L427 HydrophobicContact CD1-CD1 3.97Å; F257-L427 HydrophobicContact CD2-CB 3.64Å; F257-L427 HydrophobicContact CD2-CD1 3.94Å; F257-L427 HydrophobicContact CD2-CG 4.36Å; F257-L427 HydrophobicContact CE1-CD1 4.19Å; F257-L427 HydrophobicContact CE2-CB 4.01Å; F257-L427 HydrophobicContact CE2-CD1 4.16Å; F257-L427 HydrophobicContact CG-CB 4.24Å; F257-L427 HydrophobicContact CG-CD1 3.83Å; F257-L427 HydrophobicContact CZ-CD1 4.28Å; W423-L427 WeakPolarHBondContact O-CB 3.08Å; W423-L427 PolarHBondContact O-N 3.35Å; V424-L427 PolarHBondContact O-N 3.49Å; D425-L427 PolarHBondContact O-N 3.02Å; L427-E430 PolarHBondContact O-N 2.77Å; L427-Y431 HydrophobicContact CD1-CD1 4.22Å; L427-Y431 HydrophobicContact CD1-CE1 3.55Å; L427-Y431 HydrophobicContact CD1-CE2 4.31Å; L427-Y431 HydrophobicContact CD2-CE2 4.18Å; L427-Y431 HydrophobicContact CG-CD2 4.42Å; L427-Y431 HydrophobicContact CG-CE1 4.07Å; L427-Y431 HydrophobicContact CG-CE2 3.96Å; L427-Y431 PolarHBondContact O-N 3.4Å
428	L	96.3	Very high	96.7	Very high	13 Å²	13	36.8 Å²	36.8	7%	0.068	19%	0.188	C	C	.	.	H	α-helix	trans	-64	-41	178.1	-71.6	177.5	0	0	0	111.3	V424 D425 E430 Y431 F432 V454 K456 A459	V424-L428 HydrophobicContact CG1-CD1 4.07Å; V424-L428 HydrophobicContact CG1-CG 4.28Å; V424-L428 WeakPolarHBondContact O-CB 3.43Å; V424-L428 VanDerWaalsContact O-CG 3.31Å; V424-L428 WeakPolarHBondContact O-CG 3.39Å; V424-L428 PolarHBondContact O-N 3.19Å; D425-L428 PolarHBondContact O-N 3.45Å; L428-E430 VanDerWaalsContact C-N 3.31Å; L428-E430 PolarHBondContact O-N 2.97Å; L428-Y431 PolarHBondContact O-N 3.09Å; L428-F432 HydrophobicContact CB-CD2 4.37Å; L428-F432 HydrophobicContact CB-CE2 3.75Å; L428-F432 HydrophobicContact CB-CZ 3.91Å; L428-F432 HydrophobicContact CD2-CE1 4.48Å; L428-F432 HydrophobicContact CD2-CZ 4.13Å; L428-F432 HydrophobicContact CG-CZ 4.43Å; L428-F432 WeakPolarHBondContact O-CB 3.38Å; L428-F432 WeakPolarHBondContact O-CD2 3.49Å; L428-F432 WeakPolarHBondContact O-CG 3.45Å; L428-F432 PolarHBondContact O-N 2.94Å; L428-V454 HydrophobicContact CD2-CG1 4.29Å; L428-K456 HydrophobicContact CD1-CB 4.2Å; L428-A459 HydrophobicContact CD2-CB 4.24Å
429	E	96.6	Very high	96.7	Very high	100 Å²	100	36.9 Å²	36.9	47%	0.467	18%	0.179	S	C	.	.	H	α-helix	trans	-56.8	-45.5	174	-175.6	179.6	-176	0	0	111.6	P256 D425 C426 F432 N433	P256-E429 HydrophobicContact CB-CB 4.09Å; P256-E429 HydrophobicContact CB-CG 4.12Å; P256-E429 HydrophobicContact CG-CB 4.4Å; P256-E429 HydrophobicContact CG-CG 3.96Å; D425-E429 WeakPolarHBondContact O-CB 3.11Å; D425-E429 PolarHBondContact O-N 3.14Å; C426-E429 PolarHBondContact O-N 2.71Å; E429-F432 PolarHBondContact O-N 3.42Å; E429-N433 WeakPolarHBondContact O-CB 3.4Å; E429-N433 PolarHBondContact O-N 3.47Å; E429-N433 PolarHBondContact O-ND2 3Å
430	E	97.2	Very high	96.7	Very high	6 Å²	6	44.3 Å²	44.3	3%	0.028	22%	0.217	C	C	.	.	H	α-helix	trans	-65.8	-42.9	177.5	-159.4	171.4	125.3	0	0	112.5	N255 P256 F257 H258 H302 G304 C426 L427 L428 F432 N433 Q434	N255-E430 WeakPolarHBondContact CB-OE2 3.34Å; P256-E430 HydrophobicContact CB-CB 4.18Å; P256-E430 HydrophobicContact CG-CB 4.27Å; F257-E430 WeakPolarHBondContact CA-OE2 3.49Å; F257-E430 HydrophobicContact CB-CB 4.37Å; F257-E430 WeakPolarHBondContact CB-OE2 2.84Å; F257-E430 PolarHBondContact N-OE2 3.32Å; H258-E430 IonicContact CE1-OE1 3.4Å; H258-E430 PolarHBondContact CE1-OE1 3.14Å; H258-E430 IonicContact CG-OE1 3.61Å; H258-E430 PolarHBondContact N-OE2 2.97Å; H258-E430 VanDerWaalsContact N-OE2 3.09Å; H258-E430 IonicContact ND1-OE1 2.84Å; H258-E430 PolarHBondContact ND1-OE1 3.1Å; H258-E430 IonicContact ND1-OE2 3.96Å; H302-E430 IonicContact CE1-OE1 3.29Å; H302-E430 IonicContact ND1-OE1 2.71Å; G304-E430 VanDerWaalsContact CA-OE1 3.25Å; G304-E430 WeakPolarHBondContact CA-OE1 3.37Å; C426-E430 PolarHBondContact O-N 3.21Å; C426-E430 VanDerWaalsContact O-N 3.1Å; L427-E430 PolarHBondContact O-N 2.77Å; L428-E430 VanDerWaalsContact C-N 3.31Å; L428-E430 PolarHBondContact O-N 2.97Å; E430-F432 VanDerWaalsContact C-N 3.32Å; E430-F432 PolarHBondContact O-N 3.26Å; E430-N433 PolarHBondContact O-N 3.44Å; E430-Q434 PolarHBondContact O-N 2.94Å
431	Y	95.8	Very high	96.6	Very high	62 Å²	62	48.2 Å²	48.2	24%	0.243	24%	0.236	C	C	.	.	H	α-helix	trans	-60.1	-42.1	174.4	-74.2	0	0	0	0	112.2	L427 L428 Q434 S435 F448 M449	L427-Y431 HydrophobicContact CD1-CD1 4.22Å; L427-Y431 HydrophobicContact CD1-CE1 3.55Å; L427-Y431 HydrophobicContact CD1-CE2 4.31Å; L427-Y431 HydrophobicContact CD2-CE2 4.18Å; L427-Y431 HydrophobicContact CG-CD2 4.42Å; L427-Y431 HydrophobicContact CG-CE1 4.07Å; L427-Y431 HydrophobicContact CG-CE2 3.96Å; L427-Y431 PolarHBondContact O-N 3.4Å; L428-Y431 PolarHBondContact O-N 3.09Å; Y431-Q434 PolarHBondContact O-N 3.45Å; Y431-S435 PolarHBondContact O-N 3.34Å; Y431-F448 HydrophobicContact CE2-CD2 4.3Å; Y431-F448 HydrophobicContact CE2-CE2 4.39Å; Y431-M449 HydrophobicContact CD1-CE 4.14Å; Y431-M449 HydrophobicContact CD2-CG 4.15Å; Y431-M449 HydrophobicContact CE1-CE 4.13Å; Y431-M449 HydrophobicContact CG-CG 4.02Å
432	F	96.3	Very high	96.7	Very high	25 Å²	25	48 Å²	48	11%	0.11	25%	0.253	C	S	.	.	H	α-helix	trans	-66.8	-42.9	178.8	-58.2	-31.9	0	0	0	111.6	L428 E429 E430 Q434 S435 D436 M449 R451 V454	L428-F432 HydrophobicContact CB-CD2 4.37Å; L428-F432 HydrophobicContact CB-CE2 3.75Å; L428-F432 HydrophobicContact CB-CZ 3.91Å; L428-F432 HydrophobicContact CD2-CE1 4.48Å; L428-F432 HydrophobicContact CD2-CZ 4.13Å; L428-F432 HydrophobicContact CG-CZ 4.43Å; L428-F432 WeakPolarHBondContact O-CB 3.38Å; L428-F432 WeakPolarHBondContact O-CD2 3.49Å; L428-F432 WeakPolarHBondContact O-CG 3.45Å; L428-F432 PolarHBondContact O-N 2.94Å; E429-F432 PolarHBondContact O-N 3.42Å; E430-F432 VanDerWaalsContact C-N 3.32Å; E430-F432 PolarHBondContact O-N 3.26Å; F432-Q434 VanDerWaalsContact C-N 3.26Å; F432-Q434 PolarHBondContact O-N 2.97Å; F432-S435 PolarHBondContact O-N 3.49Å; F432-S435 VanDerWaalsContact O-N 3.16Å; F432-S435 PolarHBondContact O-OG 3.46Å; F432-D436 WeakPolarHBondContact O-CB 3.5Å; F432-D436 PolarHBondContact O-N 3.31Å; F432-M449 WeakPolarHBondContact CD1-O 3.48Å; F432-R451 HydrophobicContact CB-CB 4.48Å; F432-R451 VanDerWaalsContact CB-CZ 3.4Å; F432-R451 HydrophobicContact CD1-CB 3.63Å; F432-R451 HydrophobicContact CD1-CG 4.12Å; F432-R451 HydrophobicContact CD2-CB 4.46Å; F432-R451 HydrophobicContact CD2-CG 4.09Å; F432-R451 HydrophobicContact CE1-CB 3.9Å; F432-R451 HydrophobicContact CE1-CG 4.22Å; F432-R451 HydrophobicContact CE2-CG 4.14Å; F432-R451 HydrophobicContact CG-CB 3.95Å; F432-R451 HydrophobicContact CG-CG 4.07Å; F432-R451 HydrophobicContact CZ-CB 4.39Å; F432-R451 HydrophobicContact CZ-CG 4.22Å; F432-V454 HydrophobicContact CE1-CG1 3.38Å; F432-V454 HydrophobicContact CZ-CG1 3.78Å
433	N	96.1	Very high	96.7	Very high	71 Å²	71	47.5 Å²	47.5	38%	0.38	25%	0.247	S	C	.	.	H	α-helix	trans	-58.4	-38.3	174.6	-70.1	-23.5	0	0	0	112.1	E429 E430 R437	E429-N433 WeakPolarHBondContact O-CB 3.4Å; E429-N433 PolarHBondContact O-N 3.47Å; E429-N433 PolarHBondContact O-ND2 3Å; E430-N433 PolarHBondContact O-N 3.44Å; N433-R437 WeakPolarHBondContact O-CB 3.39Å; N433-R437 PolarHBondContact O-N 3.44Å
434	Q	96.8	Very high	96.5	Very high	5 Å²	5	51.3 Å²	51.3	2%	0.023	27%	0.273	C	S	.	.	H	α-helix	trans	-65.8	-52.4	172.3	-177.1	-177.8	-51.1	0	0	111.4	Y305 S306 Y309 E430 Y431 F432 D436 R437 E438 M449	Y305-Q434 HydrophobicContact CD1-CB 3.85Å; Y305-Q434 HydrophobicContact CD1-CG 3.86Å; Y305-Q434 HydrophobicContact CE1-CB 4.35Å; S306-Q434 PolarHBondContact OG-NE2 3.01Å; S306-Q434 PolarHBondContact OG-OE1 2.83Å; S306-Q434 VanDerWaalsContact OG-OE1 3.1Å; Y309-Q434 HydrophobicContact CD2-CG 4.03Å; Y309-Q434 HydrophobicContact CG-CG 4.28Å; E430-Q434 PolarHBondContact O-N 2.94Å; Y431-Q434 PolarHBondContact O-N 3.45Å; F432-Q434 VanDerWaalsContact C-N 3.26Å; F432-Q434 PolarHBondContact O-N 2.97Å; Q434-D436 VanDerWaalsContact C-N 3.33Å; Q434-D436 PolarHBondContact O-N 2.76Å; Q434-R437 WeakPolarHBondContact O-CB 3.47Å; Q434-R437 PolarHBondContact O-N 3.08Å; Q434-R437 VanDerWaalsContact O-N 3.11Å; Q434-E438 HydrophobicContact CG-CG 4.28Å; Q434-E438 PolarHBondContact NE2-OE1 3.04Å; Q434-E438 WeakPolarHBondContact O-CG 3.06Å; Q434-E438 PolarHBondContact O-N 3.43Å; Q434-M449 PolarHBondContact NE2-SD 2.66Å
435	S	96.3	Very high	96.4	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.9	-38.3	-175.3	75.4	0	0	0	0	112.9	Y431 F432 R437 E438 K439 M449	Y431-S435 PolarHBondContact O-N 3.34Å; F432-S435 PolarHBondContact O-N 3.49Å; F432-S435 VanDerWaalsContact O-N 3.16Å; F432-S435 PolarHBondContact O-OG 3.46Å; S435-R437 VanDerWaalsContact C-N 3.28Å; S435-R437 PolarHBondContact O-N 3.45Å; S435-E438 PolarHBondContact O-N 3.04Å; S435-K439 WeakPolarHBondContact O-CG 3.42Å; S435-K439 PolarHBondContact O-N 3.33Å; S435-M449 VanDerWaalsContact CB-O 3.28Å; S435-M449 WeakPolarHBondContact CB-O 3.31Å; S435-M449 PolarHBondContact OG-O 3.49Å; S435-M449 VanDerWaalsContact OG-O 3.06Å
436	D	95.6	Very high	96.2	Very high	58 Å²	58	51 Å²	51	31%	0.31	28%	0.277	S	S	.	.	H	α-helix	trans	-64	-39.3	177.3	-70.4	-26.2	0	0	0	109.7	F432 Q434 L440 R451	F432-D436 WeakPolarHBondContact O-CB 3.5Å; F432-D436 PolarHBondContact O-N 3.31Å; Q434-D436 VanDerWaalsContact C-N 3.33Å; Q434-D436 PolarHBondContact O-N 2.76Å; D436-L440 WeakPolarHBondContact O-CG 3.4Å; D436-L440 PolarHBondContact O-N 3.45Å; D436-R451 IonicContact OD2-CZ 2.77Å; D436-R451 IonicContact OD2-NE 3.83Å; D436-R451 IonicContact OD2-NH2 3.58Å; D436-R451 PolarHBondContact OD2-NH2 3.33Å
437	R	95.9	Very high	95.8	Very high	97 Å²	97	53.9 Å²	53.9	37%	0.366	30%	0.295	S	S	.	.	H	α-helix	trans	-69	-43.4	174.7	-174.6	169.6	-172.6	171.7	-3.1	112.8	Y305 Y309 N433 Q434 S435 K439 L440 E441	Y305-R437 WeakPolarHBondContact OH-CD 3.32Å; Y305-R437 PolarHBondContact OH-NH1 3.27Å; Y309-R437 HydrophobicContact CE2-CG 4.29Å; Y309-R437 WeakPolarHBondContact OH-CD 3.5Å; Y309-R437 PolarHBondContact OH-NE 3.05Å; N433-R437 WeakPolarHBondContact O-CB 3.39Å; N433-R437 PolarHBondContact O-N 3.44Å; Q434-R437 WeakPolarHBondContact O-CB 3.47Å; Q434-R437 PolarHBondContact O-N 3.08Å; Q434-R437 VanDerWaalsContact O-N 3.11Å; S435-R437 VanDerWaalsContact C-N 3.28Å; S435-R437 PolarHBondContact O-N 3.45Å; R437-K439 VanDerWaalsContact C-N 3.31Å; R437-K439 PolarHBondContact O-N 2.94Å; R437-L440 PolarHBondContact O-N 3.27Å; R437-L440 VanDerWaalsContact O-N 3.16Å; R437-E441 HydrophobicContact CG-CG 4.35Å; R437-E441 WeakPolarHBondContact CG-OE1 3.35Å; R437-E441 IonicContact CZ-OE1 3.44Å; R437-E441 IonicContact NE-OE1 3.46Å; R437-E441 PolarHBondContact NE-OE1 3.33Å; R437-E441 IonicContact NE-OE2 3.8Å; R437-E441 IonicContact NH2-OE1 2.63Å; R437-E441 PolarHBondContact NH2-OE1 2.97Å; R437-E441 WeakPolarHBondContact O-CB 3.45Å; R437-E441 WeakPolarHBondContact O-CG 3.17Å; R437-E441 PolarHBondContact O-N 3.14Å
438	E	97.7	Very high	95.4	Very high	4 Å²	4	58 Å²	58	2%	0.019	31%	0.312	C	S	.	.	H	α-helix	trans	-58	-43.5	175.6	-74.9	170.5	161.8	0	0	111.3	Y309 Q434 S435 L440 E441 G442 L443 V445	Y309-E438 HydrophobicContact CD2-CG 3.63Å; Y309-E438 HydrophobicContact CE2-CG 4.05Å; Q434-E438 HydrophobicContact CG-CG 4.28Å; Q434-E438 PolarHBondContact NE2-OE1 3.04Å; Q434-E438 WeakPolarHBondContact O-CG 3.06Å; Q434-E438 PolarHBondContact O-N 3.43Å; S435-E438 PolarHBondContact O-N 3.04Å; E438-L440 VanDerWaalsContact C-N 3.34Å; E438-L440 PolarHBondContact O-N 3.43Å; E438-E441 CarbonylContact O-C 3.47Å; E438-E441 PolarHBondContact O-N 3.23Å; E438-G442 PolarHBondContact O-N 2.83Å; E438-L443 HydrophobicContact CB-CB 4.04Å; E438-L443 HydrophobicContact CG-CB 4.15Å; E438-L443 HydrophobicContact CG-CD1 4.48Å; E438-L443 PolarHBondContact O-N 3.42Å; E438-V445 HydrophobicContact CB-CG2 3.71Å
439	K	95.7	Very high	95	Very high	84 Å²	84	58 Å²	58	37%	0.365	31%	0.311	S	S	.	.	H	α-helix	trans	-59.1	-43.8	174.7	-70.6	174.2	-174.3	175.7	0	111.8	S435 R437 G442 V445 D450	S435-K439 WeakPolarHBondContact O-CG 3.42Å; S435-K439 PolarHBondContact O-N 3.33Å; R437-K439 VanDerWaalsContact C-N 3.31Å; R437-K439 PolarHBondContact O-N 2.94Å; K439-G442 PolarHBondContact O-N 3.09Å; K439-V445 HydrophobicContact CG-CG2 3.74Å; K439-D450 IonicContact NZ-OD1 2.75Å; K439-D450 PolarHBondContact NZ-OD1 3.34Å; K439-D450 IonicContact NZ-OD2 3.03Å
440	L	96.3	Very high	94.5	Very high	156 Å²	156	53.4 Å²	53.4	82%	0.817	29%	0.29	S	S	*	.	H	α-helix	trans	-66.9	-36.3	178.5	-70.5	171	0	0	0	112.7	D436 R437 E438 G442	D436-L440 WeakPolarHBondContact O-CG 3.4Å; D436-L440 PolarHBondContact O-N 3.45Å; R437-L440 PolarHBondContact O-N 3.27Å; R437-L440 VanDerWaalsContact O-N 3.16Å; E438-L440 VanDerWaalsContact C-N 3.34Å; E438-L440 PolarHBondContact O-N 3.43Å; L440-G442 VanDerWaalsContact C-N 3.32Å
441	E	97	Very high	94.1	Very high	83 Å²	83	59 Å²	59	39%	0.388	31%	0.311	S	S	.	.	H	α-helix	trans	-85.6	-4	-179.4	-68	175.1	175.9	0	0	112.8	Y309 R437 E438 L443	Y309-E441 WeakPolarHBondContact CE2-OE2 3.42Å; Y309-E441 PolarHBondContact OH-OE1 3.26Å; Y309-E441 PolarHBondContact OH-OE2 3.38Å; R437-E441 HydrophobicContact CG-CG 4.35Å; R437-E441 WeakPolarHBondContact CG-OE1 3.35Å; R437-E441 IonicContact CZ-OE1 3.44Å; R437-E441 IonicContact NE-OE1 3.46Å; R437-E441 PolarHBondContact NE-OE1 3.33Å; R437-E441 IonicContact NE-OE2 3.8Å; R437-E441 IonicContact NH2-OE1 2.63Å; R437-E441 PolarHBondContact NH2-OE1 2.97Å; R437-E441 WeakPolarHBondContact O-CB 3.45Å; R437-E441 WeakPolarHBondContact O-CG 3.17Å; R437-E441 PolarHBondContact O-N 3.14Å; E438-E441 CarbonylContact O-C 3.47Å; E438-E441 PolarHBondContact O-N 3.23Å; E441-L443 VanDerWaalsContact C-N 3.29Å; E441-L443 HydrophobicContact CB-CD1 3.97Å; E441-L443 HydrophobicContact CB-CG 3.86Å; E441-L443 WeakPolarHBondContact OE2-CD1 3.38Å
442	G	97	Very high	93.6	Very high	68 Å²	68	63.8 Å²	63.8	70%	0.701	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	26.1	-177.3	0	0	0	0	0	113.4	E438 K439 L440	E438-G442 PolarHBondContact O-N 2.83Å; K439-G442 PolarHBondContact O-N 3.09Å; L440-G442 VanDerWaalsContact C-N 3.32Å
443	L	97	Very high	93.1	Very high	34 Å²	34	69.1 Å²	69.1	18%	0.178	36%	0.359	C	S	.	.			trans	-89	158.2	179.6	-60	177.5	0	0	0	111.5	Y309 N312 A313 E438 E441 V445	Y309-L443 HydrophobicContact CD2-CD1 4.26Å; Y309-L443 HydrophobicContact CE2-CD1 3.87Å; N312-L443 HydrophobicContact CB-CD2 4.38Å; A313-L443 HydrophobicContact CB-CD1 3.69Å; E438-L443 HydrophobicContact CB-CB 4.04Å; E438-L443 HydrophobicContact CG-CB 4.15Å; E438-L443 HydrophobicContact CG-CD1 4.48Å; E438-L443 PolarHBondContact O-N 3.42Å; E441-L443 VanDerWaalsContact C-N 3.29Å; E441-L443 HydrophobicContact CB-CD1 3.97Å; E441-L443 HydrophobicContact CB-CG 3.86Å; E441-L443 WeakPolarHBondContact OE2-CD1 3.38Å; L443-V445 PolarHBondContact O-N 2.76Å
444	P	95.3	Very high	92.8	Very high	83 Å²	83	66.4 Å²	66.4	54%	0.539	35%	0.345	S	S	.	.			trans	-61.2	133.4	173.3	-20.4	32.6	0	0	0	111.7
445	V	94.6	Very high	92.4	Very high	43 Å²	43	67.8 Å²	67.8	26%	0.261	35%	0.353	S	S	.	.			trans	-109.5	126.2	177.9	-179.1	0	0	0	0	109.6	E438 K439 L443 D450	E438-V445 HydrophobicContact CB-CG2 3.71Å; K439-V445 HydrophobicContact CG-CG2 3.74Å; L443-V445 PolarHBondContact O-N 2.76Å; V445-D450 HydrophobicContact CG1-CB 4.25Å
446	A	91.3	Very high	92.3	Very high	29 Å²	29	69.3 Å²	69.3	24%	0.24	36%	0.36	C	S	.	.			trans	-73.5	133.3	174.9	0	0	0	0	0	110.9	F448 M449 D450	A446-F448 HydrophobicContact CB-CD1 3.89Å; A446-F448 HydrophobicContact CB-CE1 3.5Å; A446-F448 VanDerWaalsContact CB-CE1 3.5Å; A446-F448 HydrophobicContact CB-CZ 3.89Å; A446-F448 PolarHBondContact O-N 3.42Å; A446-F448 VanDerWaalsContact O-N 3.15Å; A446-M449 HydrophobicContact CB-CG 4.28Å; A446-M449 HydrophobicContact CB-SD 4.36Å; A446-M449 PolarHBondContact O-N 3.39Å; A446-D450 PolarHBondContact O-N 3.41Å
447	P	89.9	Confident	92.2	Very high	85 Å²	85	66.6 Å²	66.6	55%	0.552	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-57.6	-32.8	-176.8	-27.9	35	0	0	0	115	M449 D450 K453	P447-M449 PolarHBondContact O-N 2.94Å; P447-D450 PolarHBondContact O-N 2.85Å; P447-K453 HydrophobicContact CB-CD 4.4Å
448	F	88.3	Confident	92	Very high	112 Å²	112	65.1 Å²	65.1	49%	0.491	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-75.7	-9.2	179	67.6	-95.1	0	0	0	113.6	Y431 A446	Y431-F448 HydrophobicContact CE2-CD2 4.3Å; Y431-F448 HydrophobicContact CE2-CE2 4.39Å; A446-F448 HydrophobicContact CB-CD1 3.89Å; A446-F448 HydrophobicContact CB-CE1 3.5Å; A446-F448 VanDerWaalsContact CB-CE1 3.5Å; A446-F448 HydrophobicContact CB-CZ 3.89Å; A446-F448 PolarHBondContact O-N 3.42Å; A446-F448 VanDerWaalsContact O-N 3.15Å
449	M	88.1	Confident	91.7	Very high	12 Å²	12	66.3 Å²	66.3	6%	0.059	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-100.5	-9.4	172.5	-63.1	-176.8	168.4	0	0	112.2	Y431 F432 Q434 S435 A446 P447 R451	Y431-M449 HydrophobicContact CD1-CE 4.14Å; Y431-M449 HydrophobicContact CD2-CG 4.15Å; Y431-M449 HydrophobicContact CE1-CE 4.13Å; Y431-M449 HydrophobicContact CG-CG 4.02Å; F432-M449 WeakPolarHBondContact CD1-O 3.48Å; Q434-M449 PolarHBondContact NE2-SD 2.66Å; S435-M449 VanDerWaalsContact CB-O 3.28Å; S435-M449 WeakPolarHBondContact CB-O 3.31Å; S435-M449 PolarHBondContact OG-O 3.49Å; S435-M449 VanDerWaalsContact OG-O 3.06Å; A446-M449 HydrophobicContact CB-CG 4.28Å; A446-M449 HydrophobicContact CB-SD 4.36Å; A446-M449 PolarHBondContact O-N 3.39Å; P447-M449 PolarHBondContact O-N 2.94Å; M449-R451 PolarHBondContact O-N 3.22Å
450	D	86.4	Confident	91.7	Very high	5 Å²	5	62.4 Å²	62.4	3%	0.027	34%	0.341	C	S	.	.			trans	-82.2	115.8	-174.5	-170	-9.3	0	0	0	110.9	K439 V445 A446 P447 E452 K453 V454	K439-D450 IonicContact NZ-OD1 2.75Å; K439-D450 PolarHBondContact NZ-OD1 3.34Å; K439-D450 IonicContact NZ-OD2 3.03Å; V445-D450 HydrophobicContact CG1-CB 4.25Å; A446-D450 PolarHBondContact O-N 3.41Å; P447-D450 PolarHBondContact O-N 2.85Å; D450-E452 PolarHBondContact O-N 2.74Å; D450-E452 PolarHBondContact OD1-N 3.4Å; D450-K453 HydrophobicContact CB-CB 4.24Å; D450-K453 HydrophobicContact CB-CD 4.18Å; D450-K453 HydrophobicContact CB-CG 4.29Å; D450-K453 PolarHBondContact O-N 2.83Å; D450-K453 WeakPolarHBondContact OD2-CE 3.43Å; D450-K453 IonicContact OD2-NZ 2.71Å; D450-K453 PolarHBondContact OD2-NZ 3.05Å; D450-V454 WeakPolarHBondContact O-CG1 3.47Å; D450-V454 PolarHBondContact O-N 2.93Å
451	R	87.8	Confident	91.7	Very high	122 Å²	122	56.1 Å²	56.1	46%	0.46	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-29	-179.8	-167.2	-169.9	-58.3	-89	6.8	114	F432 D436 M449	F432-R451 HydrophobicContact CB-CB 4.48Å; F432-R451 VanDerWaalsContact CB-CZ 3.4Å; F432-R451 HydrophobicContact CD1-CB 3.63Å; F432-R451 HydrophobicContact CD1-CG 4.12Å; F432-R451 HydrophobicContact CD2-CB 4.46Å; F432-R451 HydrophobicContact CD2-CG 4.09Å; F432-R451 HydrophobicContact CE1-CB 3.9Å; F432-R451 HydrophobicContact CE1-CG 4.22Å; F432-R451 HydrophobicContact CE2-CG 4.14Å; F432-R451 HydrophobicContact CG-CB 3.95Å; F432-R451 HydrophobicContact CG-CG 4.07Å; F432-R451 HydrophobicContact CZ-CB 4.39Å; F432-R451 HydrophobicContact CZ-CG 4.22Å; D436-R451 IonicContact OD2-CZ 2.77Å; D436-R451 IonicContact OD2-NE 3.83Å; D436-R451 IonicContact OD2-NH2 3.58Å; D436-R451 PolarHBondContact OD2-NH2 3.33Å; M449-R451 PolarHBondContact O-N 3.22Å
452	E	86.9	Confident	91.6	Very high	164 Å²	164	53.5 Å²	53.5	77%	0.766	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-16.5	-179.5	-65.5	172.2	-169.4	0	0	113.3	D450	D450-E452 PolarHBondContact O-N 2.74Å; D450-E452 PolarHBondContact OD1-N 3.4Å
453	K	86.1	Confident	91.6	Very high	136 Å²	136	53 Å²	53	59%	0.591	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.9	-29	-170.4	-63.1	179.4	-175.9	128.3	0	113.7	P447 D450	P447-K453 HydrophobicContact CB-CD 4.4Å; D450-K453 HydrophobicContact CB-CB 4.24Å; D450-K453 HydrophobicContact CB-CD 4.18Å; D450-K453 HydrophobicContact CB-CG 4.29Å; D450-K453 PolarHBondContact O-N 2.83Å; D450-K453 WeakPolarHBondContact OD2-CE 3.43Å; D450-K453 IonicContact OD2-NZ 2.71Å; D450-K453 PolarHBondContact OD2-NZ 3.05Å
454	V	89.4	Confident	91.7	Very high	15 Å²	15	51.4 Å²	51.4	9%	0.091	27%	0.273	C	S	.	.			trans	-98	135.6	-175.9	73.5	0	0	0	0	111.8	L428 F432 D450 A459	L428-V454 HydrophobicContact CD2-CG1 4.29Å; F432-V454 HydrophobicContact CE1-CG1 3.38Å; F432-V454 HydrophobicContact CZ-CG1 3.78Å; D450-V454 WeakPolarHBondContact O-CG1 3.47Å; D450-V454 PolarHBondContact O-N 2.93Å; V454-A459 HydrophobicContact CG2-CB 3.76Å
455	T	88.9	Confident	91.8	Very high	33 Å²	33	51.9 Å²	51.9	20%	0.202	27%	0.267	C	S	.	.			trans	-112.8	157.1	167.5	68	0	0	0	0	109.6	P457 T458 A459 E504	T455-P457 VanDerWaalsContact C-N 3.34Å; T455-T458 PolarHBondContact N-OG1 2.86Å; T455-T458 PolarHBondContact O-N 3.31Å; T455-T458 VanDerWaalsContact O-N 3.1Å; T455-T458 PolarHBondContact O-OG1 2.96Å; T455-T458 VanDerWaalsContact OG1-CG2 3.31Å; T455-T458 WeakPolarHBondContact OG1-CG2 3.47Å; T455-T458 PolarHBondContact OG1-N 3.4Å; T455-T458 PolarHBondContact OG1-OG1 3.2Å; T455-T458 VanDerWaalsContact OG1-OG1 3.11Å; T455-A459 PolarHBondContact O-N 3.36Å; T455-E504 PolarHBondContact OG1-OE2 3.39Å
456	K	92.4	Very high	91.9	Very high	33 Å²	33	56.9 Å²	56.9	14%	0.143	29%	0.285	C	S	.	.	H	α-helix	trans	-50.6	-46.7	177.5	173.2	179.9	-78.7	174	0	112.2	E421 V424 D425 L428 Q460 Y497	E421-K456 HydrophobicContact CG-CD 4.47Å; E421-K456 IonicContact OE1-NZ 2.9Å; E421-K456 PolarHBondContact OE1-NZ 2.98Å; V424-K456 HydrophobicContact CG1-CD 4.43Å; V424-K456 HydrophobicContact CG1-CG 3.86Å; D425-K456 VanDerWaalsContact CG-NZ 3.25Å; D425-K456 WeakPolarHBondContact OD1-CE 3.38Å; D425-K456 IonicContact OD1-NZ 3.66Å; D425-K456 PolarHBondContact OD1-NZ 3.43Å; D425-K456 IonicContact OD2-NZ 2.75Å; D425-K456 PolarHBondContact OD2-NZ 3.23Å; L428-K456 HydrophobicContact CD1-CB 4.2Å; K456-Q460 WeakPolarHBondContact O-CB 3.4Å; K456-Q460 WeakPolarHBondContact O-CG 3.2Å; K456-Q460 PolarHBondContact O-N 2.78Å; K456-Y497 HydrophobicContact CD-CE1 4.25Å; K456-Y497 HydrophobicContact CG-CE1 3.88Å
457	P	94	Very high	92.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.5	-47.8	174.2	-26.5	35.6	0	0	0	114.3	T455 A459 Q460 I461 M500 L501 E504	T455-P457 VanDerWaalsContact C-N 3.34Å; P457-A459 VanDerWaalsContact C-N 3.29Å; P457-A459 PolarHBondContact O-N 2.93Å; P457-Q460 PolarHBondContact O-N 3.44Å; P457-Q460 VanDerWaalsContact O-N 3.12Å; P457-I461 HydrophobicContact CB-CD1 4.25Å; P457-I461 VanDerWaalsContact O-CG1 3.25Å; P457-I461 WeakPolarHBondContact O-CG1 3.48Å; P457-I461 PolarHBondContact O-N 3.39Å; P457-M500 HydrophobicContact CG-CB 3.86Å; P457-M500 HydrophobicContact CG-CG 3.58Å; P457-M500 HydrophobicContact CG-SD 3.56Å; P457-M500 VanDerWaalsContact CG-SD 3.56Å; P457-L501 HydrophobicContact CB-CB 3.8Å; P457-L501 HydrophobicContact CB-CD1 4.4Å; P457-E504 WeakPolarHBondContact CD-OE1 3.42Å; P457-E504 WeakPolarHBondContact CG-OE1 3.25Å
458	T	91.2	Very high	92.7	Very high	67 Å²	67	52.8 Å²	52.8	41%	0.411	26%	0.256	S	S	.	.	H	α-helix	trans	-64.6	-34.3	-176.1	57.5	0	0	0	0	112.6	T455 L501	T455-T458 PolarHBondContact N-OG1 2.86Å; T455-T458 PolarHBondContact O-N 3.31Å; T455-T458 VanDerWaalsContact O-N 3.1Å; T455-T458 PolarHBondContact O-OG1 2.96Å; T455-T458 VanDerWaalsContact OG1-CG2 3.31Å; T455-T458 WeakPolarHBondContact OG1-CG2 3.47Å; T455-T458 PolarHBondContact OG1-N 3.4Å; T455-T458 PolarHBondContact OG1-OG1 3.2Å; T455-T458 VanDerWaalsContact OG1-OG1 3.11Å; T458-L501 HydrophobicContact CG2-CD1 3.87Å
459	A	91.7	Very high	93.2	Very high	28 Å²	28	48.3 Å²	48.3	23%	0.231	24%	0.237	C	C	.	.	H	α-helix	trans	-65.3	-41.6	173.2	0	0	0	0	0	112.1	L428 V454 T455 P457	L428-A459 HydrophobicContact CD2-CB 4.24Å; V454-A459 HydrophobicContact CG2-CB 3.76Å; T455-A459 PolarHBondContact O-N 3.36Å; P457-A459 VanDerWaalsContact C-N 3.29Å; P457-A459 PolarHBondContact O-N 2.93Å
460	Q	96.2	Very high	93.6	Very high	3 Å²	3	49.7 Å²	49.7	1%	0.014	25%	0.246	C	C	.	.	H	α-helix	trans	-86.2	-39.5	-169.1	-73	-65.1	-17.6	0	0	114.3	E413 V424 K456 P457 G462 F463 I464 Y497	E413-Q460 VanDerWaalsContact OE1-CD 3.28Å; E413-Q460 PolarHBondContact OE1-NE2 3.45Å; E413-Q460 PolarHBondContact OE1-OE1 3.39Å; V424-Q460 HydrophobicContact CG1-CG 3.99Å; V424-Q460 HydrophobicContact CG2-CG 4.24Å; V424-Q460 VanDerWaalsContact CG2-NE2 3.26Å; K456-Q460 WeakPolarHBondContact O-CB 3.4Å; K456-Q460 WeakPolarHBondContact O-CG 3.2Å; K456-Q460 PolarHBondContact O-N 2.78Å; P457-Q460 PolarHBondContact O-N 3.44Å; P457-Q460 VanDerWaalsContact O-N 3.12Å; Q460-G462 PolarHBondContact O-N 2.94Å; Q460-F463 PolarHBondContact O-N 2.83Å; Q460-I464 HydrophobicContact CB-CD1 4.22Å; Q460-I464 WeakPolarHBondContact O-CB 3.24Å; Q460-I464 WeakPolarHBondContact O-CG1 3.08Å; Q460-I464 PolarHBondContact O-N 2.69Å; Q460-Y497 HydrophobicContact CB-CD1 4.11Å; Q460-Y497 HydrophobicContact CB-CD2 3.62Å; Q460-Y497 HydrophobicContact CB-CE1 4.18Å; Q460-Y497 HydrophobicContact CB-CE2 3.69Å; Q460-Y497 HydrophobicContact CB-CG 3.85Å; Q460-Y497 HydrophobicContact CG-CD2 4.34Å; Q460-Y497 HydrophobicContact CG-CE1 4.11Å; Q460-Y497 HydrophobicContact CG-CE2 3.9Å
461	I	97.2	Very high	94.2	Very high	24 Å²	24	49.5 Å²	49.5	12%	0.123	25%	0.246	C	C	.	.	H	α-helix	trans	-56.7	-51.4	-175.5	-70.3	164.5	0	0	0	111	P457 K465 L494 E498 L501	P457-I461 HydrophobicContact CB-CD1 4.25Å; P457-I461 VanDerWaalsContact O-CG1 3.25Å; P457-I461 WeakPolarHBondContact O-CG1 3.48Å; P457-I461 PolarHBondContact O-N 3.39Å; I461-K465 WeakPolarHBondContact O-CB 3.44Å; I461-K465 PolarHBondContact O-N 2.87Å; I461-L494 HydrophobicContact CB-CD1 4.25Å; I461-L494 HydrophobicContact CG1-CD1 4.38Å; I461-L494 HydrophobicContact CG2-CD1 3.87Å; I461-E498 HydrophobicContact CD1-CG 4.08Å; I461-E498 HydrophobicContact CG1-CG 4.12Å; I461-E498 HydrophobicContact CG2-CG 4.27Å; I461-L501 HydrophobicContact CD1-CB 4Å; I461-L501 HydrophobicContact CD1-CD2 3.67Å; I461-L501 HydrophobicContact CD1-CG 4.48Å
462	G	94.6	Very high	94.7	Very high	27 Å²	27	43.8 Å²	43.8	28%	0.278	22%	0.224	S	C	.	.	H	α-helix	trans	-64.3	-43.1	-179.5	0	0	0	0	0	112.1	Q460 F466	Q460-G462 PolarHBondContact O-N 2.94Å; G462-F466 WeakPolarHBondContact O-CB 3.37Å; G462-F466 VanDerWaalsContact O-CD2 3.3Å; G462-F466 WeakPolarHBondContact O-CD2 3.47Å; G462-F466 PolarHBondContact O-N 2.93Å
463	F	96.5	Very high	95.3	Very high	59 Å²	59	40 Å²	40	26%	0.259	21%	0.206	S	C	.	.	H	α-helix	trans	-63.2	-49.2	179.7	-173.5	-127.3	0	0	0	111.9	I410 Q460 V467 L468	I410-F463 HydrophobicContact CB-CE1 4.43Å; I410-F463 HydrophobicContact CB-CZ 3.84Å; I410-F463 HydrophobicContact CD1-CE2 4.21Å; I410-F463 HydrophobicContact CD1-CZ 3.96Å; I410-F463 HydrophobicContact CG1-CZ 4.43Å; I410-F463 HydrophobicContact CG2-CZ 3.93Å; Q460-F463 PolarHBondContact O-N 2.83Å; F463-V467 HydrophobicContact CD2-CB 3.9Å; F463-V467 HydrophobicContact CD2-CG1 4.29Å; F463-V467 HydrophobicContact CD2-CG2 3.92Å; F463-V467 HydrophobicContact CE2-CB 4.12Å; F463-V467 HydrophobicContact CE2-CG1 4Å; F463-V467 HydrophobicContact CE2-CG2 4.38Å; F463-V467 WeakPolarHBondContact O-CA 3.33Å; F463-V467 WeakPolarHBondContact O-CB 3.18Å; F463-V467 PolarHBondContact O-N 3.19Å; F463-L468 HydrophobicContact CD1-CD1 3.54Å; F463-L468 HydrophobicContact CD1-CD2 4.44Å; F463-L468 HydrophobicContact CD2-CD1 3.89Å; F463-L468 HydrophobicContact CE1-CD1 3.32Å; F463-L468 HydrophobicContact CE1-CD2 4.25Å; F463-L468 HydrophobicContact CE1-CG 4.41Å; F463-L468 HydrophobicContact CE2-CD1 3.67Å; F463-L468 HydrophobicContact CG-CD1 3.84Å; F463-L468 HydrophobicContact CZ-CD1 3.39Å; F463-L468 PolarHBondContact O-N 2.74Å
464	I	98.4	Very high	95.9	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.181	C	C	.	.	I	π-helix	trans	-63.7	-48.4	179.3	-65.9	167.4	0	0	0	110.7	E413 Q460 L468 I469 L490 A493 L494 Y497	E413-I464 HydrophobicContact CB-CD1 4.35Å; E413-I464 HydrophobicContact CB-CG1 4.27Å; E413-I464 HydrophobicContact CG-CD1 4.32Å; E413-I464 HydrophobicContact CG-CG1 4.18Å; Q460-I464 HydrophobicContact CB-CD1 4.22Å; Q460-I464 WeakPolarHBondContact O-CB 3.24Å; Q460-I464 WeakPolarHBondContact O-CG1 3.08Å; Q460-I464 PolarHBondContact O-N 2.69Å; I464-L468 HydrophobicContact CG1-CD2 4.43Å; I464-L468 PolarHBondContact O-N 2.8Å; I464-I469 HydrophobicContact CG2-CD1 3.89Å; I464-I469 HydrophobicContact CG2-CG1 4.08Å; I464-I469 WeakPolarHBondContact O-CB 3.47Å; I464-I469 WeakPolarHBondContact O-CG1 3.31Å; I464-I469 PolarHBondContact O-N 3.37Å; I464-L490 HydrophobicContact CG2-CB 4.24Å; I464-L490 HydrophobicContact CG2-CD2 4.45Å; I464-L490 WeakPolarHBondContact CG2-O 3.21Å; I464-A493 HydrophobicContact CD1-CB 4.07Å; I464-L494 HydrophobicContact CG2-CB 3.93Å; I464-Y497 HydrophobicContact CD1-CD2 3.67Å; I464-Y497 HydrophobicContact CD1-CE2 3.8Å
465	K	98	Very high	96.3	Very high	93 Å²	93	33.3 Å²	33.3	40%	0.404	18%	0.177	S	C	.	.	I	π-helix	trans	-69.7	-41.5	-173.3	-173.9	172.5	-173.6	162.6	0	113.6	I461 P470 L494	I461-K465 WeakPolarHBondContact O-CB 3.44Å; I461-K465 PolarHBondContact O-N 2.87Å; K465-P470 WeakPolarHBondContact O-CD 3.43Å; K465-L494 HydrophobicContact CB-CD1 4.14Å; K465-L494 HydrophobicContact CB-CD2 4.09Å; K465-L494 HydrophobicContact CD-CD2 4.47Å; K465-L494 HydrophobicContact CG-CD2 4.25Å
466	F	97.2	Very high	96.7	Very high	148 Å²	148	32.2 Å²	32.2	65%	0.649	17%	0.171	S	C	*	.	I	π-helix	trans	-105.3	-16	-171	-57.5	-61.2	0	0	0	114	G462	G462-F466 WeakPolarHBondContact O-CB 3.37Å; G462-F466 VanDerWaalsContact O-CD2 3.3Å; G462-F466 WeakPolarHBondContact O-CD2 3.47Å; G462-F466 PolarHBondContact O-N 2.93Å
467	V	98.1	Very high	97	Very high	28 Å²	28	34.1 Å²	34.1	17%	0.17	19%	0.188	C	C	.	.	I	π-helix	trans	-114.4	-60.5	179.5	-172.4	0	0	0	0	111.1	M371 I410 F463 M471	M371-V467 HydrophobicContact CE-CG1 3.81Å; I410-V467 HydrophobicContact CD1-CG1 3.78Å; F463-V467 HydrophobicContact CD2-CB 3.9Å; F463-V467 HydrophobicContact CD2-CG1 4.29Å; F463-V467 HydrophobicContact CD2-CG2 3.92Å; F463-V467 HydrophobicContact CE2-CB 4.12Å; F463-V467 HydrophobicContact CE2-CG1 4Å; F463-V467 HydrophobicContact CE2-CG2 4.38Å; F463-V467 WeakPolarHBondContact O-CA 3.33Å; F463-V467 WeakPolarHBondContact O-CB 3.18Å; F463-V467 PolarHBondContact O-N 3.19Å; V467-M471 VanDerWaalsContact O-CB 3.23Å; V467-M471 WeakPolarHBondContact O-CB 3.23Å; V467-M471 PolarHBondContact O-N 2.62Å
468	L	98.4	Very high	97.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.199	C	C	.	.	I	π-helix	trans	-70.9	-55.4	-170	-82	60	0	0	0	112	I410 E413 F463 I464 M471 F472 L490	I410-L468 HydrophobicContact CB-CD1 4.47Å; I410-L468 HydrophobicContact CD1-CD1 3.7Å; I410-L468 HydrophobicContact CD1-CG 4.32Å; I410-L468 HydrophobicContact CG1-CD1 4.11Å; I410-L468 HydrophobicContact CG1-CG 4.34Å; I410-L468 WeakPolarHBondContact O-CD2 3.43Å; E413-L468 HydrophobicContact CB-CD2 3.64Å; E413-L468 HydrophobicContact CG-CD2 3.89Å; F463-L468 HydrophobicContact CD1-CD1 3.54Å; F463-L468 HydrophobicContact CD1-CD2 4.44Å; F463-L468 HydrophobicContact CD2-CD1 3.89Å; F463-L468 HydrophobicContact CE1-CD1 3.32Å; F463-L468 HydrophobicContact CE1-CD2 4.25Å; F463-L468 HydrophobicContact CE1-CG 4.41Å; F463-L468 HydrophobicContact CE2-CD1 3.67Å; F463-L468 HydrophobicContact CG-CD1 3.84Å; F463-L468 HydrophobicContact CZ-CD1 3.39Å; F463-L468 PolarHBondContact O-N 2.74Å; I464-L468 HydrophobicContact CG1-CD2 4.43Å; I464-L468 PolarHBondContact O-N 2.8Å; L468-M471 PolarHBondContact O-N 2.89Å; L468-M471 VanDerWaalsContact O-N 3.13Å; L468-F472 HydrophobicContact CB-CD2 4.46Å; L468-F472 WeakPolarHBondContact O-CD2 3.46Å; L468-F472 PolarHBondContact O-N 3.22Å; L468-L490 HydrophobicContact CB-CD1 3.98Å; L468-L490 HydrophobicContact CB-CD2 4.09Å; L468-L490 HydrophobicContact CD2-CD2 3.62Å; L468-L490 HydrophobicContact CG-CD2 4.45Å
469	I	98.6	Very high	97.4	Very high	17 Å²	17	34.2 Å²	34.2	9%	0.087	19%	0.185	C	C	.	.	H	α-helix	trans	-56.1	-51.7	-177	-71.1	172	0	0	0	111	I464 M471 F472 Q473 V487 L490 K491 L494	I464-I469 HydrophobicContact CG2-CD1 3.89Å; I464-I469 HydrophobicContact CG2-CG1 4.08Å; I464-I469 WeakPolarHBondContact O-CB 3.47Å; I464-I469 WeakPolarHBondContact O-CG1 3.31Å; I464-I469 PolarHBondContact O-N 3.37Å; I469-M471 VanDerWaalsContact C-N 3.29Å; I469-M471 PolarHBondContact O-N 2.94Å; I469-F472 PolarHBondContact O-N 3.47Å; I469-Q473 HydrophobicContact CG2-CG 4.23Å; I469-Q473 WeakPolarHBondContact O-CB 3.29Å; I469-Q473 WeakPolarHBondContact O-CG 3.46Å; I469-Q473 PolarHBondContact O-N 3Å; I469-V487 HydrophobicContact CG2-CG1 4.45Å; I469-L490 HydrophobicContact CD1-CB 4.37Å; I469-L490 HydrophobicContact CG1-CB 3.77Å; I469-L490 HydrophobicContact CG1-CD1 4.33Å; I469-K491 HydrophobicContact CD1-CG 4.12Å; I469-L494 HydrophobicContact CD1-CD2 4.07Å
470	P	98.2	Very high	97.7	Very high	41 Å²	41	37.5 Å²	37.5	27%	0.266	20%	0.204	S	C	.	.	H	α-helix	trans	-58.8	-39.3	177.9	-26.7	36.7	0	0	0	113.2	K465 T474	K465-P470 WeakPolarHBondContact O-CD 3.43Å; P470-T474 WeakPolarHBondContact O-CG2 3.25Å; P470-T474 PolarHBondContact O-N 3.21Å
471	M	98.5	Very high	97.8	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-68.1	-49.9	179.7	-172.9	177.6	63.6	0	0	112	L378 V403 K406 C407 I410 V467 L468 I469 Q473 T474	L378-M471 HydrophobicContact CD1-CB 4.4Å; L378-M471 HydrophobicContact CD1-CG 4.16Å; L378-M471 HydrophobicContact CD2-CB 4.47Å; V403-M471 HydrophobicContact CG1-CG 4.35Å; K406-M471 HydrophobicContact CB-SD 3.72Å; C407-M471 HydrophobicContact CB-CE 4.36Å; I410-M471 HydrophobicContact CD1-CE 3.48Å; I410-M471 VanDerWaalsContact CD1-CE 3.48Å; I410-M471 HydrophobicContact CD1-SD 4.36Å; I410-M471 HydrophobicContact CG1-CE 3.52Å; V467-M471 VanDerWaalsContact O-CB 3.23Å; V467-M471 WeakPolarHBondContact O-CB 3.23Å; V467-M471 PolarHBondContact O-N 2.62Å; L468-M471 PolarHBondContact O-N 2.89Å; L468-M471 VanDerWaalsContact O-N 3.13Å; I469-M471 VanDerWaalsContact C-N 3.29Å; I469-M471 PolarHBondContact O-N 2.94Å; M471-Q473 VanDerWaalsContact C-N 3.26Å; M471-Q473 PolarHBondContact O-N 3.22Å; M471-T474 PolarHBondContact O-N 3.26Å; M471-T474 PolarHBondContact O-OG1 2.86Å
472	F	98.7	Very high	97.8	Very high	1 Å²	1	39 Å²	39	0%	0.004	21%	0.212	C	C	.	.	H	α-helix	trans	-64.1	-31.3	177.9	-83.9	-94.7	0	0	0	112.2	C407 V414 L468 I469 T474 V475 A476 I482 M486 V487 L490	C407-F472 HydrophobicContact CB-CE1 4.01Å; C407-F472 HydrophobicContact CB-CE2 4.15Å; C407-F472 HydrophobicContact CB-CZ 3.75Å; C407-F472 WeakPolarHBondContact O-CZ 3.26Å; V414-F472 HydrophobicContact CG2-CE1 3.84Å; V414-F472 HydrophobicContact CG2-CE2 3.94Å; V414-F472 HydrophobicContact CG2-CZ 3.52Å; L468-F472 HydrophobicContact CB-CD2 4.46Å; L468-F472 WeakPolarHBondContact O-CD2 3.46Å; L468-F472 PolarHBondContact O-N 3.22Å; I469-F472 PolarHBondContact O-N 3.47Å; F472-T474 VanDerWaalsContact C-N 3.29Å; F472-T474 PolarHBondContact O-N 2.92Å; F472-V475 PolarHBondContact O-N 3.26Å; F472-V475 VanDerWaalsContact O-N 3.12Å; F472-A476 WeakPolarHBondContact O-CB 3.4Å; F472-A476 PolarHBondContact O-N 3.36Å; F472-I482 HydrophobicContact CD1-CG2 3.98Å; F472-M486 HydrophobicContact CD1-CB 3.98Å; F472-M486 HydrophobicContact CD1-SD 4.04Å; F472-M486 HydrophobicContact CE1-CB 4.23Å; F472-M486 HydrophobicContact CE1-SD 3.6Å; F472-M486 VanDerWaalsContact CE1-SD 3.6Å; F472-V487 HydrophobicContact CB-CG2 3.86Å; F472-L490 HydrophobicContact CB-CD1 4.12Å; F472-L490 HydrophobicContact CD2-CD1 3.78Å; F472-L490 HydrophobicContact CE2-CD1 4.39Å; F472-L490 HydrophobicContact CG-CD1 3.93Å
473	Q	98.4	Very high	97.9	Very high	85 Å²	85	40.7 Å²	40.7	40%	0.397	22%	0.215	S	C	.	.	H	α-helix	trans	-63.1	-32.2	172.6	-77.7	174.4	-30.2	0	0	113	I469 M471 V475 A476 S477 V487	I469-Q473 HydrophobicContact CG2-CG 4.23Å; I469-Q473 WeakPolarHBondContact O-CB 3.29Å; I469-Q473 WeakPolarHBondContact O-CG 3.46Å; I469-Q473 PolarHBondContact O-N 3Å; M471-Q473 VanDerWaalsContact C-N 3.26Å; M471-Q473 PolarHBondContact O-N 3.22Å; Q473-V475 VanDerWaalsContact C-N 3.28Å; Q473-V475 PolarHBondContact O-N 3.45Å; Q473-A476 PolarHBondContact O-N 3.02Å; Q473-S477 PolarHBondContact O-N 3.15Å; Q473-V487 HydrophobicContact CG-CG1 4.19Å; Q473-V487 HydrophobicContact CG-CG2 4.33Å
474	T	98.2	Very high	97.9	Very high	10 Å²	10	44.6 Å²	44.6	6%	0.061	23%	0.234	C	C	.	.	H	α-helix	trans	-69.2	-26.4	173.7	68.2	0	0	0	0	113.3	L378 R382 L385 P470 M471 F472 S477	L378-T474 HydrophobicContact CD1-CG2 3.56Å; L378-T474 HydrophobicContact CG-CG2 4.27Å; R382-T474 HydrophobicContact CG-CG2 4.28Å; L385-T474 HydrophobicContact CD1-CG2 4.41Å; P470-T474 WeakPolarHBondContact O-CG2 3.25Å; P470-T474 PolarHBondContact O-N 3.21Å; M471-T474 PolarHBondContact O-N 3.26Å; M471-T474 PolarHBondContact O-OG1 2.86Å; F472-T474 VanDerWaalsContact C-N 3.29Å; F472-T474 PolarHBondContact O-N 2.92Å; T474-S477 PolarHBondContact O-OG 3.42Å
475	V	98.3	Very high	97.8	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.006	25%	0.248	C	C	.	.	H	α-helix	trans	-79.9	-40.8	171.6	-173.3	0	0	0	0	109.9	F400 V403 L404 F472 Q473 S477 V478 Y479 I482	F400-V475 HydrophobicContact CE2-CG1 4.06Å; F400-V475 HydrophobicContact CE2-CG2 4.48Å; F400-V475 HydrophobicContact CZ-CG1 4.07Å; V403-V475 HydrophobicContact CG1-CG2 3.61Å; L404-V475 HydrophobicContact CD2-CG1 4.24Å; F472-V475 PolarHBondContact O-N 3.26Å; F472-V475 VanDerWaalsContact O-N 3.12Å; Q473-V475 VanDerWaalsContact C-N 3.28Å; Q473-V475 PolarHBondContact O-N 3.45Å; V475-S477 VanDerWaalsContact C-N 3.28Å; V475-S477 PolarHBondContact O-N 3.42Å; V475-V478 PolarHBondContact O-N 3.38Å; V475-Y479 PolarHBondContact O-N 3Å; V475-I482 HydrophobicContact CB-CG2 4.37Å; V475-I482 HydrophobicContact CG1-CG1 3.94Å; V475-I482 HydrophobicContact CG1-CG2 4.46Å
476	A	98.2	Very high	97.8	Very high	9 Å²	9	42.9 Å²	42.9	7%	0.074	23%	0.229	C	C	.	.	H	α-helix	trans	-63.4	-29.8	179.1	0	0	0	0	0	113.9	F472 Q473 V478 Y479 P480 I482 D483 V487	F472-A476 WeakPolarHBondContact O-CB 3.4Å; F472-A476 PolarHBondContact O-N 3.36Å; Q473-A476 PolarHBondContact O-N 3.02Å; A476-V478 PolarHBondContact O-N 3.47Å; A476-Y479 WeakPolarHBondContact CA-O 3.48Å; A476-Y479 CarbonylContact O-C 3.53Å; A476-Y479 VanDerWaalsContact O-C 3.28Å; A476-Y479 PolarHBondContact O-N 2.96Å; A476-P480 WeakPolarHBondContact O-CA 3.35Å; A476-I482 HydrophobicContact CB-CB 4.15Å; A476-I482 HydrophobicContact CB-CG2 4.25Å; A476-D483 HydrophobicContact CB-CB 3.96Å; A476-V487 HydrophobicContact CB-CG2 4.37Å
477	S	97.3	Very high	97.9	Very high	73 Å²	73	35.9 Å²	35.9	51%	0.51	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-24.8	173.2	65.1	0	0	0	0	113.1	L385 Q473 T474 V475	L385-S477 WeakPolarHBondContact CD1-OG 3.43Å; L385-S477 VanDerWaalsContact CD2-OG 3.26Å; L385-S477 WeakPolarHBondContact CD2-OG 3.45Å; Q473-S477 PolarHBondContact O-N 3.15Å; T474-S477 PolarHBondContact O-OG 3.42Å; V475-S477 VanDerWaalsContact C-N 3.28Å; V475-S477 PolarHBondContact O-N 3.42Å
478	V	97.4	Very high	97.9	Very high	35 Å²	35	37.2 Å²	37.2	21%	0.212	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-42.3	173.7	-171	0	0	0	0	110.8	M381 L385 F389 F400 V475 A476	M381-V478 HydrophobicContact CE-CG2 3.82Å; L385-V478 HydrophobicContact CD2-CG2 3.65Å; F389-V478 HydrophobicContact CD1-CG1 3.8Å; F389-V478 HydrophobicContact CD1-CG2 3.89Å; F389-V478 HydrophobicContact CE1-CG1 3.57Å; F389-V478 HydrophobicContact CE1-CG2 4.06Å; F389-V478 HydrophobicContact CG-CG2 4.2Å; F389-V478 HydrophobicContact CZ-CG1 4.45Å; F400-V478 HydrophobicContact CE2-CB 4.43Å; F400-V478 HydrophobicContact CE2-CG2 4.32Å; V475-V478 PolarHBondContact O-N 3.38Å; A476-V478 PolarHBondContact O-N 3.47Å
479	Y	97.6	Very high	97.8	Very high	34 Å²	34	40.6 Å²	40.6	13%	0.133	22%	0.222	C	C	.	.			trans	-127.5	90.1	-177.1	-65	-80.5	0	0	0	110.7	C277 L279 D282 M391 F400 V475 A476 I481 I482	C277-Y479 HydrophobicContact CB-CD1 3.61Å; C277-Y479 HydrophobicContact CB-CD2 4.19Å; C277-Y479 HydrophobicContact CB-CE1 4Å; C277-Y479 HydrophobicContact CB-CG 3.72Å; C277-Y479 WeakPolarHBondContact O-CD1 3.48Å; C277-Y479 WeakPolarHBondContact O-CE1 3.45Å; C277-Y479 VanDerWaalsContact SG-CB 3.56Å; L279-Y479 HydrophobicContact CD1-CE2 4.44Å; L279-Y479 HydrophobicContact CD2-CE1 4.42Å; L279-Y479 HydrophobicContact CD2-CE2 3.87Å; L279-Y479 WeakPolarHBondContact CD2-OH 3.25Å; L279-Y479 HydrophobicContact CG-CE2 4.32Å; D282-Y479 PolarHBondContact OD2-OH 3.24Å; M391-Y479 HydrophobicContact CE-CE2 4.17Å; M391-Y479 WeakPolarHBondContact CE-OH 3.34Å; F400-Y479 HydrophobicContact CE1-CD2 4.42Å; F400-Y479 AromaticContact CE1-CE2 3.79Å; F400-Y479 HydrophobicContact CE1-CE2 3.79Å; F400-Y479 HydrophobicContact CE2-CD2 4.47Å; F400-Y479 HydrophobicContact CE2-CE2 4.42Å; F400-Y479 AromaticContact CZ-CD2 3.69Å; F400-Y479 HydrophobicContact CZ-CD2 3.69Å; F400-Y479 AromaticContact CZ-CE2 3.49Å; F400-Y479 HydrophobicContact CZ-CE2 3.49Å; F400-Y479 VanDerWaalsContact CZ-CE2 3.49Å; V475-Y479 PolarHBondContact O-N 3Å; A476-Y479 WeakPolarHBondContact CA-O 3.48Å; A476-Y479 CarbonylContact O-C 3.53Å; A476-Y479 VanDerWaalsContact O-C 3.28Å; A476-Y479 PolarHBondContact O-N 2.96Å; Y479-I481 PolarHBondContact O-N 3.15Å; Y479-I482 WeakPolarHBondContact O-CB 3.26Å; Y479-I482 PolarHBondContact O-N 2.8Å
480	P	97.6	Very high	97.8	Very high	97 Å²	97	39.8 Å²	39.8	63%	0.63	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-23.7	-173.4	-30.2	36.6	0	0	0	115.7	A476 I482 D483	A476-P480 WeakPolarHBondContact O-CA 3.35Å; P480-I482 PolarHBondContact O-N 2.95Å; P480-I482 VanDerWaalsContact O-N 3.15Å; P480-D483 WeakPolarHBondContact O-CB 3.2Å; P480-D483 PolarHBondContact O-N 3.03Å
481	I	97.5	Very high	97.8	Very high	59 Å²	59	41.6 Å²	41.6	30%	0.303	22%	0.222	S	C	.	.	H	α-helix	trans	-57.3	-26.7	174.8	-165.1	169.1	0	0	0	113	L276 Y479 D483 E484 L485	L276-I481 HydrophobicContact CD2-CD1 4.42Å; Y479-I481 PolarHBondContact O-N 3.15Å; I481-D483 VanDerWaalsContact C-N 3.32Å; I481-E484 PolarHBondContact O-N 2.93Å; I481-L485 HydrophobicContact CD1-CD1 4.08Å; I481-L485 HydrophobicContact CG1-CD1 3.73Å; I481-L485 HydrophobicContact CG1-CG 4.15Å; I481-L485 WeakPolarHBondContact O-CB 3.23Å; I481-L485 WeakPolarHBondContact O-CG 3.34Å; I481-L485 PolarHBondContact O-N 2.83Å
482	I	98.2	Very high	97.8	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-68.6	-31.4	175.2	-61.9	-63.1	0	0	0	111.4	I273 F472 V475 A476 Y479 P480 M486 V487	I273-I482 HydrophobicContact CG1-CD1 4.42Å; I273-I482 HydrophobicContact CG2-CD1 4.47Å; F472-I482 HydrophobicContact CD1-CG2 3.98Å; V475-I482 HydrophobicContact CB-CG2 4.37Å; V475-I482 HydrophobicContact CG1-CG1 3.94Å; V475-I482 HydrophobicContact CG1-CG2 4.46Å; A476-I482 HydrophobicContact CB-CB 4.15Å; A476-I482 HydrophobicContact CB-CG2 4.25Å; Y479-I482 WeakPolarHBondContact O-CB 3.26Å; Y479-I482 PolarHBondContact O-N 2.8Å; P480-I482 PolarHBondContact O-N 2.95Å; P480-I482 VanDerWaalsContact O-N 3.15Å; I482-M486 HydrophobicContact CD1-CE 3.88Å; I482-M486 HydrophobicContact CD1-SD 3.86Å; I482-M486 HydrophobicContact CG2-CB 4.18Å; I482-M486 HydrophobicContact CG2-CG 4.48Å; I482-M486 HydrophobicContact CG2-SD 4.36Å; I482-M486 WeakPolarHBondContact O-CA 3.31Å; I482-M486 WeakPolarHBondContact O-CB 3.5Å; I482-M486 PolarHBondContact O-N 2.95Å; I482-V487 PolarHBondContact O-N 2.81Å
483	D	97.5	Very high	97.7	Very high	62 Å²	62	43.7 Å²	43.7	33%	0.332	24%	0.237	S	C	.	.	I	π-helix	trans	-65.6	-47.2	176.2	-161.4	70.2	0	0	0	110.9	A476 P480 I481 V487 T488	A476-D483 HydrophobicContact CB-CB 3.96Å; P480-D483 WeakPolarHBondContact O-CB 3.2Å; P480-D483 PolarHBondContact O-N 3.03Å; I481-D483 VanDerWaalsContact C-N 3.32Å; D483-V487 PolarHBondContact O-N 3.39Å; D483-V487 WeakPolarHBondContact OD1-CB 3.24Å; D483-V487 WeakPolarHBondContact OD1-CG1 3.49Å; D483-T488 PolarHBondContact O-N 3.37Å; D483-T488 PolarHBondContact O-OG1 3.38Å
484	E	95.8	Very high	97.7	Very high	140 Å²	140	40.6 Å²	40.6	65%	0.654	22%	0.223	S	C	*	.	I	π-helix	trans	-63.4	-48.2	179.9	-174.1	-178.2	172.9	0	0	111.8	I481 T488	I481-E484 PolarHBondContact O-N 2.93Å; E484-T488 WeakPolarHBondContact O-CB 3.22Å; E484-T488 PolarHBondContact O-OG1 3.5Å
485	L	96.6	Very high	97.6	Very high	58 Å²	58	46.3 Å²	46.3	30%	0.304	25%	0.249	S	C	.	.	I	π-helix	trans	-91.4	-23.3	-170.2	-61.3	-177.8	0	0	0	114.6	L276 I481 Q489	L276-L485 HydrophobicContact CD1-CD1 4.13Å; L276-L485 HydrophobicContact CD2-CD1 3.73Å; L276-L485 HydrophobicContact CG-CD1 4.49Å; I481-L485 HydrophobicContact CD1-CD1 4.08Å; I481-L485 HydrophobicContact CG1-CD1 3.73Å; I481-L485 HydrophobicContact CG1-CG 4.15Å; I481-L485 WeakPolarHBondContact O-CB 3.23Å; I481-L485 WeakPolarHBondContact O-CG 3.34Å; I481-L485 PolarHBondContact O-N 2.83Å; L485-Q489 WeakPolarHBondContact O-CG 3.48Å
486	M	98.4	Very high	97.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.262	C	S	.	.	I	π-helix	trans	-125.4	-49.7	-171.3	-54.5	-167.9	-177.3	0	0	113.1	P205 M269 I273 L276 V414 F472 I482 T488 Q489 L490	P205-M486 HydrophobicContact CB-CE 3.93Å; P205-M486 HydrophobicContact CB-CG 4.46Å; P205-M486 HydrophobicContact CG-CE 4.16Å; M269-M486 HydrophobicContact SD-CE 3.86Å; M269-M486 HydrophobicContact SD-SD 4.34Å; I273-M486 HydrophobicContact CD1-CE 4.19Å; I273-M486 HydrophobicContact CD1-SD 4.28Å; I273-M486 HydrophobicContact CG1-CE 3.53Å; I273-M486 HydrophobicContact CG1-SD 4.23Å; L276-M486 HydrophobicContact CD1-CE 3.92Å; V414-M486 HydrophobicContact CG1-CB 3.49Å; V414-M486 VanDerWaalsContact CG1-CB 3.49Å; V414-M486 HydrophobicContact CG1-CG 3.57Å; V414-M486 HydrophobicContact CG1-SD 4.1Å; V414-M486 HydrophobicContact CG2-CB 4.48Å; F472-M486 HydrophobicContact CD1-CB 3.98Å; F472-M486 HydrophobicContact CD1-SD 4.04Å; F472-M486 HydrophobicContact CE1-CB 4.23Å; F472-M486 HydrophobicContact CE1-SD 3.6Å; F472-M486 VanDerWaalsContact CE1-SD 3.6Å; I482-M486 HydrophobicContact CD1-CE 3.88Å; I482-M486 HydrophobicContact CD1-SD 3.86Å; I482-M486 HydrophobicContact CG2-CB 4.18Å; I482-M486 HydrophobicContact CG2-CG 4.48Å; I482-M486 HydrophobicContact CG2-SD 4.36Å; I482-M486 WeakPolarHBondContact O-CA 3.31Å; I482-M486 WeakPolarHBondContact O-CB 3.5Å; I482-M486 PolarHBondContact O-N 2.95Å; M486-T488 VanDerWaalsContact C-N 3.3Å; M486-T488 PolarHBondContact O-N 3.39Å; M486-Q489 WeakPolarHBondContact O-CB 3.34Å; M486-Q489 PolarHBondContact O-N 3.14Å; M486-L490 WeakPolarHBondContact O-CG 3.49Å; M486-L490 PolarHBondContact O-N 3.32Å
487	V	98.3	Very high	97.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.259	C	S	.	.	I	π-helix	trans	-64.8	-38.4	179.2	-178.5	0	0	0	0	110.9	I469 F472 Q473 A476 I482 D483 Q489 L490 K491	I469-V487 HydrophobicContact CG2-CG1 4.45Å; F472-V487 HydrophobicContact CB-CG2 3.86Å; Q473-V487 HydrophobicContact CG-CG1 4.19Å; Q473-V487 HydrophobicContact CG-CG2 4.33Å; A476-V487 HydrophobicContact CB-CG2 4.37Å; I482-V487 PolarHBondContact O-N 2.81Å; D483-V487 PolarHBondContact O-N 3.39Å; D483-V487 WeakPolarHBondContact OD1-CB 3.24Å; D483-V487 WeakPolarHBondContact OD1-CG1 3.49Å; V487-Q489 VanDerWaalsContact C-N 3.33Å; V487-Q489 PolarHBondContact O-N 3.35Å; V487-L490 PolarHBondContact O-N 2.85Å; V487-K491 HydrophobicContact CG1-CD 4.3Å; V487-K491 WeakPolarHBondContact O-CG 3.43Å; V487-K491 PolarHBondContact O-N 2.71Å
488	T	97.8	Very high	97.5	Very high	56 Å²	56	49.7 Å²	49.7	34%	0.344	25%	0.252	S	S	.	.	H	α-helix	trans	-59.8	-43.5	174.2	-60	0	0	0	0	111.4	D483 E484 M486 L490 K491 S492	D483-T488 PolarHBondContact O-N 3.37Å; D483-T488 PolarHBondContact O-OG1 3.38Å; E484-T488 WeakPolarHBondContact O-CB 3.22Å; E484-T488 PolarHBondContact O-OG1 3.5Å; M486-T488 VanDerWaalsContact C-N 3.3Å; M486-T488 PolarHBondContact O-N 3.39Å; T488-L490 VanDerWaalsContact C-N 3.35Å; T488-L490 PolarHBondContact O-N 2.97Å; T488-K491 PolarHBondContact O-N 3.36Å; T488-S492 PolarHBondContact O-N 3.01Å; T488-S492 PolarHBondContact O-OG 2.91Å
489	Q	97.4	Very high	97.5	Very high	71 Å²	71	54.4 Å²	54.4	33%	0.332	27%	0.269	S	S	.	.	H	α-helix	trans	-62.5	-41.7	176.3	-66.3	-59.7	116.4	0	0	112.1	V414 L485 M486 V487 S492 A493	V414-Q489 WeakPolarHBondContact O-CB 3.38Å; L485-Q489 WeakPolarHBondContact O-CG 3.48Å; M486-Q489 WeakPolarHBondContact O-CB 3.34Å; M486-Q489 PolarHBondContact O-N 3.14Å; V487-Q489 VanDerWaalsContact C-N 3.33Å; V487-Q489 PolarHBondContact O-N 3.35Å; Q489-S492 PolarHBondContact O-N 2.94Å; Q489-A493 WeakPolarHBondContact O-CB 3.33Å; Q489-A493 PolarHBondContact O-N 3.48Å
490	L	98.4	Very high	97.4	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.1	-41.2	175.9	-68.7	170.9	0	0	0	112.4	E413 V414 I464 L468 I469 F472 M486 V487 T488 A493 L494	E413-L490 HydrophobicContact CB-CD2 3.86Å; V414-L490 HydrophobicContact CG2-CD1 4.11Å; V414-L490 HydrophobicContact CG2-CD2 3.87Å; V414-L490 HydrophobicContact CG2-CG 4Å; I464-L490 HydrophobicContact CG2-CB 4.24Å; I464-L490 HydrophobicContact CG2-CD2 4.45Å; I464-L490 WeakPolarHBondContact CG2-O 3.21Å; L468-L490 HydrophobicContact CB-CD1 3.98Å; L468-L490 HydrophobicContact CB-CD2 4.09Å; L468-L490 HydrophobicContact CD2-CD2 3.62Å; L468-L490 HydrophobicContact CG-CD2 4.45Å; I469-L490 HydrophobicContact CD1-CB 4.37Å; I469-L490 HydrophobicContact CG1-CB 3.77Å; I469-L490 HydrophobicContact CG1-CD1 4.33Å; F472-L490 HydrophobicContact CB-CD1 4.12Å; F472-L490 HydrophobicContact CD2-CD1 3.78Å; F472-L490 HydrophobicContact CE2-CD1 4.39Å; F472-L490 HydrophobicContact CG-CD1 3.93Å; M486-L490 WeakPolarHBondContact O-CG 3.49Å; M486-L490 PolarHBondContact O-N 3.32Å; V487-L490 PolarHBondContact O-N 2.85Å; T488-L490 VanDerWaalsContact C-N 3.35Å; T488-L490 PolarHBondContact O-N 2.97Å; L490-A493 PolarHBondContact O-N 3.18Å; L490-L494 WeakPolarHBondContact O-CB 3.47Å; L490-L494 PolarHBondContact O-N 2.86Å
491	K	98.3	Very high	97.3	Very high	79 Å²	79	52.7 Å²	52.7	34%	0.343	26%	0.256	S	S	.	.	H	α-helix	trans	-62.4	-46.1	174.7	-72.2	169.1	179.5	162.6	0	111.1	I469 V487 T488 A493 L494 E495	I469-K491 HydrophobicContact CD1-CG 4.12Å; V487-K491 HydrophobicContact CG1-CD 4.3Å; V487-K491 WeakPolarHBondContact O-CG 3.43Å; V487-K491 PolarHBondContact O-N 2.71Å; T488-K491 PolarHBondContact O-N 3.36Å; K491-A493 VanDerWaalsContact C-N 3.27Å; K491-A493 PolarHBondContact O-N 2.99Å; K491-L494 WeakPolarHBondContact O-CB 3.28Å; K491-L494 PolarHBondContact O-N 3.17Å; K491-E495 WeakPolarHBondContact O-CG 3.33Å; K491-E495 PolarHBondContact O-N 3.35Å
492	S	97.4	Very high	97.2	Very high	48 Å²	48	52.5 Å²	52.5	34%	0.336	26%	0.263	S	S	.	.	H	α-helix	trans	-63.8	-32.2	174.4	-61.5	0	0	0	0	112.6	T488 Q489 R496	T488-S492 PolarHBondContact O-N 3.01Å; T488-S492 PolarHBondContact O-OG 2.91Å; Q489-S492 PolarHBondContact O-N 2.94Å; S492-R496 VanDerWaalsContact O-CG 3.26Å; S492-R496 WeakPolarHBondContact O-CG 3.43Å; S492-R496 PolarHBondContact O-N 3.46Å; S492-R496 PolarHBondContact O-NE 3.01Å
493	A	97	Very high	97.1	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-67.8	-44.3	172.9	0	0	0	0	0	112.4	I464 Q489 L490 K491 R496 Y497	I464-A493 HydrophobicContact CD1-CB 4.07Å; Q489-A493 WeakPolarHBondContact O-CB 3.33Å; Q489-A493 PolarHBondContact O-N 3.48Å; L490-A493 PolarHBondContact O-N 3.18Å; K491-A493 VanDerWaalsContact C-N 3.27Å; K491-A493 PolarHBondContact O-N 2.99Å; A493-R496 VanDerWaalsContact CA-NH2 3.27Å; A493-R496 VanDerWaalsContact CB-NH2 3.34Å; A493-R496 PolarHBondContact O-N 3.23Å; A493-Y497 WeakPolarHBondContact O-CD2 3.46Å; A493-Y497 PolarHBondContact O-N 3.01Å
494	L	98	Very high	96.8	Very high	20 Å²	20	56.5 Å²	56.5	11%	0.105	28%	0.28	C	S	.	.	H	α-helix	trans	-57.4	-52.3	176	179.9	59.8	0	0	0	111.8	I461 I464 K465 I469 L490 K491 R496 Y497 E498	I461-L494 HydrophobicContact CB-CD1 4.25Å; I461-L494 HydrophobicContact CG1-CD1 4.38Å; I461-L494 HydrophobicContact CG2-CD1 3.87Å; I464-L494 HydrophobicContact CG2-CB 3.93Å; K465-L494 HydrophobicContact CB-CD1 4.14Å; K465-L494 HydrophobicContact CB-CD2 4.09Å; K465-L494 HydrophobicContact CD-CD2 4.47Å; K465-L494 HydrophobicContact CG-CD2 4.25Å; I469-L494 HydrophobicContact CD1-CD2 4.07Å; L490-L494 WeakPolarHBondContact O-CB 3.47Å; L490-L494 PolarHBondContact O-N 2.86Å; K491-L494 WeakPolarHBondContact O-CB 3.28Å; K491-L494 PolarHBondContact O-N 3.17Å; L494-R496 PolarHBondContact O-N 3.04Å; L494-Y497 PolarHBondContact O-N 2.85Å; L494-Y497 VanDerWaalsContact O-N 3.14Å; L494-E498 HydrophobicContact CD1-CG 4.18Å; L494-E498 HydrophobicContact CG-CG 4.46Å; L494-E498 WeakPolarHBondContact O-CG 3.39Å; L494-E498 PolarHBondContact O-N 3.16Å
495	E	97.9	Very high	96.7	Very high	129 Å²	129	54.7 Å²	54.7	60%	0.603	27%	0.271	S	S	*	.	H	α-helix	trans	-56	-38.8	179.3	-72.8	173.4	-175.9	0	0	112.1	K491 K499	K491-E495 WeakPolarHBondContact O-CG 3.33Å; K491-E495 PolarHBondContact O-N 3.35Å; E495-K499 WeakPolarHBondContact O-CB 3.3Å; E495-K499 PolarHBondContact O-N 3.42Å
496	R	95.8	Very high	96.5	Very high	75 Å²	75	57.2 Å²	57.2	28%	0.283	28%	0.282	S	S	.	.	H	α-helix	trans	-68.6	-44.6	177.8	-73.4	-177.9	-61.9	96.3	-11.1	112.5	L417 S492 A493 L494 E498 K499 M500	L417-R496 VanDerWaalsContact CD1-CZ 3.44Å; L417-R496 VanDerWaalsContact CD1-NH1 3.31Å; L417-R496 VanDerWaalsContact CD2-CZ 3.48Å; L417-R496 VanDerWaalsContact CG-NH2 3.35Å; S492-R496 VanDerWaalsContact O-CG 3.26Å; S492-R496 WeakPolarHBondContact O-CG 3.43Å; S492-R496 PolarHBondContact O-N 3.46Å; S492-R496 PolarHBondContact O-NE 3.01Å; A493-R496 VanDerWaalsContact CA-NH2 3.27Å; A493-R496 VanDerWaalsContact CB-NH2 3.34Å; A493-R496 PolarHBondContact O-N 3.23Å; L494-R496 PolarHBondContact O-N 3.04Å; R496-E498 VanDerWaalsContact C-N 3.33Å; R496-K499 PolarHBondContact O-N 2.8Å; R496-M500 WeakPolarHBondContact O-CB 3.39Å; R496-M500 PolarHBondContact O-N 3.46Å
497	Y	97.2	Very high	96.2	Very high	1 Å²	1	61 Å²	61	0%	0.004	31%	0.305	C	S	.	.	H	α-helix	trans	-67.1	-37	177.1	-72.9	-61.3	0	0	0	111.5	K456 Q460 I464 A493 L494 K499 M500 L501	K456-Y497 HydrophobicContact CD-CE1 4.25Å; K456-Y497 HydrophobicContact CG-CE1 3.88Å; Q460-Y497 HydrophobicContact CB-CD1 4.11Å; Q460-Y497 HydrophobicContact CB-CD2 3.62Å; Q460-Y497 HydrophobicContact CB-CE1 4.18Å; Q460-Y497 HydrophobicContact CB-CE2 3.69Å; Q460-Y497 HydrophobicContact CB-CG 3.85Å; Q460-Y497 HydrophobicContact CG-CD2 4.34Å; Q460-Y497 HydrophobicContact CG-CE1 4.11Å; Q460-Y497 HydrophobicContact CG-CE2 3.9Å; I464-Y497 HydrophobicContact CD1-CD2 3.67Å; I464-Y497 HydrophobicContact CD1-CE2 3.8Å; A493-Y497 WeakPolarHBondContact O-CD2 3.46Å; A493-Y497 PolarHBondContact O-N 3.01Å; L494-Y497 PolarHBondContact O-N 2.85Å; L494-Y497 VanDerWaalsContact O-N 3.14Å; Y497-K499 VanDerWaalsContact C-N 3.33Å; Y497-K499 PolarHBondContact O-N 2.8Å; Y497-M500 HydrophobicContact CD1-CE 4.44Å; Y497-M500 HydrophobicContact CD1-SD 4.44Å; Y497-M500 PolarHBondContact O-N 2.97Å; Y497-L501 PolarHBondContact O-N 2.68Å
498	E	97.8	Very high	95.8	Very high	79 Å²	79	66.3 Å²	66.3	37%	0.369	33%	0.328	S	S	.	.	H	α-helix	trans	-60.8	-42.1	172.4	-72.6	179.3	156.7	0	0	111.4	I461 L494 R496 L501 A502	I461-E498 HydrophobicContact CD1-CG 4.08Å; I461-E498 HydrophobicContact CG1-CG 4.12Å; I461-E498 HydrophobicContact CG2-CG 4.27Å; L494-E498 HydrophobicContact CD1-CG 4.18Å; L494-E498 HydrophobicContact CG-CG 4.46Å; L494-E498 WeakPolarHBondContact O-CG 3.39Å; L494-E498 PolarHBondContact O-N 3.16Å; R496-E498 VanDerWaalsContact C-N 3.33Å; E498-L501 PolarHBondContact O-N 2.84Å; E498-A502 PolarHBondContact O-N 3.29Å; E498-A502 VanDerWaalsContact O-N 3.09Å
499	K	97.2	Very high	95.5	Very high	133 Å²	133	70.9 Å²	70.9	58%	0.578	34%	0.339	S	S	*	.	H	α-helix	trans	-63.2	-45.7	173.6	-172.2	-175.9	-179.3	-153	0	112.3	E495 R496 Y497 L501 A502 E503	E495-K499 WeakPolarHBondContact O-CB 3.3Å; E495-K499 PolarHBondContact O-N 3.42Å; R496-K499 PolarHBondContact O-N 2.8Å; Y497-K499 VanDerWaalsContact C-N 3.33Å; Y497-K499 PolarHBondContact O-N 2.8Å; K499-L501 VanDerWaalsContact C-N 3.31Å; K499-L501 PolarHBondContact O-N 2.84Å; K499-A502 PolarHBondContact O-N 2.79Å; K499-E503 WeakPolarHBondContact CE-OE1 3.41Å; K499-E503 IonicContact NZ-OE1 3.62Å; K499-E503 PolarHBondContact NZ-OE1 2.82Å; K499-E503 WeakPolarHBondContact O-CG 3.24Å; K499-E503 PolarHBondContact O-N 2.77Å
500	M	95.6	Very high	95.2	Very high	57 Å²	57	71 Å²	71	28%	0.281	34%	0.342	S	S	.	.	H	α-helix	trans	-60.7	-40.9	178.5	-171	-177.2	-62	0	0	111.5	P457 R496 Y497 E503 E504	P457-M500 HydrophobicContact CG-CB 3.86Å; P457-M500 HydrophobicContact CG-CG 3.58Å; P457-M500 HydrophobicContact CG-SD 3.56Å; P457-M500 VanDerWaalsContact CG-SD 3.56Å; R496-M500 WeakPolarHBondContact O-CB 3.39Å; R496-M500 PolarHBondContact O-N 3.46Å; Y497-M500 HydrophobicContact CD1-CE 4.44Å; Y497-M500 HydrophobicContact CD1-SD 4.44Å; Y497-M500 PolarHBondContact O-N 2.97Å; M500-E503 PolarHBondContact O-N 2.93Å; M500-E504 WeakPolarHBondContact O-CG 3.16Å; M500-E504 PolarHBondContact O-N 2.82Å
501	L	95.6	Very high	94.6	Very high	39 Å²	39	75.7 Å²	75.7	20%	0.204	37%	0.366	C	S	.	.	H	α-helix	trans	-62.4	-44.2	174.7	-177.9	59.8	0	0	0	111.8	P457 T458 I461 Y497 E498 K499 E503 E504 E505	P457-L501 HydrophobicContact CB-CB 3.8Å; P457-L501 HydrophobicContact CB-CD1 4.4Å; T458-L501 HydrophobicContact CG2-CD1 3.87Å; I461-L501 HydrophobicContact CD1-CB 4Å; I461-L501 HydrophobicContact CD1-CD2 3.67Å; I461-L501 HydrophobicContact CD1-CG 4.48Å; Y497-L501 PolarHBondContact O-N 2.68Å; E498-L501 PolarHBondContact O-N 2.84Å; K499-L501 VanDerWaalsContact C-N 3.31Å; K499-L501 PolarHBondContact O-N 2.84Å; L501-E503 VanDerWaalsContact C-N 3.33Å; L501-E503 PolarHBondContact O-N 3.09Å; L501-E504 PolarHBondContact O-N 3.36Å; L501-E505 HydrophobicContact CD1-CG 4.36Å; L501-E505 WeakPolarHBondContact O-CG 3.42Å; L501-E505 PolarHBondContact O-N 3.35Å
502	A	96.2	Very high	94	Very high	55 Å²	55	78.2 Å²	78.2	46%	0.455	38%	0.38	S	S	.	.	H	α-helix	trans	-61.3	-41.7	178	0	0	0	0	0	112.1	E498 K499 E505 E506	E498-A502 PolarHBondContact O-N 3.29Å; E498-A502 VanDerWaalsContact O-N 3.09Å; K499-A502 PolarHBondContact O-N 2.79Å; A502-E505 PolarHBondContact O-N 3.32Å; A502-E506 WeakPolarHBondContact O-CB 3.21Å; A502-E506 PolarHBondContact O-N 3.44Å
503	E	95.3	Very high	93.3	Very high	93 Å²	93	80.9 Å²	80.9	44%	0.435	39%	0.389	S	S	.	.	H	α-helix	trans	-65	-39.9	175.7	-69.5	172	178	0	0	112	K499 M500 L501 T507	K499-E503 WeakPolarHBondContact CE-OE1 3.41Å; K499-E503 IonicContact NZ-OE1 3.62Å; K499-E503 PolarHBondContact NZ-OE1 2.82Å; K499-E503 WeakPolarHBondContact O-CG 3.24Å; K499-E503 PolarHBondContact O-N 2.77Å; M500-E503 PolarHBondContact O-N 2.93Å; L501-E503 VanDerWaalsContact C-N 3.33Å; L501-E503 PolarHBondContact O-N 3.09Å; E503-T507 WeakPolarHBondContact O-CB 3.47Å; E503-T507 PolarHBondContact O-N 2.86Å; E503-T507 PolarHBondContact O-OG1 3Å
504	E	92.1	Very high	92.5	Very high	54 Å²	54	86.4 Å²	86.4	25%	0.252	42%	0.419	S	S	.	.	H	α-helix	trans	-63.3	-43.2	174.2	-76.8	-177.1	-166.5	0	0	112.1	T455 P457 M500 L501 T507 K508	T455-E504 PolarHBondContact OG1-OE2 3.39Å; P457-E504 WeakPolarHBondContact CD-OE1 3.42Å; P457-E504 WeakPolarHBondContact CG-OE1 3.25Å; M500-E504 WeakPolarHBondContact O-CG 3.16Å; M500-E504 PolarHBondContact O-N 2.82Å; L501-E504 PolarHBondContact O-N 3.36Å; E504-T507 PolarHBondContact O-N 3.04Å; E504-K508 WeakPolarHBondContact O-CB 3.44Å; E504-K508 WeakPolarHBondContact O-CG 3.43Å; E504-K508 PolarHBondContact O-N 3.44Å
505	E	92.6	Very high	91.4	Very high	101 Å²	101	93.2 Å²	93.2	47%	0.472	45%	0.45	S	S	.	.	H	α-helix	trans	-67.9	-40.3	178.8	-73.5	-176.9	169.4	0	0	112.3	L501 A502 K508 R509	L501-E505 HydrophobicContact CD1-CG 4.36Å; L501-E505 WeakPolarHBondContact O-CG 3.42Å; L501-E505 PolarHBondContact O-N 3.35Å; A502-E505 PolarHBondContact O-N 3.32Å; E505-K508 PolarHBondContact O-N 2.81Å; E505-R509 WeakPolarHBondContact O-CB 3.18Å; E505-R509 PolarHBondContact O-N 3.31Å
506	E	93.4	Very high	90.1	Very high	112 Å²	112	91.1 Å²	91.1	52%	0.523	46%	0.455	S	S	.	.	H	α-helix	trans	-62.4	-45	174	-176.5	174.1	-171.4	0	0	111.1	A502 K508 R509 N510	A502-E506 WeakPolarHBondContact O-CB 3.21Å; A502-E506 PolarHBondContact O-N 3.44Å; E506-K508 PolarHBondContact O-N 2.95Å; E506-R509 PolarHBondContact O-N 3.48Å; E506-N510 WeakPolarHBondContact O-CB 3.47Å; E506-N510 VanDerWaalsContact O-CG 3.24Å; E506-N510 PolarHBondContact O-N 3.25Å; E506-N510 PolarHBondContact O-ND2 3.04Å
507	T	92.2	Very high	88.4	Confident	80 Å²	80	96.8 Å²	96.8	49%	0.491	49%	0.491	S	S	.	.	H	α-helix	trans	-61.3	-46.1	177.2	-57.5	0	0	0	0	111.5	E503 E504 R509 N510 L511	E503-T507 WeakPolarHBondContact O-CB 3.47Å; E503-T507 PolarHBondContact O-N 2.86Å; E503-T507 PolarHBondContact O-OG1 3Å; E504-T507 PolarHBondContact O-N 3.04Å; T507-R509 VanDerWaalsContact C-N 3.34Å; T507-R509 PolarHBondContact O-N 2.86Å; T507-N510 PolarHBondContact O-N 3.36Å; T507-L511 HydrophobicContact CG2-CD1 4.22Å; T507-L511 WeakPolarHBondContact O-CG 3.45Å; T507-L511 PolarHBondContact O-N 3.26Å
508	K	89.6	Confident	87.9	Confident	111 Å²	111	101.6 Å²	101.6	48%	0.483	52%	0.515	S	S	.	.	H	α-helix	trans	-60.5	-42.1	176.4	-76.2	172.2	-177.5	168	0	112	E504 E505 E506 L511 Q512	E504-K508 WeakPolarHBondContact O-CB 3.44Å; E504-K508 WeakPolarHBondContact O-CG 3.43Å; E504-K508 PolarHBondContact O-N 3.44Å; E505-K508 PolarHBondContact O-N 2.81Å; E506-K508 PolarHBondContact O-N 2.95Å; K508-L511 PolarHBondContact O-N 3.01Å; K508-Q512 WeakPolarHBondContact O-CG 3.29Å; K508-Q512 PolarHBondContact O-N 3.49Å; K508-Q512 VanDerWaalsContact O-N 3.09Å
509	R	90.8	Very high	87.4	Confident	152 Å²	152	102.8 Å²	102.8	57%	0.574	52%	0.523	S	S	*	.	H	α-helix	trans	-63.7	-43.3	177.2	-170.5	-175.8	-59.1	157.6	6.1	111.8	E505 E506 T507 Q512 L513	E505-R509 WeakPolarHBondContact O-CB 3.18Å; E505-R509 PolarHBondContact O-N 3.31Å; E506-R509 PolarHBondContact O-N 3.48Å; T507-R509 VanDerWaalsContact C-N 3.34Å; T507-R509 PolarHBondContact O-N 2.86Å; R509-Q512 PolarHBondContact O-N 3.49Å; R509-L513 HydrophobicContact CG-CD1 4.43Å; R509-L513 WeakPolarHBondContact O-CG 3.28Å; R509-L513 PolarHBondContact O-N 3Å
510	N	90.5	Very high	86.9	Confident	74 Å²	74	101.1 Å²	101.1	40%	0.396	52%	0.52	S	S	.	.	H	α-helix	trans	-66.6	-37.2	179.3	-69.3	-20.2	0	0	0	112.1	E506 T507 L513 N514	E506-N510 WeakPolarHBondContact O-CB 3.47Å; E506-N510 VanDerWaalsContact O-CG 3.24Å; E506-N510 PolarHBondContact O-N 3.25Å; E506-N510 PolarHBondContact O-ND2 3.04Å; T507-N510 PolarHBondContact O-N 3.36Å; N510-L513 PolarHBondContact O-N 3.41Å; N510-N514 VanDerWaalsContact O-CG 3.25Å; N510-N514 PolarHBondContact O-N 2.89Å; N510-N514 VanDerWaalsContact O-N 3.08Å; N510-N514 PolarHBondContact O-ND2 2.94Å
511	L	87.2	Confident	86.4	Confident	97 Å²	97	103.7 Å²	103.7	51%	0.508	53%	0.534	S	S	.	.	H	α-helix	trans	-64.4	-43.1	173.6	-71.2	169.8	0	0	0	111.9	T507 K508 L513 N514 E515	T507-L511 HydrophobicContact CG2-CD1 4.22Å; T507-L511 WeakPolarHBondContact O-CG 3.45Å; T507-L511 PolarHBondContact O-N 3.26Å; K508-L511 PolarHBondContact O-N 3.01Å; L511-L513 VanDerWaalsContact C-N 3.32Å; L511-L513 PolarHBondContact O-N 3.44Å; L511-N514 PolarHBondContact O-N 2.95Å; L511-E515 WeakPolarHBondContact O-CG 3.47Å; L511-E515 PolarHBondContact O-N 2.98Å
512	Q	85.2	Confident	85.8	Confident	133 Å²	133	107.8 Å²	107.8	62%	0.621	55%	0.554	S	S	*	*	H	α-helix	trans	-64.9	-34.3	177.4	-72.6	173.8	1.2	0	0	113.2	K508 R509 A516	K508-Q512 WeakPolarHBondContact O-CG 3.29Å; K508-Q512 PolarHBondContact O-N 3.49Å; K508-Q512 VanDerWaalsContact O-N 3.09Å; R509-Q512 PolarHBondContact O-N 3.49Å; Q512-A516 PolarHBondContact O-N 3.3Å
513	L	83	Confident	85.1	Confident	103 Å²	103	111.3 Å²	111.3	54%	0.539	56%	0.561	S	S	.	*	H	α-helix	trans	-69	-42.1	174.4	-71.1	170.1	0	0	0	111.4	R509 N510 L511 E515 A516 D517	R509-L513 HydrophobicContact CG-CD1 4.43Å; R509-L513 WeakPolarHBondContact O-CG 3.28Å; R509-L513 PolarHBondContact O-N 3Å; N510-L513 PolarHBondContact O-N 3.41Å; L511-L513 VanDerWaalsContact C-N 3.32Å; L511-L513 PolarHBondContact O-N 3.44Å; L513-E515 VanDerWaalsContact C-N 3.31Å; L513-E515 PolarHBondContact O-N 2.97Å; L513-A516 PolarHBondContact O-N 3.2Å; L513-D517 PolarHBondContact O-N 3.02Å
514	N	79.1	Confident	84.4	Confident	116 Å²	116	112.6 Å²	112.6	62%	0.62	57%	0.57	S	S	*	*	H	α-helix	trans	-70.8	-22.6	178.7	-68.8	-20.2	0	0	0	114	N510 L511	N510-N514 VanDerWaalsContact O-CG 3.25Å; N510-N514 PolarHBondContact O-N 2.89Å; N510-N514 VanDerWaalsContact O-N 3.08Å; N510-N514 PolarHBondContact O-ND2 2.94Å; L511-N514 PolarHBondContact O-N 2.95Å
515	E	74.9	Confident	83.8	Confident	164 Å²	164	117.1 Å²	117.1	77%	0.766	60%	0.595	S	S	*	*	H	α-helix	trans	-82.8	-15.8	173.2	-73.8	179.9	175.4	0	0	113	L511 L513	L511-E515 WeakPolarHBondContact O-CG 3.47Å; L511-E515 PolarHBondContact O-N 2.98Å; L513-E515 VanDerWaalsContact C-N 3.31Å; L513-E515 PolarHBondContact O-N 2.97Å
516	A	71.2	Confident	83	Confident	84 Å²	84	118.4 Å²	118.4	69%	0.694	61%	0.605	S	S	*	*	H	α-helix	trans	-87.7	-20.1	178.5	0	0	0	0	0	113.4	Q512 L513	Q512-A516 PolarHBondContact O-N 3.3Å; L513-A516 PolarHBondContact O-N 3.2Å
517	D	59.2	Low	82.1	Confident	195 Å²	195	119 Å²	119	100%	1.043	61%	0.612	S	S	*	*			trans	-88.9	0	172	-73.1	-20.5	0	0	0	111.3	L513	L513-D517 PolarHBondContact O-N 3.02Å

Retrieved 517 of 517 residues in 107.2 ms (Link to these results)

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