A0A096LR52_POEFO Loading...

Thyroid hormone receptor beta

AlphaFold DB , UniProt , Accession A0A096LR52, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 415 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	36.6	Very low	38.4	Very low	241 Å²	241	149 Å²	149	100%	1.187	81%	0.806	S	S	*	*				0	99	0	-74.5	177.3	68.9	0	0	106.6
2	S	34.4	Very low	39.1	Very low	120 Å²	120	150.6 Å²	150.6	84%	0.839	79%	0.791	S	S	*	*			trans	-128.4	111.6	-174.7	-35.2	0	0	0	0	106.1
3	E	33.2	Very low	39.3	Very low	193 Å²	193	147.4 Å²	147.4	90%	0.902	77%	0.767	S	S	*	*			trans	-67.3	143.6	-179	-72.9	175.9	146.3	0	0	111.3
4	P	37.8	Very low	39.5	Very low	118 Å²	118	145.6 Å²	145.6	77%	0.766	76%	0.759	S	S	*	*			trans	-80.1	134.8	174.6	32.3	-31.7	0	0	0	110.8	E6	P4-E6 PolarHBondContact O-N 3.23Å; P4-E6 VanDerWaalsContact O-N 3.15Å
5	A	36.2	Very low	39.5	Very low	102 Å²	102	146.1 Å²	146.1	84%	0.843	76%	0.756	S	S	*	*			trans	-62.8	111.6	175.4	0	0	0	0	0	111.3	K7	A5-K7 PolarHBondContact O-N 3.31Å
6	E	37.2	Very low	40	Very low	189 Å²	189	139.8 Å²	139.8	88%	0.883	73%	0.732	S	S	*	*			trans	-62.2	117.5	170.1	-79.3	-175.9	146.5	0	0	110.3	P4 C8	P4-E6 PolarHBondContact O-N 3.23Å; P4-E6 VanDerWaalsContact O-N 3.15Å; E6-C8 VanDerWaalsContact C-N 3.35Å; E6-C8 PolarHBondContact O-N 2.65Å
7	K	42.7	Very low	40.5	Very low	207 Å²	207	139.1 Å²	139.1	90%	0.9	74%	0.735	S	S	*	*			trans	-64.7	97.4	164.9	-76.7	176.8	178.8	172.9	0	108	A5 S9	A5-K7 PolarHBondContact O-N 3.31Å; K7-S9 VanDerWaalsContact C-N 3.27Å; K7-S9 PolarHBondContact O-N 3.4Å
8	C	33.3	Very low	40.7	Very low	119 Å²	119	141.2 Å²	141.2	80%	0.804	74%	0.74	S	S	*	*			trans	-65.1	88.1	171.2	-163	0	0	0	0	109.1	E6 P10	E6-C8 VanDerWaalsContact C-N 3.35Å; E6-C8 PolarHBondContact O-N 2.65Å; C8-P10 WeakPolarHBondContact O-CD 3.36Å
9	S	44.9	Very low	41.1	Very low	87 Å²	87	141.5 Å²	141.5	61%	0.608	74%	0.742	S	S	*	*			trans	-67.7	119	164.1	-170.2	0	0	0	0	106.3	K7 R11	K7-S9 VanDerWaalsContact C-N 3.27Å; K7-S9 PolarHBondContact O-N 3.4Å; S9-R11 PolarHBondContact O-N 3.19Å; S9-R11 VanDerWaalsContact O-N 3.17Å
10	P	44.7	Very low	41.8	Very low	50 Å²	50	136.9 Å²	136.9	33%	0.325	73%	0.731	S	S	.	*			trans	-76.1	122.3	-167.5	33	-38	0	0	0	109.4	C8 W12 K13	C8-P10 WeakPolarHBondContact O-CD 3.36Å; P10-W12 VanDerWaalsContact CB-CD1 3.46Å; P10-W12 HydrophobicContact CB-CG 4.39Å; P10-W12 HydrophobicContact CG-CD2 4.39Å; P10-W12 VanDerWaalsContact CG-CE2 3.43Å; P10-W12 HydrophobicContact CG-CZ2 3.64Å; P10-W12 PolarHBondContact O-N 3.23Å; P10-K13 PolarHBondContact O-N 3.46Å; P10-K13 VanDerWaalsContact O-N 3.16Å
11	R	41.6	Very low	42.8	Very low	213 Å²	213	139 Å²	139	80%	0.804	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50	-9.3	-174.1	-154.7	173.2	165.1	-173.8	-4.7	115.8	S9 K13	S9-R11 PolarHBondContact O-N 3.19Å; S9-R11 VanDerWaalsContact O-N 3.17Å; R11-K13 VanDerWaalsContact C-N 3.3Å; R11-K13 PolarHBondContact O-N 2.64Å
12	W	46.9	Very low	44.1	Very low	168 Å²	168	130.6 Å²	130.6	64%	0.636	69%	0.689	S	S	*	*	H	α-helix	trans	-73.2	-15.7	174.6	56.5	-105.1	0	0	0	114.2	P10	P10-W12 VanDerWaalsContact CB-CD1 3.46Å; P10-W12 HydrophobicContact CB-CG 4.39Å; P10-W12 HydrophobicContact CG-CD2 4.39Å; P10-W12 VanDerWaalsContact CG-CE2 3.43Å; P10-W12 HydrophobicContact CG-CZ2 3.64Å; P10-W12 PolarHBondContact O-N 3.23Å
13	K	41.6	Very low	45.8	Very low	109 Å²	109	125.2 Å²	125.2	47%	0.474	65%	0.651	S	S	.	*	H	α-helix	trans	-71.4	-32.7	177.8	-78.4	-175.3	177.5	175.9	0	112.9	P10 R11	P10-K13 PolarHBondContact O-N 3.46Å; P10-K13 VanDerWaalsContact O-N 3.16Å; R11-K13 VanDerWaalsContact C-N 3.3Å; R11-K13 PolarHBondContact O-N 2.64Å
14	D	42.1	Very low	47.7	Very low	122 Å²	122	122 Å²	122	65%	0.652	65%	0.65	S	S	*	*	H	α-helix	trans	-85.7	-30.1	-170.9	-60.5	-35.2	0	0	0	112.9
15	E	39.8	Very low	49.5	Very low	153 Å²	153	123.4 Å²	123.4	72%	0.715	64%	0.641	S	S	*	*	H	α-helix	trans	-77.7	-21.6	175.6	-70.8	-176.2	159.3	0	0	113.6	V17	E15-V17 VanDerWaalsContact C-N 3.31Å; E15-V17 PolarHBondContact O-N 3.44Å
16	A	47.8	Very low	51.5	Low	45 Å²	45	119.1 Å²	119.1	37%	0.372	60%	0.604	S	S	.	*	H	α-helix	trans	-72.5	-23.5	-178.3	0	0	0	0	0	113.4
17	V	47	Very low	53.4	Low	128 Å²	128	116.1 Å²	116.1	78%	0.776	59%	0.594	S	S	*	*	H	α-helix	trans	-79.4	-23	-173.5	-177.8	0	0	0	0	112.1	E15	E15-V17 VanDerWaalsContact C-N 3.31Å; E15-V17 PolarHBondContact O-N 3.44Å
18	Q	45.2	Very low	54.6	Low	177 Å²	177	114.1 Å²	114.1	83%	0.827	59%	0.585	S	S	*	*	H	α-helix	trans	-102.7	-19.3	-174.6	-116	165.2	-8.7	0	0	115.3
19	N	47.5	Very low	56.8	Low	148 Å²	148	114.7 Å²	114.7	79%	0.791	58%	0.58	S	S	*	*	H	α-helix	trans	-128.5	2	-174.4	-100.8	-21	0	0	0	116.7
20	G	55	Low	58.9	Low	49 Å²	49	113.2 Å²	113.2	51%	0.505	56%	0.564	S	S	.	*			trans	72.1	138.4	-175.2	0	0	0	0	0	111.8	I22	G20-I22 PolarHBondContact O-N 2.97Å; G20-I22 VanDerWaalsContact O-N 3.09Å
21	Y	63.5	Low	61.3	Low	182 Å²	182	116 Å²	116	71%	0.714	58%	0.575	S	S	*	*			trans	-64.8	111.5	178.6	177.2	-100.5	0	0	0	110.5	P23	Y21-P23 HydrophobicContact CD1-CG 4.33Å; Y21-P23 HydrophobicContact CE1-CB 4.25Å; Y21-P23 HydrophobicContact CE1-CG 3.92Å
22	I	62.9	Low	64	Low	63 Å²	63	106 Å²	106	32%	0.323	54%	0.538	S	S	.	.			trans	-99.1	117.7	168.5	-59.4	176.9	0	0	0	106.7	G20 L26	G20-I22 PolarHBondContact O-N 2.97Å; G20-I22 VanDerWaalsContact O-N 3.09Å; I22-L26 HydrophobicContact CG2-CB 4.16Å; I22-L26 HydrophobicContact CG2-CD2 4.37Å
23	P	70.8	Confident	66.4	Low	7 Å²	7	101.2 Å²	101.2	5%	0.045	53%	0.527	C	S	.	.			trans	-59.2	142.6	178.2	-20.7	30.8	0	0	0	111.7	Y21 Y25 L26	Y21-P23 HydrophobicContact CD1-CG 4.33Å; Y21-P23 HydrophobicContact CE1-CB 4.25Å; Y21-P23 HydrophobicContact CE1-CG 3.92Å; P23-Y25 HydrophobicContact CB-CD1 3.88Å; P23-Y25 HydrophobicContact CB-CD2 4.02Å; P23-Y25 HydrophobicContact CB-CE1 3.35Å; P23-Y25 HydrophobicContact CB-CE2 3.48Å; P23-Y25 VanDerWaalsContact CB-CE2 3.48Å; P23-Y25 HydrophobicContact CB-CG 4.21Å; P23-Y25 WeakPolarHBondContact CB-OH 2.95Å; P23-Y25 HydrophobicContact CG-CE1 4.38Å; P23-Y25 HydrophobicContact CG-CE2 4.01Å; P23-Y25 PolarHBondContact O-N 2.63Å; P23-L26 PolarHBondContact O-N 3.46Å
24	S	73.3	Confident	69	Low	126 Å²	126	96.1 Å²	96.1	88%	0.881	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-10.9	-173.9	58.8	0	0	0	0	115.5
25	Y	75.9	Confident	71.7	Confident	147 Å²	147	90.6 Å²	90.6	58%	0.576	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	4.5	177.4	51.6	-103.4	0	0	0	113.5	P23 Y42	P23-Y25 HydrophobicContact CB-CD1 3.88Å; P23-Y25 HydrophobicContact CB-CD2 4.02Å; P23-Y25 HydrophobicContact CB-CE1 3.35Å; P23-Y25 HydrophobicContact CB-CE2 3.48Å; P23-Y25 VanDerWaalsContact CB-CE2 3.48Å; P23-Y25 HydrophobicContact CB-CG 4.21Å; P23-Y25 WeakPolarHBondContact CB-OH 2.95Å; P23-Y25 HydrophobicContact CG-CE1 4.38Å; P23-Y25 HydrophobicContact CG-CE2 4.01Å; P23-Y25 PolarHBondContact O-N 2.63Å; Y25-Y42 AromaticContact CD2-CD2 3.99Å; Y25-Y42 HydrophobicContact CD2-CD2 3.99Å; Y25-Y42 HydrophobicContact CD2-CE2 4.16Å; Y25-Y42 AromaticContact CE2-CD2 3.79Å; Y25-Y42 HydrophobicContact CE2-CD2 3.79Å; Y25-Y42 HydrophobicContact CE2-CE2 4.43Å
26	L	76.8	Confident	74.4	Confident	12 Å²	12	85.3 Å²	85.3	6%	0.063	46%	0.462	C	S	.	.	S	Bend	trans	-116.8	124.8	-178.9	-152.5	88.4	0	0	0	109.4	I22 P23 E30 A39 Y42 I47	I22-L26 HydrophobicContact CG2-CB 4.16Å; I22-L26 HydrophobicContact CG2-CD2 4.37Å; P23-L26 PolarHBondContact O-N 3.46Å; L26-E30 WeakPolarHBondContact CD1-OE2 3.47Å; L26-E30 HydrophobicContact CG-CB 4.35Å; L26-E30 HydrophobicContact CG-CG 4.45Å; L26-A39 HydrophobicContact CD2-CB 4.47Å; L26-Y42 HydrophobicContact CD1-CD2 4.05Å; L26-Y42 HydrophobicContact CD1-CE2 3.93Å; L26-I47 HydrophobicContact CD1-CG1 4.26Å; L26-I47 HydrophobicContact CD1-CG2 4.42Å
27	D	77.4	Confident	76.6	Confident	126 Å²	126	84.2 Å²	84.2	67%	0.674	45%	0.45	S	S	*	.			trans	-67.1	148.5	174.9	-71.2	-34.3	0	0	0	111	D29 E30	D27-D29 PolarHBondContact O-N 3.37Å; D27-E30 HydrophobicContact CB-CG 4.21Å; D27-E30 PolarHBondContact O-N 2.89Å
28	K	67.9	Low	78.9	Confident	165 Å²	165	83.5 Å²	83.5	72%	0.717	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-10.7	-166.3	-81.9	-174.5	176.1	-179.7	0	115.7
29	D	79.9	Confident	81.3	Confident	131 Å²	131	75.4 Å²	75.4	70%	0.701	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.5	21.7	-175.6	-62.3	-55.6	0	0	0	114	D27 L31	D27-D29 PolarHBondContact O-N 3.37Å; D29-L31 PolarHBondContact O-N 2.91Å
30	E	90.3	Very high	83.4	Confident	56 Å²	56	70.8 Å²	70.8	26%	0.262	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-61.2	134.4	174.6	-76.2	-153.2	149.9	0	0	112.1	L26 D27 A39 I47	L26-E30 WeakPolarHBondContact CD1-OE2 3.47Å; L26-E30 HydrophobicContact CG-CB 4.35Å; L26-E30 HydrophobicContact CG-CG 4.45Å; D27-E30 HydrophobicContact CB-CG 4.21Å; D27-E30 PolarHBondContact O-N 2.89Å; E30-A39 HydrophobicContact CB-CB 4.31Å; E30-A39 WeakPolarHBondContact O-CB 3.5Å; E30-A39 PolarHBondContact O-N 3.13Å; E30-I47 HydrophobicContact CB-CG2 4.02Å; E30-I47 WeakPolarHBondContact OE2-CD1 3.4Å; E30-I47 VanDerWaalsContact OE2-CG1 3.28Å; E30-I47 WeakPolarHBondContact OE2-CG1 3.44Å; E30-I47 WeakPolarHBondContact OE2-CG2 3.44Å
31	L	94.8	Very high	85.2	Confident	109 Å²	109	68.6 Å²	68.6	57%	0.571	35%	0.354	S	S	*	.	B	Isolated β-bridge	trans	-96.7	143.6	-179.3	-58.7	-177.4	0	0	0	110.9	D29 V33	D29-L31 PolarHBondContact O-N 2.91Å; L31-V33 PolarHBondContact O-N 3.46Å
32	C	96.9	Very high	86.6	Confident	2 Å²	2	65.5 Å²	65.5	1%	0.014	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-61.8	118.9	175.6	174.1	0	0	0	0	110.3	V34 C35 G36 D37 T48 C49	C32-V34 PolarHBondContact O-N 3.23Å; C32-C35 PolarHBondContact O-N 2.91Å; C32-G36 WeakPolarHBondContact O-CA 3.19Å; C32-G36 PolarHBondContact O-N 3.34Å; C32-D37 WeakPolarHBondContact CB-O 3.14Å; C32-D37 PolarHBondContact N-O 2.86Å; C32-T48 VanDerWaalsContact SG-CA 3.6Å; C32-C49 HydrophobicContact CB-CB 3.96Å; C32-C49 PolarHBondContact SG-N 2.88Å; C32-C49 VanDerWaalsContact SG-N 3.36Å
33	V	97.1	Very high	88.1	Confident	68 Å²	68	63.7 Å²	63.7	41%	0.412	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-13.1	-177.6	-58.6	0	0	0	0	114.5	L31 C46 I47 T48 V97	L31-V33 PolarHBondContact O-N 3.46Å; V33-C46 HydrophobicContact CG2-CB 4.16Å; V33-I47 HydrophobicContact CG1-CB 4.43Å; V33-I47 WeakPolarHBondContact CG2-O 3.49Å; V33-I47 PolarHBondContact N-O 3.02Å; V33-I47 VanDerWaalsContact N-O 3.13Å; V33-T48 HydrophobicContact CG2-CG2 4.27Å; V33-V97 HydrophobicContact CB-CG1 4.44Å; V33-V97 HydrophobicContact CG2-CB 3.84Å; V33-V97 HydrophobicContact CG2-CG1 4.18Å; V33-V97 HydrophobicContact CG2-CG2 3.82Å
34	V	98.1	Very high	89.4	Confident	3 Å²	3	65.2 Å²	65.2	2%	0.018	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-42.2	178.3	179.5	0	0	0	0	112.7	C32 T48 C52 I78 R90 K93 V97 M99	C32-V34 PolarHBondContact O-N 3.23Å; V34-T48 HydrophobicContact CG2-CG2 4.09Å; V34-C52 HydrophobicContact CB-CB 4.23Å; V34-C52 HydrophobicContact CG1-CB 4.4Å; V34-C52 HydrophobicContact CG2-CB 4.37Å; V34-I78 HydrophobicContact CG1-CG2 4.2Å; V34-I78 WeakPolarHBondContact O-CG2 3.28Å; V34-R90 HydrophobicContact CG1-CG 4.49Å; V34-K93 HydrophobicContact CG1-CB 4.44Å; V34-K93 HydrophobicContact CG1-CG 4.16Å; V34-V97 HydrophobicContact CG2-CG2 3.75Å; V34-M99 HydrophobicContact CG2-SD 4.15Å
35	C	97.4	Very high	90.4	Very high	5 Å²	5	67.5 Å²	67.5	3%	0.034	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-138.9	1.8	-167.5	69.6	0	0	0	0	115.1	C32 D37 C49 I78 D79 K80 R83	C32-C35 PolarHBondContact O-N 2.91Å; C35-D37 PolarHBondContact O-N 3.3Å; C35-D37 VanDerWaalsContact O-N 3.15Å; C35-C49 VanDerWaalsContact SG-SG 3.66Å; C35-I78 HydrophobicContact CB-CG2 4.06Å; C35-D79 CarbonylContact O-C 3.48Å; C35-D79 VanDerWaalsContact O-CA 3.26Å; C35-D79 WeakPolarHBondContact O-CA 3.34Å; C35-K80 PolarHBondContact O-N 2.82Å; C35-R83 HydrophobicContact CB-CB 4.17Å; C35-R83 PolarHBondContact SG-NH1 3.03Å
36	G	96.1	Very high	91.3	Very high	42 Å²	42	61 Å²	61	43%	0.433	30%	0.303	S	S	.	.	S	Bend	trans	71.4	1.7	179	0	0	0	0	0	115.9	C32	C32-G36 WeakPolarHBondContact O-CA 3.19Å; C32-G36 PolarHBondContact O-N 3.34Å
37	D	95.9	Very high	92.2	Very high	23 Å²	23	61.7 Å²	61.7	12%	0.123	31%	0.307	C	S	.	.	S	Bend	trans	-71.9	162.6	172.1	-163	11.4	0	0	0	111.3	C32 C35 A39 C49 K80 R83	C32-D37 WeakPolarHBondContact CB-O 3.14Å; C32-D37 PolarHBondContact N-O 2.86Å; C35-D37 PolarHBondContact O-N 3.3Å; C35-D37 VanDerWaalsContact O-N 3.15Å; D37-A39 PolarHBondContact O-N 3.38Å; D37-C49 HydrophobicContact CB-CB 4.23Å; D37-K80 HydrophobicContact CB-CB 4.32Å; D37-K80 HydrophobicContact CB-CD 4.26Å; D37-K80 HydrophobicContact CB-CG 4.16Å; D37-K80 WeakPolarHBondContact OD1-CD 3.39Å; D37-K80 WeakPolarHBondContact OD1-CE 3.45Å; D37-K80 IonicContact OD1-NZ 2.8Å; D37-K80 PolarHBondContact OD1-NZ 3.4Å; D37-R83 IonicContact OD2-CZ 3.21Å; D37-R83 IonicContact OD2-NH1 3.99Å; D37-R83 PolarHBondContact OD2-NH1 3.11Å; D37-R83 IonicContact OD2-NH2 3.94Å; D37-R83 PolarHBondContact OD2-NH2 3.29Å; D37-R83 VanDerWaalsContact OD2-NH2 3.12Å
38	K	94.5	Very high	93.1	Very high	113 Å²	113	55.7 Å²	55.7	49%	0.491	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-57.2	124	-178.5	-172.7	169.5	-177	167.6	0	111.2	C49	K38-C49 WeakPolarHBondContact O-CB 3.49Å
39	A	94.6	Very high	94.4	Very high	7 Å²	7	48 Å²	48	6%	0.058	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-74.1	154.6	177.7	0	0	0	0	0	111.2	L26 E30 D37 I47	L26-A39 HydrophobicContact CD2-CB 4.47Å; E30-A39 HydrophobicContact CB-CB 4.31Å; E30-A39 WeakPolarHBondContact O-CB 3.5Å; E30-A39 PolarHBondContact O-N 3.13Å; D37-A39 PolarHBondContact O-N 3.38Å; A39-I47 HydrophobicContact CB-CG2 3.38Å
40	T	92.5	Very high	95.2	Very high	51 Å²	51	46.2 Å²	46.2	31%	0.313	23%	0.229	S	C	.	.			trans	-121.4	-0.5	-176.3	49.5	0	0	0	0	112.1	H43 T48 E50	T40-H43 PolarHBondContact OG1-NE2 3.25Å; T40-T48 PolarHBondContact N-O 2.94Å; T40-T48 PolarHBondContact OG1-O 3.33Å; T40-T48 VanDerWaalsContact OG1-O 3.07Å; T40-E50 HydrophobicContact CG2-CG 3.92Å; T40-E50 PolarHBondContact OG1-N 3.15Å; T40-E50 PolarHBondContact OG1-OE1 3.24Å
41	G	92.1	Very high	95.6	Very high	2 Å²	2	44.9 Å²	44.9	2%	0.021	23%	0.23	C	C	.	.	S	Bend	trans	140.7	-175.7	-177	0	0	0	0	0	112.5	T48	G41-T48 PolarHBondContact O-N 3.09Å; G41-T48 VanDerWaalsContact O-N 3.08Å
42	Y	93.4	Very high	95.7	Very high	117 Å²	117	39.7 Å²	39.7	46%	0.459	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	116.3	170.8	-76.3	-98.3	0	0	0	109.8	Y25 L26 C46 I47	Y25-Y42 AromaticContact CD2-CD2 3.99Å; Y25-Y42 HydrophobicContact CD2-CD2 3.99Å; Y25-Y42 HydrophobicContact CD2-CE2 4.16Å; Y25-Y42 AromaticContact CE2-CD2 3.79Å; Y25-Y42 HydrophobicContact CE2-CD2 3.79Å; Y25-Y42 HydrophobicContact CE2-CE2 4.43Å; L26-Y42 HydrophobicContact CD1-CD2 4.05Å; L26-Y42 HydrophobicContact CD1-CE2 3.93Å; Y42-C46 WeakPolarHBondContact CA-O 3.49Å; Y42-I47 HydrophobicContact CD1-CG1 4.16Å; Y42-I47 HydrophobicContact CD2-CG1 4.25Å; Y42-I47 HydrophobicContact CE1-CD1 4.2Å; Y42-I47 HydrophobicContact CE1-CG1 3.72Å; Y42-I47 HydrophobicContact CE2-CD1 4.36Å; Y42-I47 HydrophobicContact CE2-CG1 3.82Å; Y42-I47 HydrophobicContact CG-CG1 4.42Å
43	H	95.1	Very high	95.8	Very high	26 Å²	26	42.2 Å²	42.2	12%	0.12	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	124.2	172.9	-53.8	-67.2	0	0	0	109.1	T40 R45 C46 T48 E50 K53	T40-H43 PolarHBondContact OG1-NE2 3.25Å; H43-R45 PolarHBondContact O-N 3.07Å; H43-C46 PolarHBondContact N-O 2.88Å; H43-C46 PolarHBondContact O-N 3.46Å; H43-C46 VanDerWaalsContact O-N 3.11Å; H43-T48 WeakPolarHBondContact CB-OG1 3.39Å; H43-T48 PolarHBondContact CD2-O 2.79Å; H43-T48 PolarHBondContact CD2-OG1 3.33Å; H43-T48 VanDerWaalsContact CD2-OG1 3.3Å; H43-E50 IonicContact CE1-OE1 3.12Å; H43-E50 PolarHBondContact CE1-OE1 2.87Å; H43-E50 IonicContact NE2-OE1 3.38Å; H43-E50 PolarHBondContact NE2-OE1 3.07Å; H43-K53 HydrophobicContact CB-CB 3.93Å; H43-K53 HydrophobicContact CB-CD 4.34Å; H43-K53 HydrophobicContact CB-CG 3.78Å; H43-K53 PolarHBondContact CE1-NZ 3.45Å; H43-K53 WeakPolarHBondContact ND1-CD 3.32Å; H43-K53 VanDerWaalsContact ND1-CE 3.27Å; H43-K53 WeakPolarHBondContact ND1-CE 3.49Å
44	Y	96.3	Very high	95.8	Very high	39 Å²	39	39.3 Å²	39.3	15%	0.153	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	42.7	-179.2	-47.6	-70.8	0	0	0	112.5	C46 K53 F56 R57 M99 A100 L103 V104	Y44-C46 PolarHBondContact O-N 3.34Å; Y44-K53 HydrophobicContact CE2-CG 3.96Å; Y44-F56 AromaticContact CD2-CD1 3.66Å; Y44-F56 HydrophobicContact CD2-CD1 3.66Å; Y44-F56 HydrophobicContact CD2-CE1 4.26Å; Y44-F56 HydrophobicContact CE2-CD1 4.09Å; Y44-F56 AromaticContact CG-CD1 3.92Å; Y44-F56 HydrophobicContact CG-CD1 3.92Å; Y44-F56 HydrophobicContact CG-CE1 4.04Å; Y44-R57 HydrophobicContact CE2-CB 4.29Å; Y44-R57 WeakPolarHBondContact OH-CB 3.37Å; Y44-R57 WeakPolarHBondContact OH-CD 3.36Å; Y44-R57 WeakPolarHBondContact OH-CG 3.34Å; Y44-M99 HydrophobicContact CD2-CE 3.64Å; Y44-M99 HydrophobicContact CG-CE 4.36Å; Y44-M99 WeakPolarHBondContact O-CA 3.27Å; Y44-A100 PolarHBondContact O-N 3.46Å; Y44-L103 HydrophobicContact CD1-CB 3.9Å; Y44-V104 HydrophobicContact CD1-CG2 3.84Å; Y44-V104 HydrophobicContact CE1-CB 4.35Å; Y44-V104 HydrophobicContact CE1-CG2 3.56Å
45	R	94.7	Very high	95.8	Very high	174 Å²	174	39.7 Å²	39.7	66%	0.657	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	75	0.2	-176.9	-52.1	-176.8	-178.3	-95.5	1.6	117.3	H43 A100 L103	H43-R45 PolarHBondContact O-N 3.07Å; R45-A100 HydrophobicContact CG-CB 4.08Å; R45-L103 HydrophobicContact CG-CD1 3.7Å
46	C	95.4	Very high	95.8	Very high	11 Å²	11	39.4 Å²	39.4	7%	0.074	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	144.2	-178.8	-58.2	0	0	0	0	112.7	V33 Y42 H43 Y44 T48 V97 G98 M99	V33-C46 HydrophobicContact CG2-CB 4.16Å; Y42-C46 WeakPolarHBondContact CA-O 3.49Å; H43-C46 PolarHBondContact N-O 2.88Å; H43-C46 PolarHBondContact O-N 3.46Å; H43-C46 VanDerWaalsContact O-N 3.11Å; Y44-C46 PolarHBondContact O-N 3.34Å; C46-T48 HydrophobicContact CB-CG2 3.95Å; C46-T48 PolarHBondContact O-N 3.25Å; C46-T48 VanDerWaalsContact O-N 3.09Å; C46-T48 PolarHBondContact O-OG1 2.89Å; C46-V97 PolarHBondContact SG-O 3.13Å; C46-G98 PolarHBondContact SG-O 3.18Å; C46-M99 HydrophobicContact CB-CG 3.98Å; C46-M99 PolarHBondContact SG-N 2.7Å; C46-M99 VanDerWaalsContact SG-N 3.41Å
47	I	95.1	Very high	95.8	Very high	26 Å²	26	42.7 Å²	42.7	13%	0.133	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	106.3	170.6	-64.6	155.3	0	0	0	109.1	L26 E30 V33 A39 Y42	L26-I47 HydrophobicContact CD1-CG1 4.26Å; L26-I47 HydrophobicContact CD1-CG2 4.42Å; E30-I47 HydrophobicContact CB-CG2 4.02Å; E30-I47 WeakPolarHBondContact OE2-CD1 3.4Å; E30-I47 VanDerWaalsContact OE2-CG1 3.28Å; E30-I47 WeakPolarHBondContact OE2-CG1 3.44Å; E30-I47 WeakPolarHBondContact OE2-CG2 3.44Å; V33-I47 HydrophobicContact CG1-CB 4.43Å; V33-I47 WeakPolarHBondContact CG2-O 3.49Å; V33-I47 PolarHBondContact N-O 3.02Å; V33-I47 VanDerWaalsContact N-O 3.13Å; A39-I47 HydrophobicContact CB-CG2 3.38Å; Y42-I47 HydrophobicContact CD1-CG1 4.16Å; Y42-I47 HydrophobicContact CD2-CG1 4.25Å; Y42-I47 HydrophobicContact CE1-CD1 4.2Å; Y42-I47 HydrophobicContact CE1-CG1 3.72Å; Y42-I47 HydrophobicContact CE2-CD1 4.36Å; Y42-I47 HydrophobicContact CE2-CG1 3.82Å; Y42-I47 HydrophobicContact CG-CG1 4.42Å
48	T	96.8	Very high	95.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	21%	0.212	C	C	.	.			trans	-140.4	159.5	-175	56.7	0	0	0	0	113.3	C32 V33 V34 T40 G41 H43 C46 M99	C32-T48 VanDerWaalsContact SG-CA 3.6Å; V33-T48 HydrophobicContact CG2-CG2 4.27Å; V34-T48 HydrophobicContact CG2-CG2 4.09Å; T40-T48 PolarHBondContact N-O 2.94Å; T40-T48 PolarHBondContact OG1-O 3.33Å; T40-T48 VanDerWaalsContact OG1-O 3.07Å; G41-T48 PolarHBondContact O-N 3.09Å; G41-T48 VanDerWaalsContact O-N 3.08Å; H43-T48 WeakPolarHBondContact CB-OG1 3.39Å; H43-T48 PolarHBondContact CD2-O 2.79Å; H43-T48 PolarHBondContact CD2-OG1 3.33Å; H43-T48 VanDerWaalsContact CD2-OG1 3.3Å; C46-T48 HydrophobicContact CB-CG2 3.95Å; C46-T48 PolarHBondContact O-N 3.25Å; C46-T48 VanDerWaalsContact O-N 3.09Å; C46-T48 PolarHBondContact O-OG1 2.89Å; T48-M99 HydrophobicContact CG2-CE 4.3Å; T48-M99 HydrophobicContact CG2-SD 4.12Å
49	C	96.1	Very high	95.9	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.02	19%	0.189	C	C	.	.			trans	-78.1	160.1	170.3	65.9	0	0	0	0	110.8	C32 C35 D37 K38 G51 C52 K53 R83	C32-C49 HydrophobicContact CB-CB 3.96Å; C32-C49 PolarHBondContact SG-N 2.88Å; C32-C49 VanDerWaalsContact SG-N 3.36Å; C35-C49 VanDerWaalsContact SG-SG 3.66Å; D37-C49 HydrophobicContact CB-CB 4.23Å; K38-C49 WeakPolarHBondContact O-CB 3.49Å; C49-G51 PolarHBondContact O-N 3.38Å; C49-G51 VanDerWaalsContact O-N 3.15Å; C49-C52 PolarHBondContact O-N 2.81Å; C49-C52 PolarHBondContact SG-N 3.22Å; C49-C52 VanDerWaalsContact SG-N 3.38Å; C49-K53 PolarHBondContact O-N 2.98Å; C49-R83 PolarHBondContact SG-NH1 3.49Å; C49-R83 VanDerWaalsContact SG-NH1 3.36Å
50	E	95.9	Very high	95.9	Very high	93 Å²	93	43.4 Å²	43.4	44%	0.435	20%	0.195	S	C	.	.	H	α-helix	trans	-56.6	-30.8	174.8	-76.1	-59.9	133	0	0	112.6	T40 H43 K53 G54	T40-E50 HydrophobicContact CG2-CG 3.92Å; T40-E50 PolarHBondContact OG1-N 3.15Å; T40-E50 PolarHBondContact OG1-OE1 3.24Å; H43-E50 IonicContact CE1-OE1 3.12Å; H43-E50 PolarHBondContact CE1-OE1 2.87Å; H43-E50 IonicContact NE2-OE1 3.38Å; H43-E50 PolarHBondContact NE2-OE1 3.07Å; E50-K53 WeakPolarHBondContact OE1-CD 3.34Å; E50-K53 IonicContact OE1-NZ 4Å; E50-K53 PolarHBondContact OE1-NZ 3.4Å; E50-K53 WeakPolarHBondContact OE2-CD 3.37Å; E50-K53 IonicContact OE2-NZ 3.41Å; E50-K53 PolarHBondContact OE2-NZ 3Å; E50-G54 PolarHBondContact O-N 3.38Å
51	G	97.5	Very high	95.9	Very high	28 Å²	28	43.8 Å²	43.8	29%	0.289	19%	0.194	S	C	.	.	H	α-helix	trans	-62.5	-48.6	176.8	0	0	0	0	0	113	C49 F55	C49-G51 PolarHBondContact O-N 3.38Å; C49-G51 VanDerWaalsContact O-N 3.15Å; G51-F55 WeakPolarHBondContact O-CB 3.37Å; G51-F55 PolarHBondContact O-N 2.97Å
52	C	98.3	Very high	95.9	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-75.5	-36.3	179.6	-71.5	0	0	0	0	112.3	V34 C49 F55 F56 R90	V34-C52 HydrophobicContact CB-CB 4.23Å; V34-C52 HydrophobicContact CG1-CB 4.4Å; V34-C52 HydrophobicContact CG2-CB 4.37Å; C49-C52 PolarHBondContact O-N 2.81Å; C49-C52 PolarHBondContact SG-N 3.22Å; C49-C52 VanDerWaalsContact SG-N 3.38Å; C52-F55 PolarHBondContact O-N 3.07Å; C52-F56 VanDerWaalsContact O-CB 3.29Å; C52-F56 WeakPolarHBondContact O-CB 3.18Å; C52-F56 PolarHBondContact O-N 3.01Å; C52-R90 PolarHBondContact SG-NH2 3.17Å
53	K	97.6	Very high	95.8	Very high	55 Å²	55	50.3 Å²	50.3	24%	0.239	23%	0.229	C	C	.	.	H	α-helix	trans	-54.1	-53.5	168.4	173.3	-157.8	-168.4	178.8	0	111.6	H43 Y44 C49 E50 F56 R57	H43-K53 HydrophobicContact CB-CB 3.93Å; H43-K53 HydrophobicContact CB-CD 4.34Å; H43-K53 HydrophobicContact CB-CG 3.78Å; H43-K53 PolarHBondContact CE1-NZ 3.45Å; H43-K53 WeakPolarHBondContact ND1-CD 3.32Å; H43-K53 VanDerWaalsContact ND1-CE 3.27Å; H43-K53 WeakPolarHBondContact ND1-CE 3.49Å; Y44-K53 HydrophobicContact CE2-CG 3.96Å; C49-K53 PolarHBondContact O-N 2.98Å; E50-K53 WeakPolarHBondContact OE1-CD 3.34Å; E50-K53 IonicContact OE1-NZ 4Å; E50-K53 PolarHBondContact OE1-NZ 3.4Å; E50-K53 WeakPolarHBondContact OE2-CD 3.37Å; E50-K53 IonicContact OE2-NZ 3.41Å; E50-K53 PolarHBondContact OE2-NZ 3Å; K53-F56 PolarHBondContact O-N 2.91Å; K53-R57 WeakPolarHBondContact O-CB 3.4Å; K53-R57 PolarHBondContact O-N 3.45Å
54	G	97.2	Very high	95.8	Very high	8 Å²	8	51.6 Å²	51.6	8%	0.082	24%	0.236	C	C	.	.	H	α-helix	trans	-64.6	-40.5	-178.5	0	0	0	0	0	112.9	E50 R58	E50-G54 PolarHBondContact O-N 3.38Å; G54-R58 WeakPolarHBondContact O-CG 3.2Å; G54-R58 PolarHBondContact O-N 3.41Å; G54-R58 VanDerWaalsContact O-N 3.07Å
55	F	98.3	Very high	95.6	Very high	10 Å²	10	52.5 Å²	52.5	4%	0.044	24%	0.244	C	C	.	.	H	α-helix	trans	-62.2	-49.8	175.4	171.1	-98.7	0	0	0	112.3	G51 C52 R58 T59 Y68 Q87 R90 F91	G51-F55 WeakPolarHBondContact O-CB 3.37Å; G51-F55 PolarHBondContact O-N 2.97Å; C52-F55 PolarHBondContact O-N 3.07Å; F55-R58 PolarHBondContact O-N 3.03Å; F55-T59 WeakPolarHBondContact O-CB 3.38Å; F55-T59 PolarHBondContact O-N 3.29Å; F55-T59 PolarHBondContact O-OG1 2.94Å; F55-Y68 HydrophobicContact CE2-CE2 4.12Å; F55-Y68 AromaticContact CZ-CE2 3.83Å; F55-Y68 HydrophobicContact CZ-CE2 3.83Å; F55-Q87 HydrophobicContact CE2-CB 4.24Å; F55-Q87 HydrophobicContact CE2-CG 4.27Å; F55-Q87 HydrophobicContact CZ-CB 4.35Å; F55-Q87 WeakPolarHBondContact CZ-O 3.1Å; F55-R90 HydrophobicContact CD1-CG 4.1Å; F55-R90 HydrophobicContact CE1-CB 4.06Å; F55-R90 HydrophobicContact CE1-CG 3.86Å; F55-R90 HydrophobicContact CZ-CB 4.16Å; F55-R90 HydrophobicContact CZ-CG 4.33Å; F55-F91 HydrophobicContact CE1-CB 3.86Å; F55-F91 HydrophobicContact CE1-CD2 4.34Å; F55-F91 HydrophobicContact CZ-CB 3.98Å
56	F	97.9	Very high	95.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60	-49.3	179.5	-174	-101.7	0	0	0	111.2	Y44 C52 K53 R58 T59 I60 F91 C94 I95 M99 T101 V104	Y44-F56 AromaticContact CD2-CD1 3.66Å; Y44-F56 HydrophobicContact CD2-CD1 3.66Å; Y44-F56 HydrophobicContact CD2-CE1 4.26Å; Y44-F56 HydrophobicContact CE2-CD1 4.09Å; Y44-F56 AromaticContact CG-CD1 3.92Å; Y44-F56 HydrophobicContact CG-CD1 3.92Å; Y44-F56 HydrophobicContact CG-CE1 4.04Å; C52-F56 VanDerWaalsContact O-CB 3.29Å; C52-F56 WeakPolarHBondContact O-CB 3.18Å; C52-F56 PolarHBondContact O-N 3.01Å; K53-F56 PolarHBondContact O-N 2.91Å; F56-R58 PolarHBondContact O-N 3Å; F56-T59 PolarHBondContact O-N 3.21Å; F56-I60 HydrophobicContact CE1-CG1 4.26Å; F56-I60 HydrophobicContact CE2-CG1 4.48Å; F56-I60 HydrophobicContact CZ-CG1 4.24Å; F56-I60 WeakPolarHBondContact O-CG1 3.25Å; F56-I60 PolarHBondContact O-N 3.41Å; F56-F91 HydrophobicContact CD2-CD2 4.28Å; F56-F91 AromaticContact CD2-CE2 3.96Å; F56-F91 HydrophobicContact CD2-CE2 3.96Å; F56-F91 AromaticContact CE2-CE2 3.92Å; F56-F91 HydrophobicContact CE2-CE2 3.92Å; F56-C94 HydrophobicContact CD2-CB 3.62Å; F56-C94 HydrophobicContact CE2-CB 4.08Å; F56-I95 HydrophobicContact CE2-CD1 3.82Å; F56-I95 HydrophobicContact CZ-CD1 4.31Å; F56-M99 HydrophobicContact CB-CE 3.6Å; F56-M99 HydrophobicContact CB-SD 4.09Å; F56-M99 HydrophobicContact CD1-CB 4.28Å; F56-M99 HydrophobicContact CD1-CE 3.76Å; F56-M99 HydrophobicContact CD2-CB 3.94Å; F56-M99 HydrophobicContact CD2-CE 4.23Å; F56-M99 HydrophobicContact CD2-SD 3.99Å; F56-M99 HydrophobicContact CE1-CB 3.92Å; F56-M99 HydrophobicContact CE1-CE 4.47Å; F56-M99 HydrophobicContact CE2-CB 3.55Å; F56-M99 HydrophobicContact CG-CB 4.27Å; F56-M99 HydrophobicContact CG-CE 3.6Å; F56-M99 HydrophobicContact CG-SD 3.97Å; F56-M99 HydrophobicContact CZ-CB 3.53Å; F56-M99 VanDerWaalsContact CZ-O 3.27Å; F56-M99 WeakPolarHBondContact CZ-O 3.38Å; F56-T101 HydrophobicContact CE2-CG2 4.27Å; F56-T101 HydrophobicContact CZ-CG2 3.64Å; F56-V104 HydrophobicContact CD1-CG2 4.01Å; F56-V104 HydrophobicContact CE1-CG2 3.83Å
57	R	96.4	Very high	95.5	Very high	110 Å²	110	52.8 Å²	52.8	42%	0.415	27%	0.266	S	S	.	.	H	α-helix	trans	-53.8	-52	176.1	-174.9	-179.2	63.3	167.1	-1.8	112.5	Y44 K53 T59 I60 Q61 V104	Y44-R57 HydrophobicContact CE2-CB 4.29Å; Y44-R57 WeakPolarHBondContact OH-CB 3.37Å; Y44-R57 WeakPolarHBondContact OH-CD 3.36Å; Y44-R57 WeakPolarHBondContact OH-CG 3.34Å; K53-R57 WeakPolarHBondContact O-CB 3.4Å; K53-R57 PolarHBondContact O-N 3.45Å; R57-T59 VanDerWaalsContact C-N 3.31Å; R57-T59 PolarHBondContact O-N 3.04Å; R57-I60 PolarHBondContact O-N 3.47Å; R57-Q61 HydrophobicContact CG-CG 4.31Å; R57-Q61 WeakPolarHBondContact O-CB 3.37Å; R57-Q61 VanDerWaalsContact O-CG 3.28Å; R57-Q61 WeakPolarHBondContact O-CG 3.49Å; R57-Q61 PolarHBondContact O-N 3.26Å; R57-V104 HydrophobicContact CG-CG1 4.25Å
58	R	95.9	Very high	95.6	Very high	120 Å²	120	52.7 Å²	52.7	45%	0.453	26%	0.264	S	S	.	.	H	α-helix	trans	-64.3	-38.5	-178.4	-74.7	-172.6	-60.5	-92.7	-1.1	111.9	G54 F55 F56 K62	G54-R58 WeakPolarHBondContact O-CG 3.2Å; G54-R58 PolarHBondContact O-N 3.41Å; G54-R58 VanDerWaalsContact O-N 3.07Å; F55-R58 PolarHBondContact O-N 3.03Å; F56-R58 PolarHBondContact O-N 3Å; R58-K62 WeakPolarHBondContact O-CB 3.29Å; R58-K62 PolarHBondContact O-N 3.11Å; R58-K62 VanDerWaalsContact O-N 3.07Å
59	T	96.2	Very high	95.6	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.9	-45.9	-179.9	-59.7	0	0	0	0	111.3	F55 F56 R57 N63 L64 N65 Y68 F91	F55-T59 WeakPolarHBondContact O-CB 3.38Å; F55-T59 PolarHBondContact O-N 3.29Å; F55-T59 PolarHBondContact O-OG1 2.94Å; F56-T59 PolarHBondContact O-N 3.21Å; R57-T59 VanDerWaalsContact C-N 3.31Å; R57-T59 PolarHBondContact O-N 3.04Å; T59-N63 WeakPolarHBondContact O-CA 3.37Å; T59-N63 PolarHBondContact O-N 3.42Å; T59-L64 HydrophobicContact CG2-CB 4.39Å; T59-L64 PolarHBondContact O-N 3.42Å; T59-N65 HydrophobicContact CG2-CB 3.83Å; T59-Y68 HydrophobicContact CG2-CD2 4.31Å; T59-Y68 HydrophobicContact CG2-CE2 3.42Å; T59-Y68 VanDerWaalsContact CG2-CE2 3.42Å; T59-Y68 PolarHBondContact OG1-OH 2.93Å; T59-F91 HydrophobicContact CG2-CD2 3.5Å; T59-F91 HydrophobicContact CG2-CE2 3.62Å; T59-F91 HydrophobicContact CG2-CG 3.98Å; T59-F91 HydrophobicContact CG2-CZ 4.2Å
60	I	94.9	Very high	95.6	Very high	38 Å²	38	57.6 Å²	57.6	20%	0.195	30%	0.303	C	S	.	.	H	α-helix	trans	-71.9	-48	178.7	-59.8	-57.1	0	0	0	111.4	F56 R57 K62 N63 F91 T101 V104	F56-I60 HydrophobicContact CE1-CG1 4.26Å; F56-I60 HydrophobicContact CE2-CG1 4.48Å; F56-I60 HydrophobicContact CZ-CG1 4.24Å; F56-I60 WeakPolarHBondContact O-CG1 3.25Å; F56-I60 PolarHBondContact O-N 3.41Å; R57-I60 PolarHBondContact O-N 3.47Å; I60-K62 VanDerWaalsContact C-N 3.33Å; I60-K62 PolarHBondContact O-N 3.36Å; I60-N63 PolarHBondContact O-N 2.99Å; I60-N63 VanDerWaalsContact O-N 3.13Å; I60-F91 HydrophobicContact CD1-CE2 3.71Å; I60-F91 HydrophobicContact CD1-CZ 3.62Å; I60-F91 HydrophobicContact CG1-CE2 4.35Å; I60-T101 HydrophobicContact CD1-CG2 3.53Å; I60-T101 HydrophobicContact CG1-CG2 4.07Å; I60-V104 HydrophobicContact CB-CB 4.2Å; I60-V104 HydrophobicContact CB-CG1 4.08Å; I60-V104 HydrophobicContact CB-CG2 4.13Å; I60-V104 HydrophobicContact CG1-CG2 4.28Å; I60-V104 HydrophobicContact CG2-CB 3.84Å; I60-V104 HydrophobicContact CG2-CG1 3.98Å; I60-V104 HydrophobicContact CG2-CG2 4.19Å
61	Q	91.9	Very high	95.6	Very high	59 Å²	59	62.5 Å²	62.5	28%	0.276	32%	0.324	S	S	.	.	H	α-helix	trans	-61.9	-38.2	-176.5	-74.7	-176.8	-28.6	0	0	113.7	R57 N63 V104 L105	R57-Q61 HydrophobicContact CG-CG 4.31Å; R57-Q61 WeakPolarHBondContact O-CB 3.37Å; R57-Q61 VanDerWaalsContact O-CG 3.28Å; R57-Q61 WeakPolarHBondContact O-CG 3.49Å; R57-Q61 PolarHBondContact O-N 3.26Å; Q61-N63 VanDerWaalsContact C-N 3.35Å; Q61-V104 HydrophobicContact CG-CG1 3.47Å; Q61-V104 VanDerWaalsContact CG-CG1 3.47Å; Q61-L105 PolarHBondContact NE2-O 3.28Å
62	K	92.4	Very high	95.3	Very high	148 Å²	148	69.6 Å²	69.6	64%	0.643	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	7.6	-179.8	-66	-174.9	176.3	-166.1	0	112.9	R58 I60 L64	R58-K62 WeakPolarHBondContact O-CB 3.29Å; R58-K62 PolarHBondContact O-N 3.11Å; R58-K62 VanDerWaalsContact O-N 3.07Å; I60-K62 VanDerWaalsContact C-N 3.33Å; I60-K62 PolarHBondContact O-N 3.36Å; K62-L64 VanDerWaalsContact C-N 3.27Å; K62-L64 HydrophobicContact CB-CD1 3.97Å; K62-L64 HydrophobicContact CB-CD2 4.01Å; K62-L64 HydrophobicContact CB-CG 3.65Å; K62-L64 HydrophobicContact CD-CD1 4.27Å; K62-L64 PolarHBondContact O-N 2.96Å
63	N	92.6	Very high	95.1	Very high	109 Å²	109	77 Å²	77	58%	0.583	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	47	-175.4	-164.3	35.1	0	0	0	113.3	T59 I60 Q61 P66	T59-N63 WeakPolarHBondContact O-CA 3.37Å; T59-N63 PolarHBondContact O-N 3.42Å; I60-N63 PolarHBondContact O-N 2.99Å; I60-N63 VanDerWaalsContact O-N 3.13Å; Q61-N63 VanDerWaalsContact C-N 3.35Å; N63-P66 WeakPolarHBondContact O-CD 3.28Å
64	L	94.5	Very high	94.9	Very high	52 Å²	52	75.6 Å²	75.6	27%	0.272	38%	0.379	S	S	.	.			trans	-85.8	-15.8	-174.1	-61.2	173.9	0	0	0	113.3	T59 K62 P66 T67 Y68	T59-L64 HydrophobicContact CG2-CB 4.39Å; T59-L64 PolarHBondContact O-N 3.42Å; K62-L64 VanDerWaalsContact C-N 3.27Å; K62-L64 HydrophobicContact CB-CD1 3.97Å; K62-L64 HydrophobicContact CB-CD2 4.01Å; K62-L64 HydrophobicContact CB-CG 3.65Å; K62-L64 HydrophobicContact CD-CD1 4.27Å; K62-L64 PolarHBondContact O-N 2.96Å; L64-P66 VanDerWaalsContact C-N 3.28Å; L64-P66 WeakPolarHBondContact O-CD 3.21Å; L64-T67 WeakPolarHBondContact O-CB 3.4Å; L64-T67 PolarHBondContact O-N 3.25Å; L64-T67 PolarHBondContact O-OG1 3.07Å; L64-Y68 HydrophobicContact CB-CE1 3.79Å; L64-Y68 HydrophobicContact CB-CE2 4.39Å; L64-Y68 WeakPolarHBondContact CB-OH 3.4Å; L64-Y68 PolarHBondContact O-N 3.33Å
65	N	91.4	Very high	94.8	Very high	59 Å²	59	83 Å²	83	32%	0.316	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-56.1	-30.2	-177	70.4	12	0	0	0	115.3	T59 T67 F91	T59-N65 HydrophobicContact CG2-CB 3.83Å; N65-T67 VanDerWaalsContact C-N 3.26Å; N65-T67 PolarHBondContact O-N 3.38Å; N65-F91 HydrophobicContact CB-CD1 3.69Å; N65-F91 HydrophobicContact CB-CE1 3.37Å; N65-F91 HydrophobicContact CB-CG 4.42Å; N65-F91 HydrophobicContact CB-CZ 3.86Å
66	P	94.3	Very high	94.7	Very high	92 Å²	92	84.1 Å²	84.1	60%	0.597	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-78.9	-16.8	179	-8.2	29.4	0	0	0	111.5	N63 L64	N63-P66 WeakPolarHBondContact O-CD 3.28Å; L64-P66 VanDerWaalsContact C-N 3.28Å; L64-P66 WeakPolarHBondContact O-CD 3.21Å
67	T	94.9	Very high	94.7	Very high	98 Å²	98	89.4 Å²	89.4	60%	0.601	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-86	-15.6	-179.3	71.7	0	0	0	0	112.8	L64 N65	L64-T67 WeakPolarHBondContact O-CB 3.4Å; L64-T67 PolarHBondContact O-N 3.25Å; L64-T67 PolarHBondContact O-OG1 3.07Å; N65-T67 VanDerWaalsContact C-N 3.26Å; N65-T67 PolarHBondContact O-N 3.38Å
68	Y	96.8	Very high	94.8	Very high	24 Å²	24	85.3 Å²	85.3	9%	0.094	44%	0.436	C	S	.	.			trans	-79.2	126.7	179.8	-61.3	-22	0	0	0	110.3	F55 T59 L64 Q87 F91	F55-Y68 HydrophobicContact CE2-CE2 4.12Å; F55-Y68 AromaticContact CZ-CE2 3.83Å; F55-Y68 HydrophobicContact CZ-CE2 3.83Å; T59-Y68 HydrophobicContact CG2-CD2 4.31Å; T59-Y68 HydrophobicContact CG2-CE2 3.42Å; T59-Y68 VanDerWaalsContact CG2-CE2 3.42Å; T59-Y68 PolarHBondContact OG1-OH 2.93Å; L64-Y68 HydrophobicContact CB-CE1 3.79Å; L64-Y68 HydrophobicContact CB-CE2 4.39Å; L64-Y68 WeakPolarHBondContact CB-OH 3.4Å; L64-Y68 PolarHBondContact O-N 3.33Å; Y68-Q87 HydrophobicContact CD1-CB 3.78Å; Y68-Q87 HydrophobicContact CD2-CB 3.9Å; Y68-Q87 HydrophobicContact CE1-CB 3.95Å; Y68-Q87 HydrophobicContact CE1-CG 4.38Å; Y68-Q87 HydrophobicContact CE2-CB 4.05Å; Y68-Q87 HydrophobicContact CG-CB 3.77Å; Y68-F91 HydrophobicContact CD2-CB 4.24Å; Y68-F91 HydrophobicContact CE2-CB 4.36Å
69	A	95.7	Very high	94.8	Very high	81 Å²	81	82.2 Å²	82.2	67%	0.669	43%	0.428	S	S	*	.			trans	-131.2	128.2	173.7	0	0	0	0	0	110.2
70	C	96.9	Very high	94.8	Very high	25 Å²	25	88 Å²	88	17%	0.169	45%	0.453	C	S	.	.			trans	-72.9	135.5	173.5	-174.6	0	0	0	0	109.2	Y72 G74 C76 C86 E88	C70-Y72 VanDerWaalsContact C-N 3.26Å; C70-Y72 PolarHBondContact SG-N 2.92Å; C70-G74 PolarHBondContact SG-N 3.08Å; C70-G74 VanDerWaalsContact SG-N 3.4Å; C70-C76 VanDerWaalsContact SG-SG 3.65Å; C70-C86 VanDerWaalsContact SG-SG 3.63Å; C70-E88 WeakPolarHBondContact CA-OE2 3.26Å; C70-E88 HydrophobicContact CB-CB 4.32Å; C70-E88 WeakPolarHBondContact CB-OE2 3.32Å; C70-E88 PolarHBondContact N-OE2 3.5Å
71	K	95	Very high	94.9	Very high	197 Å²	197	92 Å²	92	86%	0.857	48%	0.479	S	S	*	.	S	Bend	trans	-85.4	-0	175.6	-59.1	-179	-179.7	-179.9	0	113.2
72	Y	93.3	Very high	95.1	Very high	176 Å²	176	91.1 Å²	91.1	69%	0.69	48%	0.478	S	S	*	.	S	Bend	trans	-127.5	-151.6	-175.7	-51.6	-79.8	0	0	0	109.2	C70 G74	C70-Y72 VanDerWaalsContact C-N 3.26Å; C70-Y72 PolarHBondContact SG-N 2.92Å; Y72-G74 VanDerWaalsContact C-N 3.26Å; Y72-G74 PolarHBondContact O-N 3.22Å
73	E	93.6	Very high	95.3	Very high	155 Å²	155	86 Å²	86	72%	0.724	45%	0.454	S	S	*	.	S	Bend	trans	-82.9	14.8	-177.1	-57.6	-173.7	-179.4	0	0	115.2	K75	E73-K75 PolarHBondContact O-N 3.34Å; E73-K75 IonicContact OE2-NZ 2.8Å
74	G	93	Very high	95.5	Very high	27 Å²	27	86.2 Å²	86.2	28%	0.278	46%	0.456	S	S	.	.	S	Bend	trans	69.3	11.1	-176.1	0	0	0	0	0	114.9	C70 Y72 C89	C70-G74 PolarHBondContact SG-N 3.08Å; C70-G74 VanDerWaalsContact SG-N 3.4Å; Y72-G74 VanDerWaalsContact C-N 3.26Å; Y72-G74 PolarHBondContact O-N 3.22Å; G74-C89 PolarHBondContact O-SG 3.05Å
75	K	95.2	Very high	95.6	Very high	163 Å²	163	91 Å²	91	71%	0.709	48%	0.477	S	S	*	.			trans	-115.2	26	-177.5	-62.3	171.7	-171.5	162.6	0	113.5	E73 V77	E73-K75 PolarHBondContact O-N 3.34Å; E73-K75 IonicContact OE2-NZ 2.8Å; K75-V77 PolarHBondContact O-N 3.04Å
76	C	97.1	Very high	95.9	Very high	34 Å²	34	88.6 Å²	88.6	23%	0.23	46%	0.464	C	S	.	.			trans	-58.1	133.5	179.9	-56.2	0	0	0	0	111.2	C70 C86 C89	C70-C76 VanDerWaalsContact SG-SG 3.65Å; C76-C86 HydrophobicContact CB-CB 3.99Å; C76-C89 HydrophobicContact CB-CB 3.81Å
77	V	96.5	Very high	96.1	Very high	111 Å²	111	89.2 Å²	89.2	67%	0.673	46%	0.459	S	S	*	.			trans	-65.5	136.1	170.9	178.7	0	0	0	0	108.9	K75 T82	K75-V77 PolarHBondContact O-N 3.04Å; V77-T82 PolarHBondContact O-OG1 3.38Å; V77-T82 VanDerWaalsContact O-OG1 3.04Å
78	I	98.1	Very high	96.2	Very high	24 Å²	24	86.7 Å²	86.7	12%	0.123	44%	0.441	C	S	.	.			trans	-116.3	101.7	179.6	-55.3	-60.6	0	0	0	108.1	V34 C35 R83 C89 R90 K93	V34-I78 HydrophobicContact CG1-CG2 4.2Å; V34-I78 WeakPolarHBondContact O-CG2 3.28Å; C35-I78 HydrophobicContact CB-CG2 4.06Å; I78-R83 HydrophobicContact CG2-CB 3.85Å; I78-C89 HydrophobicContact CD1-CB 4.05Å; I78-R90 HydrophobicContact CD1-CB 3.99Å; I78-R90 HydrophobicContact CG2-CG 4.1Å; I78-K93 HydrophobicContact CG1-CB 4.44Å
79	D	97.4	Very high	96.3	Very high	54 Å²	54	86 Å²	86	29%	0.289	44%	0.439	S	S	.	.			trans	-125.8	-178.2	173.4	63.7	58.7	0	0	0	110.7	C35 V81 T82 R83	C35-D79 CarbonylContact O-C 3.48Å; C35-D79 VanDerWaalsContact O-CA 3.26Å; C35-D79 WeakPolarHBondContact O-CA 3.34Å; D79-V81 PolarHBondContact O-N 2.76Å; D79-V81 WeakPolarHBondContact OD1-CA 3.27Å; D79-V81 WeakPolarHBondContact OD1-CB 3.48Å; D79-V81 PolarHBondContact OD1-N 2.7Å; D79-T82 PolarHBondContact N-OG1 3.17Å; D79-T82 PolarHBondContact O-N 2.73Å; D79-T82 PolarHBondContact OD1-N 2.92Å; D79-T82 PolarHBondContact OD1-OG1 3.03Å; D79-T82 VanDerWaalsContact OD1-OG1 3.08Å; D79-T82 WeakPolarHBondContact OD2-CG2 3.36Å; D79-T82 PolarHBondContact OD2-OG1 3.18Å; D79-R83 WeakPolarHBondContact O-CB 3.3Å; D79-R83 WeakPolarHBondContact O-CG 3.34Å; D79-R83 PolarHBondContact O-N 3.43Å
80	K	95.9	Very high	96.4	Very high	123 Å²	123	82.6 Å²	82.6	54%	0.535	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-35.4	-178.5	-178.6	173.1	-178.2	151.8	0	113.1	C35 D37	C35-K80 PolarHBondContact O-N 2.82Å; D37-K80 HydrophobicContact CB-CB 4.32Å; D37-K80 HydrophobicContact CB-CD 4.26Å; D37-K80 HydrophobicContact CB-CG 4.16Å; D37-K80 WeakPolarHBondContact OD1-CD 3.39Å; D37-K80 WeakPolarHBondContact OD1-CE 3.45Å; D37-K80 IonicContact OD1-NZ 2.8Å; D37-K80 PolarHBondContact OD1-NZ 3.4Å
81	V	96.6	Very high	96.5	Very high	121 Å²	121	82.4 Å²	82.4	73%	0.733	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-44.2	-176.3	-174	0	0	0	0	110.6	D79	D79-V81 PolarHBondContact O-N 2.76Å; D79-V81 WeakPolarHBondContact OD1-CA 3.27Å; D79-V81 WeakPolarHBondContact OD1-CB 3.48Å; D79-V81 PolarHBondContact OD1-N 2.7Å
82	T	96.1	Very high	96.6	Very high	41 Å²	41	78 Å²	78	25%	0.252	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-11.7	-170.4	60.7	0	0	0	0	114.3	V77 D79 N84 Q85	V77-T82 PolarHBondContact O-OG1 3.38Å; V77-T82 VanDerWaalsContact O-OG1 3.04Å; D79-T82 PolarHBondContact N-OG1 3.17Å; D79-T82 PolarHBondContact O-N 2.73Å; D79-T82 PolarHBondContact OD1-N 2.92Å; D79-T82 PolarHBondContact OD1-OG1 3.03Å; D79-T82 VanDerWaalsContact OD1-OG1 3.08Å; D79-T82 WeakPolarHBondContact OD2-CG2 3.36Å; D79-T82 PolarHBondContact OD2-OG1 3.18Å; T82-N84 PolarHBondContact O-N 3.49Å; T82-Q85 WeakPolarHBondContact O-CB 3.35Å; T82-Q85 WeakPolarHBondContact O-CG 3.34Å; T82-Q85 PolarHBondContact O-N 3.33Å
83	R	96.8	Very high	96.8	Very high	39 Å²	39	74.2 Å²	74.2	15%	0.147	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-15.8	-176.5	63.3	-173	-173.5	-170.9	-6.6	116.3	C35 D37 C49 I78 D79 R90	C35-R83 HydrophobicContact CB-CB 4.17Å; C35-R83 PolarHBondContact SG-NH1 3.03Å; D37-R83 IonicContact OD2-CZ 3.21Å; D37-R83 IonicContact OD2-NH1 3.99Å; D37-R83 PolarHBondContact OD2-NH1 3.11Å; D37-R83 IonicContact OD2-NH2 3.94Å; D37-R83 PolarHBondContact OD2-NH2 3.29Å; D37-R83 VanDerWaalsContact OD2-NH2 3.12Å; C49-R83 PolarHBondContact SG-NH1 3.49Å; C49-R83 VanDerWaalsContact SG-NH1 3.36Å; I78-R83 HydrophobicContact CG2-CB 3.85Å; D79-R83 WeakPolarHBondContact O-CB 3.3Å; D79-R83 WeakPolarHBondContact O-CG 3.34Å; D79-R83 PolarHBondContact O-N 3.43Å; R83-R90 WeakPolarHBondContact O-CD 3.49Å; R83-R90 PolarHBondContact O-NH1 2.9Å
84	N	96.6	Very high	97.1	Very high	115 Å²	115	66.9 Å²	66.9	62%	0.615	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-7.7	177.6	-65.3	-30.2	0	0	0	113.5	T82 R90	T82-N84 PolarHBondContact O-N 3.49Å; N84-R90 PolarHBondContact OD1-NH1 2.93Å
85	Q	96.5	Very high	97.3	Very high	152 Å²	152	69.2 Å²	69.2	71%	0.71	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-30.1	-175.2	-59.9	-62.2	-8.3	0	0	113.2	T82	T82-Q85 WeakPolarHBondContact O-CB 3.35Å; T82-Q85 WeakPolarHBondContact O-CG 3.34Å; T82-Q85 PolarHBondContact O-N 3.33Å
86	C	97.8	Very high	97.4	Very high	8 Å²	8	65.4 Å²	65.4	5%	0.054	34%	0.343	C	S	.	.			trans	-141.2	108.2	178.7	-176.2	0	0	0	0	111.2	C70 C76 C89 R90	C70-C86 VanDerWaalsContact SG-SG 3.63Å; C76-C86 HydrophobicContact CB-CB 3.99Å; C86-C89 HydrophobicContact CB-CB 4.18Å; C86-C89 PolarHBondContact SG-N 3.43Å; C86-R90 WeakPolarHBondContact O-CB 3.35Å; C86-R90 PolarHBondContact O-N 3.18Å; C86-R90 VanDerWaalsContact O-N 3.15Å
87	Q	97.9	Very high	97.4	Very high	105 Å²	105	65.8 Å²	65.8	49%	0.491	34%	0.344	S	S	.	.	H	α-helix	trans	-68.6	-36.1	179.7	-64.8	173.2	-45.7	0	0	112.2	F55 Y68 R90 F91	F55-Q87 HydrophobicContact CE2-CB 4.24Å; F55-Q87 HydrophobicContact CE2-CG 4.27Å; F55-Q87 HydrophobicContact CZ-CB 4.35Å; F55-Q87 WeakPolarHBondContact CZ-O 3.1Å; Y68-Q87 HydrophobicContact CD1-CB 3.78Å; Y68-Q87 HydrophobicContact CD2-CB 3.9Å; Y68-Q87 HydrophobicContact CE1-CB 3.95Å; Y68-Q87 HydrophobicContact CE1-CG 4.38Å; Y68-Q87 HydrophobicContact CE2-CB 4.05Å; Y68-Q87 HydrophobicContact CG-CB 3.77Å; Q87-R90 PolarHBondContact O-N 3.06Å; Q87-F91 WeakPolarHBondContact O-CB 3.47Å; Q87-F91 PolarHBondContact O-N 3.12Å
88	E	98.1	Very high	97.4	Very high	46 Å²	46	62.5 Å²	62.5	22%	0.215	33%	0.333	C	S	.	.	H	α-helix	trans	-63.4	-53.4	179.3	-165.2	-163.3	168.7	0	0	111.2	C70 R90 F91 K92	C70-E88 WeakPolarHBondContact CA-OE2 3.26Å; C70-E88 HydrophobicContact CB-CB 4.32Å; C70-E88 WeakPolarHBondContact CB-OE2 3.32Å; C70-E88 PolarHBondContact N-OE2 3.5Å; E88-R90 VanDerWaalsContact C-N 3.3Å; E88-R90 PolarHBondContact O-N 3.45Å; E88-F91 PolarHBondContact O-N 2.92Å; E88-K92 HydrophobicContact CG-CD 4.29Å; E88-K92 WeakPolarHBondContact O-CB 3.36Å; E88-K92 WeakPolarHBondContact O-CG 3.44Å; E88-K92 PolarHBondContact O-N 2.8Å; E88-K92 WeakPolarHBondContact OE1-CE 3.37Å; E88-K92 IonicContact OE1-NZ 3.73Å; E88-K92 PolarHBondContact OE1-NZ 3.23Å
89	C	98.1	Very high	97.4	Very high	8 Å²	8	61.6 Å²	61.6	5%	0.054	33%	0.328	C	S	.	.	H	α-helix	trans	-63.1	-36.9	178.6	-66	0	0	0	0	112	G74 C76 I78 C86 K93	G74-C89 PolarHBondContact O-SG 3.05Å; C76-C89 HydrophobicContact CB-CB 3.81Å; I78-C89 HydrophobicContact CD1-CB 4.05Å; C86-C89 HydrophobicContact CB-CB 4.18Å; C86-C89 PolarHBondContact SG-N 3.43Å; C89-K93 WeakPolarHBondContact O-CB 3.36Å; C89-K93 PolarHBondContact O-N 2.76Å
90	R	98.4	Very high	97.3	Very high	10 Å²	10	59.8 Å²	59.8	4%	0.038	32%	0.32	C	S	.	.	H	α-helix	trans	-63.4	-45.8	175	-167.2	-165.6	-168.5	153.6	-7.2	111.7	V34 C52 F55 I78 R83 N84 C86 Q87 E88 K93 C94	V34-R90 HydrophobicContact CG1-CG 4.49Å; C52-R90 PolarHBondContact SG-NH2 3.17Å; F55-R90 HydrophobicContact CD1-CG 4.1Å; F55-R90 HydrophobicContact CE1-CB 4.06Å; F55-R90 HydrophobicContact CE1-CG 3.86Å; F55-R90 HydrophobicContact CZ-CB 4.16Å; F55-R90 HydrophobicContact CZ-CG 4.33Å; I78-R90 HydrophobicContact CD1-CB 3.99Å; I78-R90 HydrophobicContact CG2-CG 4.1Å; R83-R90 WeakPolarHBondContact O-CD 3.49Å; R83-R90 PolarHBondContact O-NH1 2.9Å; N84-R90 PolarHBondContact OD1-NH1 2.93Å; C86-R90 WeakPolarHBondContact O-CB 3.35Å; C86-R90 PolarHBondContact O-N 3.18Å; C86-R90 VanDerWaalsContact O-N 3.15Å; Q87-R90 PolarHBondContact O-N 3.06Å; E88-R90 VanDerWaalsContact C-N 3.3Å; E88-R90 PolarHBondContact O-N 3.45Å; R90-K93 PolarHBondContact O-N 2.82Å; R90-C94 PolarHBondContact O-N 2.94Å; R90-C94 PolarHBondContact O-SG 2.92Å; R90-C94 VanDerWaalsContact O-SG 3.38Å
91	F	98.3	Very high	97.1	Very high	22 Å²	22	57 Å²	57	10%	0.096	31%	0.314	C	S	.	.	H	α-helix	trans	-67.3	-42.9	178.7	-177.4	-108.1	0	0	0	111.9	F55 F56 T59 I60 N65 Y68 Q87 E88 K93 C94 I95	F55-F91 HydrophobicContact CE1-CB 3.86Å; F55-F91 HydrophobicContact CE1-CD2 4.34Å; F55-F91 HydrophobicContact CZ-CB 3.98Å; F56-F91 HydrophobicContact CD2-CD2 4.28Å; F56-F91 AromaticContact CD2-CE2 3.96Å; F56-F91 HydrophobicContact CD2-CE2 3.96Å; F56-F91 AromaticContact CE2-CE2 3.92Å; F56-F91 HydrophobicContact CE2-CE2 3.92Å; T59-F91 HydrophobicContact CG2-CD2 3.5Å; T59-F91 HydrophobicContact CG2-CE2 3.62Å; T59-F91 HydrophobicContact CG2-CG 3.98Å; T59-F91 HydrophobicContact CG2-CZ 4.2Å; I60-F91 HydrophobicContact CD1-CE2 3.71Å; I60-F91 HydrophobicContact CD1-CZ 3.62Å; I60-F91 HydrophobicContact CG1-CE2 4.35Å; N65-F91 HydrophobicContact CB-CD1 3.69Å; N65-F91 HydrophobicContact CB-CE1 3.37Å; N65-F91 HydrophobicContact CB-CG 4.42Å; N65-F91 HydrophobicContact CB-CZ 3.86Å; Y68-F91 HydrophobicContact CD2-CB 4.24Å; Y68-F91 HydrophobicContact CE2-CB 4.36Å; Q87-F91 WeakPolarHBondContact O-CB 3.47Å; Q87-F91 PolarHBondContact O-N 3.12Å; E88-F91 PolarHBondContact O-N 2.92Å; F91-K93 VanDerWaalsContact C-N 3.27Å; F91-K93 PolarHBondContact O-N 2.93Å; F91-C94 WeakPolarHBondContact O-CB 3.42Å; F91-C94 PolarHBondContact O-N 3.15Å; F91-C94 VanDerWaalsContact O-N 3.09Å; F91-I95 HydrophobicContact CD1-CG1 4.43Å; F91-I95 HydrophobicContact CE1-CD1 4.39Å; F91-I95 HydrophobicContact CE1-CG1 3.93Å; F91-I95 HydrophobicContact CE2-CD1 4.26Å; F91-I95 HydrophobicContact CE2-CG1 4.29Å; F91-I95 HydrophobicContact CZ-CD1 3.85Å; F91-I95 HydrophobicContact CZ-CG1 3.86Å; F91-I95 PolarHBondContact O-N 3.36Å
92	K	97.6	Very high	96.9	Very high	105 Å²	105	56.5 Å²	56.5	46%	0.457	31%	0.307	S	S	.	.	H	α-helix	trans	-54.9	-43.1	171.3	-78.2	175.9	167.5	171.3	0	111.5	E88 I95 A96	E88-K92 HydrophobicContact CG-CD 4.29Å; E88-K92 WeakPolarHBondContact O-CB 3.36Å; E88-K92 WeakPolarHBondContact O-CG 3.44Å; E88-K92 PolarHBondContact O-N 2.8Å; E88-K92 WeakPolarHBondContact OE1-CE 3.37Å; E88-K92 IonicContact OE1-NZ 3.73Å; E88-K92 PolarHBondContact OE1-NZ 3.23Å; K92-I95 PolarHBondContact O-N 3.31Å; K92-A96 VanDerWaalsContact O-CB 3.32Å; K92-A96 WeakPolarHBondContact O-CB 3.35Å; K92-A96 PolarHBondContact O-N 3.15Å
93	K	98.2	Very high	96.6	Very high	96 Å²	96	58.2 Å²	58.2	42%	0.417	31%	0.314	S	S	.	.	H	α-helix	trans	-64	-42.5	175.1	-171.3	66.3	175.9	-177	0	112.2	V34 I78 C89 R90 F91 I95 A96 V97	V34-K93 HydrophobicContact CG1-CB 4.44Å; V34-K93 HydrophobicContact CG1-CG 4.16Å; I78-K93 HydrophobicContact CG1-CB 4.44Å; C89-K93 WeakPolarHBondContact O-CB 3.36Å; C89-K93 PolarHBondContact O-N 2.76Å; R90-K93 PolarHBondContact O-N 2.82Å; F91-K93 VanDerWaalsContact C-N 3.27Å; F91-K93 PolarHBondContact O-N 2.93Å; K93-I95 VanDerWaalsContact C-N 3.32Å; K93-I95 PolarHBondContact O-N 3.36Å; K93-A96 PolarHBondContact O-N 3.07Å; K93-V97 HydrophobicContact CD-CG1 4.3Å; K93-V97 HydrophobicContact CG-CG1 4.45Å; K93-V97 WeakPolarHBondContact O-CG1 3.16Å; K93-V97 WeakPolarHBondContact O-CG2 3.4Å; K93-V97 PolarHBondContact O-N 2.84Å
94	C	98.3	Very high	96.4	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-56.1	-43.7	174.1	-71	0	0	0	0	112.5	F56 R90 F91 V97 M99	F56-C94 HydrophobicContact CD2-CB 3.62Å; F56-C94 HydrophobicContact CE2-CB 4.08Å; R90-C94 PolarHBondContact O-N 2.94Å; R90-C94 PolarHBondContact O-SG 2.92Å; R90-C94 VanDerWaalsContact O-SG 3.38Å; F91-C94 WeakPolarHBondContact O-CB 3.42Å; F91-C94 PolarHBondContact O-N 3.15Å; F91-C94 VanDerWaalsContact O-N 3.09Å; C94-V97 WeakPolarHBondContact O-CG2 3.21Å; C94-M99 HydrophobicContact CB-CB 4.48Å; C94-M99 HydrophobicContact CB-CG 4.34Å; C94-M99 HydrophobicContact CB-SD 3.68Å; C94-M99 VanDerWaalsContact O-CB 3.28Å; C94-M99 WeakPolarHBondContact O-CB 3.11Å; C94-M99 WeakPolarHBondContact O-CG 3.46Å; C94-M99 PolarHBondContact O-N 3.31Å
95	I	98	Very high	96	Very high	77 Å²	77	54.9 Å²	54.9	40%	0.395	30%	0.299	S	S	.	.	H	α-helix	trans	-69.2	-44	177	-62.3	-64.5	0	0	0	110.8	F56 F91 K92 K93 V97 G98 T101	F56-I95 HydrophobicContact CE2-CD1 3.82Å; F56-I95 HydrophobicContact CZ-CD1 4.31Å; F91-I95 HydrophobicContact CD1-CG1 4.43Å; F91-I95 HydrophobicContact CE1-CD1 4.39Å; F91-I95 HydrophobicContact CE1-CG1 3.93Å; F91-I95 HydrophobicContact CE2-CD1 4.26Å; F91-I95 HydrophobicContact CE2-CG1 4.29Å; F91-I95 HydrophobicContact CZ-CD1 3.85Å; F91-I95 HydrophobicContact CZ-CG1 3.86Å; F91-I95 PolarHBondContact O-N 3.36Å; K92-I95 PolarHBondContact O-N 3.31Å; K93-I95 VanDerWaalsContact C-N 3.32Å; K93-I95 PolarHBondContact O-N 3.36Å; I95-V97 VanDerWaalsContact C-N 3.27Å; I95-V97 PolarHBondContact O-N 3.42Å; I95-G98 WeakPolarHBondContact O-CA 3.17Å; I95-G98 PolarHBondContact O-N 2.96Å; I95-T101 HydrophobicContact CD1-CG2 3.79Å
96	A	97.3	Very high	95.5	Very high	82 Å²	82	50.7 Å²	50.7	68%	0.678	28%	0.282	S	S	*	.	H	α-helix	trans	-61.9	-32.3	-179.3	0	0	0	0	0	113.5	K92 K93 G98	K92-A96 VanDerWaalsContact O-CB 3.32Å; K92-A96 WeakPolarHBondContact O-CB 3.35Å; K92-A96 PolarHBondContact O-N 3.15Å; K93-A96 PolarHBondContact O-N 3.07Å; A96-G98 VanDerWaalsContact C-N 3.26Å
97	V	96.9	Very high	94.8	Very high	42 Å²	42	55 Å²	55	26%	0.255	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-1.9	174.7	-57.4	0	0	0	0	113.5	V33 V34 C46 K93 C94 I95 M99	V33-V97 HydrophobicContact CB-CG1 4.44Å; V33-V97 HydrophobicContact CG2-CB 3.84Å; V33-V97 HydrophobicContact CG2-CG1 4.18Å; V33-V97 HydrophobicContact CG2-CG2 3.82Å; V34-V97 HydrophobicContact CG2-CG2 3.75Å; C46-V97 PolarHBondContact SG-O 3.13Å; K93-V97 HydrophobicContact CD-CG1 4.3Å; K93-V97 HydrophobicContact CG-CG1 4.45Å; K93-V97 WeakPolarHBondContact O-CG1 3.16Å; K93-V97 WeakPolarHBondContact O-CG2 3.4Å; K93-V97 PolarHBondContact O-N 2.84Å; C94-V97 WeakPolarHBondContact O-CG2 3.21Å; I95-V97 VanDerWaalsContact C-N 3.27Å; I95-V97 PolarHBondContact O-N 3.42Å; V97-M99 HydrophobicContact CG2-CG 4.09Å
98	G	96.5	Very high	94.3	Very high	42 Å²	42	54.4 Å²	54.4	43%	0.433	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	20.9	174	0	0	0	0	0	116.1	C46 I95 A96 A100	C46-G98 PolarHBondContact SG-O 3.18Å; I95-G98 WeakPolarHBondContact O-CA 3.17Å; I95-G98 PolarHBondContact O-N 2.96Å; A96-G98 VanDerWaalsContact C-N 3.26Å; G98-A100 PolarHBondContact O-N 2.97Å
99	M	97.7	Very high	93.8	Very high	6 Å²	6	57.4 Å²	57.4	3%	0.03	32%	0.324	C	S	.	.			trans	-64.5	124.6	175.5	-66.6	-172.1	76.4	0	0	110.5	V34 Y44 C46 T48 F56 C94 V97	V34-M99 HydrophobicContact CG2-SD 4.15Å; Y44-M99 HydrophobicContact CD2-CE 3.64Å; Y44-M99 HydrophobicContact CG-CE 4.36Å; Y44-M99 WeakPolarHBondContact O-CA 3.27Å; C46-M99 HydrophobicContact CB-CG 3.98Å; C46-M99 PolarHBondContact SG-N 2.7Å; C46-M99 VanDerWaalsContact SG-N 3.41Å; T48-M99 HydrophobicContact CG2-CE 4.3Å; T48-M99 HydrophobicContact CG2-SD 4.12Å; F56-M99 HydrophobicContact CB-CE 3.6Å; F56-M99 HydrophobicContact CB-SD 4.09Å; F56-M99 HydrophobicContact CD1-CB 4.28Å; F56-M99 HydrophobicContact CD1-CE 3.76Å; F56-M99 HydrophobicContact CD2-CB 3.94Å; F56-M99 HydrophobicContact CD2-CE 4.23Å; F56-M99 HydrophobicContact CD2-SD 3.99Å; F56-M99 HydrophobicContact CE1-CB 3.92Å; F56-M99 HydrophobicContact CE1-CE 4.47Å; F56-M99 HydrophobicContact CE2-CB 3.55Å; F56-M99 HydrophobicContact CG-CB 4.27Å; F56-M99 HydrophobicContact CG-CE 3.6Å; F56-M99 HydrophobicContact CG-SD 3.97Å; F56-M99 HydrophobicContact CZ-CB 3.53Å; F56-M99 VanDerWaalsContact CZ-O 3.27Å; F56-M99 WeakPolarHBondContact CZ-O 3.38Å; C94-M99 HydrophobicContact CB-CB 4.48Å; C94-M99 HydrophobicContact CB-CG 4.34Å; C94-M99 HydrophobicContact CB-SD 3.68Å; C94-M99 VanDerWaalsContact O-CB 3.28Å; C94-M99 WeakPolarHBondContact O-CB 3.11Å; C94-M99 WeakPolarHBondContact O-CG 3.46Å; C94-M99 PolarHBondContact O-N 3.31Å; V97-M99 HydrophobicContact CG2-CG 4.09Å
100	A	95.4	Very high	93.2	Very high	15 Å²	15	61.5 Å²	61.5	12%	0.124	34%	0.338	C	S	.	.			trans	-86.7	116.2	-170.4	0	0	0	0	0	112.2	Y44 R45 G98 D102 L103	Y44-A100 PolarHBondContact O-N 3.46Å; R45-A100 HydrophobicContact CG-CB 4.08Å; G98-A100 PolarHBondContact O-N 2.97Å; A100-D102 VanDerWaalsContact CB-OD1 3.3Å; A100-D102 WeakPolarHBondContact CB-OD1 3.46Å; A100-L103 HydrophobicContact CB-CD1 4.02Å; A100-L103 HydrophobicContact CB-CG 4.1Å
101	T	93.1	Very high	92.7	Very high	66 Å²	66	66.8 Å²	66.8	41%	0.405	37%	0.367	S	S	.	.	S	Bend	trans	-73.1	-31.8	-175.5	54.4	0	0	0	0	113.1	F56 I60 I95 L103 V104	F56-T101 HydrophobicContact CE2-CG2 4.27Å; F56-T101 HydrophobicContact CZ-CG2 3.64Å; I60-T101 HydrophobicContact CD1-CG2 3.53Å; I60-T101 HydrophobicContact CG1-CG2 4.07Å; I95-T101 HydrophobicContact CD1-CG2 3.79Å; T101-L103 PolarHBondContact O-N 3.4Å; T101-V104 WeakPolarHBondContact O-CB 3.4Å; T101-V104 PolarHBondContact O-N 3.42Å; T101-V104 VanDerWaalsContact O-N 3.07Å
102	D	90.6	Very high	92.3	Very high	110 Å²	110	68.5 Å²	68.5	59%	0.588	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-24.4	178.5	65	-36.5	0	0	0	113.6	A100 V104	A100-D102 VanDerWaalsContact CB-OD1 3.3Å; A100-D102 WeakPolarHBondContact CB-OD1 3.46Å; D102-V104 VanDerWaalsContact C-N 3.28Å
103	L	91.6	Very high	91.9	Very high	77 Å²	77	69.3 Å²	69.3	40%	0.403	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-8.8	174.4	-64.7	-174.7	0	0	0	113.4	Y44 R45 A100 T101 L105	Y44-L103 HydrophobicContact CD1-CB 3.9Å; R45-L103 HydrophobicContact CG-CD1 3.7Å; A100-L103 HydrophobicContact CB-CD1 4.02Å; A100-L103 HydrophobicContact CB-CG 4.1Å; T101-L103 PolarHBondContact O-N 3.4Å; L103-L105 PolarHBondContact O-N 3.3Å
104	V	91.1	Very high	91.5	Very high	11 Å²	11	72.2 Å²	72.2	7%	0.067	40%	0.397	C	S	.	.	S	Bend	trans	-81.1	111.1	171.9	-176.9	0	0	0	0	108.5	Y44 F56 R57 I60 Q61 T101 D102 D106	Y44-V104 HydrophobicContact CD1-CG2 3.84Å; Y44-V104 HydrophobicContact CE1-CB 4.35Å; Y44-V104 HydrophobicContact CE1-CG2 3.56Å; F56-V104 HydrophobicContact CD1-CG2 4.01Å; F56-V104 HydrophobicContact CE1-CG2 3.83Å; R57-V104 HydrophobicContact CG-CG1 4.25Å; I60-V104 HydrophobicContact CB-CB 4.2Å; I60-V104 HydrophobicContact CB-CG1 4.08Å; I60-V104 HydrophobicContact CB-CG2 4.13Å; I60-V104 HydrophobicContact CG1-CG2 4.28Å; I60-V104 HydrophobicContact CG2-CB 3.84Å; I60-V104 HydrophobicContact CG2-CG1 3.98Å; I60-V104 HydrophobicContact CG2-CG2 4.19Å; Q61-V104 HydrophobicContact CG-CG1 3.47Å; Q61-V104 VanDerWaalsContact CG-CG1 3.47Å; T101-V104 WeakPolarHBondContact O-CB 3.4Å; T101-V104 PolarHBondContact O-N 3.42Å; T101-V104 VanDerWaalsContact O-N 3.07Å; D102-V104 VanDerWaalsContact C-N 3.28Å; V104-D106 PolarHBondContact O-N 3.42Å
105	L	88	Confident	91.2	Very high	72 Å²	72	78.8 Å²	78.8	38%	0.377	43%	0.426	S	S	.	.			trans	-61	124.2	177.7	-62.3	171.3	0	0	0	110.7	Q61 L103 K109 K113	Q61-L105 PolarHBondContact NE2-O 3.28Å; L103-L105 PolarHBondContact O-N 3.3Å; L105-K109 HydrophobicContact CB-CB 4.39Å; L105-K109 HydrophobicContact CD2-CB 3.88Å; L105-K109 HydrophobicContact CD2-CD 4.12Å; L105-K113 HydrophobicContact CD1-CD 4.27Å
106	D	86	Confident	91	Very high	64 Å²	64	79.7 Å²	79.7	34%	0.342	43%	0.431	S	S	.	.			trans	-66.6	169.6	166.1	60.5	58.1	0	0	0	111.6	V104 S108 K109 R110	V104-D106 PolarHBondContact O-N 3.42Å; D106-S108 VanDerWaalsContact C-N 3.28Å; D106-S108 PolarHBondContact O-N 3.49Å; D106-S108 WeakPolarHBondContact OD1-CB 3.22Å; D106-S108 PolarHBondContact OD1-N 3.02Å; D106-S108 VanDerWaalsContact OD1-N 3.11Å; D106-K109 PolarHBondContact O-N 3.09Å; D106-K109 WeakPolarHBondContact OD1-CG 3.41Å; D106-K109 PolarHBondContact OD1-N 2.84Å; D106-K109 VanDerWaalsContact OD2-CD 3.25Å; D106-K109 WeakPolarHBondContact OD2-CD 3.45Å; D106-K109 WeakPolarHBondContact OD2-CE 3.47Å; D106-K109 IonicContact OD2-NZ 3.06Å; D106-K109 PolarHBondContact OD2-NZ 3.1Å; D106-R110 WeakPolarHBondContact O-CB 3.24Å; D106-R110 PolarHBondContact O-N 3.08Å
107	D	84.4	Confident	90.6	Very high	100 Å²	100	79.2 Å²	79.2	54%	0.535	42%	0.416	S	S	.	.	H	α-helix	trans	-62.6	-35.1	-176.5	-81.6	-35.1	0	0	0	112.8	R110 L111	D107-R110 PolarHBondContact O-N 3.06Å; D107-R110 IonicContact OD1-CZ 2.63Å; D107-R110 IonicContact OD1-NE 2.71Å; D107-R110 IonicContact OD1-NH1 3.78Å; D107-R110 IonicContact OD1-NH2 3.33Å; D107-R110 PolarHBondContact OD1-NH2 3.43Å; D107-L111 WeakPolarHBondContact O-CB 3.04Å; D107-L111 PolarHBondContact O-N 3.23Å
108	S	87.4	Confident	90.4	Very high	92 Å²	92	81.4 Å²	81.4	64%	0.643	42%	0.424	S	S	*	.	H	α-helix	trans	-64.2	-51.7	178	-179.9	0	0	0	0	111.3	D106 R110 L111 A112	D106-S108 VanDerWaalsContact C-N 3.28Å; D106-S108 PolarHBondContact O-N 3.49Å; D106-S108 WeakPolarHBondContact OD1-CB 3.22Å; D106-S108 PolarHBondContact OD1-N 3.02Å; D106-S108 VanDerWaalsContact OD1-N 3.11Å; S108-R110 VanDerWaalsContact C-N 3.28Å; S108-R110 PolarHBondContact O-N 3.29Å; S108-L111 PolarHBondContact O-N 3Å; S108-A112 WeakPolarHBondContact O-CB 3.28Å; S108-A112 PolarHBondContact O-N 3.37Å
109	K	87.1	Confident	90.2	Very high	108 Å²	108	83.8 Å²	83.8	47%	0.47	42%	0.423	S	S	.	.	H	α-helix	trans	-64.7	-32.5	177.9	-66.5	174.4	-172	161.6	0	112.2	L105 D106 K113	L105-K109 HydrophobicContact CB-CB 4.39Å; L105-K109 HydrophobicContact CD2-CB 3.88Å; L105-K109 HydrophobicContact CD2-CD 4.12Å; D106-K109 PolarHBondContact O-N 3.09Å; D106-K109 WeakPolarHBondContact OD1-CG 3.41Å; D106-K109 PolarHBondContact OD1-N 2.84Å; D106-K109 VanDerWaalsContact OD2-CD 3.25Å; D106-K109 WeakPolarHBondContact OD2-CD 3.45Å; D106-K109 WeakPolarHBondContact OD2-CE 3.47Å; D106-K109 IonicContact OD2-NZ 3.06Å; D106-K109 PolarHBondContact OD2-NZ 3.1Å; K109-K113 WeakPolarHBondContact O-CB 3.35Å; K109-K113 PolarHBondContact O-N 2.85Å
110	R	85.8	Confident	89.9	Confident	94 Å²	94	85.8 Å²	85.8	36%	0.355	43%	0.434	S	S	.	.	H	α-helix	trans	-69	-41.5	176	-163.6	179.5	72.2	-173.1	-3.9	111.6	D106 D107 S108 K113 R114	D106-R110 WeakPolarHBondContact O-CB 3.24Å; D106-R110 PolarHBondContact O-N 3.08Å; D107-R110 PolarHBondContact O-N 3.06Å; D107-R110 IonicContact OD1-CZ 2.63Å; D107-R110 IonicContact OD1-NE 2.71Å; D107-R110 IonicContact OD1-NH1 3.78Å; D107-R110 IonicContact OD1-NH2 3.33Å; D107-R110 PolarHBondContact OD1-NH2 3.43Å; S108-R110 VanDerWaalsContact C-N 3.28Å; S108-R110 PolarHBondContact O-N 3.29Å; R110-K113 PolarHBondContact O-N 2.9Å; R110-R114 WeakPolarHBondContact O-CG 3.49Å; R110-R114 PolarHBondContact O-N 2.78Å
111	L	87.9	Confident	89.7	Confident	122 Å²	122	92.6 Å²	92.6	64%	0.639	46%	0.457	S	S	*	.	H	α-helix	trans	-65.3	-45.3	175.2	-170.8	65.6	0	0	0	110.9	D107 S108 K113 R114 K115	D107-L111 WeakPolarHBondContact O-CB 3.04Å; D107-L111 PolarHBondContact O-N 3.23Å; S108-L111 PolarHBondContact O-N 3Å; L111-K113 PolarHBondContact O-N 2.89Å; L111-R114 PolarHBondContact O-N 3.17Å; L111-K115 PolarHBondContact O-N 3.26Å
112	A	89.7	Confident	89.4	Confident	58 Å²	58	94.3 Å²	94.3	48%	0.479	46%	0.46	S	S	.	.	H	α-helix	trans	-58.3	-45	175.4	0	0	0	0	0	112.2	S108 R114 K115 L116	S108-A112 WeakPolarHBondContact O-CB 3.28Å; S108-A112 PolarHBondContact O-N 3.37Å; A112-R114 PolarHBondContact O-N 3.43Å; A112-K115 PolarHBondContact O-N 3.28Å; A112-L116 WeakPolarHBondContact O-CB 3.19Å; A112-L116 PolarHBondContact O-N 2.93Å
113	K	89.4	Confident	89.2	Confident	122 Å²	122	95.3 Å²	95.3	53%	0.53	46%	0.456	S	S	.	.	H	α-helix	trans	-62.2	-40.9	176	-176.2	174	-179.2	174.5	0	112.3	L105 K109 R110 L111 I117	L105-K113 HydrophobicContact CD1-CD 4.27Å; K109-K113 WeakPolarHBondContact O-CB 3.35Å; K109-K113 PolarHBondContact O-N 2.85Å; R110-K113 PolarHBondContact O-N 2.9Å; L111-K113 PolarHBondContact O-N 2.89Å; K113-I117 HydrophobicContact CG-CD1 4.04Å; K113-I117 WeakPolarHBondContact O-CD1 3.23Å; K113-I117 VanDerWaalsContact O-CG1 3.24Å; K113-I117 WeakPolarHBondContact O-CG1 3.15Å; K113-I117 PolarHBondContact O-N 3.04Å
114	R	90.1	Very high	88.9	Confident	156 Å²	156	99.5 Å²	99.5	59%	0.589	47%	0.466	S	S	*	.	H	α-helix	trans	-63.6	-45.8	176.3	-77.6	178.8	176.5	-179.5	-2.9	111.4	R110 L111 A112 L116 I117 E118	R110-R114 WeakPolarHBondContact O-CG 3.49Å; R110-R114 PolarHBondContact O-N 2.78Å; L111-R114 PolarHBondContact O-N 3.17Å; A112-R114 PolarHBondContact O-N 3.43Å; R114-L116 PolarHBondContact O-N 2.98Å; R114-I117 PolarHBondContact O-N 2.88Å; R114-E118 PolarHBondContact O-N 3.36Å
115	K	92.2	Very high	88.5	Confident	139 Å²	139	106.9 Å²	106.9	60%	0.604	49%	0.493	S	S	*	.	H	α-helix	trans	-59.2	-47	177	-168	179.3	-179.4	-171.3	0	111.4	L111 A112 I117 E118 E119	L111-K115 PolarHBondContact O-N 3.26Å; A112-K115 PolarHBondContact O-N 3.28Å; K115-I117 VanDerWaalsContact C-N 3.33Å; K115-I117 PolarHBondContact O-N 3.42Å; K115-E118 PolarHBondContact O-N 3.36Å; K115-E118 VanDerWaalsContact O-N 3.17Å; K115-E119 WeakPolarHBondContact CE-OE1 3.29Å; K115-E119 HydrophobicContact CG-CG 4.48Å; K115-E119 IonicContact NZ-OE1 3.51Å; K115-E119 WeakPolarHBondContact O-CB 3.11Å; K115-E119 WeakPolarHBondContact O-CG 3.31Å; K115-E119 PolarHBondContact O-N 3.11Å
116	L	92.4	Very high	88	Confident	96 Å²	96	111.8 Å²	111.8	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-62.1	-36.7	177.2	-175.7	66.6	0	0	0	113	A112 R114 N120	A112-L116 WeakPolarHBondContact O-CB 3.19Å; A112-L116 PolarHBondContact O-N 2.93Å; R114-L116 PolarHBondContact O-N 2.98Å; L116-N120 VanDerWaalsContact O-CB 3.29Å; L116-N120 WeakPolarHBondContact O-CB 3.36Å; L116-N120 VanDerWaalsContact O-CG 3.28Å; L116-N120 PolarHBondContact O-N 3.46Å; L116-N120 PolarHBondContact O-ND2 3.48Å
117	I	90.4	Very high	87.7	Confident	71 Å²	71	113.5 Å²	113.5	36%	0.364	51%	0.512	S	S	.	.	H	α-helix	trans	-65.5	-43.6	175.8	-72	164.4	0	0	0	110.3	K113 R114 K115 N120 R121	K113-I117 HydrophobicContact CG-CD1 4.04Å; K113-I117 WeakPolarHBondContact O-CD1 3.23Å; K113-I117 VanDerWaalsContact O-CG1 3.24Å; K113-I117 WeakPolarHBondContact O-CG1 3.15Å; K113-I117 PolarHBondContact O-N 3.04Å; R114-I117 PolarHBondContact O-N 2.88Å; K115-I117 VanDerWaalsContact C-N 3.33Å; K115-I117 PolarHBondContact O-N 3.42Å; I117-N120 PolarHBondContact O-N 3.31Å; I117-R121 WeakPolarHBondContact O-CG 3.34Å; I117-R121 PolarHBondContact O-N 3.45Å
118	E	91.2	Very high	87.2	Confident	89 Å²	89	115 Å²	115	42%	0.416	52%	0.516	S	S	.	.	H	α-helix	trans	-66.2	-47.9	179.6	-162.1	57.4	-145.5	0	0	111.3	R114 K115 N120 R121 E122	R114-E118 PolarHBondContact O-N 3.36Å; K115-E118 PolarHBondContact O-N 3.36Å; K115-E118 VanDerWaalsContact O-N 3.17Å; E118-N120 VanDerWaalsContact C-N 3.29Å; E118-N120 PolarHBondContact O-N 2.92Å; E118-R121 WeakPolarHBondContact O-CB 3.28Å; E118-R121 PolarHBondContact O-N 3.03Å; E118-R121 IonicContact OE2-NH1 2.84Å; E118-E122 PolarHBondContact O-N 3.34Å
119	E	92.7	Very high	86.3	Confident	91 Å²	91	115 Å²	115	43%	0.425	51%	0.508	S	S	.	.	H	α-helix	trans	-56.9	-41.2	175	-72.6	170.5	173.3	0	0	112	K115 E122 R123	K115-E119 WeakPolarHBondContact CE-OE1 3.29Å; K115-E119 HydrophobicContact CG-CG 4.48Å; K115-E119 IonicContact NZ-OE1 3.51Å; K115-E119 WeakPolarHBondContact O-CB 3.11Å; K115-E119 WeakPolarHBondContact O-CG 3.31Å; K115-E119 PolarHBondContact O-N 3.11Å; E119-E122 PolarHBondContact O-N 3Å; E119-R123 WeakPolarHBondContact O-CB 3.48Å; E119-R123 PolarHBondContact O-N 3.13Å
120	N	91.3	Very high	85.3	Confident	49 Å²	49	115.4 Å²	115.4	26%	0.262	51%	0.512	S	S	.	.	H	α-helix	trans	-68.2	-34.1	176.4	-81.4	-50.4	0	0	0	113.1	L116 I117 E118 R123 R124	L116-N120 VanDerWaalsContact O-CB 3.29Å; L116-N120 WeakPolarHBondContact O-CB 3.36Å; L116-N120 VanDerWaalsContact O-CG 3.28Å; L116-N120 PolarHBondContact O-N 3.46Å; L116-N120 PolarHBondContact O-ND2 3.48Å; I117-N120 PolarHBondContact O-N 3.31Å; E118-N120 VanDerWaalsContact C-N 3.29Å; E118-N120 PolarHBondContact O-N 2.92Å; N120-R123 PolarHBondContact OD1-NH2 3Å; N120-R124 WeakPolarHBondContact O-CG 3.35Å; N120-R124 PolarHBondContact O-N 3.08Å
121	R	91.1	Very high	84.2	Confident	157 Å²	157	118.9 Å²	118.9	59%	0.592	53%	0.53	S	S	*	.	H	α-helix	trans	-68.3	-44.5	175.2	-76.2	171.5	172.8	-175.1	-5	111	I117 E118 R124 R125	I117-R121 WeakPolarHBondContact O-CG 3.34Å; I117-R121 PolarHBondContact O-N 3.45Å; E118-R121 WeakPolarHBondContact O-CB 3.28Å; E118-R121 PolarHBondContact O-N 3.03Å; E118-R121 IonicContact OE2-NH1 2.84Å; R121-R124 PolarHBondContact O-N 3.02Å; R121-R125 WeakPolarHBondContact O-CB 3.39Å; R121-R125 PolarHBondContact O-N 2.95Å
122	E	87.8	Confident	82.8	Confident	103 Å²	103	117 Å²	117	48%	0.481	52%	0.523	S	S	.	.	H	α-helix	trans	-62.4	-43.5	174.8	-71.9	-173.7	163.6	0	0	111.7	E118 E119 R125 R126	E118-E122 PolarHBondContact O-N 3.34Å; E119-E122 PolarHBondContact O-N 3Å; E122-R125 PolarHBondContact O-N 2.87Å; E122-R126 WeakPolarHBondContact O-CB 3.36Å; E122-R126 PolarHBondContact O-N 3.42Å
123	R	86.6	Confident	81.4	Confident	130 Å²	130	116.6 Å²	116.6	49%	0.491	52%	0.52	S	S	.	.	H	α-helix	trans	-60.2	-49.2	176.4	-171	-175.6	67.9	-157	-10.4	111.5	E119 N120 R125 R126 E127	E119-R123 WeakPolarHBondContact O-CB 3.48Å; E119-R123 PolarHBondContact O-N 3.13Å; N120-R123 PolarHBondContact OD1-NH2 3Å; R123-R125 VanDerWaalsContact C-N 3.33Å; R123-R125 PolarHBondContact O-N 2.54Å; R123-R126 WeakPolarHBondContact O-CB 3.33Å; R123-R126 PolarHBondContact O-N 2.98Å; R123-R126 VanDerWaalsContact O-N 3.11Å; R123-E127 WeakPolarHBondContact CD-OE1 3.17Å; R123-E127 HydrophobicContact CG-CG 4.35Å; R123-E127 WeakPolarHBondContact CG-OE1 3.36Å; R123-E127 IonicContact NE-OE1 2.7Å; R123-E127 PolarHBondContact NE-OE1 3.41Å; R123-E127 WeakPolarHBondContact O-CG 3.43Å; R123-E127 PolarHBondContact O-N 2.9Å
124	R	84.2	Confident	79.6	Confident	165 Å²	165	121 Å²	121	62%	0.623	53%	0.533	S	S	*	.	H	α-helix	trans	-58.9	-43.4	177	-78.5	-177.1	-177.9	-170.7	0	112.1	N120 R121 R126 E127 E128	N120-R124 WeakPolarHBondContact O-CG 3.35Å; N120-R124 PolarHBondContact O-N 3.08Å; R121-R124 PolarHBondContact O-N 3.02Å; R124-R126 VanDerWaalsContact C-N 3.29Å; R124-R126 PolarHBondContact O-N 2.95Å; R124-E127 PolarHBondContact O-N 3.09Å; R124-E128 WeakPolarHBondContact O-CB 3.48Å; R124-E128 WeakPolarHBondContact O-CG 3.44Å; R124-E128 PolarHBondContact O-N 2.77Å
125	R	82.3	Confident	78.3	Confident	167 Å²	167	120.2 Å²	120.2	63%	0.63	54%	0.541	S	S	*	.	H	α-helix	trans	-59.3	-42.1	175.7	-170.2	-171.1	-63.1	-173.5	1.8	111.4	R121 E122 R123 L129	R121-R125 WeakPolarHBondContact O-CB 3.39Å; R121-R125 PolarHBondContact O-N 2.95Å; E122-R125 PolarHBondContact O-N 2.87Å; R123-R125 VanDerWaalsContact C-N 3.33Å; R123-R125 PolarHBondContact O-N 2.54Å; R125-L129 HydrophobicContact CG-CD1 4.3Å; R125-L129 WeakPolarHBondContact O-CB 3.32Å; R125-L129 WeakPolarHBondContact O-CD1 3.42Å; R125-L129 VanDerWaalsContact O-CG 3.31Å; R125-L129 WeakPolarHBondContact O-CG 3.41Å; R125-L129 PolarHBondContact O-N 2.83Å
126	R	78.8	Confident	77.3	Confident	174 Å²	174	120 Å²	120	66%	0.657	54%	0.536	S	S	*	.	H	α-helix	trans	-66.6	-44.2	177.8	-167.6	-176.4	-61.5	178.3	1.8	111.9	E122 R123 R124 L129 Q130	E122-R126 WeakPolarHBondContact O-CB 3.36Å; E122-R126 PolarHBondContact O-N 3.42Å; R123-R126 WeakPolarHBondContact O-CB 3.33Å; R123-R126 PolarHBondContact O-N 2.98Å; R123-R126 VanDerWaalsContact O-N 3.11Å; R124-R126 VanDerWaalsContact C-N 3.29Å; R124-R126 PolarHBondContact O-N 2.95Å; R126-L129 PolarHBondContact O-N 3.17Å; R126-Q130 WeakPolarHBondContact O-CB 3.39Å; R126-Q130 PolarHBondContact O-N 2.9Å
127	E	79.6	Confident	77	Confident	100 Å²	100	121 Å²	121	47%	0.467	54%	0.542	S	S	.	.	H	α-helix	trans	-62.5	-42.1	177.2	-72.6	167.4	177.5	0	0	111.6	R123 R124 Q130 K131	R123-E127 WeakPolarHBondContact CD-OE1 3.17Å; R123-E127 HydrophobicContact CG-CG 4.35Å; R123-E127 WeakPolarHBondContact CG-OE1 3.36Å; R123-E127 IonicContact NE-OE1 2.7Å; R123-E127 PolarHBondContact NE-OE1 3.41Å; R123-E127 WeakPolarHBondContact O-CG 3.43Å; R123-E127 PolarHBondContact O-N 2.9Å; R124-E127 PolarHBondContact O-N 3.09Å; E127-Q130 PolarHBondContact O-N 3.07Å; E127-K131 WeakPolarHBondContact O-CB 3.21Å; E127-K131 PolarHBondContact O-N 3.21Å
128	E	73.1	Confident	76.9	Confident	132 Å²	132	122.1 Å²	122.1	62%	0.617	55%	0.545	S	S	*	.	H	α-helix	trans	-63.4	-46.8	175.2	-76.4	171.3	179.7	0	0	112	R124 Q130 K131 T132	R124-E128 WeakPolarHBondContact O-CB 3.48Å; R124-E128 WeakPolarHBondContact O-CG 3.44Å; R124-E128 PolarHBondContact O-N 2.77Å; E128-Q130 VanDerWaalsContact C-N 3.29Å; E128-Q130 PolarHBondContact O-N 3.27Å; E128-K131 PolarHBondContact O-N 3.35Å; E128-T132 PolarHBondContact O-N 3.41Å
129	L	68.1	Low	77.1	Confident	92 Å²	92	118.5 Å²	118.5	48%	0.482	53%	0.529	S	S	.	.	H	α-helix	trans	-57.8	-42.9	174.4	-77.4	163.7	0	0	0	111.6	R125 R126 T132 A133	R125-L129 HydrophobicContact CG-CD1 4.3Å; R125-L129 WeakPolarHBondContact O-CB 3.32Å; R125-L129 WeakPolarHBondContact O-CD1 3.42Å; R125-L129 VanDerWaalsContact O-CG 3.31Å; R125-L129 WeakPolarHBondContact O-CG 3.41Å; R125-L129 PolarHBondContact O-N 2.83Å; R126-L129 PolarHBondContact O-N 3.17Å; L129-T132 PolarHBondContact O-N 2.68Å; L129-T132 PolarHBondContact O-OG1 2.72Å; L129-A133 PolarHBondContact O-N 3.39Å
130	Q	65.8	Low	77.3	Confident	116 Å²	116	117.6 Å²	117.6	54%	0.542	53%	0.531	S	S	.	.	H	α-helix	trans	-69.3	-35.8	-179.5	-162.8	168	19.5	0	0	112.1	R126 E127 E128 T132 A133	R126-Q130 WeakPolarHBondContact O-CB 3.39Å; R126-Q130 PolarHBondContact O-N 2.9Å; E127-Q130 PolarHBondContact O-N 3.07Å; E128-Q130 VanDerWaalsContact C-N 3.29Å; E128-Q130 PolarHBondContact O-N 3.27Å; Q130-T132 VanDerWaalsContact C-N 3.34Å; Q130-T132 PolarHBondContact O-N 2.9Å; Q130-A133 WeakPolarHBondContact O-CB 3.3Å; Q130-A133 PolarHBondContact O-N 3.11Å; Q130-A133 VanDerWaalsContact O-N 3.09Å
131	K	63.8	Low	77.5	Confident	168 Å²	168	121.8 Å²	121.8	73%	0.73	55%	0.549	S	S	*	.	H	α-helix	trans	-63.8	-38.5	176	-160	175.3	-177.7	-177.1	0	112.1	E127 E128 A133	E127-K131 WeakPolarHBondContact O-CB 3.21Å; E127-K131 PolarHBondContact O-N 3.21Å; E128-K131 PolarHBondContact O-N 3.35Å; K131-A133 PolarHBondContact O-N 3.05Å
132	T	59.2	Low	77.8	Confident	82 Å²	82	122.3 Å²	122.3	50%	0.503	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.4	-9.7	173.7	61.7	0	0	0	0	114.6	E128 L129 Q130	E128-T132 PolarHBondContact O-N 3.41Å; L129-T132 PolarHBondContact O-N 2.68Å; L129-T132 PolarHBondContact O-OG1 2.72Å; Q130-T132 VanDerWaalsContact C-N 3.34Å; Q130-T132 PolarHBondContact O-N 2.9Å
133	A	59.3	Low	78.3	Confident	50 Å²	50	118.6 Å²	118.6	41%	0.413	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-23.9	179.4	0	0	0	0	0	113.1	L129 Q130 K131	L129-A133 PolarHBondContact O-N 3.39Å; Q130-A133 WeakPolarHBondContact O-CB 3.3Å; Q130-A133 PolarHBondContact O-N 3.11Å; Q130-A133 VanDerWaalsContact O-N 3.09Å; K131-A133 PolarHBondContact O-N 3.05Å
134	W	52.1	Low	78.8	Confident	213 Å²	213	116.4 Å²	116.4	81%	0.807	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-19.1	-179.8	-82.6	97	0	0	0	114
135	D	62.7	Low	79.5	Confident	140 Å²	140	112.7 Å²	112.7	75%	0.749	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	5.2	176.5	-70.5	-28.2	0	0	0	113.3	L137	D135-L137 PolarHBondContact O-N 2.9Å
136	R	71.1	Confident	80.2	Confident	134 Å²	134	106 Å²	106	51%	0.506	50%	0.498	S	S	.	.			trans	-82.3	105.5	-177	-72	179.8	-177.2	-149.4	5.9	110.6	N362	R136-N362 HydrophobicContact CB-CB 4Å; R136-N362 WeakPolarHBondContact CD-OD1 3.14Å
137	L	85.1	Confident	81.2	Confident	118 Å²	118	97.8 Å²	97.8	62%	0.618	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-64.1	135.9	175.3	-61.3	171.6	0	0	0	110.2	D135 H359 N362	D135-L137 PolarHBondContact O-N 2.9Å; L137-H359 WeakPolarHBondContact CB-NE2 3.42Å; L137-H359 WeakPolarHBondContact O-CA 3.5Å; L137-H359 PolarHBondContact O-CD2 3.14Å; L137-N362 WeakPolarHBondContact O-CB 3.28Å; L137-N362 PolarHBondContact O-ND2 2.73Å; L137-N362 VanDerWaalsContact O-ND2 3.14Å
138	E	89.7	Confident	82.1	Confident	94 Å²	94	98.5 Å²	98.5	44%	0.439	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-91.7	161.9	169	-66.6	-171.5	171.6	0	0	109.3	T140 K365	E138-T140 PolarHBondContact O-N 3.41Å; E138-K365 WeakPolarHBondContact OE1-CE 3.44Å; E138-K365 IonicContact OE1-NZ 3.7Å; E138-K365 PolarHBondContact OE1-NZ 3.46Å
139	P	95.7	Very high	83.3	Confident	13 Å²	13	94.8 Å²	94.8	8%	0.084	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-64.1	136.3	-172	-18.8	29.7	0	0	0	112.5	E143 W144 I147 H359 Y360	P139-E143 WeakPolarHBondContact CA-OE2 3.29Å; P139-E143 HydrophobicContact CB-CB 4.06Å; P139-W144 HydrophobicContact CB-CD2 4.28Å; P139-W144 HydrophobicContact CB-CG 4.26Å; P139-W144 HydrophobicContact CB-CZ2 4.49Å; P139-W144 HydrophobicContact CG-CZ2 4.09Å; P139-W144 PolarHBondContact O-NE1 3.48Å; P139-I147 HydrophobicContact CB-CD1 4.06Å; P139-I147 HydrophobicContact CG-CD1 4.12Å; P139-H359 HydrophobicContact CB-CB 4.21Å; P139-H359 WeakPolarHBondContact CD-O 3.39Å; P139-H359 HydrophobicContact CG-CB 3.91Å; P139-Y360 HydrophobicContact CG-CD2 4.38Å
140	T	95.6	Very high	84.7	Confident	73 Å²	73	90.4 Å²	90.4	45%	0.448	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-68.8	168.4	169.2	64	0	0	0	0	111.2	E138 E142 E143 W144	E138-T140 PolarHBondContact O-N 3.41Å; T140-E142 VanDerWaalsContact C-N 3.29Å; T140-E142 PolarHBondContact O-N 3.3Å; T140-E143 WeakPolarHBondContact CG2-OE2 3.31Å; T140-E143 PolarHBondContact N-OE2 2.94Å; T140-E143 PolarHBondContact O-N 2.86Å; T140-E143 VanDerWaalsContact OG1-CD 3.32Å; T140-E143 VanDerWaalsContact OG1-CG 3.25Å; T140-E143 WeakPolarHBondContact OG1-CG 3.46Å; T140-E143 PolarHBondContact OG1-N 3.28Å; T140-E143 PolarHBondContact OG1-OE2 3.05Å; T140-W144 PolarHBondContact O-N 2.98Å
141	Q	96.7	Very high	86.2	Confident	137 Å²	137	85.6 Å²	85.6	64%	0.64	41%	0.405	S	S	*	.	H	α-helix	trans	-60.8	-38.8	179	-173.5	63.4	34.6	0	0	112.5	W144 E145	Q141-W144 PolarHBondContact O-N 3.38Å; Q141-E145 PolarHBondContact O-N 2.76Å
142	E	96.6	Very high	87.8	Confident	168 Å²	168	82.3 Å²	82.3	79%	0.785	39%	0.393	S	S	*	.	H	α-helix	trans	-67.1	-42.9	178.1	-67.4	173	-176.9	0	0	110.9	T140 W144 E145 L146	T140-E142 VanDerWaalsContact C-N 3.29Å; T140-E142 PolarHBondContact O-N 3.3Å; E142-W144 VanDerWaalsContact C-N 3.33Å; E142-W144 PolarHBondContact O-N 3.2Å; E142-E145 PolarHBondContact O-N 3.29Å; E142-L146 PolarHBondContact O-N 2.8Å
143	E	97.5	Very high	89.7	Confident	25 Å²	25	78.6 Å²	78.6	12%	0.117	37%	0.37	C	S	.	.	H	α-helix	trans	-64	-37.2	174.6	-69.2	168.5	143.7	0	0	111.9	P139 T140 E145 L146 I147 A356 H359	P139-E143 WeakPolarHBondContact CA-OE2 3.29Å; P139-E143 HydrophobicContact CB-CB 4.06Å; T140-E143 WeakPolarHBondContact CG2-OE2 3.31Å; T140-E143 PolarHBondContact N-OE2 2.94Å; T140-E143 PolarHBondContact O-N 2.86Å; T140-E143 VanDerWaalsContact OG1-CD 3.32Å; T140-E143 VanDerWaalsContact OG1-CG 3.25Å; T140-E143 WeakPolarHBondContact OG1-CG 3.46Å; T140-E143 PolarHBondContact OG1-N 3.28Å; T140-E143 PolarHBondContact OG1-OE2 3.05Å; E143-E145 PolarHBondContact O-N 2.98Å; E143-L146 WeakPolarHBondContact O-CB 3.48Å; E143-L146 PolarHBondContact O-N 3.43Å; E143-I147 WeakPolarHBondContact O-CB 3.38Å; E143-I147 WeakPolarHBondContact O-CD1 3.37Å; E143-I147 WeakPolarHBondContact O-CG1 3.45Å; E143-I147 PolarHBondContact O-N 3.08Å; E143-A356 HydrophobicContact CB-CB 3.93Å; E143-A356 HydrophobicContact CG-CB 3.93Å; E143-H359 IonicContact OE1-CE1 3.05Å; E143-H359 PolarHBondContact OE1-CE1 3.19Å; E143-H359 VanDerWaalsContact OE1-CE1 3.3Å; E143-H359 IonicContact OE1-CG 2.83Å; E143-H359 IonicContact OE1-ND1 2.77Å; E143-H359 PolarHBondContact OE1-ND1 3.18Å; E143-H359 IonicContact OE2-CE1 3.23Å; E143-H359 IonicContact OE2-CG 2.9Å; E143-H359 IonicContact OE2-ND1 3.89Å; E143-H359 PolarHBondContact OE2-ND1 3.23Å
144	W	98.2	Very high	91.5	Very high	83 Å²	83	76.2 Å²	76.2	31%	0.314	35%	0.351	S	S	.	.	H	α-helix	trans	-61.6	-41	174.2	-87.3	115.9	0	0	0	113	P139 T140 Q141 E142 L146 I147 R148 Y360 Y363	P139-W144 HydrophobicContact CB-CD2 4.28Å; P139-W144 HydrophobicContact CB-CG 4.26Å; P139-W144 HydrophobicContact CB-CZ2 4.49Å; P139-W144 HydrophobicContact CG-CZ2 4.09Å; P139-W144 PolarHBondContact O-NE1 3.48Å; T140-W144 PolarHBondContact O-N 2.98Å; Q141-W144 PolarHBondContact O-N 3.38Å; E142-W144 VanDerWaalsContact C-N 3.33Å; E142-W144 PolarHBondContact O-N 3.2Å; W144-L146 VanDerWaalsContact C-N 3.34Å; W144-I147 HydrophobicContact CE3-CD1 4.46Å; W144-I147 PolarHBondContact O-N 2.98Å; W144-R148 WeakPolarHBondContact O-CB 3.37Å; W144-R148 PolarHBondContact O-N 3Å; W144-Y360 AromaticContact CH2-CD2 3.86Å; W144-Y360 HydrophobicContact CH2-CD2 3.86Å; W144-Y360 AromaticContact CH2-CE2 3.53Å; W144-Y360 HydrophobicContact CH2-CE2 3.53Å; W144-Y360 AromaticContact CZ3-CD2 3.97Å; W144-Y360 HydrophobicContact CZ3-CD2 3.97Å; W144-Y360 AromaticContact CZ3-CE2 3.56Å; W144-Y360 HydrophobicContact CZ3-CE2 3.56Å; W144-Y363 AromaticContact CH2-CD1 3.88Å; W144-Y363 HydrophobicContact CH2-CD1 3.88Å; W144-Y363 AromaticContact CH2-CE1 3.77Å; W144-Y363 HydrophobicContact CH2-CE1 3.77Å; W144-Y363 HydrophobicContact CH2-CG 4.42Å; W144-Y363 HydrophobicContact CZ2-CD1 4.07Å; W144-Y363 HydrophobicContact CZ2-CD2 4.24Å; W144-Y363 HydrophobicContact CZ2-CE1 4.1Å; W144-Y363 HydrophobicContact CZ2-CE2 4.26Å; W144-Y363 HydrophobicContact CZ2-CG 4.14Å
145	E	98	Very high	93.4	Very high	88 Å²	88	71.1 Å²	71.1	41%	0.411	34%	0.337	S	S	.	.	H	α-helix	trans	-66.4	-39.2	174.6	-71.1	-55.8	146.3	0	0	111.7	Q141 E142 E143 R148 L149	Q141-E145 PolarHBondContact O-N 2.76Å; E142-E145 PolarHBondContact O-N 3.29Å; E143-E145 PolarHBondContact O-N 2.98Å; E145-R148 PolarHBondContact O-N 2.85Å; E145-R148 IonicContact OE2-CZ 3.31Å; E145-R148 IonicContact OE2-NE 3.09Å; E145-R148 PolarHBondContact OE2-NE 3.28Å; E145-R148 IonicContact OE2-NH2 2.73Å; E145-R148 PolarHBondContact OE2-NH2 2.95Å; E145-L149 WeakPolarHBondContact O-CB 3.42Å; E145-L149 PolarHBondContact O-N 3.28Å
146	L	98.1	Very high	95	Very high	26 Å²	26	67.9 Å²	67.9	14%	0.136	33%	0.325	C	S	.	.	H	α-helix	trans	-62.8	-46.4	175.3	-177.1	60.2	0	0	0	111.7	E142 E143 W144 L149 V150 M246 E352 F353 A356	E142-L146 PolarHBondContact O-N 2.8Å; E143-L146 WeakPolarHBondContact O-CB 3.48Å; E143-L146 PolarHBondContact O-N 3.43Å; W144-L146 VanDerWaalsContact C-N 3.34Å; L146-L149 PolarHBondContact O-N 2.82Å; L146-V150 PolarHBondContact O-N 3.24Å; L146-M246 HydrophobicContact CD1-CE 3.5Å; L146-M246 HydrophobicContact CD2-CE 4.47Å; L146-E352 HydrophobicContact CD2-CB 4.32Å; L146-F353 HydrophobicContact CD1-CD1 4.25Å; L146-F353 HydrophobicContact CD1-CE1 3.52Å; L146-F353 HydrophobicContact CD1-CZ 3.8Å; L146-F353 HydrophobicContact CD2-CD1 3.96Å; L146-F353 HydrophobicContact CD2-CE1 4.1Å; L146-F353 HydrophobicContact CD2-CG 4.49Å; L146-F353 HydrophobicContact CG-CD1 4.03Å; L146-F353 HydrophobicContact CG-CE1 3.75Å; L146-F353 HydrophobicContact CG-CZ 4.48Å; L146-A356 HydrophobicContact CD2-CB 4.27Å
147	I	98.5	Very high	96.1	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-59.8	-48.1	176.2	-67.4	160.1	0	0	0	109.6	P139 E143 W144 L149 V150 T151 L326 A356 Y360	P139-I147 HydrophobicContact CB-CD1 4.06Å; P139-I147 HydrophobicContact CG-CD1 4.12Å; E143-I147 WeakPolarHBondContact O-CB 3.38Å; E143-I147 WeakPolarHBondContact O-CD1 3.37Å; E143-I147 WeakPolarHBondContact O-CG1 3.45Å; E143-I147 PolarHBondContact O-N 3.08Å; W144-I147 HydrophobicContact CE3-CD1 4.46Å; W144-I147 PolarHBondContact O-N 2.98Å; I147-L149 VanDerWaalsContact C-N 3.33Å; I147-L149 PolarHBondContact O-N 3.39Å; I147-V150 VanDerWaalsContact O-CG1 3.29Å; I147-V150 WeakPolarHBondContact O-CG1 3.23Å; I147-V150 PolarHBondContact O-N 2.96Å; I147-T151 VanDerWaalsContact O-CB 3.31Å; I147-T151 WeakPolarHBondContact O-CB 3.23Å; I147-T151 PolarHBondContact O-N 3.34Å; I147-T151 PolarHBondContact O-OG1 2.83Å; I147-L326 HydrophobicContact CG1-CD1 4.18Å; I147-L326 HydrophobicContact CG1-CD2 4.18Å; I147-L326 HydrophobicContact CG2-CD1 4.48Å; I147-A356 HydrophobicContact CD1-CB 4.33Å; I147-A356 HydrophobicContact CG1-CB 4.15Å; I147-Y360 HydrophobicContact CD1-CD2 3.87Å; I147-Y360 HydrophobicContact CD1-CG 4.17Å; I147-Y360 HydrophobicContact CG2-CD2 4.29Å; I147-Y360 HydrophobicContact CG2-CE2 4.33Å
148	R	98.4	Very high	96	Very high	115 Å²	115	57.1 Å²	57.1	43%	0.434	28%	0.279	S	S	.	.	H	α-helix	trans	-58.3	-46.4	177.9	-172.8	-175.6	65.5	73.6	4.6	111.5	W144 E145 T151 E152	W144-R148 WeakPolarHBondContact O-CB 3.37Å; W144-R148 PolarHBondContact O-N 3Å; E145-R148 PolarHBondContact O-N 2.85Å; E145-R148 IonicContact OE2-CZ 3.31Å; E145-R148 IonicContact OE2-NE 3.09Å; E145-R148 PolarHBondContact OE2-NE 3.28Å; E145-R148 IonicContact OE2-NH2 2.73Å; E145-R148 PolarHBondContact OE2-NH2 2.95Å; R148-T151 PolarHBondContact O-N 3.48Å; R148-E152 WeakPolarHBondContact CG-OE1 3.48Å; R148-E152 IonicContact CZ-OE1 3.61Å; R148-E152 IonicContact NH1-OE1 2.73Å; R148-E152 PolarHBondContact NH1-OE1 3.13Å; R148-E152 IonicContact NH1-OE2 3.36Å; R148-E152 PolarHBondContact NH1-OE2 2.92Å; R148-E152 WeakPolarHBondContact O-CB 3.34Å; R148-E152 WeakPolarHBondContact O-CG 3.33Å; R148-E152 PolarHBondContact O-N 3.32Å
149	L	98.4	Very high	95.1	Very high	53 Å²	53	53.2 Å²	53.2	28%	0.277	26%	0.263	S	S	.	.	H	α-helix	trans	-59.4	-49.3	180	-179.5	148	0	0	0	111.8	E145 L146 I147 E152 A153 L244 P245	E145-L149 WeakPolarHBondContact O-CB 3.42Å; E145-L149 PolarHBondContact O-N 3.28Å; L146-L149 PolarHBondContact O-N 2.82Å; I147-L149 VanDerWaalsContact C-N 3.33Å; I147-L149 PolarHBondContact O-N 3.39Å; L149-E152 PolarHBondContact O-N 3.03Å; L149-A153 WeakPolarHBondContact O-CB 3.3Å; L149-A153 PolarHBondContact O-N 3.44Å; L149-L244 HydrophobicContact CD2-CD2 3.65Å; L149-P245 HydrophobicContact CD1-CG 4.02Å
150	V	98.4	Very high	93.6	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-69.8	-36	-179.1	72	0	0	0	0	111.5	L146 I147 A153 H154 F240 L244 A325 L326 A329 F353	L146-V150 PolarHBondContact O-N 3.24Å; I147-V150 VanDerWaalsContact O-CG1 3.29Å; I147-V150 WeakPolarHBondContact O-CG1 3.23Å; I147-V150 PolarHBondContact O-N 2.96Å; V150-A153 WeakPolarHBondContact O-CB 3.25Å; V150-A153 PolarHBondContact O-N 2.74Å; V150-H154 WeakPolarHBondContact O-CB 3.47Å; V150-H154 PolarHBondContact O-N 3.36Å; V150-F240 HydrophobicContact CG2-CE2 4.03Å; V150-F240 HydrophobicContact CG2-CZ 3.85Å; V150-L244 HydrophobicContact CB-CD2 4.2Å; V150-L244 HydrophobicContact CG2-CD2 3.95Å; V150-A325 HydrophobicContact CB-CB 4.46Å; V150-A325 HydrophobicContact CG1-CB 4.06Å; V150-A325 HydrophobicContact CG2-CB 4.04Å; V150-A325 WeakPolarHBondContact CG2-O 3.24Å; V150-A325 WeakPolarHBondContact O-CB 3.49Å; V150-L326 HydrophobicContact CG1-CD2 3.85Å; V150-L326 HydrophobicContact CG1-CG 4.07Å; V150-A329 HydrophobicContact CG2-CB 3.85Å; V150-F353 HydrophobicContact CB-CE1 3.95Å; V150-F353 HydrophobicContact CG1-CE1 4.27Å; V150-F353 HydrophobicContact CG2-CE1 4.09Å
151	T	98.1	Very high	92.1	Very high	15 Å²	15	53.5 Å²	53.5	9%	0.092	27%	0.266	C	S	.	.	H	α-helix	trans	-63	-46.1	175	-60.5	0	0	0	0	111.3	I147 R148 A153 H154 M155 D321 S322	I147-T151 VanDerWaalsContact O-CB 3.31Å; I147-T151 WeakPolarHBondContact O-CB 3.23Å; I147-T151 PolarHBondContact O-N 3.34Å; I147-T151 PolarHBondContact O-OG1 2.83Å; R148-T151 PolarHBondContact O-N 3.48Å; T151-A153 VanDerWaalsContact C-N 3.33Å; T151-A153 PolarHBondContact O-N 2.94Å; T151-H154 WeakPolarHBondContact O-CB 3.17Å; T151-H154 PolarHBondContact O-N 3.41Å; T151-M155 HydrophobicContact CG2-CG 4.26Å; T151-M155 HydrophobicContact CG2-SD 3.93Å; T151-M155 WeakPolarHBondContact O-CB 3.44Å; T151-M155 VanDerWaalsContact O-CG 3.29Å; T151-M155 WeakPolarHBondContact O-CG 3.23Å; T151-M155 PolarHBondContact O-N 3.41Å; T151-D321 HydrophobicContact CG2-CB 4.26Å; T151-S322 WeakPolarHBondContact OG1-CA 3.4Å; T151-S322 VanDerWaalsContact OG1-CB 3.27Å; T151-S322 WeakPolarHBondContact OG1-CB 3.46Å; T151-S322 PolarHBondContact OG1-OG 2.7Å
152	E	97.5	Very high	90.3	Very high	100 Å²	100	53 Å²	53	47%	0.467	27%	0.268	S	S	.	.	H	α-helix	trans	-62.9	-39.4	175.7	-75.1	174.3	-169.6	0	0	112.1	R148 L149 H154 M155 S156	R148-E152 WeakPolarHBondContact CG-OE1 3.48Å; R148-E152 IonicContact CZ-OE1 3.61Å; R148-E152 IonicContact NH1-OE1 2.73Å; R148-E152 PolarHBondContact NH1-OE1 3.13Å; R148-E152 IonicContact NH1-OE2 3.36Å; R148-E152 PolarHBondContact NH1-OE2 2.92Å; R148-E152 WeakPolarHBondContact O-CB 3.34Å; R148-E152 WeakPolarHBondContact O-CG 3.33Å; R148-E152 PolarHBondContact O-N 3.32Å; L149-E152 PolarHBondContact O-N 3.03Å; E152-H154 VanDerWaalsContact C-N 3.35Å; E152-M155 PolarHBondContact O-N 2.65Å; E152-S156 WeakPolarHBondContact O-CB 3.43Å; E152-S156 PolarHBondContact O-N 3.33Å; E152-S156 PolarHBondContact O-OG 3.35Å
153	A	98.1	Very high	88.7	Confident	3 Å²	3	50.3 Å²	50.3	3%	0.025	26%	0.255	C	S	.	.	H	α-helix	trans	-60.8	-44.8	173.5	0	0	0	0	0	111.7	L149 V150 T151 S156 T157 F240 K243 L244	L149-A153 WeakPolarHBondContact O-CB 3.3Å; L149-A153 PolarHBondContact O-N 3.44Å; V150-A153 WeakPolarHBondContact O-CB 3.25Å; V150-A153 PolarHBondContact O-N 2.74Å; T151-A153 VanDerWaalsContact C-N 3.33Å; T151-A153 PolarHBondContact O-N 2.94Å; A153-S156 PolarHBondContact O-OG 3.41Å; A153-T157 WeakPolarHBondContact O-CG2 3.47Å; A153-T157 PolarHBondContact O-N 2.78Å; A153-T157 PolarHBondContact O-OG1 3.19Å; A153-F240 HydrophobicContact CB-CD2 3.91Å; A153-F240 HydrophobicContact CB-CE2 4.02Å; A153-K243 HydrophobicContact CB-CB 3.57Å; A153-K243 HydrophobicContact CB-CD 4.02Å; A153-K243 HydrophobicContact CB-CG 4.47Å; A153-L244 HydrophobicContact CB-CD2 4Å
154	H	96	Very high	87.3	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-61.5	-57.2	174.9	175.2	53.8	0	0	0	111	V150 T151 E152 S156 T157 N158 F240 D321 A325 Q328	V150-H154 WeakPolarHBondContact O-CB 3.47Å; V150-H154 PolarHBondContact O-N 3.36Å; T151-H154 WeakPolarHBondContact O-CB 3.17Å; T151-H154 PolarHBondContact O-N 3.41Å; E152-H154 VanDerWaalsContact C-N 3.35Å; H154-S156 VanDerWaalsContact C-N 3.3Å; H154-S156 PolarHBondContact O-N 3.48Å; H154-T157 CarbonylContact O-C 3.42Å; H154-T157 PolarHBondContact O-N 3.5Å; H154-T157 PolarHBondContact O-OG1 3.11Å; H154-N158 PolarHBondContact CE1-ND2 3.26Å; H154-N158 VanDerWaalsContact CE1-ND2 3.25Å; H154-N158 PolarHBondContact NE2-ND2 2.92Å; H154-N158 VanDerWaalsContact NE2-ND2 3.2Å; H154-N158 WeakPolarHBondContact O-CB 3.32Å; H154-N158 PolarHBondContact O-N 3.47Å; H154-F240 HydrophobicContact CB-CD2 4.41Å; H154-F240 HydrophobicContact CB-CE2 4.1Å; H154-D321 PolarHBondContact CD2-O 3.45Å; H154-D321 IonicContact NE2-OD1 2.77Å; H154-A325 HydrophobicContact CB-CB 3.54Å; H154-Q328 PolarHBondContact CE1-NE2 3.15Å; H154-Q328 VanDerWaalsContact CE1-NE2 3.33Å; H154-Q328 PolarHBondContact ND1-NE2 2.89Å; H154-Q328 PolarHBondContact ND1-OE1 3.01Å
155	M	93.7	Very high	85.9	Confident	106 Å²	106	51.3 Å²	51.3	52%	0.522	26%	0.26	S	S	.	.	H	α-helix	trans	-59.1	-39.2	-174.4	-69.2	-179.7	75.9	0	0	112.9	T151 E152 T157 D321	T151-M155 HydrophobicContact CG2-CG 4.26Å; T151-M155 HydrophobicContact CG2-SD 3.93Å; T151-M155 WeakPolarHBondContact O-CB 3.44Å; T151-M155 VanDerWaalsContact O-CG 3.29Å; T151-M155 WeakPolarHBondContact O-CG 3.23Å; T151-M155 PolarHBondContact O-N 3.41Å; E152-M155 PolarHBondContact O-N 2.65Å; M155-T157 VanDerWaalsContact C-N 3.26Å; M155-T157 PolarHBondContact O-N 3.42Å; M155-D321 HydrophobicContact CG-CB 4.24Å
156	S	94.6	Very high	84.4	Confident	71 Å²	71	54.3 Å²	54.3	50%	0.497	27%	0.274	S	S	.	.	H	α-helix	trans	-73.7	-14.6	179.2	60	0	0	0	0	114.3	E152 A153 H154 K243	E152-S156 WeakPolarHBondContact O-CB 3.43Å; E152-S156 PolarHBondContact O-N 3.33Å; E152-S156 PolarHBondContact O-OG 3.35Å; A153-S156 PolarHBondContact O-OG 3.41Å; H154-S156 VanDerWaalsContact C-N 3.3Å; H154-S156 PolarHBondContact O-N 3.48Å; S156-K243 WeakPolarHBondContact OG-CD 3.47Å; S156-K243 WeakPolarHBondContact OG-CE 3.46Å; S156-K243 PolarHBondContact OG-NZ 3.09Å; S156-K243 VanDerWaalsContact OG-NZ 3.15Å
157	T	94.1	Very high	82.9	Confident	7 Å²	7	59.2 Å²	59.2	4%	0.043	30%	0.295	C	S	.	.	H	α-helix	trans	-115.6	-6.6	179.9	62.7	0	0	0	0	112.8	A153 H154 M155 R236 D239 F240 K243 R270	A153-T157 WeakPolarHBondContact O-CG2 3.47Å; A153-T157 PolarHBondContact O-N 2.78Å; A153-T157 PolarHBondContact O-OG1 3.19Å; H154-T157 CarbonylContact O-C 3.42Å; H154-T157 PolarHBondContact O-N 3.5Å; H154-T157 PolarHBondContact O-OG1 3.11Å; M155-T157 VanDerWaalsContact C-N 3.26Å; M155-T157 PolarHBondContact O-N 3.42Å; T157-R236 WeakPolarHBondContact CB-O 3.43Å; T157-R236 WeakPolarHBondContact O-CB 3.3Å; T157-R236 VanDerWaalsContact O-CD 3.28Å; T157-R236 WeakPolarHBondContact O-CD 3.48Å; T157-R236 WeakPolarHBondContact O-CG 3.41Å; T157-R236 PolarHBondContact O-NH1 2.86Å; T157-D239 HydrophobicContact CG2-CB 3.81Å; T157-F240 HydrophobicContact CG2-CB 4.34Å; T157-K243 HydrophobicContact CG2-CD 4.06Å; T157-R270 PolarHBondContact O-NH1 3.09Å; T157-R270 PolarHBondContact OG1-NH2 3.02Å; T157-R270 VanDerWaalsContact OG1-NH2 3.15Å
158	N	84.6	Confident	81.8	Confident	20 Å²	20	61.5 Å²	61.5	11%	0.107	30%	0.303	C	S	.	.	S	Bend	trans	-83.7	132.1	178.3	-155.5	24.2	0	0	0	110.3	H154 Q160 R274	H154-N158 PolarHBondContact CE1-ND2 3.26Å; H154-N158 VanDerWaalsContact CE1-ND2 3.25Å; H154-N158 PolarHBondContact NE2-ND2 2.92Å; H154-N158 VanDerWaalsContact NE2-ND2 3.2Å; H154-N158 WeakPolarHBondContact O-CB 3.32Å; H154-N158 PolarHBondContact O-N 3.47Å; N158-Q160 PolarHBondContact O-N 3.38Å; N158-Q160 VanDerWaalsContact O-N 3.13Å; N158-R274 PolarHBondContact ND2-NH2 3.26Å; N158-R274 PolarHBondContact OD1-NH1 3.02Å; N158-R274 PolarHBondContact OD1-NH2 2.9Å
159	A	70.1	Confident	80.9	Confident	12 Å²	12	63 Å²	63	10%	0.099	31%	0.313	C	S	.	.	S	Bend	trans	-68	115.4	179	0	0	0	0	0	111	G161 R274 N285	A159-G161 PolarHBondContact O-N 3.35Å; A159-R274 PolarHBondContact O-NH2 3.24Å; A159-N285 WeakPolarHBondContact CB-O 3.49Å
160	Q	65	Low	80	Confident	60 Å²	60	65.6 Å²	65.6	28%	0.28	32%	0.322	S	S	.	.	S	Bend	trans	68.3	13	166.5	-60.6	-162.8	-13.4	0	0	120.3	N158 H163 G286 E287	N158-Q160 PolarHBondContact O-N 3.38Å; N158-Q160 VanDerWaalsContact O-N 3.13Å; Q160-H163 PolarHBondContact O-N 3.13Å; Q160-G286 PolarHBondContact OE1-O 3.28Å; Q160-G286 VanDerWaalsContact OE1-O 3.07Å; Q160-E287 PolarHBondContact NE2-OE1 2.72Å
161	G	63.7	Low	79	Confident	32 Å²	32	67.1 Å²	67.1	33%	0.33	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	48.5	-147.6	169.3	0	0	0	0	0	115.1	A159 H163	A159-G161 PolarHBondContact O-N 3.35Å; G161-H163 PolarHBondContact O-N 3.48Å; G161-H163 VanDerWaalsContact O-N 3.13Å
162	N	59.3	Low	77.4	Confident	127 Å²	127	71.7 Å²	71.7	68%	0.679	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-70.2	-4.6	-174.7	-69.5	-29	0	0	0	115.7
163	H	62.6	Low	75.2	Confident	110 Å²	110	71.7 Å²	71.7	51%	0.509	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-100.5	8.5	-177	-66.8	-78.9	0	0	0	114.2	Q160 G161 K165 Q166	Q160-H163 PolarHBondContact O-N 3.13Å; G161-H163 PolarHBondContact O-N 3.48Å; G161-H163 VanDerWaalsContact O-N 3.13Å; H163-K165 PolarHBondContact O-N 3.41Å; H163-K165 VanDerWaalsContact O-N 3.11Å; H163-Q166 PolarHBondContact ND1-OE1 3.45Å; H163-Q166 PolarHBondContact O-N 3.32Å
164	W	67.3	Low	72.7	Confident	30 Å²	30	78.6 Å²	78.6	11%	0.114	39%	0.39	C	S	.	.	H	α-helix	trans	-55.2	-32.9	-175.6	68	-94.7	0	0	0	113.6	Q166 K167 R168 R274 D276 T283	W164-Q166 VanDerWaalsContact C-N 3.25Å; W164-Q166 PolarHBondContact O-N 3.27Å; W164-K167 PolarHBondContact O-N 3.21Å; W164-R168 PolarHBondContact O-N 2.9Å; W164-R274 HydrophobicContact CD2-CB 4.18Å; W164-R274 HydrophobicContact CD2-CG 4.17Å; W164-R274 HydrophobicContact CE3-CB 4.26Å; W164-R274 HydrophobicContact CG-CG 4.31Å; W164-R274 HydrophobicContact CH2-CB 4.22Å; W164-R274 VanDerWaalsContact CH2-O 3.23Å; W164-R274 WeakPolarHBondContact CH2-O 3.41Å; W164-R274 HydrophobicContact CZ2-CB 4.16Å; W164-R274 HydrophobicContact CZ3-CB 4.29Å; W164-R274 WeakPolarHBondContact CZ3-O 3.44Å; W164-D276 HydrophobicContact CH2-CB 3.99Å; W164-D276 HydrophobicContact CZ3-CB 4.4Å; W164-T283 HydrophobicContact CE3-CG2 4.16Å; W164-T283 VanDerWaalsContact CE3-OG1 3.27Å; W164-T283 WeakPolarHBondContact CZ3-OG1 3.46Å
165	K	68.5	Low	70.2	Confident	99 Å²	99	82.3 Å²	82.3	43%	0.43	42%	0.42	S	S	.	.	H	α-helix	trans	-63.4	-27.9	177.5	-68	-161.5	179.8	-155.5	0	113.7	H163 D276	H163-K165 PolarHBondContact O-N 3.41Å; H163-K165 VanDerWaalsContact O-N 3.11Å; K165-D276 IonicContact NZ-OD1 3Å; K165-D276 PolarHBondContact NZ-OD1 2.88Å
166	Q	67.4	Low	67.7	Low	151 Å²	151	83.8 Å²	83.8	71%	0.706	43%	0.428	S	S	*	.	H	α-helix	trans	-89.4	-17.9	-172.9	-66.9	167.6	-10.3	0	0	113.3	H163 W164	H163-Q166 PolarHBondContact ND1-OE1 3.45Å; H163-Q166 PolarHBondContact O-N 3.32Å; W164-Q166 VanDerWaalsContact C-N 3.25Å; W164-Q166 PolarHBondContact O-N 3.27Å
167	K	65.8	Low	65.1	Low	130 Å²	130	86.5 Å²	86.5	57%	0.565	44%	0.436	S	S	*	.	H	α-helix	trans	-116.2	3.7	-173	-67.8	-173.3	178.8	-177.4	0	114.2	W164	W164-K167 PolarHBondContact O-N 3.21Å
168	R	75.8	Confident	62.5	Low	49 Å²	49	91.6 Å²	91.6	19%	0.185	46%	0.462	C	S	.	.			trans	-74.9	139.6	-178.9	72.4	-173.5	-178.5	172.8	-6.5	112.3	W164 D276 S279 T281 T283 E287 A289	W164-R168 PolarHBondContact O-N 2.9Å; R168-D276 IonicContact CZ-OD2 3.4Å; R168-D276 VanDerWaalsContact NH1-CB 3.28Å; R168-D276 IonicContact NH1-OD2 2.88Å; R168-D276 PolarHBondContact NH1-OD2 3.47Å; R168-D276 IonicContact NH2-OD2 3.42Å; R168-D276 PolarHBondContact NH2-OD2 3.26Å; R168-S279 PolarHBondContact NH1-OG 3.3Å; R168-S279 VanDerWaalsContact NH1-OG 3.07Å; R168-S279 PolarHBondContact NH2-OG 3.14Å; R168-T281 PolarHBondContact NH1-OG1 3.44Å; R168-T283 HydrophobicContact CB-CG2 4.08Å; R168-E287 CarbonylContact C-O 3.6Å; R168-E287 VanDerWaalsContact CA-O 3.3Å; R168-E287 WeakPolarHBondContact CA-O 3.16Å; R168-A289 HydrophobicContact CB-CB 4.21Å; R168-A289 HydrophobicContact CG-CB 4.19Å
169	K	79.5	Confident	60.5	Low	147 Å²	147	96.2 Å²	96.2	64%	0.639	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	129	171.7	-61.7	175.6	-175.8	169.2	0	107.3	E287 A289	K169-E287 PolarHBondContact N-O 2.83Å; K169-A289 PolarHBondContact O-N 3.44Å
170	F	80.8	Confident	59.1	Low	107 Å²	107	102.4 Å²	102.4	47%	0.469	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	135.5	173.5	-69.9	-92.3	0	0	0	108.9	V172 T281 A289	F170-V172 PolarHBondContact O-N 3.23Å; F170-V172 VanDerWaalsContact O-N 3.08Å; F170-T281 HydrophobicContact CD1-CG2 4.33Å; F170-T281 HydrophobicContact CE1-CG2 3.89Å; F170-A289 HydrophobicContact CD1-CB 3.89Å; F170-A289 HydrophobicContact CE1-CB 4.06Å; F170-A289 HydrophobicContact CG-CB 4.23Å
171	L	76.2	Confident	58.1	Low	32 Å²	32	103.5 Å²	103.5	17%	0.168	52%	0.521	C	S	.	.			trans	-64.8	110.3	167.6	-172.1	64.1	0	0	0	106.7	Q225 F226 M288 A289 V290 Q294	L171-Q225 HydrophobicContact CD1-CB 4.34Å; L171-Q225 HydrophobicContact CD1-CG 4.29Å; L171-F226 HydrophobicContact CD2-CE1 4.34Å; L171-F226 HydrophobicContact CD2-CZ 4Å; L171-M288 HydrophobicContact CB-CG 4.33Å; L171-M288 HydrophobicContact CD1-SD 3.92Å; L171-M288 HydrophobicContact CD2-SD 4.47Å; L171-A289 PolarHBondContact N-O 3.46Å; L171-V290 HydrophobicContact CB-CG1 4.1Å; L171-V290 HydrophobicContact CD2-CG1 4.1Å; L171-Q294 HydrophobicContact CD2-CB 4.4Å; L171-Q294 PolarHBondContact O-NE2 3.3Å
172	V	65.5	Low	57.1	Low	111 Å²	111	104.7 Å²	104.7	67%	0.673	52%	0.522	S	S	*	.			trans	-85.3	127.1	-179.6	-177.2	0	0	0	0	107.8	F170 E174	F170-V172 PolarHBondContact O-N 3.23Å; F170-V172 VanDerWaalsContact O-N 3.08Å; V172-E174 PolarHBondContact O-N 3.39Å
173	E	51.5	Low	56.2	Low	101 Å²	101	102.4 Å²	102.4	47%	0.472	52%	0.515	S	S	.	.			trans	-70.6	102.6	161.7	-74.2	175.2	-175	0	0	107.4	A175	E173-A175 PolarHBondContact O-N 3.02Å
174	E	45.2	Very low	55.1	Low	148 Å²	148	102.4 Å²	102.4	69%	0.692	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	0.8	168.8	-82	-172.4	164.2	0	0	112.5	V172	V172-E174 PolarHBondContact O-N 3.39Å
175	A	44.2	Very low	53.8	Low	78 Å²	78	106.5 Å²	106.5	65%	0.645	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-10.3	179.5	0	0	0	0	0	115.8	E173	E173-A175 PolarHBondContact O-N 3.02Å
176	M	39.9	Very low	52.3	Low	138 Å²	138	109.9 Å²	109.9	68%	0.68	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	-19.7	-179.7	-78.1	-162.2	154.8	0	0	115.7
177	L	40.8	Very low	50.6	Low	127 Å²	127	112.9 Å²	112.9	67%	0.665	56%	0.563	S	S	*	*	H	α-helix	trans	-84.3	-27.7	179.2	-125.7	89.6	0	0	0	113.5	I181	L177-I181 HydrophobicContact CD2-CD1 4.2Å; L177-I181 WeakPolarHBondContact O-CB 3.45Å; L177-I181 WeakPolarHBondContact O-CD1 3.36Å; L177-I181 WeakPolarHBondContact O-CG1 3.41Å; L177-I181 PolarHBondContact O-N 2.83Å
178	L	40.2	Very low	49.1	Very low	115 Å²	115	112.3 Å²	112.3	60%	0.602	57%	0.571	S	S	*	*	H	α-helix	trans	-76.2	-27.1	177.9	-92.6	154.7	0	0	0	112.2	T182	L178-T182 WeakPolarHBondContact O-CB 3.2Å; L178-T182 PolarHBondContact O-N 3.44Å; L178-T182 PolarHBondContact O-OG1 3.23Å
179	N	40.8	Very low	47.1	Very low	116 Å²	116	114.2 Å²	114.2	62%	0.62	59%	0.592	S	S	*	*	H	α-helix	trans	-78.6	-29.9	-179.1	-127.1	12.1	0	0	0	113.3	C183	N179-C183 VanDerWaalsContact O-CB 3.23Å; N179-C183 WeakPolarHBondContact O-CB 3.49Å; N179-C183 PolarHBondContact O-N 3.16Å; N179-C183 VanDerWaalsContact O-N 3.08Å; N179-C183 PolarHBondContact O-SG 3.35Å; N179-C183 VanDerWaalsContact O-SG 3.41Å
180	E	41.2	Very low	44.9	Very low	142 Å²	142	114.9 Å²	114.9	66%	0.664	60%	0.602	S	S	*	*	H	α-helix	trans	-75.5	-35.9	170.4	-97	-175.9	163.6	0	0	112.6	N184	E180-N184 VanDerWaalsContact O-CB 3.28Å; E180-N184 WeakPolarHBondContact O-CB 3.42Å; E180-N184 PolarHBondContact O-N 3.05Å; E180-N184 VanDerWaalsContact O-N 3.11Å; E180-N184 PolarHBondContact O-ND2 3.47Å; E180-N184 VanDerWaalsContact O-ND2 3.1Å
181	I	44.6	Very low	42.5	Very low	84 Å²	84	119.2 Å²	119.2	43%	0.431	62%	0.624	S	S	.	*	H	α-helix	trans	-72.7	-40.8	177.3	-66.5	173	0	0	0	110	L177 N184 L185	L177-I181 HydrophobicContact CD2-CD1 4.2Å; L177-I181 WeakPolarHBondContact O-CB 3.45Å; L177-I181 WeakPolarHBondContact O-CD1 3.36Å; L177-I181 WeakPolarHBondContact O-CG1 3.41Å; L177-I181 PolarHBondContact O-N 2.83Å; I181-N184 PolarHBondContact O-N 3.19Å; I181-L185 HydrophobicContact CG2-CD1 3.38Å; I181-L185 WeakPolarHBondContact O-CB 3.5Å; I181-L185 VanDerWaalsContact O-CD1 3.31Å; I181-L185 WeakPolarHBondContact O-CD1 3.33Å; I181-L185 PolarHBondContact O-N 2.82Å
182	T	42.6	Very low	40.2	Very low	57 Å²	57	123 Å²	123	35%	0.35	65%	0.653	S	S	.	*	H	α-helix	trans	-73.1	-37.2	179.9	-42.3	0	0	0	0	111.6	L178 N184 L185 F186	L178-T182 WeakPolarHBondContact O-CB 3.2Å; L178-T182 PolarHBondContact O-N 3.44Å; L178-T182 PolarHBondContact O-OG1 3.23Å; T182-N184 VanDerWaalsContact C-N 3.34Å; T182-N184 PolarHBondContact O-N 3.16Å; T182-L185 PolarHBondContact O-N 3.12Å; T182-F186 HydrophobicContact CG2-CD2 3.94Å; T182-F186 HydrophobicContact CG2-CE2 3.82Å; T182-F186 WeakPolarHBondContact O-CD2 3.48Å; T182-F186 PolarHBondContact O-N 3.31Å
183	C	39.6	Very low	38.6	Very low	79 Å²	79	122.9 Å²	122.9	53%	0.534	66%	0.664	S	S	.	*	H	α-helix	trans	-66.6	-32.6	172.1	-79	0	0	0	0	113	N179	N179-C183 VanDerWaalsContact O-CB 3.23Å; N179-C183 WeakPolarHBondContact O-CB 3.49Å; N179-C183 PolarHBondContact O-N 3.16Å; N179-C183 VanDerWaalsContact O-N 3.08Å; N179-C183 PolarHBondContact O-SG 3.35Å; N179-C183 VanDerWaalsContact O-SG 3.41Å
184	N	39.8	Very low	37.5	Very low	109 Å²	109	123.2 Å²	123.2	58%	0.583	68%	0.684	S	S	*	*	H	α-helix	trans	-82.2	-21.4	177	-75.6	-32.7	0	0	0	114.1	E180 I181 T182 T188	E180-N184 VanDerWaalsContact O-CB 3.28Å; E180-N184 WeakPolarHBondContact O-CB 3.42Å; E180-N184 PolarHBondContact O-N 3.05Å; E180-N184 VanDerWaalsContact O-N 3.11Å; E180-N184 PolarHBondContact O-ND2 3.47Å; E180-N184 VanDerWaalsContact O-ND2 3.1Å; I181-N184 PolarHBondContact O-N 3.19Å; T182-N184 VanDerWaalsContact C-N 3.34Å; T182-N184 PolarHBondContact O-N 3.16Å; N184-T188 PolarHBondContact O-OG1 3.05Å
185	L	39.6	Very low	36.7	Very low	116 Å²	116	119.9 Å²	119.9	61%	0.607	69%	0.689	S	S	*	*	H	α-helix	trans	-84.4	-17.2	175.2	-94.7	131.2	0	0	0	114.2	I181 T182	I181-L185 HydrophobicContact CG2-CD1 3.38Å; I181-L185 WeakPolarHBondContact O-CB 3.5Å; I181-L185 VanDerWaalsContact O-CD1 3.31Å; I181-L185 WeakPolarHBondContact O-CD1 3.33Å; I181-L185 PolarHBondContact O-N 2.82Å; T182-L185 PolarHBondContact O-N 3.12Å
186	F	36.6	Very low	36	Very low	170 Å²	170	122.6 Å²	122.6	75%	0.746	70%	0.697	S	S	*	*	S	Bend	trans	-94.2	-8	171.6	-80.6	-79.4	0	0	0	114.3	T182	T182-F186 HydrophobicContact CG2-CD2 3.94Å; T182-F186 HydrophobicContact CG2-CE2 3.82Å; T182-F186 WeakPolarHBondContact O-CD2 3.48Å; T182-F186 PolarHBondContact O-N 3.31Å
187	Y	32.9	Very low	35.4	Very low	215 Å²	215	125.6 Å²	125.6	84%	0.843	71%	0.707	S	S	*	*	S	Bend	trans	-104.9	4.2	179.2	-113.6	-90.3	0	0	0	115.1
188	T	33.7	Very low	34.8	Very low	117 Å²	117	126.5 Å²	126.5	72%	0.718	71%	0.712	S	S	*	*	S	Bend	trans	-117.8	14	-177.5	48.4	0	0	0	0	114.9	N184	N184-T188 PolarHBondContact O-OG1 3.05Å
189	S	35	Very low	34.1	Very low	90 Å²	90	128.2 Å²	128.2	63%	0.629	73%	0.728	S	S	*	*	S	Bend	trans	-126.8	63.7	172.4	72	0	0	0	0	112.5
190	D	32.3	Very low	33.5	Very low	160 Å²	160	132.4 Å²	132.4	86%	0.856	74%	0.74	S	S	*	*			trans	-171.5	82.5	148.4	-101.7	-18.4	0	0	0	110.8
191	Q	31.2	Very low	33.2	Very low	198 Å²	198	131 Å²	131	93%	0.925	74%	0.744	S	S	*	*			trans	-130.8	82.4	156.6	-86.4	-171.2	7.5	0	0	109.2
192	S	28.3	Very low	32.3	Very low	112 Å²	112	136.8 Å²	136.8	78%	0.783	77%	0.769	S	S	*	*			trans	-157.8	90.7	147.3	62.3	0	0	0	0	110.9
193	A	30.2	Very low	31.5	Very low	108 Å²	108	141.7 Å²	141.7	89%	0.893	79%	0.793	S	S	*	*			trans	175.3	136.6	130.2	0	0	0	0	0	112.3
194	A	28.6	Very low	30.7	Very low	109 Å²	109	144 Å²	144	90%	0.901	81%	0.808	S	S	*	*			trans	-52.1	149.9	178.7	0	0	0	0	0	116.1
195	G	28.9	Very low	30.5	Very low	78 Å²	78	141.7 Å²	141.7	80%	0.804	81%	0.81	S	S	*	*			trans	169.1	88.6	161.1	0	0	0	0	0	114.6
196	V	29.3	Very low	29.9	Very low	134 Å²	134	145.2 Å²	145.2	81%	0.812	82%	0.824	S	S	*	*			trans	-60.9	135.7	173.6	172.1	0	0	0	0	112
197	K	28.2	Very low	29.5	Very low	201 Å²	201	141.8 Å²	141.8	87%	0.874	83%	0.827	S	S	*	*			trans	-171.4	136.5	132.1	-102.9	170.1	-171.8	-175.4	0	113.4
198	D	27.1	Very low	29.1	Very low	146 Å²	146	137.2 Å²	137.2	78%	0.781	83%	0.826	S	S	*	*			trans	-58.1	143.6	-179.7	-64.9	-77	0	0	0	115.8
199	T	26.6	Very low	29.1	Very low	151 Å²	151	139.3 Å²	139.3	93%	0.926	83%	0.83	S	S	*	*				-172.2	149	123.4	15.5	0	0	0	0	112.4
200	K	28.3	Very low	28.8	Very low	205 Å²	205	141 Å²	141	89%	0.891	84%	0.836	S	S	*	*			trans	-81.3	170.6	-170.7	-99.8	-176	-177.8	179.9	0	113.7
201	P	34.4	Very low	28.6	Very low	113 Å²	113	140.7 Å²	140.7	73%	0.734	83%	0.834	S	S	*	*			trans	-93.6	145.3	-159.3	36.7	-31.5	0	0	0	113.1
202	E	25.9	Very low	28.7	Very low	205 Å²	205	136.5 Å²	136.5	96%	0.958	83%	0.834	S	S	*	*			trans	-141.4	146.7	158.7	-75.1	-163.8	158.3	0	0	112.1
203	D	25.8	Very low	29	Very low	160 Å²	160	135.3 Å²	135.3	86%	0.856	83%	0.831	S	S	*	*			trans	-69.1	141.7	-168.4	-170.8	18.6	0	0	0	113.7
204	C	22.8	Very low	29.5	Very low	126 Å²	126	138.4 Å²	138.4	85%	0.851	83%	0.827	S	S	*	*			trans	-172.4	119.4	139.2	-153.9	0	0	0	0	110.9
205	G	34.1	Very low	30.4	Very low	61 Å²	61	142.6 Å²	142.6	63%	0.629	83%	0.828	S	S	*	*			trans	-58	141.7	176.4	0	0	0	0	0	114.4
206	Q	27.3	Very low	31.7	Very low	191 Å²	191	145.9 Å²	145.9	89%	0.893	83%	0.827	S	S	*	*			trans	-145.4	97.7	145.4	-115.7	146.5	-0.2	0	0	108.1	S208	Q206-S208 PolarHBondContact O-N 2.97Å
207	A	28.4	Very low	34	Very low	98 Å²	98	147.2 Å²	147.2	81%	0.81	82%	0.822	S	S	*	*			trans	-56.3	106.1	158.8	0	0	0	0	0	107.3	M209	A207-M209 PolarHBondContact O-N 3.49Å; A207-M209 VanDerWaalsContact O-N 3.13Å
208	S	25.4	Very low	36.8	Very low	119 Å²	119	138 Å²	138	83%	0.832	78%	0.783	S	S	*	*			trans	-73.5	102.4	164.1	-161	0	0	0	0	106.8	Q206	Q206-S208 PolarHBondContact O-N 2.97Å
209	M	32.8	Very low	39.8	Very low	161 Å²	161	134.4 Å²	134.4	79%	0.793	76%	0.763	S	S	*	*			trans	-61.2	171.2	153.8	-67.3	-159	-166.7	0	0	109.7	A207	A207-M209 PolarHBondContact O-N 3.49Å; A207-M209 VanDerWaalsContact O-N 3.13Å
210	V	28.2	Very low	42.8	Very low	126 Å²	126	130.1 Å²	130.1	76%	0.764	73%	0.734	S	S	*	*			trans	85.6	102.5	177.2	-147.8	0	0	0	0	111.5
211	N	28.2	Very low	45.7	Very low	152 Å²	152	125.9 Å²	125.9	81%	0.813	72%	0.717	S	S	*	*			cis	-138.5	115.7	47.8	-66.2	-67.3	0	0	0	112.8
212	A	33.6	Very low	48.3	Very low	110 Å²	110	120.9 Å²	120.9	91%	0.909	69%	0.685	S	S	*	*			trans	-112.8	76.8	159.6	0	0	0	0	0	107
213	A	35.5	Very low	51.4	Low	88 Å²	88	111.5 Å²	111.5	73%	0.727	64%	0.642	S	S	*	*			trans	-161.8	58.4	178	0	0	0	0	0	110.8
214	E	40.7	Very low	54.4	Low	173 Å²	173	105.4 Å²	105.4	81%	0.808	61%	0.611	S	S	*	*			trans	-151.8	24.7	173.8	-121.5	171.5	-165.2	0	0	113.9	N216	E214-N216 VanDerWaalsContact C-N 3.34Å; E214-N216 PolarHBondContact O-N 3.06Å
215	E	48	Very low	57.6	Low	196 Å²	196	102.4 Å²	102.4	92%	0.916	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	3.9	-170.6	-87.3	-175.3	159.9	0	0	116.6
216	N	55.4	Low	60.4	Low	147 Å²	147	100.3 Å²	100.3	79%	0.786	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.4	12.8	-172.5	-87.2	-31.7	0	0	0	115.9	E214	E214-N216 VanDerWaalsContact C-N 3.34Å; E214-N216 PolarHBondContact O-N 3.06Å
217	K	77.4	Confident	63.3	Low	162 Å²	162	92 Å²	92	70%	0.704	52%	0.521	S	S	*	.			trans	-90.3	130	177.6	-160.6	174.6	-178.8	-177	0	110.3	D219	K217-D219 PolarHBondContact O-N 2.88Å
218	V	86.3	Confident	66.2	Low	9 Å²	9	93.1 Å²	93.1	6%	0.055	51%	0.507	C	S	.	.			trans	-62.2	130.7	173.6	176	0	0	0	0	109.3	I220 F223 N297 R392 E399 C400	V218-I220 HydrophobicContact CG1-CD1 4.5Å; V218-I220 PolarHBondContact O-N 3.36Å; V218-I220 VanDerWaalsContact O-N 3.12Å; V218-F223 HydrophobicContact CG1-CB 3.82Å; V218-F223 HydrophobicContact CG1-CD2 4.32Å; V218-F223 HydrophobicContact CG1-CG 4.19Å; V218-N297 WeakPolarHBondContact CA-O 3.49Å; V218-N297 WeakPolarHBondContact CG1-O 3.31Å; V218-R392 VanDerWaalsContact CG2-NH2 3.28Å; V218-E399 HydrophobicContact CG2-CB 4.09Å; V218-E399 WeakPolarHBondContact CG2-OE2 3.5Å; V218-C400 VanDerWaalsContact CG1-SG 3.6Å
219	D	90.9	Very high	69.3	Low	69 Å²	69	89 Å²	89	37%	0.369	48%	0.475	S	S	.	.			trans	-68.9	105.6	167.3	179.2	-13.7	0	0	0	108.2	K217 E221 A222 F223 N297	K217-D219 PolarHBondContact O-N 2.88Å; D219-E221 VanDerWaalsContact C-N 3.27Å; D219-E221 PolarHBondContact O-N 3.43Å; D219-E221 PolarHBondContact OD1-N 3.48Å; D219-A222 HydrophobicContact CB-CB 3.91Å; D219-A222 PolarHBondContact O-N 3.4Å; D219-A222 PolarHBondContact OD1-N 3.18Å; D219-A222 VanDerWaalsContact OD1-N 3.13Å; D219-F223 VanDerWaalsContact O-CB 3.28Å; D219-F223 WeakPolarHBondContact O-CB 3.2Å; D219-F223 PolarHBondContact O-N 3.01Å; D219-N297 HydrophobicContact CB-CB 4.22Å; D219-N297 PolarHBondContact N-O 3.41Å
220	I	90.1	Very high	72.2	Confident	61 Å²	61	83.1 Å²	83.1	31%	0.313	45%	0.447	S	S	.	.	H	α-helix	trans	-66	-31.2	-175	-58.7	-57.2	0	0	0	111.6	V218 S224 L404	V218-I220 HydrophobicContact CG1-CD1 4.5Å; V218-I220 PolarHBondContact O-N 3.36Å; V218-I220 VanDerWaalsContact O-N 3.12Å; I220-S224 VanDerWaalsContact O-CB 3.31Å; I220-S224 WeakPolarHBondContact O-CB 3.38Å; I220-S224 PolarHBondContact O-N 2.95Å; I220-L404 HydrophobicContact CG2-CD1 3.72Å
221	E	88.3	Confident	75.2	Confident	116 Å²	116	79.2 Å²	79.2	54%	0.542	42%	0.423	S	S	.	.	H	α-helix	trans	-72.4	-48.4	178	-177.3	168.4	-165.8	0	0	110.4	D219 F223 S224 Q225	D219-E221 VanDerWaalsContact C-N 3.27Å; D219-E221 PolarHBondContact O-N 3.43Å; D219-E221 PolarHBondContact OD1-N 3.48Å; E221-F223 VanDerWaalsContact C-N 3.32Å; E221-F223 PolarHBondContact O-N 2.98Å; E221-S224 WeakPolarHBondContact O-CB 3.48Å; E221-S224 PolarHBondContact O-N 3.43Å; E221-S224 VanDerWaalsContact O-N 3.17Å; E221-Q225 WeakPolarHBondContact O-CG 3.47Å; E221-Q225 PolarHBondContact O-N 2.98Å
222	A	88.6	Confident	78.3	Confident	8 Å²	8	74.5 Å²	74.5	7%	0.066	40%	0.401	C	S	.	.	H	α-helix	trans	-58.3	-44.9	173.7	0	0	0	0	0	111.3	D219 S224 Q225 F226	D219-A222 HydrophobicContact CB-CB 3.91Å; D219-A222 PolarHBondContact O-N 3.4Å; D219-A222 PolarHBondContact OD1-N 3.18Å; D219-A222 VanDerWaalsContact OD1-N 3.13Å; A222-S224 VanDerWaalsContact C-N 3.35Å; A222-S224 PolarHBondContact O-N 2.93Å; A222-Q225 PolarHBondContact O-N 2.95Å; A222-Q225 VanDerWaalsContact O-N 3.16Å; A222-F226 HydrophobicContact CB-CE2 4.21Å; A222-F226 WeakPolarHBondContact O-CD2 3.36Å; A222-F226 WeakPolarHBondContact O-CG 3.45Å; A222-F226 PolarHBondContact O-N 2.79Å
223	F	91.9	Very high	81.2	Confident	9 Å²	9	70 Å²	70	4%	0.039	36%	0.364	C	S	.	.	H	α-helix	trans	-57.9	-45.2	175.1	-176.4	-105.9	0	0	0	111.7	V218 D219 E221 Q225 F226 T227 G298 M396 C400 L404 F405	V218-F223 HydrophobicContact CG1-CB 3.82Å; V218-F223 HydrophobicContact CG1-CD2 4.32Å; V218-F223 HydrophobicContact CG1-CG 4.19Å; D219-F223 VanDerWaalsContact O-CB 3.28Å; D219-F223 WeakPolarHBondContact O-CB 3.2Å; D219-F223 PolarHBondContact O-N 3.01Å; E221-F223 VanDerWaalsContact C-N 3.32Å; E221-F223 PolarHBondContact O-N 2.98Å; F223-Q225 VanDerWaalsContact C-N 3.31Å; F223-Q225 PolarHBondContact O-N 2.95Å; F223-F226 PolarHBondContact O-N 3.14Å; F223-F226 VanDerWaalsContact O-N 3.13Å; F223-T227 HydrophobicContact CD1-CG2 4.09Å; F223-T227 HydrophobicContact CE1-CG2 3.75Å; F223-T227 HydrophobicContact CE2-CG2 4.23Å; F223-T227 HydrophobicContact CG-CG2 4.47Å; F223-T227 HydrophobicContact CZ-CG2 3.81Å; F223-T227 WeakPolarHBondContact O-CG2 3.49Å; F223-T227 PolarHBondContact O-N 2.91Å; F223-T227 PolarHBondContact O-OG1 3.17Å; F223-G298 WeakPolarHBondContact CD2-O 3.13Å; F223-M396 HydrophobicContact CE2-SD 4.11Å; F223-C400 HydrophobicContact CD1-CB 4.1Å; F223-C400 HydrophobicContact CE1-CB 3.72Å; F223-C400 HydrophobicContact CZ-CB 4.1Å; F223-L404 HydrophobicContact CD1-CB 4.1Å; F223-L404 HydrophobicContact CD1-CD1 3.93Å; F223-L404 HydrophobicContact CE1-CB 3.75Å; F223-L404 HydrophobicContact CE1-CD1 4.32Å; F223-F405 HydrophobicContact CE1-CE2 4.23Å; F223-F405 HydrophobicContact CE1-CZ 4.23Å; F223-F405 HydrophobicContact CE2-CE1 4.49Å; F223-F405 HydrophobicContact CZ-CD1 4.13Å; F223-F405 HydrophobicContact CZ-CD2 4.49Å; F223-F405 AromaticContact CZ-CE1 3.68Å; F223-F405 HydrophobicContact CZ-CE1 3.68Å; F223-F405 HydrophobicContact CZ-CE2 4.09Å; F223-F405 AromaticContact CZ-CZ 3.65Å; F223-F405 HydrophobicContact CZ-CZ 3.65Å
224	S	89.7	Confident	84.1	Confident	31 Å²	31	65.9 Å²	65.9	22%	0.217	33%	0.33	C	S	.	.	H	α-helix	trans	-61.4	-35.5	176.2	-175	0	0	0	0	113	I220 E221 A222 T227 K228	I220-S224 VanDerWaalsContact O-CB 3.31Å; I220-S224 WeakPolarHBondContact O-CB 3.38Å; I220-S224 PolarHBondContact O-N 2.95Å; E221-S224 WeakPolarHBondContact O-CB 3.48Å; E221-S224 PolarHBondContact O-N 3.43Å; E221-S224 VanDerWaalsContact O-N 3.17Å; A222-S224 VanDerWaalsContact C-N 3.35Å; A222-S224 PolarHBondContact O-N 2.93Å; S224-T227 PolarHBondContact O-OG1 3.39Å; S224-K228 WeakPolarHBondContact O-CG 3.47Å; S224-K228 PolarHBondContact O-N 3Å
225	Q	89.8	Confident	86.8	Confident	64 Å²	64	60.3 Å²	60.3	30%	0.299	31%	0.308	S	S	.	.	H	α-helix	trans	-70.5	-37.8	173.9	-60.3	-59.9	-16.5	0	0	111.7	L171 E221 A222 F223 K228	L171-Q225 HydrophobicContact CD1-CB 4.34Å; L171-Q225 HydrophobicContact CD1-CG 4.29Å; E221-Q225 WeakPolarHBondContact O-CG 3.47Å; E221-Q225 PolarHBondContact O-N 2.98Å; A222-Q225 PolarHBondContact O-N 2.95Å; A222-Q225 VanDerWaalsContact O-N 3.16Å; F223-Q225 VanDerWaalsContact C-N 3.31Å; F223-Q225 PolarHBondContact O-N 2.95Å; Q225-K228 PolarHBondContact O-N 3.2Å
226	F	91.4	Very high	89.1	Confident	17 Å²	17	53 Å²	53	8%	0.075	27%	0.272	C	S	.	.	H	α-helix	trans	-66.7	-39.1	176.3	-66.7	-45.1	0	0	0	113	L171 A222 F223 K228 I229 I230 L284 M288 V290 Q294 L295 G298	L171-F226 HydrophobicContact CD2-CE1 4.34Å; L171-F226 HydrophobicContact CD2-CZ 4Å; A222-F226 HydrophobicContact CB-CE2 4.21Å; A222-F226 WeakPolarHBondContact O-CD2 3.36Å; A222-F226 WeakPolarHBondContact O-CG 3.45Å; A222-F226 PolarHBondContact O-N 2.79Å; F223-F226 PolarHBondContact O-N 3.14Å; F223-F226 VanDerWaalsContact O-N 3.13Å; F226-K228 PolarHBondContact O-N 3.2Å; F226-I229 WeakPolarHBondContact O-CG1 3.43Å; F226-I229 PolarHBondContact O-N 2.86Å; F226-I229 VanDerWaalsContact O-N 3.09Å; F226-I230 PolarHBondContact O-N 3.13Å; F226-I230 VanDerWaalsContact O-N 3.08Å; F226-L284 HydrophobicContact CD1-CD1 4.01Å; F226-L284 HydrophobicContact CE1-CD1 3.76Å; F226-M288 HydrophobicContact CD1-CE 3.51Å; F226-M288 HydrophobicContact CE1-CE 3.57Å; F226-M288 HydrophobicContact CE1-SD 4.38Å; F226-V290 HydrophobicContact CE1-CG1 3.82Å; F226-V290 HydrophobicContact CZ-CG1 4.06Å; F226-Q294 WeakPolarHBondContact CE2-O 3.24Å; F226-L295 HydrophobicContact CE1-CD1 4.25Å; F226-L295 HydrophobicContact CE2-CD1 4.32Å; F226-L295 HydrophobicContact CZ-CD1 4.05Å; F226-G298 WeakPolarHBondContact CD2-O 3.38Å
227	T	89.4	Confident	91.1	Very high	16 Å²	16	46 Å²	46	10%	0.098	24%	0.235	C	C	.	.	H	α-helix	trans	-65	-28.5	178.2	59.4	0	0	0	0	112.5	F223 S224 I229 I230 L404 P406	F223-T227 HydrophobicContact CD1-CG2 4.09Å; F223-T227 HydrophobicContact CE1-CG2 3.75Å; F223-T227 HydrophobicContact CE2-CG2 4.23Å; F223-T227 HydrophobicContact CG-CG2 4.47Å; F223-T227 HydrophobicContact CZ-CG2 3.81Å; F223-T227 WeakPolarHBondContact O-CG2 3.49Å; F223-T227 PolarHBondContact O-N 2.91Å; F223-T227 PolarHBondContact O-OG1 3.17Å; S224-T227 PolarHBondContact O-OG1 3.39Å; T227-I229 VanDerWaalsContact C-N 3.3Å; T227-I229 PolarHBondContact O-N 3.19Å; T227-I230 WeakPolarHBondContact O-CG2 3.44Å; T227-L404 WeakPolarHBondContact CB-O 3.35Å; T227-L404 VanDerWaalsContact CG2-O 3.23Å; T227-L404 WeakPolarHBondContact CG2-O 3.49Å; T227-L404 PolarHBondContact OG1-O 3.28Å; T227-P406 WeakPolarHBondContact O-CG 3.36Å
228	K	89.3	Confident	92.1	Very high	122 Å²	122	39.9 Å²	39.9	53%	0.53	21%	0.21	S	C	.	.	H	α-helix	trans	-65.7	-30.4	173.6	-67.2	168.9	-163	169.1	0	113.3	S224 Q225 F226	S224-K228 WeakPolarHBondContact O-CG 3.47Å; S224-K228 PolarHBondContact O-N 3Å; Q225-K228 PolarHBondContact O-N 3.2Å; F226-K228 PolarHBondContact O-N 3.2Å
229	I	90.7	Very high	92.7	Very high	31 Å²	31	42.6 Å²	42.6	16%	0.159	23%	0.225	C	C	.	.	H	α-helix	trans	-98.7	-13.8	-177.3	64.9	146.1	0	0	0	113.8	F226 T227 P232 A233 L284 N285 M288	F226-I229 WeakPolarHBondContact O-CG1 3.43Å; F226-I229 PolarHBondContact O-N 2.86Å; F226-I229 VanDerWaalsContact O-N 3.09Å; T227-I229 VanDerWaalsContact C-N 3.3Å; T227-I229 PolarHBondContact O-N 3.19Å; I229-P232 WeakPolarHBondContact O-CD 3.46Å; I229-A233 WeakPolarHBondContact O-CB 3.49Å; I229-A233 PolarHBondContact O-N 3.45Å; I229-L284 HydrophobicContact CD1-CB 3.51Å; I229-L284 HydrophobicContact CD1-CD1 4.01Å; I229-L284 HydrophobicContact CD1-CG 4.43Å; I229-N285 HydrophobicContact CB-CB 3.98Å; I229-N285 HydrophobicContact CD1-CB 4.11Å; I229-N285 HydrophobicContact CG2-CB 4.23Å; I229-M288 HydrophobicContact CD1-CE 3.27Å; I229-M288 HydrophobicContact CG1-CE 3.77Å; I229-M288 HydrophobicContact CG2-CE 4.26Å
230	I	92.1	Very high	93	Very high	38 Å²	38	39.3 Å²	39.3	20%	0.195	21%	0.207	C	C	.	.	H	α-helix	trans	-72.2	-41.5	-175	-154.2	153.4	0	0	0	112.3	F226 T227 A233 I234 P406 F409	F226-I230 PolarHBondContact O-N 3.13Å; F226-I230 VanDerWaalsContact O-N 3.08Å; T227-I230 WeakPolarHBondContact O-CG2 3.44Å; I230-A233 WeakPolarHBondContact O-CA 3.12Å; I230-A233 WeakPolarHBondContact O-CB 3.28Å; I230-A233 PolarHBondContact O-N 3.26Å; I230-I234 HydrophobicContact CG1-CD1 4.37Å; I230-I234 WeakPolarHBondContact O-CG1 3.26Å; I230-I234 PolarHBondContact O-N 3.07Å; I230-P406 HydrophobicContact CG2-CG 3.87Å; I230-F409 HydrophobicContact CD1-CD2 3.35Å; I230-F409 HydrophobicContact CD1-CE2 3.22Å; I230-F409 HydrophobicContact CD1-CG 4.41Å; I230-F409 HydrophobicContact CD1-CZ 4.16Å; I230-F409 HydrophobicContact CG1-CD2 3.78Å; I230-F409 HydrophobicContact CG1-CE2 4.13Å; I230-F409 HydrophobicContact CG2-CB 4.2Å; I230-F409 HydrophobicContact CG2-CD2 4.09Å; I230-F409 HydrophobicContact CG2-CG 4.32Å
231	T	92.9	Very high	93.4	Very high	44 Å²	44	36.4 Å²	36.4	27%	0.27	19%	0.192	S	C	.	.	H	α-helix	trans	-60.1	-50.9	177.6	-61.9	0	0	0	0	111.6	A233 I234 T235 P406 L408	T231-A233 PolarHBondContact O-N 3.13Å; T231-I234 PolarHBondContact O-N 3.28Å; T231-T235 PolarHBondContact O-N 2.87Å; T231-T235 PolarHBondContact O-OG1 3.31Å; T231-T235 VanDerWaalsContact O-OG1 3.06Å; T231-P406 WeakPolarHBondContact OG1-CB 3.32Å; T231-L408 HydrophobicContact CG2-CB 4.38Å; T231-L408 HydrophobicContact CG2-CD2 3.99Å
232	P	93.3	Very high	93.9	Very high	53 Å²	53	36.9 Å²	36.9	34%	0.344	19%	0.192	S	C	.	.	H	α-helix	trans	-56.6	-34.2	171.7	-25.8	32.9	0	0	0	114.1	I229 R236	I229-P232 WeakPolarHBondContact O-CD 3.46Å; P232-R236 WeakPolarHBondContact O-CB 3.35Å; P232-R236 VanDerWaalsContact O-CG 3.27Å; P232-R236 WeakPolarHBondContact O-CG 3.42Å; P232-R236 PolarHBondContact O-N 2.8Å; P232-R236 VanDerWaalsContact O-N 3.12Å; P232-R236 PolarHBondContact O-NE 2.87Å
233	A	94.3	Very high	94.4	Very high	17 Å²	17	41.3 Å²	41.3	14%	0.14	21%	0.21	C	C	.	.	H	α-helix	trans	-68.5	-46.4	177.7	0	0	0	0	0	111.7	I229 I230 T231 R236 V237 M267	I229-A233 WeakPolarHBondContact O-CB 3.49Å; I229-A233 PolarHBondContact O-N 3.45Å; I230-A233 WeakPolarHBondContact O-CA 3.12Å; I230-A233 WeakPolarHBondContact O-CB 3.28Å; I230-A233 PolarHBondContact O-N 3.26Å; T231-A233 PolarHBondContact O-N 3.13Å; A233-R236 PolarHBondContact O-N 3.36Å; A233-V237 WeakPolarHBondContact O-CG2 3.47Å; A233-V237 PolarHBondContact O-N 3.24Å; A233-V237 VanDerWaalsContact O-N 3.15Å; A233-M267 HydrophobicContact CB-CG 4.34Å; A233-M267 HydrophobicContact CB-SD 3.62Å
234	I	96.3	Very high	94.6	Very high	1 Å²	1	41 Å²	41	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-59.4	-49.6	175.5	-65.5	169.1	0	0	0	110.4	I230 T231 R236 V237 V238 M267 L408 F409 V412 F413	I230-I234 HydrophobicContact CG1-CD1 4.37Å; I230-I234 WeakPolarHBondContact O-CG1 3.26Å; I230-I234 PolarHBondContact O-N 3.07Å; T231-I234 PolarHBondContact O-N 3.28Å; I234-R236 PolarHBondContact O-N 2.73Å; I234-V237 WeakPolarHBondContact O-CA 3.4Å; I234-V237 WeakPolarHBondContact O-CB 3.46Å; I234-V237 PolarHBondContact O-N 3.02Å; I234-V238 HydrophobicContact CG2-CG2 4.45Å; I234-V238 PolarHBondContact O-N 3.32Å; I234-M267 HydrophobicContact CG1-CE 4.24Å; I234-M267 HydrophobicContact CG1-SD 4.08Å; I234-L408 HydrophobicContact CB-CD2 4.1Å; I234-L408 HydrophobicContact CD1-CG 4.48Å; I234-L408 HydrophobicContact CG2-CD1 4.48Å; I234-L408 HydrophobicContact CG2-CD2 3.73Å; I234-L408 HydrophobicContact CG2-CG 3.92Å; I234-F409 HydrophobicContact CD1-CB 4.21Å; I234-F409 HydrophobicContact CD1-CD2 4.15Å; I234-V412 HydrophobicContact CG2-CG2 3.93Å; I234-F413 HydrophobicContact CD1-CE2 4.04Å; I234-F413 HydrophobicContact CG1-CE2 4.47Å
235	T	96.7	Very high	94.8	Very high	56 Å²	56	42.4 Å²	42.4	34%	0.344	22%	0.217	S	C	.	.	H	α-helix	trans	-56.2	-42	178.5	-55.4	0	0	0	0	111.1	T231 V237 V238 D239	T231-T235 PolarHBondContact O-N 2.87Å; T231-T235 PolarHBondContact O-OG1 3.31Å; T231-T235 VanDerWaalsContact O-OG1 3.06Å; T235-V237 VanDerWaalsContact C-N 3.26Å; T235-V237 PolarHBondContact O-N 2.89Å; T235-V238 PolarHBondContact O-N 3.2Å; T235-V238 VanDerWaalsContact O-N 3.15Å; T235-D239 WeakPolarHBondContact O-CB 3.45Å; T235-D239 VanDerWaalsContact O-CG 3.22Å; T235-D239 PolarHBondContact O-N 2.77Å
236	R	96.4	Very high	95	Very high	42 Å²	42	40.5 Å²	40.5	16%	0.158	21%	0.209	C	C	.	.	H	α-helix	trans	-68.1	-19.5	176	-75	-176.6	-61.6	107	-1.3	114.2	T157 P232 A233 I234 F240 R270 N285	T157-R236 WeakPolarHBondContact CB-O 3.43Å; T157-R236 WeakPolarHBondContact O-CB 3.3Å; T157-R236 VanDerWaalsContact O-CD 3.28Å; T157-R236 WeakPolarHBondContact O-CD 3.48Å; T157-R236 WeakPolarHBondContact O-CG 3.41Å; T157-R236 PolarHBondContact O-NH1 2.86Å; P232-R236 WeakPolarHBondContact O-CB 3.35Å; P232-R236 VanDerWaalsContact O-CG 3.27Å; P232-R236 WeakPolarHBondContact O-CG 3.42Å; P232-R236 PolarHBondContact O-N 2.8Å; P232-R236 VanDerWaalsContact O-N 3.12Å; P232-R236 PolarHBondContact O-NE 2.87Å; A233-R236 PolarHBondContact O-N 3.36Å; I234-R236 PolarHBondContact O-N 2.73Å; R236-F240 PolarHBondContact O-N 3.09Å; R236-R270 PolarHBondContact O-NH1 3.49Å; R236-N285 PolarHBondContact NH2-OD1 3.45Å
237	V	97.8	Very high	95.3	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.006	21%	0.206	C	C	.	.	H	α-helix	trans	-78.3	-44	168.6	179.8	0	0	0	0	110.3	A233 I234 T235 D239 F240 A241 I266 M267	A233-V237 WeakPolarHBondContact O-CG2 3.47Å; A233-V237 PolarHBondContact O-N 3.24Å; A233-V237 VanDerWaalsContact O-N 3.15Å; I234-V237 WeakPolarHBondContact O-CA 3.4Å; I234-V237 WeakPolarHBondContact O-CB 3.46Å; I234-V237 PolarHBondContact O-N 3.02Å; T235-V237 VanDerWaalsContact C-N 3.26Å; T235-V237 PolarHBondContact O-N 2.89Å; V237-D239 VanDerWaalsContact C-N 3.35Å; V237-D239 PolarHBondContact O-N 3.34Å; V237-F240 WeakPolarHBondContact O-CB 3.47Å; V237-F240 PolarHBondContact O-N 2.88Å; V237-A241 PolarHBondContact O-N 3.5Å; V237-I266 HydrophobicContact CB-CG2 4.42Å; V237-I266 HydrophobicContact CG1-CB 4.13Å; V237-I266 HydrophobicContact CG1-CD1 3.89Å; V237-I266 HydrophobicContact CG1-CG2 3.98Å; V237-I266 HydrophobicContact CG2-CB 4.23Å; V237-I266 HydrophobicContact CG2-CG2 3.67Å; V237-M267 HydrophobicContact CG2-CG 3.9Å
238	V	98.2	Very high	95.7	Very high	32 Å²	32	41.8 Å²	41.8	19%	0.194	22%	0.22	C	C	.	.	H	α-helix	trans	-60.8	-44.8	176.2	177.8	0	0	0	0	111	I234 T235 F240 A241 K242 L259	I234-V238 HydrophobicContact CG2-CG2 4.45Å; I234-V238 PolarHBondContact O-N 3.32Å; T235-V238 PolarHBondContact O-N 3.2Å; T235-V238 VanDerWaalsContact O-N 3.15Å; V238-F240 VanDerWaalsContact C-N 3.27Å; V238-F240 PolarHBondContact O-N 3.2Å; V238-A241 PolarHBondContact O-N 3.12Å; V238-K242 HydrophobicContact CG1-CD 4.07Å; V238-K242 HydrophobicContact CG1-CG 4.45Å; V238-K242 WeakPolarHBondContact O-CG 2.99Å; V238-K242 PolarHBondContact O-N 3.43Å; V238-L259 HydrophobicContact CG1-CD1 4.35Å; V238-L259 HydrophobicContact CG2-CD1 4.29Å; V238-L259 HydrophobicContact CG2-CD2 4.22Å
239	D	98.2	Very high	96	Very high	66 Å²	66	41.7 Å²	41.7	35%	0.353	22%	0.221	S	C	.	.	H	α-helix	trans	-64.5	-32.4	177.9	-68.7	-21.1	0	0	0	112.2	T157 T235 V237 K243	T157-D239 HydrophobicContact CG2-CB 3.81Å; T235-D239 WeakPolarHBondContact O-CB 3.45Å; T235-D239 VanDerWaalsContact O-CG 3.22Å; T235-D239 PolarHBondContact O-N 2.77Å; V237-D239 VanDerWaalsContact C-N 3.35Å; V237-D239 PolarHBondContact O-N 3.34Å; D239-K243 WeakPolarHBondContact O-CG 3.35Å; D239-K243 PolarHBondContact O-N 2.94Å
240	F	98.6	Very high	96.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65	-50.6	173.3	168.5	-101.9	0	0	0	110.4	V150 A153 H154 T157 R236 V237 V238 K242 K243 L244 Q328 L332	V150-F240 HydrophobicContact CG2-CE2 4.03Å; V150-F240 HydrophobicContact CG2-CZ 3.85Å; A153-F240 HydrophobicContact CB-CD2 3.91Å; A153-F240 HydrophobicContact CB-CE2 4.02Å; H154-F240 HydrophobicContact CB-CD2 4.41Å; H154-F240 HydrophobicContact CB-CE2 4.1Å; T157-F240 HydrophobicContact CG2-CB 4.34Å; R236-F240 PolarHBondContact O-N 3.09Å; V237-F240 WeakPolarHBondContact O-CB 3.47Å; V237-F240 PolarHBondContact O-N 2.88Å; V238-F240 VanDerWaalsContact C-N 3.27Å; V238-F240 PolarHBondContact O-N 3.2Å; F240-K242 VanDerWaalsContact C-N 3.33Å; F240-K242 PolarHBondContact O-N 2.99Å; F240-K243 WeakPolarHBondContact O-CB 3.24Å; F240-K243 PolarHBondContact O-N 3.41Å; F240-K243 VanDerWaalsContact O-N 3.12Å; F240-L244 HydrophobicContact CE1-CD1 4.06Å; F240-L244 HydrophobicContact CZ-CD1 4.07Å; F240-Q328 HydrophobicContact CE1-CB 3.67Å; F240-Q328 HydrophobicContact CZ-CB 3.68Å; F240-L332 HydrophobicContact CE1-CD2 4.47Å
241	A	98.6	Very high	96.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.5	-43.7	179.7	0	0	0	0	0	111.9	V237 V238 K243 L244 F247 L259 L332	V237-A241 PolarHBondContact O-N 3.5Å; V238-A241 PolarHBondContact O-N 3.12Å; A241-K243 PolarHBondContact O-N 3.13Å; A241-K243 VanDerWaalsContact O-N 3.14Å; A241-L244 WeakPolarHBondContact O-CB 3.32Å; A241-L244 PolarHBondContact O-N 2.98Å; A241-F247 HydrophobicContact CB-CD1 3.78Å; A241-F247 HydrophobicContact CB-CD2 4.39Å; A241-F247 HydrophobicContact CB-CE1 3.69Å; A241-F247 HydrophobicContact CB-CE2 4.31Å; A241-F247 HydrophobicContact CB-CG 4.14Å; A241-F247 HydrophobicContact CB-CZ 3.97Å; A241-F247 WeakPolarHBondContact O-CD1 3.36Å; A241-L259 HydrophobicContact CB-CD2 3.78Å; A241-L332 HydrophobicContact CB-CD1 4.01Å; A241-L332 HydrophobicContact CB-CD2 3.65Å
242	K	98.1	Very high	96.9	Very high	126 Å²	126	42.6 Å²	42.6	55%	0.548	23%	0.233	S	C	.	.	H	α-helix	trans	-63.8	-16.7	178.2	-74.4	179.2	176.9	176.8	0	114.7	V238 F240 L244 C248	V238-K242 HydrophobicContact CG1-CD 4.07Å; V238-K242 HydrophobicContact CG1-CG 4.45Å; V238-K242 WeakPolarHBondContact O-CG 2.99Å; V238-K242 PolarHBondContact O-N 3.43Å; F240-K242 VanDerWaalsContact C-N 3.33Å; F240-K242 PolarHBondContact O-N 2.99Å; K242-L244 VanDerWaalsContact C-N 3.33Å; K242-C248 PolarHBondContact O-SG 3.48Å
243	K	98.1	Very high	97.1	Very high	102 Å²	102	46.1 Å²	46.1	44%	0.443	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-7.4	174.9	-75.2	173.9	177.1	-89.5	0	113	A153 S156 T157 D239 F240 A241 P245	A153-K243 HydrophobicContact CB-CB 3.57Å; A153-K243 HydrophobicContact CB-CD 4.02Å; A153-K243 HydrophobicContact CB-CG 4.47Å; S156-K243 WeakPolarHBondContact OG-CD 3.47Å; S156-K243 WeakPolarHBondContact OG-CE 3.46Å; S156-K243 PolarHBondContact OG-NZ 3.09Å; S156-K243 VanDerWaalsContact OG-NZ 3.15Å; T157-K243 HydrophobicContact CG2-CD 4.06Å; D239-K243 WeakPolarHBondContact O-CG 3.35Å; D239-K243 PolarHBondContact O-N 2.94Å; F240-K243 WeakPolarHBondContact O-CB 3.24Å; F240-K243 PolarHBondContact O-N 3.41Å; F240-K243 VanDerWaalsContact O-N 3.12Å; A241-K243 PolarHBondContact O-N 3.13Å; A241-K243 VanDerWaalsContact O-N 3.14Å; K243-P245 WeakPolarHBondContact O-CD 3.33Å
244	L	97.8	Very high	97.3	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	24%	0.238	C	C	.	.			trans	-96.6	112.8	177.8	-52.6	-176.1	0	0	0	109.3	L149 V150 A153 F240 A241 K242 M246 F247 C248 A329 L332 F353	L149-L244 HydrophobicContact CD2-CD2 3.65Å; V150-L244 HydrophobicContact CB-CD2 4.2Å; V150-L244 HydrophobicContact CG2-CD2 3.95Å; A153-L244 HydrophobicContact CB-CD2 4Å; F240-L244 HydrophobicContact CE1-CD1 4.06Å; F240-L244 HydrophobicContact CZ-CD1 4.07Å; A241-L244 WeakPolarHBondContact O-CB 3.32Å; A241-L244 PolarHBondContact O-N 2.98Å; K242-L244 VanDerWaalsContact C-N 3.33Å; L244-M246 VanDerWaalsContact C-N 3.29Å; L244-M246 PolarHBondContact O-N 2.87Å; L244-F247 HydrophobicContact CB-CB 4.18Å; L244-F247 WeakPolarHBondContact O-CB 3.49Å; L244-F247 PolarHBondContact O-N 3.02Å; L244-C248 PolarHBondContact O-N 3.41Å; L244-A329 HydrophobicContact CD1-CB 4.28Å; L244-L332 HydrophobicContact CD1-CD2 3.88Å; L244-F353 HydrophobicContact CD1-CZ 4.35Å
245	P	93.7	Very high	97.4	Very high	61 Å²	61	46.8 Å²	46.8	40%	0.396	25%	0.245	S	C	.	.	H	α-helix	trans	-54.6	-44.7	-177.9	-27.4	34.9	0	0	0	112.7	L149 K243 F247 C248 E249	L149-P245 HydrophobicContact CD1-CG 4.02Å; K243-P245 WeakPolarHBondContact O-CD 3.33Å; P245-F247 PolarHBondContact O-N 2.85Å; P245-F247 VanDerWaalsContact O-N 3.14Å; P245-C248 PolarHBondContact O-N 3.39Å; P245-C248 VanDerWaalsContact O-N 3.08Å; P245-E249 WeakPolarHBondContact O-CG 3.45Å; P245-E249 PolarHBondContact O-N 2.94Å; P245-E249 VanDerWaalsContact O-N 3.1Å
246	M	93.6	Very high	97.5	Very high	25 Å²	25	48.7 Å²	48.7	12%	0.123	25%	0.252	C	S	.	.	H	α-helix	trans	-56.5	-31.9	178.5	-69.7	-176.4	-84.7	0	0	113.9	L146 L244 C349 F353	L146-M246 HydrophobicContact CD1-CE 3.5Å; L146-M246 HydrophobicContact CD2-CE 4.47Å; L244-M246 VanDerWaalsContact C-N 3.29Å; L244-M246 PolarHBondContact O-N 2.87Å; M246-C349 HydrophobicContact CB-CB 4.31Å; M246-C349 HydrophobicContact SD-CB 3.83Å; M246-F353 HydrophobicContact CE-CD2 3.94Å; M246-F353 HydrophobicContact CE-CE1 4.15Å; M246-F353 HydrophobicContact CE-CE2 3.13Å; M246-F353 HydrophobicContact CE-CZ 3.27Å; M246-F353 HydrophobicContact SD-CE2 4.29Å
247	F	97.6	Very high	97.5	Very high	1 Å²	1	48.8 Å²	48.8	0%	0.004	26%	0.255	C	S	.	.	H	α-helix	trans	-77.2	-45.4	176.1	175.4	-94.2	0	0	0	111.3	A241 L244 P245 E249 L250 Q255 L258 L259 L332	A241-F247 HydrophobicContact CB-CD1 3.78Å; A241-F247 HydrophobicContact CB-CD2 4.39Å; A241-F247 HydrophobicContact CB-CE1 3.69Å; A241-F247 HydrophobicContact CB-CE2 4.31Å; A241-F247 HydrophobicContact CB-CG 4.14Å; A241-F247 HydrophobicContact CB-CZ 3.97Å; A241-F247 WeakPolarHBondContact O-CD1 3.36Å; L244-F247 HydrophobicContact CB-CB 4.18Å; L244-F247 WeakPolarHBondContact O-CB 3.49Å; L244-F247 PolarHBondContact O-N 3.02Å; P245-F247 PolarHBondContact O-N 2.85Å; P245-F247 VanDerWaalsContact O-N 3.14Å; F247-E249 PolarHBondContact O-N 2.94Å; F247-L250 HydrophobicContact CD2-CD1 4.35Å; F247-L250 WeakPolarHBondContact O-CB 3.45Å; F247-L250 PolarHBondContact O-N 3.08Å; F247-Q255 HydrophobicContact CD1-CG 4.29Å; F247-Q255 HydrophobicContact CD2-CG 4.49Å; F247-Q255 HydrophobicContact CE1-CB 3.98Å; F247-Q255 HydrophobicContact CE1-CG 3.77Å; F247-Q255 HydrophobicContact CE2-CB 4.03Å; F247-Q255 HydrophobicContact CE2-CG 4Å; F247-Q255 HydrophobicContact CZ-CB 3.46Å; F247-Q255 VanDerWaalsContact CZ-CB 3.46Å; F247-Q255 HydrophobicContact CZ-CG 3.62Å; F247-Q255 PolarHBondContact O-NE2 2.98Å; F247-L258 HydrophobicContact CD2-CD1 4.3Å; F247-L258 HydrophobicContact CE2-CB 4.16Å; F247-L258 HydrophobicContact CE2-CD1 4.17Å; F247-L259 HydrophobicContact CE1-CD1 4.36Å; F247-L259 HydrophobicContact CE2-CG 4.36Å; F247-L259 HydrophobicContact CZ-CD1 3.8Å; F247-L259 HydrophobicContact CZ-CD2 4.32Å; F247-L259 HydrophobicContact CZ-CG 3.75Å; F247-L332 HydrophobicContact CB-CD2 4.48Å; F247-L332 HydrophobicContact CD2-CD1 4.15Å; F247-L332 HydrophobicContact CD2-CD2 3.98Å; F247-L332 HydrophobicContact CD2-CG 4.14Å; F247-L332 HydrophobicContact CE2-CD1 3.94Å; F247-L332 HydrophobicContact CE2-CG 4.44Å; F247-L332 HydrophobicContact CG-CD2 4.29Å
248	C	97	Very high	97.6	Very high	58 Å²	58	48.8 Å²	48.8	39%	0.392	26%	0.255	S	S	.	.	H	α-helix	trans	-63.1	-24.2	-178.7	-70.6	0	0	0	0	113.8	K242 L244 P245 L250 Q255	K242-C248 PolarHBondContact O-SG 3.48Å; L244-C248 PolarHBondContact O-N 3.41Å; P245-C248 PolarHBondContact O-N 3.39Å; P245-C248 VanDerWaalsContact O-N 3.08Å; C248-L250 VanDerWaalsContact C-N 3.34Å; C248-Q255 PolarHBondContact O-NE2 3.43Å
249	E	96.5	Very high	97.6	Very high	120 Å²	120	48.5 Å²	48.5	56%	0.561	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-5.3	177.6	-61.8	170.8	-175.3	0	0	113.8	P245 F247 R345	P245-E249 WeakPolarHBondContact O-CG 3.45Å; P245-E249 PolarHBondContact O-N 2.94Å; P245-E249 VanDerWaalsContact O-N 3.1Å; F247-E249 PolarHBondContact O-N 2.94Å; E249-R345 PolarHBondContact O-NH1 3.35Å; E249-R345 PolarHBondContact O-NH2 3.17Å; E249-R345 IonicContact OE2-NH2 2.95Å; E249-R345 PolarHBondContact OE2-NH2 3.45Å
250	L	97.8	Very high	97.5	Very high	7 Å²	7	48.7 Å²	48.7	4%	0.037	25%	0.25	C	S	.	.	S	Bend	trans	-75.2	157.5	174.2	-62.5	175.2	0	0	0	111.3	F247 C248 Q255 L258 L333 R345 I346	F247-L250 HydrophobicContact CD2-CD1 4.35Å; F247-L250 WeakPolarHBondContact O-CB 3.45Å; F247-L250 PolarHBondContact O-N 3.08Å; C248-L250 VanDerWaalsContact C-N 3.34Å; L250-Q255 HydrophobicContact CB-CG 4.04Å; L250-Q255 PolarHBondContact O-NE2 3.16Å; L250-L258 HydrophobicContact CD1-CD1 3.63Å; L250-L333 HydrophobicContact CD1-CD2 4.32Å; L250-R345 HydrophobicContact CD2-CG 4.16Å; L250-I346 HydrophobicContact CD1-CD1 4.46Å; L250-I346 HydrophobicContact CD1-CG1 3.93Å; L250-I346 HydrophobicContact CD2-CG1 3.99Å
251	P	98.2	Very high	97.4	Very high	43 Å²	43	49.7 Å²	49.7	28%	0.279	26%	0.261	S	S	.	.			trans	-54.2	145.1	169.9	-24.5	34.9	0	0	0	112.2	E253 D254 Q255 S342	P251-E253 PolarHBondContact O-N 3.16Å; P251-D254 HydrophobicContact CB-CB 4.39Å; P251-D254 PolarHBondContact O-N 3.07Å; P251-D254 VanDerWaalsContact O-N 3.12Å; P251-Q255 WeakPolarHBondContact O-CG 3.38Å; P251-Q255 PolarHBondContact O-N 3.02Å; P251-S342 WeakPolarHBondContact CD-OG 3.39Å; P251-S342 WeakPolarHBondContact CG-OG 3.35Å
252	C	97.8	Very high	97.4	Very high	83 Å²	83	49.7 Å²	49.7	56%	0.561	26%	0.261	S	S	*	.	H	α-helix	trans	-57.6	-38.5	-178.5	-69.6	0	0	0	0	112.2	Q255 I256	C252-Q255 WeakPolarHBondContact O-CB 3.36Å; C252-Q255 PolarHBondContact O-N 3.42Å; C252-I256 VanDerWaalsContact O-CG1 3.3Å; C252-I256 WeakPolarHBondContact O-CG1 3.48Å; C252-I256 PolarHBondContact O-N 3.13Å
253	E	97.9	Very high	97.4	Very high	126 Å²	126	43.9 Å²	43.9	59%	0.589	24%	0.235	S	C	*	.	H	α-helix	trans	-61.9	-46.2	177.6	-65.5	73.9	-166.7	0	0	111	P251 I256 I257	P251-E253 PolarHBondContact O-N 3.16Å; E253-I256 PolarHBondContact O-N 3.36Å; E253-I257 VanDerWaalsContact O-CG1 3.32Å; E253-I257 WeakPolarHBondContact O-CG1 3.28Å; E253-I257 PolarHBondContact O-N 2.79Å
254	D	98.4	Very high	97.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.5	-41.3	176.1	-71.2	-5.1	0	0	0	110.8	P251 I256 I257 L258 L340 T341 S342	P251-D254 HydrophobicContact CB-CB 4.39Å; P251-D254 PolarHBondContact O-N 3.07Å; P251-D254 VanDerWaalsContact O-N 3.12Å; D254-I256 VanDerWaalsContact C-N 3.31Å; D254-I256 PolarHBondContact O-N 3.4Å; D254-I257 PolarHBondContact O-N 3.45Å; D254-L258 WeakPolarHBondContact O-CB 3.49Å; D254-L258 VanDerWaalsContact O-CG 3.27Å; D254-L258 WeakPolarHBondContact O-CG 3.22Å; D254-L258 PolarHBondContact O-N 3.17Å; D254-L340 HydrophobicContact CB-CD2 3.92Å; D254-T341 VanDerWaalsContact CG-OG1 3.23Å; D254-T341 PolarHBondContact OD1-N 3.17Å; D254-T341 PolarHBondContact OD1-OG1 3.17Å; D254-T341 PolarHBondContact OD2-OG1 2.95Å; D254-S342 WeakPolarHBondContact OD2-CB 3.5Å; D254-S342 PolarHBondContact OD2-N 2.8Å; D254-S342 PolarHBondContact OD2-OG 2.71Å
255	Q	98.5	Very high	97.4	Very high	33 Å²	33	39.8 Å²	39.8	15%	0.154	22%	0.218	C	C	.	.	H	α-helix	trans	-57.9	-43.3	175.6	-71	-176.5	41.4	0	0	111.9	F247 C248 L250 P251 C252 L259	F247-Q255 HydrophobicContact CD1-CG 4.29Å; F247-Q255 HydrophobicContact CD2-CG 4.49Å; F247-Q255 HydrophobicContact CE1-CB 3.98Å; F247-Q255 HydrophobicContact CE1-CG 3.77Å; F247-Q255 HydrophobicContact CE2-CB 4.03Å; F247-Q255 HydrophobicContact CE2-CG 4Å; F247-Q255 HydrophobicContact CZ-CB 3.46Å; F247-Q255 VanDerWaalsContact CZ-CB 3.46Å; F247-Q255 HydrophobicContact CZ-CG 3.62Å; F247-Q255 PolarHBondContact O-NE2 2.98Å; C248-Q255 PolarHBondContact O-NE2 3.43Å; L250-Q255 HydrophobicContact CB-CG 4.04Å; L250-Q255 PolarHBondContact O-NE2 3.16Å; P251-Q255 WeakPolarHBondContact O-CG 3.38Å; P251-Q255 PolarHBondContact O-N 3.02Å; C252-Q255 WeakPolarHBondContact O-CB 3.36Å; C252-Q255 PolarHBondContact O-N 3.42Å; Q255-L259 WeakPolarHBondContact O-CB 3.42Å; Q255-L259 VanDerWaalsContact O-CG 3.3Å; Q255-L259 WeakPolarHBondContact O-CG 3.45Å; Q255-L259 PolarHBondContact O-N 2.82Å
256	I	98	Very high	97.6	Very high	96 Å²	96	36.9 Å²	36.9	49%	0.492	20%	0.199	S	C	.	.	H	α-helix	trans	-63.9	-47.6	177.4	-68.3	163.1	0	0	0	110.4	C252 E253 D254 L258 L259 K260	C252-I256 VanDerWaalsContact O-CG1 3.3Å; C252-I256 WeakPolarHBondContact O-CG1 3.48Å; C252-I256 PolarHBondContact O-N 3.13Å; E253-I256 PolarHBondContact O-N 3.36Å; D254-I256 VanDerWaalsContact C-N 3.31Å; D254-I256 PolarHBondContact O-N 3.4Å; I256-L258 PolarHBondContact O-N 3.29Å; I256-L259 PolarHBondContact O-N 3.4Å; I256-K260 HydrophobicContact CG2-CD 4.47Å; I256-K260 HydrophobicContact CG2-CG 4.35Å; I256-K260 WeakPolarHBondContact O-CB 3.47Å; I256-K260 WeakPolarHBondContact O-CG 3.1Å; I256-K260 PolarHBondContact O-N 3.26Å
257	I	98.3	Very high	97.7	Very high	44 Å²	44	37 Å²	37	23%	0.226	20%	0.2	C	C	.	.	H	α-helix	trans	-59.8	-46.5	179.9	-68.5	166.3	0	0	0	110.9	E253 D254 K260 G261 R337 G339 L340	E253-I257 VanDerWaalsContact O-CG1 3.32Å; E253-I257 WeakPolarHBondContact O-CG1 3.28Å; E253-I257 PolarHBondContact O-N 2.79Å; D254-I257 PolarHBondContact O-N 3.45Å; I257-K260 PolarHBondContact O-N 3.5Å; I257-G261 PolarHBondContact O-N 2.85Å; I257-R337 HydrophobicContact CG2-CB 3.67Å; I257-G339 WeakPolarHBondContact CD1-O 3.11Å; I257-L340 HydrophobicContact CB-CD2 3.92Å; I257-L340 HydrophobicContact CD1-CD2 4.4Å; I257-L340 HydrophobicContact CG2-CD2 3.69Å; I257-L340 HydrophobicContact CG2-CG 3.97Å
258	L	98.4	Very high	97.7	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-62.4	-45.6	178.3	-68.7	175.7	0	0	0	111.5	F247 L250 D254 I256 G261 C262 L332 L333 S334 R337 L340 I346	F247-L258 HydrophobicContact CD2-CD1 4.3Å; F247-L258 HydrophobicContact CE2-CB 4.16Å; F247-L258 HydrophobicContact CE2-CD1 4.17Å; L250-L258 HydrophobicContact CD1-CD1 3.63Å; D254-L258 WeakPolarHBondContact O-CB 3.49Å; D254-L258 VanDerWaalsContact O-CG 3.27Å; D254-L258 WeakPolarHBondContact O-CG 3.22Å; D254-L258 PolarHBondContact O-N 3.17Å; I256-L258 PolarHBondContact O-N 3.29Å; L258-G261 PolarHBondContact O-N 3.45Å; L258-C262 WeakPolarHBondContact O-CB 3.35Å; L258-C262 PolarHBondContact O-N 2.92Å; L258-C262 PolarHBondContact O-SG 3.13Å; L258-L332 WeakPolarHBondContact CD2-O 3.43Å; L258-L333 HydrophobicContact CD1-CD2 4.49Å; L258-S334 WeakPolarHBondContact CD2-O 3.26Å; L258-R337 HydrophobicContact CD2-CG 4.31Å; L258-L340 HydrophobicContact CD2-CD1 4.03Å; L258-L340 HydrophobicContact CD2-CD2 4.1Å; L258-L340 HydrophobicContact CG-CD2 4.06Å; L258-I346 HydrophobicContact CD1-CD1 4.09Å; L258-I346 HydrophobicContact CD1-CG1 4.38Å; L258-I346 HydrophobicContact CD2-CD1 4.44Å; L258-I346 HydrophobicContact CD2-CG2 4.43Å
259	L	98.4	Very high	97.8	Very high	26 Å²	26	34.3 Å²	34.3	14%	0.136	18%	0.182	C	C	.	.	H	α-helix	trans	-63	-46.7	178.4	-77.7	169.2	0	0	0	112.2	V238 A241 F247 Q255 I256 G261 C262 C263 L332	V238-L259 HydrophobicContact CG1-CD1 4.35Å; V238-L259 HydrophobicContact CG2-CD1 4.29Å; V238-L259 HydrophobicContact CG2-CD2 4.22Å; A241-L259 HydrophobicContact CB-CD2 3.78Å; F247-L259 HydrophobicContact CE1-CD1 4.36Å; F247-L259 HydrophobicContact CE2-CG 4.36Å; F247-L259 HydrophobicContact CZ-CD1 3.8Å; F247-L259 HydrophobicContact CZ-CD2 4.32Å; F247-L259 HydrophobicContact CZ-CG 3.75Å; Q255-L259 WeakPolarHBondContact O-CB 3.42Å; Q255-L259 VanDerWaalsContact O-CG 3.3Å; Q255-L259 WeakPolarHBondContact O-CG 3.45Å; Q255-L259 PolarHBondContact O-N 2.82Å; I256-L259 PolarHBondContact O-N 3.4Å; L259-G261 VanDerWaalsContact C-N 3.3Å; L259-G261 PolarHBondContact O-N 2.96Å; L259-C262 PolarHBondContact O-N 3.12Å; L259-C263 VanDerWaalsContact O-CB 3.25Å; L259-C263 WeakPolarHBondContact O-CB 3.42Å; L259-C263 PolarHBondContact O-N 3.1Å; L259-L332 HydrophobicContact CD2-CD1 4.27Å
260	K	97.2	Very high	97.7	Very high	70 Å²	70	29.1 Å²	29.1	30%	0.304	16%	0.157	S	C	.	.	H	α-helix	trans	-58.2	-44.5	174.9	-74.4	-161.3	174.9	-154.1	0	111.1	I256 I257 E411 V412 E414	I256-K260 HydrophobicContact CG2-CD 4.47Å; I256-K260 HydrophobicContact CG2-CG 4.35Å; I256-K260 WeakPolarHBondContact O-CB 3.47Å; I256-K260 WeakPolarHBondContact O-CG 3.1Å; I256-K260 PolarHBondContact O-N 3.26Å; I257-K260 PolarHBondContact O-N 3.5Å; K260-E411 WeakPolarHBondContact CE-O 3.49Å; K260-E411 PolarHBondContact NZ-O 2.82Å; K260-V412 WeakPolarHBondContact CG-O 3.4Å; K260-E414 PolarHBondContact NZ-O 2.78Å
261	G	96.6	Very high	97.6	Very high	21 Å²	21	29.1 Å²	29.1	22%	0.216	16%	0.159	C	C	.	.	H	α-helix	trans	-66.9	-37	-178.7	0	0	0	0	0	114.4	I257 L258 L259 R337	I257-G261 PolarHBondContact O-N 2.85Å; L258-G261 PolarHBondContact O-N 3.45Å; L259-G261 VanDerWaalsContact C-N 3.3Å; L259-G261 PolarHBondContact O-N 2.96Å; G261-R337 VanDerWaalsContact O-CZ 3.27Å; G261-R337 PolarHBondContact O-NH1 3.03Å; G261-R337 VanDerWaalsContact O-NH1 3.12Å; G261-R337 PolarHBondContact O-NH2 2.81Å
262	C	97.7	Very high	97.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-100.4	-12.2	-171	83	0	0	0	0	114.3	L258 L259 M264 E265 I266 I331 L332	L258-C262 WeakPolarHBondContact O-CB 3.35Å; L258-C262 PolarHBondContact O-N 2.92Å; L258-C262 PolarHBondContact O-SG 3.13Å; L259-C262 PolarHBondContact O-N 3.12Å; C262-M264 PolarHBondContact O-N 3.32Å; C262-E265 WeakPolarHBondContact O-CB 3.41Å; C262-E265 PolarHBondContact O-N 3.46Å; C262-E265 VanDerWaalsContact O-N 3.11Å; C262-I266 HydrophobicContact CB-CD1 4.35Å; C262-I266 PolarHBondContact O-N 3.34Å; C262-I331 HydrophobicContact CB-CG2 3.92Å; C262-L332 VanDerWaalsContact SG-CD1 3.53Å
263	C	97.9	Very high	97.3	Very high	3 Å²	3	25.3 Å²	25.3	2%	0.02	13%	0.132	C	C	.	.	H	α-helix	trans	-57.4	-50.6	-167.3	-168	0	0	0	0	112.7	L259 E265 I266 M267 V412 F413	L259-C263 VanDerWaalsContact O-CB 3.25Å; L259-C263 WeakPolarHBondContact O-CB 3.42Å; L259-C263 PolarHBondContact O-N 3.1Å; C263-E265 VanDerWaalsContact C-N 3.31Å; C263-E265 PolarHBondContact O-N 2.95Å; C263-I266 PolarHBondContact O-N 2.74Å; C263-M267 WeakPolarHBondContact O-CB 3.24Å; C263-M267 WeakPolarHBondContact O-CG 3.37Å; C263-M267 PolarHBondContact O-N 2.95Å; C263-V412 HydrophobicContact CB-CG1 3.76Å; C263-F413 HydrophobicContact CB-CE1 4.12Å; C263-F413 HydrophobicContact CB-CZ 3.91Å
264	M	96.9	Very high	97	Very high	15 Å²	15	19.8 Å²	19.8	7%	0.074	11%	0.106	C	C	.	.	H	α-helix	trans	-65.2	-36.3	179	-176	58.6	179.9	0	0	112.2	C262 M267 S268 L300 V303 I307 I385 H389 F413	C262-M264 PolarHBondContact O-N 3.32Å; M264-M267 PolarHBondContact O-N 3.42Å; M264-M267 HydrophobicContact SD-CE 4.2Å; M264-S268 VanDerWaalsContact O-CB 3.24Å; M264-S268 WeakPolarHBondContact O-CB 3.27Å; M264-S268 PolarHBondContact O-N 2.99Å; M264-S268 PolarHBondContact O-OG 3.37Å; M264-L300 HydrophobicContact CE-CD1 4.31Å; M264-L300 HydrophobicContact CE-CD2 4.2Å; M264-V303 HydrophobicContact CE-CG1 3.94Å; M264-I307 HydrophobicContact CE-CD1 3.92Å; M264-I385 HydrophobicContact CE-CG2 4.48Å; M264-H389 HydrophobicContact CE-CB 4.15Å; M264-H389 HydrophobicContact CG-CB 3.69Å; M264-H389 HydrophobicContact SD-CB 4.46Å; M264-F413 HydrophobicContact CB-CE1 3.78Å; M264-F413 HydrophobicContact CB-CZ 4.13Å
265	E	98.2	Very high	96.9	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.009	11%	0.111	C	C	.	.	H	α-helix	trans	-64.5	-48.5	179.9	-53.5	178.2	-174.2	0	0	110.2	C262 C263 S268 L269 I331 R337 L382 R383	C262-E265 WeakPolarHBondContact O-CB 3.41Å; C262-E265 PolarHBondContact O-N 3.46Å; C262-E265 VanDerWaalsContact O-N 3.11Å; C263-E265 VanDerWaalsContact C-N 3.31Å; C263-E265 PolarHBondContact O-N 2.95Å; E265-S268 PolarHBondContact O-N 2.61Å; E265-L269 WeakPolarHBondContact O-CB 3.44Å; E265-L269 PolarHBondContact O-N 2.86Å; E265-I331 HydrophobicContact CB-CG2 3.78Å; E265-I331 VanDerWaalsContact OE2-CG2 3.28Å; E265-I331 WeakPolarHBondContact OE2-CG2 3.37Å; E265-R337 IonicContact OE1-CZ 3.07Å; E265-R337 IonicContact OE1-NH1 2.58Å; E265-R337 PolarHBondContact OE1-NH1 3.37Å; E265-R337 IonicContact OE1-NH2 3.93Å; E265-R337 PolarHBondContact OE1-NH2 3.23Å; E265-R337 IonicContact OE2-NH2 2.79Å; E265-R337 PolarHBondContact OE2-NH2 3.47Å; E265-L382 HydrophobicContact CB-CB 4.34Å; E265-L382 WeakPolarHBondContact O-CD2 3.5Å; E265-R383 VanDerWaalsContact CD-CD 3.49Å; E265-R383 WeakPolarHBondContact OE1-CD 3.36Å; E265-R383 IonicContact OE1-NE 2.82Å; E265-R383 VanDerWaalsContact OE2-CD 3.28Å; E265-R383 WeakPolarHBondContact OE2-CD 3.1Å; E265-R383 IonicContact OE2-NE 2.73Å
266	I	98.3	Very high	96.6	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-65.3	-42	177.3	-69.6	179	0	0	0	111.4	V237 C262 C263 S268 L269 R270 Q328 I331 L332	V237-I266 HydrophobicContact CB-CG2 4.42Å; V237-I266 HydrophobicContact CG1-CB 4.13Å; V237-I266 HydrophobicContact CG1-CD1 3.89Å; V237-I266 HydrophobicContact CG1-CG2 3.98Å; V237-I266 HydrophobicContact CG2-CB 4.23Å; V237-I266 HydrophobicContact CG2-CG2 3.67Å; C262-I266 HydrophobicContact CB-CD1 4.35Å; C262-I266 PolarHBondContact O-N 3.34Å; C263-I266 PolarHBondContact O-N 2.74Å; I266-S268 VanDerWaalsContact C-N 3.33Å; I266-S268 PolarHBondContact O-N 2.66Å; I266-L269 PolarHBondContact O-N 3.33Å; I266-R270 HydrophobicContact CG2-CG 4.46Å; I266-R270 WeakPolarHBondContact O-CB 3.18Å; I266-R270 VanDerWaalsContact O-CG 3.31Å; I266-R270 WeakPolarHBondContact O-CG 3.42Å; I266-R270 PolarHBondContact O-N 2.91Å; I266-Q328 HydrophobicContact CD1-CB 4.41Å; I266-Q328 HydrophobicContact CG1-CB 4.45Å; I266-Q328 HydrophobicContact CG1-CG 4.35Å; I266-Q328 HydrophobicContact CG2-CG 4.09Å; I266-I331 HydrophobicContact CD1-CG2 4.39Å; I266-I331 HydrophobicContact CG1-CB 4.45Å; I266-I331 HydrophobicContact CG1-CG2 3.79Å; I266-L332 HydrophobicContact CD1-CB 4.31Å
267	M	96.7	Very high	96.3	Very high	28 Å²	28	18.6 Å²	18.6	14%	0.138	10%	0.103	C	C	.	.	H	α-helix	trans	-62.4	-41.7	176.1	-73.3	-167.3	-62	0	0	111.8	A233 I234 V237 C263 M264 R270 A271 F413	A233-M267 HydrophobicContact CB-CG 4.34Å; A233-M267 HydrophobicContact CB-SD 3.62Å; I234-M267 HydrophobicContact CG1-CE 4.24Å; I234-M267 HydrophobicContact CG1-SD 4.08Å; V237-M267 HydrophobicContact CG2-CG 3.9Å; C263-M267 WeakPolarHBondContact O-CB 3.24Å; C263-M267 WeakPolarHBondContact O-CG 3.37Å; C263-M267 PolarHBondContact O-N 2.95Å; M264-M267 PolarHBondContact O-N 3.42Å; M264-M267 HydrophobicContact SD-CE 4.2Å; M267-R270 PolarHBondContact O-N 3.44Å; M267-A271 PolarHBondContact O-N 2.9Å; M267-F413 HydrophobicContact CE-CE2 4.07Å; M267-F413 HydrophobicContact CE-CZ 3.66Å
268	S	97.6	Very high	96	Very high	3 Å²	3	23.6 Å²	23.6	2%	0.021	13%	0.13	C	C	.	.	H	α-helix	trans	-65.3	-43.9	177.8	-60.9	0	0	0	0	111.8	M264 E265 I266 R270 A271 A272 I385	M264-S268 VanDerWaalsContact O-CB 3.24Å; M264-S268 WeakPolarHBondContact O-CB 3.27Å; M264-S268 PolarHBondContact O-N 2.99Å; M264-S268 PolarHBondContact O-OG 3.37Å; E265-S268 PolarHBondContact O-N 2.61Å; I266-S268 VanDerWaalsContact C-N 3.33Å; I266-S268 PolarHBondContact O-N 2.66Å; S268-R270 PolarHBondContact O-N 2.73Å; S268-A271 PolarHBondContact O-N 3.35Å; S268-A272 VanDerWaalsContact O-CB 3.26Å; S268-A272 WeakPolarHBondContact O-CB 3.31Å; S268-A272 PolarHBondContact O-N 3.47Å; S268-I385 WeakPolarHBondContact OG-CG2 3.45Å
269	L	97.7	Very high	95.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-58.8	-48.6	173.6	174.6	59.4	0	0	0	111.2	E265 I266 A271 A272 V273 L314 V324 L327 Q328 I331 L382	E265-L269 WeakPolarHBondContact O-CB 3.44Å; E265-L269 PolarHBondContact O-N 2.86Å; I266-L269 PolarHBondContact O-N 3.33Å; L269-A271 VanDerWaalsContact C-N 3.27Å; L269-A271 PolarHBondContact O-N 2.8Å; L269-A272 PolarHBondContact O-N 3.2Å; L269-V273 HydrophobicContact CD1-CG1 3.88Å; L269-V273 WeakPolarHBondContact O-CG1 3.27Å; L269-V273 WeakPolarHBondContact O-CG2 3.41Å; L269-V273 PolarHBondContact O-N 3.25Å; L269-L314 HydrophobicContact CD1-CD1 3.79Å; L269-V324 HydrophobicContact CD2-CG1 4.5Å; L269-V324 HydrophobicContact CG-CG1 4.48Å; L269-L327 HydrophobicContact CD1-CD2 3.76Å; L269-L327 HydrophobicContact CD2-CB 4.14Å; L269-L327 HydrophobicContact CD2-CD2 3.76Å; L269-L327 HydrophobicContact CD2-CG 3.88Å; L269-L327 HydrophobicContact CG-CD2 4.44Å; L269-Q328 HydrophobicContact CD2-CG 3.79Å; L269-I331 HydrophobicContact CD2-CD1 3.99Å; L269-L382 HydrophobicContact CB-CD1 3.99Å; L269-L382 HydrophobicContact CB-CD2 4.02Å; L269-L382 HydrophobicContact CD1-CD1 4.23Å; L269-L382 HydrophobicContact CD2-CD1 4.33Å; L269-L382 HydrophobicContact CG-CD1 4.41Å
270	R	95.4	Very high	95.5	Very high	10 Å²	10	30.5 Å²	30.5	4%	0.038	17%	0.166	C	C	.	.	H	α-helix	trans	-60.2	-35.9	178.2	-76	177.2	177.1	-165.2	-6.9	112.3	T157 R236 I266 M267 S268 V273 R274 Q328	T157-R270 PolarHBondContact O-NH1 3.09Å; T157-R270 PolarHBondContact OG1-NH2 3.02Å; T157-R270 VanDerWaalsContact OG1-NH2 3.15Å; R236-R270 PolarHBondContact O-NH1 3.49Å; I266-R270 HydrophobicContact CG2-CG 4.46Å; I266-R270 WeakPolarHBondContact O-CB 3.18Å; I266-R270 VanDerWaalsContact O-CG 3.31Å; I266-R270 WeakPolarHBondContact O-CG 3.42Å; I266-R270 PolarHBondContact O-N 2.91Å; M267-R270 PolarHBondContact O-N 3.44Å; S268-R270 PolarHBondContact O-N 2.73Å; R270-V273 WeakPolarHBondContact O-CG2 3.49Å; R270-R274 PolarHBondContact O-NH1 3.05Å; R270-Q328 VanDerWaalsContact CZ-OE1 3.28Å
271	A	94.8	Very high	95.4	Very high	8 Å²	8	27.2 Å²	27.2	7%	0.066	15%	0.151	C	C	.	.	H	α-helix	trans	-70.1	-49.1	174	0	0	0	0	0	111.1	M267 S268 L269 V273 R274 L282 L284 I307	M267-A271 PolarHBondContact O-N 2.9Å; S268-A271 PolarHBondContact O-N 3.35Å; L269-A271 VanDerWaalsContact C-N 3.27Å; L269-A271 PolarHBondContact O-N 2.8Å; A271-V273 PolarHBondContact O-N 3.5Å; A271-R274 CarbonylContact O-C 3.51Å; A271-R274 WeakPolarHBondContact O-CA 3.49Å; A271-R274 WeakPolarHBondContact O-CB 3.44Å; A271-R274 PolarHBondContact O-N 2.83Å; A271-L282 WeakPolarHBondContact O-CD2 3.31Å; A271-L284 HydrophobicContact CB-CD2 3.69Å; A271-I307 HydrophobicContact CB-CG2 4.33Å
272	A	96.3	Very high	95.3	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.008	14%	0.141	C	C	.	.	H	α-helix	trans	-60.8	-39.9	-175.7	0	0	0	0	0	113.4	S268 L269 R274 Y275 L310 G311 L314	S268-A272 VanDerWaalsContact O-CB 3.26Å; S268-A272 WeakPolarHBondContact O-CB 3.31Å; S268-A272 PolarHBondContact O-N 3.47Å; L269-A272 PolarHBondContact O-N 3.2Å; A272-R274 PolarHBondContact O-N 3.48Å; A272-R274 VanDerWaalsContact O-N 3.17Å; A272-Y275 VanDerWaalsContact O-CB 3.23Å; A272-Y275 WeakPolarHBondContact O-CB 3.48Å; A272-Y275 PolarHBondContact O-N 2.88Å; A272-L310 HydrophobicContact CB-CB 4.31Å; A272-L310 HydrophobicContact CB-CD2 3.9Å; A272-L310 HydrophobicContact CB-CG 3.87Å; A272-G311 WeakPolarHBondContact O-CA 3.38Å; A272-L314 HydrophobicContact CB-CD1 4.02Å
273	V	94.4	Very high	95	Very high	45 Å²	45	26.2 Å²	26.2	27%	0.273	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-11.5	175.5	-59.9	0	0	0	0	113.3	L269 R270 A271 L314 V324	L269-V273 HydrophobicContact CD1-CG1 3.88Å; L269-V273 WeakPolarHBondContact O-CG1 3.27Å; L269-V273 WeakPolarHBondContact O-CG2 3.41Å; L269-V273 PolarHBondContact O-N 3.25Å; R270-V273 WeakPolarHBondContact O-CG2 3.49Å; A271-V273 PolarHBondContact O-N 3.5Å; V273-L314 HydrophobicContact CG1-CD1 4.04Å; V273-V324 HydrophobicContact CB-CG2 4.49Å; V273-V324 HydrophobicContact CG1-CG1 4.36Å; V273-V324 HydrophobicContact CG1-CG2 3.85Å; V273-V324 HydrophobicContact CG2-CG1 4.46Å
274	R	92.3	Very high	94.6	Very high	10 Å²	10	27.2 Å²	27.2	4%	0.038	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	26.1	171.6	-60.3	-176	-177.7	89.9	-8.4	112.5	N158 A159 W164 R270 A271 A272 T283	N158-R274 PolarHBondContact ND2-NH2 3.26Å; N158-R274 PolarHBondContact OD1-NH1 3.02Å; N158-R274 PolarHBondContact OD1-NH2 2.9Å; A159-R274 PolarHBondContact O-NH2 3.24Å; W164-R274 HydrophobicContact CD2-CB 4.18Å; W164-R274 HydrophobicContact CD2-CG 4.17Å; W164-R274 HydrophobicContact CE3-CB 4.26Å; W164-R274 HydrophobicContact CG-CG 4.31Å; W164-R274 HydrophobicContact CH2-CB 4.22Å; W164-R274 VanDerWaalsContact CH2-O 3.23Å; W164-R274 WeakPolarHBondContact CH2-O 3.41Å; W164-R274 HydrophobicContact CZ2-CB 4.16Å; W164-R274 HydrophobicContact CZ3-CB 4.29Å; W164-R274 WeakPolarHBondContact CZ3-O 3.44Å; R270-R274 PolarHBondContact O-NH1 3.05Å; A271-R274 CarbonylContact O-C 3.51Å; A271-R274 WeakPolarHBondContact O-CA 3.49Å; A271-R274 WeakPolarHBondContact O-CB 3.44Å; A271-R274 PolarHBondContact O-N 2.83Å; A272-R274 PolarHBondContact O-N 3.48Å; A272-R274 VanDerWaalsContact O-N 3.17Å; R274-T283 WeakPolarHBondContact CD-O 3.22Å; R274-T283 PolarHBondContact O-N 3.16Å
275	Y	94.8	Very high	93.9	Very high	30 Å²	30	28.9 Å²	28.9	12%	0.118	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	133.3	166.7	178.2	-107.1	0	0	0	109.9	A272 P277 L282 F308 V312 A315	A272-Y275 VanDerWaalsContact O-CB 3.23Å; A272-Y275 WeakPolarHBondContact O-CB 3.48Å; A272-Y275 PolarHBondContact O-N 2.88Å; Y275-P277 HydrophobicContact CD1-CG 4.2Å; Y275-P277 HydrophobicContact CE1-CB 4.2Å; Y275-P277 HydrophobicContact CE1-CG 3.96Å; Y275-L282 HydrophobicContact CD2-CD2 3.96Å; Y275-L282 HydrophobicContact CG-CD2 4.34Å; Y275-F308 HydrophobicContact CD2-CD1 4.26Å; Y275-F308 HydrophobicContact CE2-CD1 4.06Å; Y275-F308 HydrophobicContact CE2-CE1 4.38Å; Y275-V312 HydrophobicContact CD1-CG2 4.31Å; Y275-V312 HydrophobicContact CE1-CB 4.31Å; Y275-V312 HydrophobicContact CE1-CG2 3.63Å; Y275-V312 HydrophobicContact CE2-CG2 4.12Å; Y275-A315 HydrophobicContact CD1-CB 4.19Å
276	D	92.8	Very high	92.9	Very high	4 Å²	4	28.8 Å²	28.8	2%	0.021	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	112.6	174.4	-166.4	28.7	0	0	0	110.3	W164 K165 R168 D278 S279 E280 T281	W164-D276 HydrophobicContact CH2-CB 3.99Å; W164-D276 HydrophobicContact CZ3-CB 4.4Å; K165-D276 IonicContact NZ-OD1 3Å; K165-D276 PolarHBondContact NZ-OD1 2.88Å; R168-D276 IonicContact CZ-OD2 3.4Å; R168-D276 VanDerWaalsContact NH1-CB 3.28Å; R168-D276 IonicContact NH1-OD2 2.88Å; R168-D276 PolarHBondContact NH1-OD2 3.47Å; R168-D276 IonicContact NH2-OD2 3.42Å; R168-D276 PolarHBondContact NH2-OD2 3.26Å; D276-D278 VanDerWaalsContact C-N 3.26Å; D276-D278 PolarHBondContact O-N 3.22Å; D276-S279 PolarHBondContact OD2-OG 3.43Å; D276-E280 VanDerWaalsContact O-CA 3.3Å; D276-E280 WeakPolarHBondContact O-CA 3.33Å; D276-E280 PolarHBondContact O-N 3.26Å; D276-T281 PolarHBondContact N-O 2.99Å; D276-T281 PolarHBondContact O-N 3.16Å
277	P	92.4	Very high	92.1	Very high	69 Å²	69	32.9 Å²	32.9	45%	0.448	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-30	179.6	-23.2	33.7	0	0	0	113.7	Y275 A315	Y275-P277 HydrophobicContact CD1-CG 4.2Å; Y275-P277 HydrophobicContact CE1-CB 4.2Å; Y275-P277 HydrophobicContact CE1-CG 3.96Å; P277-A315 HydrophobicContact CG-CB 4.35Å
278	D	91.8	Very high	91.7	Very high	149 Å²	149	32.7 Å²	32.7	80%	0.797	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-37.5	-175.2	-63	-36.9	0	0	0	112.3	D276	D276-D278 VanDerWaalsContact C-N 3.26Å; D276-D278 PolarHBondContact O-N 3.22Å
279	S	91.1	Very high	91.4	Very high	37 Å²	37	32.6 Å²	32.6	26%	0.259	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-1.7	178.6	63.2	0	0	0	0	113.6	R168 D276 T281	R168-S279 PolarHBondContact NH1-OG 3.3Å; R168-S279 VanDerWaalsContact NH1-OG 3.07Å; R168-S279 PolarHBondContact NH2-OG 3.14Å; D276-S279 PolarHBondContact OD2-OG 3.43Å; S279-T281 VanDerWaalsContact O-CG2 3.29Å; S279-T281 WeakPolarHBondContact O-CG2 3.34Å; S279-T281 PolarHBondContact O-N 3.39Å; S279-T281 PolarHBondContact OG-OG1 3Å
280	E	94.7	Very high	91.2	Very high	135 Å²	135	32.6 Å²	32.6	63%	0.631	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.3	40.2	-174.9	-58.7	-172.3	167.8	0	0	113.7	D276 F308	D276-E280 VanDerWaalsContact O-CA 3.3Å; D276-E280 WeakPolarHBondContact O-CA 3.33Å; D276-E280 PolarHBondContact O-N 3.26Å; E280-F308 WeakPolarHBondContact O-CE1 3.33Å
281	T	95.3	Very high	91.2	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	151	-176.9	58.5	0	0	0	0	112.9	R168 F170 D276 S279 V290 T291	R168-T281 PolarHBondContact NH1-OG1 3.44Å; F170-T281 HydrophobicContact CD1-CG2 4.33Å; F170-T281 HydrophobicContact CE1-CG2 3.89Å; D276-T281 PolarHBondContact N-O 2.99Å; D276-T281 PolarHBondContact O-N 3.16Å; S279-T281 VanDerWaalsContact O-CG2 3.29Å; S279-T281 WeakPolarHBondContact O-CG2 3.34Å; S279-T281 PolarHBondContact O-N 3.39Å; S279-T281 PolarHBondContact OG-OG1 3Å; T281-V290 CarbonylContact C-O 3.22Å; T281-V290 VanDerWaalsContact CA-O 3.23Å; T281-V290 WeakPolarHBondContact CA-O 3.46Å; T281-V290 VanDerWaalsContact CB-O 3.25Å; T281-V290 WeakPolarHBondContact CB-O 3.22Å; T281-T291 HydrophobicContact CG2-CG2 4.2Å
282	L	94.7	Very high	91.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	145.8	163	-64.6	173.4	0	0	0	110	A271 Y275 A289 V290 L295 I307 F308	A271-L282 WeakPolarHBondContact O-CD2 3.31Å; Y275-L282 HydrophobicContact CD2-CD2 3.96Å; Y275-L282 HydrophobicContact CG-CD2 4.34Å; L282-A289 CarbonylContact O-C 3.57Å; L282-A289 WeakPolarHBondContact O-CA 3.29Å; L282-V290 HydrophobicContact CB-CG2 4.26Å; L282-V290 PolarHBondContact N-O 3.43Å; L282-V290 PolarHBondContact O-N 2.76Å; L282-L295 HydrophobicContact CD1-CD2 4Å; L282-I307 HydrophobicContact CD1-CB 4.43Å; L282-I307 HydrophobicContact CD1-CG2 3.6Å; L282-F308 HydrophobicContact CB-CZ 4.12Å; L282-F308 HydrophobicContact CD1-CD1 4.33Å; L282-F308 HydrophobicContact CD1-CD2 3.53Å; L282-F308 HydrophobicContact CD1-CE1 4.21Å; L282-F308 HydrophobicContact CD1-CE2 3.37Å; L282-F308 HydrophobicContact CD1-CG 4.01Å; L282-F308 HydrophobicContact CD1-CZ 3.73Å; L282-F308 HydrophobicContact CG-CD1 4.09Å; L282-F308 HydrophobicContact CG-CD2 4.16Å; L282-F308 HydrophobicContact CG-CE1 3.76Å; L282-F308 HydrophobicContact CG-CE2 3.82Å; L282-F308 HydrophobicContact CG-CG 4.28Å; L282-F308 HydrophobicContact CG-CZ 3.6Å
283	T	91.4	Very high	91.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	111.8	171.9	-55.2	0	0	0	0	111.1	W164 R168 R274 M288	W164-T283 HydrophobicContact CE3-CG2 4.16Å; W164-T283 VanDerWaalsContact CE3-OG1 3.27Å; W164-T283 WeakPolarHBondContact CZ3-OG1 3.46Å; R168-T283 HydrophobicContact CB-CG2 4.08Å; R274-T283 WeakPolarHBondContact CD-O 3.22Å; R274-T283 PolarHBondContact O-N 3.16Å; T283-M288 CarbonylContact C-O 3.58Å; T283-M288 WeakPolarHBondContact CA-O 3.49Å
284	L	89.9	Confident	91.1	Very high	25 Å²	25	38.6 Å²	38.6	13%	0.131	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	143.4	179.2	-51.7	-175.1	0	0	0	111.2	F226 I229 A271 G286 E287 M288 V290 L295	F226-L284 HydrophobicContact CD1-CD1 4.01Å; F226-L284 HydrophobicContact CE1-CD1 3.76Å; I229-L284 HydrophobicContact CD1-CB 3.51Å; I229-L284 HydrophobicContact CD1-CD1 4.01Å; I229-L284 HydrophobicContact CD1-CG 4.43Å; A271-L284 HydrophobicContact CB-CD2 3.69Å; L284-G286 PolarHBondContact O-N 2.86Å; L284-E287 PolarHBondContact O-N 2.97Å; L284-E287 VanDerWaalsContact O-N 3.14Å; L284-M288 HydrophobicContact CB-CE 4.33Å; L284-M288 HydrophobicContact CD1-CE 4.24Å; L284-M288 PolarHBondContact N-O 3.04Å; L284-M288 PolarHBondContact O-N 3.06Å; L284-V290 HydrophobicContact CD1-CG1 4.42Å; L284-V290 HydrophobicContact CD1-CG2 3.92Å; L284-V290 HydrophobicContact CG-CG2 3.95Å; L284-L295 HydrophobicContact CD1-CD1 4.02Å
285	N	81.7	Confident	91.2	Very high	49 Å²	49	38.4 Å²	38.4	26%	0.262	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	22	179.8	-163.7	40.4	0	0	0	114.5	A159 I229 R236 E287	A159-N285 WeakPolarHBondContact CB-O 3.49Å; I229-N285 HydrophobicContact CB-CB 3.98Å; I229-N285 HydrophobicContact CD1-CB 4.11Å; I229-N285 HydrophobicContact CG2-CB 4.23Å; R236-N285 PolarHBondContact NH2-OD1 3.45Å; N285-E287 PolarHBondContact O-N 2.9Å
286	G	77	Confident	91.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	79	-14	-179.1	0	0	0	0	0	115.5	Q160 L284	Q160-G286 PolarHBondContact OE1-O 3.28Å; Q160-G286 VanDerWaalsContact OE1-O 3.07Å; L284-G286 PolarHBondContact O-N 2.86Å
287	E	81	Confident	91.2	Very high	87 Å²	87	44.4 Å²	44.4	41%	0.407	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.8	-23	-171.5	-63.8	-171.3	176.7	0	0	114.4	Q160 R168 K169 L284 N285	Q160-E287 PolarHBondContact NE2-OE1 2.72Å; R168-E287 CarbonylContact C-O 3.6Å; R168-E287 VanDerWaalsContact CA-O 3.3Å; R168-E287 WeakPolarHBondContact CA-O 3.16Å; K169-E287 PolarHBondContact N-O 2.83Å; L284-E287 PolarHBondContact O-N 2.97Å; L284-E287 VanDerWaalsContact O-N 3.14Å; N285-E287 PolarHBondContact O-N 2.9Å
288	M	87.9	Confident	91.1	Very high	24 Å²	24	41.2 Å²	41.2	12%	0.118	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	104.3	-172.7	-172.8	168.5	56	0	0	111	L171 F226 I229 T283 L284 V290	L171-M288 HydrophobicContact CB-CG 4.33Å; L171-M288 HydrophobicContact CD1-SD 3.92Å; L171-M288 HydrophobicContact CD2-SD 4.47Å; F226-M288 HydrophobicContact CD1-CE 3.51Å; F226-M288 HydrophobicContact CE1-CE 3.57Å; F226-M288 HydrophobicContact CE1-SD 4.38Å; I229-M288 HydrophobicContact CD1-CE 3.27Å; I229-M288 HydrophobicContact CG1-CE 3.77Å; I229-M288 HydrophobicContact CG2-CE 4.26Å; T283-M288 CarbonylContact C-O 3.58Å; T283-M288 WeakPolarHBondContact CA-O 3.49Å; L284-M288 HydrophobicContact CB-CE 4.33Å; L284-M288 HydrophobicContact CD1-CE 4.24Å; L284-M288 PolarHBondContact N-O 3.04Å; L284-M288 PolarHBondContact O-N 3.06Å; M288-V290 HydrophobicContact CG-CG1 3.87Å; M288-V290 HydrophobicContact SD-CG1 4.46Å
289	A	91.9	Very high	91.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	125.5	173.3	0	0	0	0	0	110	R168 K169 F170 L171 L282	R168-A289 HydrophobicContact CB-CB 4.21Å; R168-A289 HydrophobicContact CG-CB 4.19Å; K169-A289 PolarHBondContact O-N 3.44Å; F170-A289 HydrophobicContact CD1-CB 3.89Å; F170-A289 HydrophobicContact CE1-CB 4.06Å; F170-A289 HydrophobicContact CG-CB 4.23Å; L171-A289 PolarHBondContact N-O 3.46Å; L282-A289 CarbonylContact O-C 3.57Å; L282-A289 WeakPolarHBondContact O-CA 3.29Å
290	V	94.3	Very high	91.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	142.8	-177.6	-61.1	0	0	0	0	111.8	L171 F226 T281 L282 L284 M288 Q294 L295 F308	L171-V290 HydrophobicContact CB-CG1 4.1Å; L171-V290 HydrophobicContact CD2-CG1 4.1Å; F226-V290 HydrophobicContact CE1-CG1 3.82Å; F226-V290 HydrophobicContact CZ-CG1 4.06Å; T281-V290 CarbonylContact C-O 3.22Å; T281-V290 VanDerWaalsContact CA-O 3.23Å; T281-V290 WeakPolarHBondContact CA-O 3.46Å; T281-V290 VanDerWaalsContact CB-O 3.25Å; T281-V290 WeakPolarHBondContact CB-O 3.22Å; L282-V290 HydrophobicContact CB-CG2 4.26Å; L282-V290 PolarHBondContact N-O 3.43Å; L282-V290 PolarHBondContact O-N 2.76Å; L284-V290 HydrophobicContact CD1-CG1 4.42Å; L284-V290 HydrophobicContact CD1-CG2 3.92Å; L284-V290 HydrophobicContact CG-CG2 3.95Å; M288-V290 HydrophobicContact CG-CG1 3.87Å; M288-V290 HydrophobicContact SD-CG1 4.46Å; V290-Q294 HydrophobicContact CB-CB 4.44Å; V290-L295 HydrophobicContact CG2-CB 4.24Å; V290-F308 WeakPolarHBondContact O-CZ 3.37Å
291	T	95.4	Very high	91.1	Very high	56 Å²	56	28 Å²	28	34%	0.344	15%	0.149	S	C	.	.			trans	-81.8	166	171.6	72	0	0	0	0	111	T281 G293 Q294 L295	T281-T291 HydrophobicContact CG2-CG2 4.2Å; T291-G293 VanDerWaalsContact C-N 3.29Å; T291-G293 PolarHBondContact O-N 2.91Å; T291-Q294 PolarHBondContact O-N 2.88Å; T291-Q294 WeakPolarHBondContact OG1-CG 3.45Å; T291-Q294 PolarHBondContact OG1-N 2.92Å; T291-Q294 PolarHBondContact OG1-OE1 3.26Å; T291-L295 PolarHBondContact O-N 2.95Å; T291-L295 VanDerWaalsContact O-N 3.12Å
292	R	95.4	Very high	91	Very high	81 Å²	81	32.8 Å²	32.8	31%	0.306	18%	0.178	S	C	.	.	H	α-helix	trans	-56	-44	176.4	-174.4	-175.1	-72.5	-97	6.7	112.3	K296 S304 D305 F308 D309	R292-K296 WeakPolarHBondContact O-CB 3.27Å; R292-K296 PolarHBondContact O-N 3.44Å; R292-S304 PolarHBondContact O-OG 3.49Å; R292-S304 VanDerWaalsContact O-OG 3.05Å; R292-D305 WeakPolarHBondContact CD-OD1 3.37Å; R292-D305 VanDerWaalsContact NH1-CA 3.32Å; R292-D305 PolarHBondContact NH1-O 3.33Å; R292-D305 IonicContact NH1-OD1 3.03Å; R292-D305 PolarHBondContact NH1-OD1 3.46Å; R292-F308 VanDerWaalsContact CA-CZ 3.44Å; R292-F308 HydrophobicContact CB-CD1 4.14Å; R292-F308 HydrophobicContact CB-CD2 4.07Å; R292-F308 HydrophobicContact CB-CE1 4.09Å; R292-F308 HydrophobicContact CB-CE2 4.04Å; R292-F308 HydrophobicContact CB-CG 4.13Å; R292-F308 HydrophobicContact CB-CZ 4.06Å; R292-F308 HydrophobicContact CG-CD2 4.08Å; R292-F308 HydrophobicContact CG-CE2 4.47Å; R292-F308 HydrophobicContact CG-CG 4.18Å; R292-F308 VanDerWaalsContact NH2-CB 3.34Å; R292-D309 IonicContact CZ-OD1 2.78Å; R292-D309 IonicContact NH1-OD1 3.54Å; R292-D309 PolarHBondContact NH1-OD1 2.9Å; R292-D309 IonicContact NH2-OD1 3.88Å; R292-D309 PolarHBondContact NH2-OD1 3.47Å
293	G	93.5	Very high	91	Very high	33 Å²	33	32.8 Å²	32.8	34%	0.34	18%	0.179	S	C	.	.	H	α-helix	trans	-64.6	-45.6	178.3	0	0	0	0	0	112.6	T291 L295 K296 N297	T291-G293 VanDerWaalsContact C-N 3.29Å; T291-G293 PolarHBondContact O-N 2.91Å; G293-L295 PolarHBondContact O-N 3.13Å; G293-K296 WeakPolarHBondContact O-CB 3.39Å; G293-K296 PolarHBondContact O-N 3Å; G293-N297 WeakPolarHBondContact O-CB 3.29Å; G293-N297 PolarHBondContact O-N 3.37Å; G293-N297 PolarHBondContact O-ND2 3.27Å
294	Q	93.3	Very high	91.3	Very high	21 Å²	21	32.8 Å²	32.8	10%	0.098	18%	0.179	C	C	.	.	H	α-helix	trans	-61	-45.6	179.4	-72.5	172.9	-28.8	0	0	112.2	L171 F226 V290 T291 K296 G298	L171-Q294 HydrophobicContact CD2-CB 4.4Å; L171-Q294 PolarHBondContact O-NE2 3.3Å; F226-Q294 WeakPolarHBondContact CE2-O 3.24Å; V290-Q294 HydrophobicContact CB-CB 4.44Å; T291-Q294 PolarHBondContact O-N 2.88Å; T291-Q294 WeakPolarHBondContact OG1-CG 3.45Å; T291-Q294 PolarHBondContact OG1-N 2.92Å; T291-Q294 PolarHBondContact OG1-OE1 3.26Å; Q294-K296 VanDerWaalsContact C-N 3.35Å; Q294-G298 PolarHBondContact O-N 3.34Å
295	L	94.4	Very high	91.6	Very high	5 Å²	5	33.5 Å²	33.5	3%	0.026	18%	0.183	C	C	.	.	H	α-helix	trans	-68.1	-35.8	178.3	-173.8	62.5	0	0	0	112.2	F226 L282 L284 V290 T291 G293 L300 S304 F308	F226-L295 HydrophobicContact CE1-CD1 4.25Å; F226-L295 HydrophobicContact CE2-CD1 4.32Å; F226-L295 HydrophobicContact CZ-CD1 4.05Å; L282-L295 HydrophobicContact CD1-CD2 4Å; L284-L295 HydrophobicContact CD1-CD1 4.02Å; V290-L295 HydrophobicContact CG2-CB 4.24Å; T291-L295 PolarHBondContact O-N 2.95Å; T291-L295 VanDerWaalsContact O-N 3.12Å; G293-L295 PolarHBondContact O-N 3.13Å; L295-L300 HydrophobicContact CD1-CD1 3.6Å; L295-L300 HydrophobicContact CD1-CG 4.26Å; L295-L300 HydrophobicContact CD2-CD1 4.13Å; L295-L300 HydrophobicContact CG-CD1 3.81Å; L295-L300 PolarHBondContact O-N 3.48Å; L295-S304 WeakPolarHBondContact CB-OG 3.27Å; L295-F308 HydrophobicContact CB-CE2 4.15Å; L295-F308 HydrophobicContact CD2-CD2 4.31Å; L295-F308 HydrophobicContact CD2-CE2 3.8Å
296	K	94.5	Very high	92.4	Very high	78 Å²	78	33 Å²	33	34%	0.339	19%	0.185	S	C	.	.	I	π-helix	trans	-64.5	-50.2	175.6	179.8	164.3	-171.5	157.7	0	111.4	R292 G293 Q294 G301 S304 D305	R292-K296 WeakPolarHBondContact O-CB 3.27Å; R292-K296 PolarHBondContact O-N 3.44Å; G293-K296 WeakPolarHBondContact O-CB 3.39Å; G293-K296 PolarHBondContact O-N 3Å; Q294-K296 VanDerWaalsContact C-N 3.35Å; K296-G301 WeakPolarHBondContact O-CA 3.49Å; K296-G301 PolarHBondContact O-N 3.29Å; K296-S304 PolarHBondContact N-OG 3.21Å; K296-D305 IonicContact NZ-OD2 2.65Å; K296-D305 PolarHBondContact NZ-OD2 3.35Å
297	N	92.4	Very high	93.4	Very high	82 Å²	82	33.3 Å²	33.3	44%	0.439	19%	0.187	S	C	.	.	I	π-helix	trans	-73.4	-31.8	-175.6	-65	-11	0	0	0	112.2	V218 D219 G293 G299	V218-N297 WeakPolarHBondContact CA-O 3.49Å; V218-N297 WeakPolarHBondContact CG1-O 3.31Å; D219-N297 HydrophobicContact CB-CB 4.22Å; D219-N297 PolarHBondContact N-O 3.41Å; G293-N297 WeakPolarHBondContact O-CB 3.29Å; G293-N297 PolarHBondContact O-N 3.37Å; G293-N297 PolarHBondContact O-ND2 3.27Å; N297-G299 PolarHBondContact O-N 3.03Å
298	G	91.9	Very high	94.2	Very high	3 Å²	3	29.3 Å²	29.3	3%	0.031	17%	0.168	C	C	.	.	I	π-helix	trans	-79.8	31.2	175.4	0	0	0	0	0	114.6	F223 F226 Q294	F223-G298 WeakPolarHBondContact CD2-O 3.13Å; F226-G298 WeakPolarHBondContact CD2-O 3.38Å; Q294-G298 PolarHBondContact O-N 3.34Å
299	G	91.4	Very high	94.7	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.185	C	C	.	.	I	π-helix	trans	115.7	-30.1	165.2	0	0	0	0	0	115.4	N297 G301 R392 M396	N297-G299 PolarHBondContact O-N 3.03Å; G299-G301 VanDerWaalsContact C-N 3.33Å; G299-G301 PolarHBondContact O-N 3.29Å; G299-R392 PolarHBondContact O-NE 3.21Å; G299-R392 PolarHBondContact O-NH2 3.14Å; G299-M396 WeakPolarHBondContact O-CG 2.97Å
300	L	93.1	Very high	94.9	Very high	29 Å²	29	32.7 Å²	32.7	15%	0.152	19%	0.186	C	C	.	.	I	π-helix	trans	-74.6	-18.5	-174.3	-69.9	-170.1	0	0	0	114.4	M264 L295 V302 V303 I307	M264-L300 HydrophobicContact CE-CD1 4.31Å; M264-L300 HydrophobicContact CE-CD2 4.2Å; L295-L300 HydrophobicContact CD1-CD1 3.6Å; L295-L300 HydrophobicContact CD1-CG 4.26Å; L295-L300 HydrophobicContact CD2-CD1 4.13Å; L295-L300 HydrophobicContact CG-CD1 3.81Å; L295-L300 PolarHBondContact O-N 3.48Å; L300-V302 PolarHBondContact O-N 3.09Å; L300-V303 HydrophobicContact CB-CB 4.33Å; L300-V303 VanDerWaalsContact O-CB 3.26Å; L300-V303 WeakPolarHBondContact O-CB 3.41Å; L300-V303 WeakPolarHBondContact O-CG2 3.35Å; L300-V303 PolarHBondContact O-N 2.99Å; L300-I307 HydrophobicContact CD1-CD1 3.95Å
301	G	93.2	Very high	95.1	Very high	13 Å²	13	32.7 Å²	32.7	13%	0.134	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	-133	177.7	0	0	0	0	0	112.3	K296 G299 V303 S304	K296-G301 WeakPolarHBondContact O-CA 3.49Å; K296-G301 PolarHBondContact O-N 3.29Å; G299-G301 VanDerWaalsContact C-N 3.33Å; G299-G301 PolarHBondContact O-N 3.29Å; G301-V303 PolarHBondContact O-N 3.47Å; G301-V303 VanDerWaalsContact O-N 3.16Å; G301-S304 WeakPolarHBondContact O-CB 3.38Å; G301-S304 PolarHBondContact O-N 3.4Å; G301-S304 VanDerWaalsContact O-N 3.08Å
302	V	91.7	Very high	95.1	Very high	102 Å²	102	33.3 Å²	33.3	62%	0.618	19%	0.19	S	C	*	.	H	α-helix	trans	-62.2	-19.3	179.5	-61.9	0	0	0	0	114.2	L300 S304 D305	L300-V302 PolarHBondContact O-N 3.09Å; V302-S304 PolarHBondContact O-N 3.08Å; V302-D305 WeakPolarHBondContact O-CB 3.42Å; V302-D305 PolarHBondContact O-N 3.31Å; V302-D305 VanDerWaalsContact O-N 3.16Å
303	V	96.4	Very high	95.2	Very high	1 Å²	1	31 Å²	31	1%	0.006	19%	0.187	C	C	.	.	H	α-helix	trans	-65.5	-32.8	175.7	-173.9	0	0	0	0	110.4	M264 L300 G301 D305 A306 I307 I385 C388 H389 R392	M264-V303 HydrophobicContact CE-CG1 3.94Å; L300-V303 HydrophobicContact CB-CB 4.33Å; L300-V303 VanDerWaalsContact O-CB 3.26Å; L300-V303 WeakPolarHBondContact O-CB 3.41Å; L300-V303 WeakPolarHBondContact O-CG2 3.35Å; L300-V303 PolarHBondContact O-N 2.99Å; G301-V303 PolarHBondContact O-N 3.47Å; G301-V303 VanDerWaalsContact O-N 3.16Å; V303-D305 VanDerWaalsContact C-N 3.25Å; V303-D305 PolarHBondContact O-N 3.42Å; V303-A306 PolarHBondContact O-N 2.9Å; V303-I307 HydrophobicContact CG1-CD1 4.12Å; V303-I307 HydrophobicContact CG1-CG1 4.45Å; V303-I307 WeakPolarHBondContact O-CG1 3.42Å; V303-I307 PolarHBondContact O-N 3.22Å; V303-I307 VanDerWaalsContact O-N 3.13Å; V303-I385 HydrophobicContact CG1-CG2 3.97Å; V303-C388 HydrophobicContact CG2-CB 4.05Å; V303-H389 HydrophobicContact CG1-CB 4.32Å; V303-H389 HydrophobicContact CG2-CB 4.5Å; V303-R392 HydrophobicContact CG2-CB 3.93Å; V303-R392 HydrophobicContact CG2-CG 4.33Å
304	S	96.8	Very high	95.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-54.5	-45.2	172.8	-178.4	0	0	0	0	111	R292 L295 K296 G301 V302 A306 I307 F308	R292-S304 PolarHBondContact O-OG 3.49Å; R292-S304 VanDerWaalsContact O-OG 3.05Å; L295-S304 WeakPolarHBondContact CB-OG 3.27Å; K296-S304 PolarHBondContact N-OG 3.21Å; G301-S304 WeakPolarHBondContact O-CB 3.38Å; G301-S304 PolarHBondContact O-N 3.4Å; G301-S304 VanDerWaalsContact O-N 3.08Å; V302-S304 PolarHBondContact O-N 3.08Å; S304-A306 VanDerWaalsContact C-N 3.33Å; S304-A306 PolarHBondContact O-N 2.72Å; S304-I307 PolarHBondContact O-N 2.87Å; S304-F308 WeakPolarHBondContact O-CD2 3.31Å; S304-F308 PolarHBondContact O-N 2.93Å
305	D	96.4	Very high	95.2	Very high	40 Å²	40	31.2 Å²	31.2	21%	0.214	19%	0.187	C	C	.	.	H	α-helix	trans	-61.2	-43.9	-176.5	-69	-43.2	0	0	0	111.4	R292 K296 V302 V303 I307 F308 D309	R292-D305 WeakPolarHBondContact CD-OD1 3.37Å; R292-D305 VanDerWaalsContact NH1-CA 3.32Å; R292-D305 PolarHBondContact NH1-O 3.33Å; R292-D305 IonicContact NH1-OD1 3.03Å; R292-D305 PolarHBondContact NH1-OD1 3.46Å; K296-D305 IonicContact NZ-OD2 2.65Å; K296-D305 PolarHBondContact NZ-OD2 3.35Å; V302-D305 WeakPolarHBondContact O-CB 3.42Å; V302-D305 PolarHBondContact O-N 3.31Å; V302-D305 VanDerWaalsContact O-N 3.16Å; V303-D305 VanDerWaalsContact C-N 3.25Å; V303-D305 PolarHBondContact O-N 3.42Å; D305-I307 PolarHBondContact O-N 3.11Å; D305-F308 PolarHBondContact O-N 2.87Å; D305-D309 WeakPolarHBondContact O-CB 3.41Å; D305-D309 PolarHBondContact O-N 3.46Å
306	A	97.8	Very high	95	Very high	39 Å²	39	35 Å²	35	32%	0.322	21%	0.214	S	C	.	.	H	α-helix	trans	-64.4	-39.2	177	0	0	0	0	0	113.2	V303 S304 D309 L310 I385	V303-A306 PolarHBondContact O-N 2.9Å; S304-A306 VanDerWaalsContact C-N 3.33Å; S304-A306 PolarHBondContact O-N 2.72Å; A306-D309 PolarHBondContact O-N 2.94Å; A306-L310 WeakPolarHBondContact O-CB 3.15Å; A306-L310 PolarHBondContact O-N 3.24Å; A306-I385 HydrophobicContact CB-CD1 4.23Å; A306-I385 HydrophobicContact CB-CG1 3.7Å
307	I	98.2	Very high	94.9	Very high	5 Å²	5	32 Å²	32	3%	0.026	20%	0.201	C	C	.	.	H	α-helix	trans	-67.5	-42.1	178.3	-60.9	167.7	0	0	0	110.8	M264 A271 L282 L300 V303 S304 D305 L310 G311 I385	M264-I307 HydrophobicContact CE-CD1 3.92Å; A271-I307 HydrophobicContact CB-CG2 4.33Å; L282-I307 HydrophobicContact CD1-CB 4.43Å; L282-I307 HydrophobicContact CD1-CG2 3.6Å; L300-I307 HydrophobicContact CD1-CD1 3.95Å; V303-I307 HydrophobicContact CG1-CD1 4.12Å; V303-I307 HydrophobicContact CG1-CG1 4.45Å; V303-I307 WeakPolarHBondContact O-CG1 3.42Å; V303-I307 PolarHBondContact O-N 3.22Å; V303-I307 VanDerWaalsContact O-N 3.13Å; S304-I307 PolarHBondContact O-N 2.87Å; D305-I307 PolarHBondContact O-N 3.11Å; I307-L310 WeakPolarHBondContact O-CB 3.4Å; I307-L310 PolarHBondContact O-N 3.12Å; I307-G311 PolarHBondContact O-N 3.24Å; I307-I385 HydrophobicContact CG1-CD1 4.28Å; I307-I385 HydrophobicContact CG1-CG2 4.03Å
308	F	98.1	Very high	94.9	Very high	3 Å²	3	34.2 Å²	34.2	1%	0.013	21%	0.213	C	C	.	.	H	α-helix	trans	-66.2	-41.7	177	-89.9	-94.7	0	0	0	112	Y275 E280 L282 V290 R292 L295 S304 D305 L310 G311 V312	Y275-F308 HydrophobicContact CD2-CD1 4.26Å; Y275-F308 HydrophobicContact CE2-CD1 4.06Å; Y275-F308 HydrophobicContact CE2-CE1 4.38Å; E280-F308 WeakPolarHBondContact O-CE1 3.33Å; L282-F308 HydrophobicContact CB-CZ 4.12Å; L282-F308 HydrophobicContact CD1-CD1 4.33Å; L282-F308 HydrophobicContact CD1-CD2 3.53Å; L282-F308 HydrophobicContact CD1-CE1 4.21Å; L282-F308 HydrophobicContact CD1-CE2 3.37Å; L282-F308 HydrophobicContact CD1-CG 4.01Å; L282-F308 HydrophobicContact CD1-CZ 3.73Å; L282-F308 HydrophobicContact CG-CD1 4.09Å; L282-F308 HydrophobicContact CG-CD2 4.16Å; L282-F308 HydrophobicContact CG-CE1 3.76Å; L282-F308 HydrophobicContact CG-CE2 3.82Å; L282-F308 HydrophobicContact CG-CG 4.28Å; L282-F308 HydrophobicContact CG-CZ 3.6Å; V290-F308 WeakPolarHBondContact O-CZ 3.37Å; R292-F308 VanDerWaalsContact CA-CZ 3.44Å; R292-F308 HydrophobicContact CB-CD1 4.14Å; R292-F308 HydrophobicContact CB-CD2 4.07Å; R292-F308 HydrophobicContact CB-CE1 4.09Å; R292-F308 HydrophobicContact CB-CE2 4.04Å; R292-F308 HydrophobicContact CB-CG 4.13Å; R292-F308 HydrophobicContact CB-CZ 4.06Å; R292-F308 HydrophobicContact CG-CD2 4.08Å; R292-F308 HydrophobicContact CG-CE2 4.47Å; R292-F308 HydrophobicContact CG-CG 4.18Å; R292-F308 VanDerWaalsContact NH2-CB 3.34Å; L295-F308 HydrophobicContact CB-CE2 4.15Å; L295-F308 HydrophobicContact CD2-CD2 4.31Å; L295-F308 HydrophobicContact CD2-CE2 3.8Å; S304-F308 WeakPolarHBondContact O-CD2 3.31Å; S304-F308 PolarHBondContact O-N 2.93Å; D305-F308 PolarHBondContact O-N 2.87Å; F308-L310 VanDerWaalsContact C-N 3.29Å; F308-L310 PolarHBondContact O-N 3.06Å; F308-G311 WeakPolarHBondContact O-CA 3.43Å; F308-G311 PolarHBondContact O-N 3.18Å; F308-V312 WeakPolarHBondContact O-CG2 3.23Å; F308-V312 PolarHBondContact O-N 3Å
309	D	97.6	Very high	95	Very high	90 Å²	90	35.6 Å²	35.6	48%	0.481	22%	0.22	S	C	.	.	H	α-helix	trans	-64.9	-37	178.2	-66	-4.3	0	0	0	111.2	R292 D305 A306 S313	R292-D309 IonicContact CZ-OD1 2.78Å; R292-D309 IonicContact NH1-OD1 3.54Å; R292-D309 PolarHBondContact NH1-OD1 2.9Å; R292-D309 IonicContact NH2-OD1 3.88Å; R292-D309 PolarHBondContact NH2-OD1 3.47Å; D305-D309 WeakPolarHBondContact O-CB 3.41Å; D305-D309 PolarHBondContact O-N 3.46Å; A306-D309 PolarHBondContact O-N 2.94Å; D309-S313 WeakPolarHBondContact O-CB 3.39Å; D309-S313 PolarHBondContact O-N 3.24Å
310	L	97.9	Very high	95.2	Very high	5 Å²	5	37.8 Å²	37.8	3%	0.026	23%	0.231	C	C	.	.	H	α-helix	trans	-61.2	-44.6	169.1	-179.9	64.6	0	0	0	111.6	A272 A306 I307 F308 S313 L314 K378 D381 L382 I385	A272-L310 HydrophobicContact CB-CB 4.31Å; A272-L310 HydrophobicContact CB-CD2 3.9Å; A272-L310 HydrophobicContact CB-CG 3.87Å; A306-L310 WeakPolarHBondContact O-CB 3.15Å; A306-L310 PolarHBondContact O-N 3.24Å; I307-L310 WeakPolarHBondContact O-CB 3.4Å; I307-L310 PolarHBondContact O-N 3.12Å; F308-L310 VanDerWaalsContact C-N 3.29Å; F308-L310 PolarHBondContact O-N 3.06Å; L310-S313 WeakPolarHBondContact O-CB 3.46Å; L310-S313 PolarHBondContact O-N 3.44Å; L310-L314 HydrophobicContact CD1-CD1 3.91Å; L310-L314 HydrophobicContact CD1-CG 3.95Å; L310-L314 HydrophobicContact CD2-CD1 4.36Å; L310-L314 HydrophobicContact CG-CD1 3.83Å; L310-L314 HydrophobicContact CG-CG 4.24Å; L310-L314 WeakPolarHBondContact O-CB 3.42Å; L310-L314 WeakPolarHBondContact O-CG 3.33Å; L310-L314 PolarHBondContact O-N 3.44Å; L310-K378 HydrophobicContact CD1-CB 4.33Å; L310-K378 HydrophobicContact CD1-CD 3.88Å; L310-K378 HydrophobicContact CD1-CG 4.47Å; L310-D381 HydrophobicContact CD1-CB 4.3Å; L310-L382 HydrophobicContact CD2-CD1 4.48Å; L310-L382 HydrophobicContact CD2-CD2 3.38Å; L310-L382 HydrophobicContact CD2-CG 3.82Å; L310-I385 HydrophobicContact CB-CD1 4.38Å; L310-I385 HydrophobicContact CD2-CD1 3.94Å
311	G	97.2	Very high	95.3	Very high	0 Å²	0	38 Å²	38	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.1	-47.7	178	0	0	0	0	0	113.3	A272 I307 F308 S313 L314 A315	A272-G311 WeakPolarHBondContact O-CA 3.38Å; I307-G311 PolarHBondContact O-N 3.24Å; F308-G311 WeakPolarHBondContact O-CA 3.43Å; F308-G311 PolarHBondContact O-N 3.18Å; G311-S313 VanDerWaalsContact C-N 3.28Å; G311-S313 PolarHBondContact O-N 3.42Å; G311-L314 PolarHBondContact O-N 3.15Å; G311-A315 PolarHBondContact O-N 2.98Å
312	V	96.7	Very high	95.5	Very high	70 Å²	70	38.1 Å²	38.1	42%	0.424	23%	0.231	S	C	.	.	H	α-helix	trans	-56.9	-45.3	173.1	173	0	0	0	0	110.3	Y275 F308	Y275-V312 HydrophobicContact CD1-CG2 4.31Å; Y275-V312 HydrophobicContact CE1-CB 4.31Å; Y275-V312 HydrophobicContact CE1-CG2 3.63Å; Y275-V312 HydrophobicContact CE2-CG2 4.12Å; F308-V312 WeakPolarHBondContact O-CG2 3.23Å; F308-V312 PolarHBondContact O-N 3Å
313	S	95.7	Very high	95.8	Very high	33 Å²	33	33.2 Å²	33.2	23%	0.231	20%	0.202	C	C	.	.	H	α-helix	trans	-63.1	-47.7	178.4	-174.9	0	0	0	0	112.2	D309 L310 G311 A315 S316 F317 K378	D309-S313 WeakPolarHBondContact O-CB 3.39Å; D309-S313 PolarHBondContact O-N 3.24Å; L310-S313 WeakPolarHBondContact O-CB 3.46Å; L310-S313 PolarHBondContact O-N 3.44Å; G311-S313 VanDerWaalsContact C-N 3.28Å; G311-S313 PolarHBondContact O-N 3.42Å; S313-A315 VanDerWaalsContact C-N 3.33Å; S313-A315 PolarHBondContact O-N 3.15Å; S313-S316 PolarHBondContact O-N 3.26Å; S313-S316 PolarHBondContact O-OG 3.23Å; S313-F317 VanDerWaalsContact O-CD2 3.3Å; S313-F317 WeakPolarHBondContact O-CD2 3.43Å; S313-K378 WeakPolarHBondContact OG-CE 3.37Å; S313-K378 PolarHBondContact OG-NZ 3.4Å
314	L	95.6	Very high	95.8	Very high	7 Å²	7	33.5 Å²	33.5	4%	0.037	20%	0.203	C	C	.	.	H	α-helix	trans	-70.5	-27.6	-176	-73.8	178.1	0	0	0	112.8	L269 A272 V273 L310 G311 S316 F317 L319 K378	L269-L314 HydrophobicContact CD1-CD1 3.79Å; A272-L314 HydrophobicContact CB-CD1 4.02Å; V273-L314 HydrophobicContact CG1-CD1 4.04Å; L310-L314 HydrophobicContact CD1-CD1 3.91Å; L310-L314 HydrophobicContact CD1-CG 3.95Å; L310-L314 HydrophobicContact CD2-CD1 4.36Å; L310-L314 HydrophobicContact CG-CD1 3.83Å; L310-L314 HydrophobicContact CG-CG 4.24Å; L310-L314 WeakPolarHBondContact O-CB 3.42Å; L310-L314 WeakPolarHBondContact O-CG 3.33Å; L310-L314 PolarHBondContact O-N 3.44Å; G311-L314 PolarHBondContact O-N 3.15Å; L314-S316 PolarHBondContact O-N 3.16Å; L314-S316 VanDerWaalsContact O-N 3.13Å; L314-F317 WeakPolarHBondContact O-CB 3.43Å; L314-F317 PolarHBondContact O-N 3Å; L314-L319 HydrophobicContact CD2-CD1 3.97Å; L314-K378 HydrophobicContact CD2-CG 3.99Å
315	A	92.9	Very high	95.9	Very high	50 Å²	50	33.5 Å²	33.5	41%	0.413	20%	0.203	S	C	.	.	H	α-helix	trans	-56	-30.6	174.5	0	0	0	0	0	112.7	Y275 P277 G311 S313 F317	Y275-A315 HydrophobicContact CD1-CB 4.19Å; P277-A315 HydrophobicContact CG-CB 4.35Å; G311-A315 PolarHBondContact O-N 2.98Å; S313-A315 VanDerWaalsContact C-N 3.33Å; S313-A315 PolarHBondContact O-N 3.15Å; A315-F317 VanDerWaalsContact C-N 3.33Å
316	S	90.3	Very high	96	Very high	84 Å²	84	31.6 Å²	31.6	59%	0.587	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-13.6	177	72.4	0	0	0	0	114.6	S313 L314	S313-S316 PolarHBondContact O-N 3.26Å; S313-S316 PolarHBondContact O-OG 3.23Å; L314-S316 PolarHBondContact O-N 3.16Å; L314-S316 VanDerWaalsContact O-N 3.13Å
317	F	92	Very high	96	Very high	17 Å²	17	29.7 Å²	29.7	8%	0.075	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-24.3	-178.3	-79.2	-118.4	0	0	0	112.5	S313 L314 A315 L319 F371 K374 L375	S313-F317 VanDerWaalsContact O-CD2 3.3Å; S313-F317 WeakPolarHBondContact O-CD2 3.43Å; L314-F317 WeakPolarHBondContact O-CB 3.43Å; L314-F317 PolarHBondContact O-N 3Å; A315-F317 VanDerWaalsContact C-N 3.33Å; F317-L319 VanDerWaalsContact C-N 3.34Å; F317-L319 HydrophobicContact CB-CD2 3.87Å; F317-L319 HydrophobicContact CB-CG 3.94Å; F317-L319 HydrophobicContact CD1-CD2 4.44Å; F317-L319 PolarHBondContact O-N 3.4Å; F317-F371 HydrophobicContact CB-CE2 3.99Å; F317-F371 HydrophobicContact CB-CZ 4.39Å; F317-F371 AromaticContact CD1-CD2 3.93Å; F317-F371 HydrophobicContact CD1-CD2 3.93Å; F317-F371 AromaticContact CD1-CE2 3.37Å; F317-F371 HydrophobicContact CD1-CE2 3.37Å; F317-F371 AromaticContact CD1-CZ 3.73Å; F317-F371 HydrophobicContact CD1-CZ 3.73Å; F317-F371 HydrophobicContact CE1-CD2 4.3Å; F317-F371 HydrophobicContact CE1-CE2 4.18Å; F317-F371 AromaticContact CG-CE2 3.99Å; F317-F371 HydrophobicContact CG-CE2 3.99Å; F317-K374 HydrophobicContact CE1-CB 4.1Å; F317-K374 HydrophobicContact CZ-CB 3.88Å; F317-L375 HydrophobicContact CD1-CB 4.33Å; F317-L375 HydrophobicContact CD1-CD1 4.04Å; F317-L375 HydrophobicContact CE1-CB 3.95Å; F317-L375 HydrophobicContact CE1-CD1 4.23Å
318	N	91.1	Very high	96	Very high	127 Å²	127	29.5 Å²	29.5	68%	0.679	18%	0.176	S	C	*	.			trans	51	53.3	-177.2	-169.8	57.7	0	0	0	112.2
319	L	94.8	Very high	96.1	Very high	33 Å²	33	29.3 Å²	29.3	17%	0.173	18%	0.176	C	C	.	.			trans	-67.6	141.4	178.3	-58.4	-178.1	0	0	0	110.7	L314 F317 E323 V324 F371 L375	L314-L319 HydrophobicContact CD2-CD1 3.97Å; F317-L319 VanDerWaalsContact C-N 3.34Å; F317-L319 HydrophobicContact CB-CD2 3.87Å; F317-L319 HydrophobicContact CB-CG 3.94Å; F317-L319 HydrophobicContact CD1-CD2 4.44Å; F317-L319 PolarHBondContact O-N 3.4Å; L319-E323 VanDerWaalsContact CA-OE2 3.24Å; L319-E323 WeakPolarHBondContact CA-OE2 3.36Å; L319-E323 HydrophobicContact CB-CB 4.25Å; L319-E323 HydrophobicContact CD2-CB 4.1Å; L319-V324 HydrophobicContact CB-CG2 3.89Å; L319-V324 HydrophobicContact CD1-CG2 4.19Å; L319-F371 HydrophobicContact CD2-CZ 3.76Å; L319-L375 HydrophobicContact CD1-CD1 4.04Å; L319-L375 HydrophobicContact CD2-CD1 4.06Å; L319-L375 HydrophobicContact CD2-CD2 4.1Å
320	D	94.9	Very high	96.1	Very high	46 Å²	46	25.3 Å²	25.3	25%	0.246	15%	0.154	C	C	.	.			trans	-92	176.3	166.9	79.5	-6.7	0	0	0	112.4	S322 E323 V324 Y360 R364	D320-S322 PolarHBondContact O-N 3.5Å; D320-S322 WeakPolarHBondContact OD1-CA 3.19Å; D320-S322 WeakPolarHBondContact OD1-CB 3.43Å; D320-S322 PolarHBondContact OD1-N 3.36Å; D320-E323 PolarHBondContact N-OE2 3.49Å; D320-E323 PolarHBondContact O-N 2.97Å; D320-E323 VanDerWaalsContact OD1-CG 3.32Å; D320-E323 WeakPolarHBondContact OD1-CG 3.48Å; D320-E323 PolarHBondContact OD1-N 2.88Å; D320-V324 WeakPolarHBondContact O-CG2 3.34Å; D320-V324 PolarHBondContact O-N 3.38Å; D320-V324 VanDerWaalsContact O-N 3.09Å; D320-Y360 PolarHBondContact OD2-OH 2.9Å; D320-R364 VanDerWaalsContact CB-NH1 3.34Å; D320-R364 IonicContact OD1-NH1 3.41Å; D320-R364 PolarHBondContact OD1-NH1 3.29Å; D320-R364 VanDerWaalsContact OD1-NH1 3.09Å; D320-R364 IonicContact OD2-CZ 2.8Å; D320-R364 IonicContact OD2-NH1 3.6Å; D320-R364 PolarHBondContact OD2-NH1 3.42Å
321	D	95.4	Very high	96.1	Very high	33 Å²	33	25 Å²	25	18%	0.176	15%	0.153	C	C	.	.	H	α-helix	trans	-58.4	-33	180	-71.3	-45.7	0	0	0	112.6	T151 H154 M155 A325	T151-D321 HydrophobicContact CG2-CB 4.26Å; H154-D321 PolarHBondContact CD2-O 3.45Å; H154-D321 IonicContact NE2-OD1 2.77Å; M155-D321 HydrophobicContact CG-CB 4.24Å; D321-A325 WeakPolarHBondContact O-CB 3.31Å; D321-A325 PolarHBondContact O-N 2.86Å
322	S	97.8	Very high	96.2	Very high	15 Å²	15	25.1 Å²	25.1	11%	0.105	15%	0.153	C	C	.	.	H	α-helix	trans	-71.8	-42.5	-179.8	-54.1	0	0	0	0	111.8	T151 D320 V324 A325 L326	T151-S322 WeakPolarHBondContact OG1-CA 3.4Å; T151-S322 VanDerWaalsContact OG1-CB 3.27Å; T151-S322 WeakPolarHBondContact OG1-CB 3.46Å; T151-S322 PolarHBondContact OG1-OG 2.7Å; D320-S322 PolarHBondContact O-N 3.5Å; D320-S322 WeakPolarHBondContact OD1-CA 3.19Å; D320-S322 WeakPolarHBondContact OD1-CB 3.43Å; D320-S322 PolarHBondContact OD1-N 3.36Å; S322-V324 VanDerWaalsContact C-N 3.34Å; S322-V324 PolarHBondContact O-N 3.39Å; S322-A325 WeakPolarHBondContact O-CB 3.31Å; S322-A325 PolarHBondContact O-N 3.35Å; S322-L326 WeakPolarHBondContact O-CB 3.4Å; S322-L326 WeakPolarHBondContact O-CD1 3.47Å; S322-L326 VanDerWaalsContact O-CG 3.24Å; S322-L326 WeakPolarHBondContact O-CG 3.46Å; S322-L326 PolarHBondContact O-N 3.17Å
323	E	97.8	Very high	96.2	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-66	-39.1	177.3	-65.9	167.7	140.3	0	0	111.5	L319 D320 L327 F357 Y360 I361 R364 H366	L319-E323 VanDerWaalsContact CA-OE2 3.24Å; L319-E323 WeakPolarHBondContact CA-OE2 3.36Å; L319-E323 HydrophobicContact CB-CB 4.25Å; L319-E323 HydrophobicContact CD2-CB 4.1Å; D320-E323 PolarHBondContact N-OE2 3.49Å; D320-E323 PolarHBondContact O-N 2.97Å; D320-E323 VanDerWaalsContact OD1-CG 3.32Å; D320-E323 WeakPolarHBondContact OD1-CG 3.48Å; D320-E323 PolarHBondContact OD1-N 2.88Å; E323-L327 VanDerWaalsContact O-CB 3.31Å; E323-L327 WeakPolarHBondContact O-CB 3.27Å; E323-L327 PolarHBondContact O-N 2.75Å; E323-F357 HydrophobicContact CB-CE2 3.9Å; E323-F357 HydrophobicContact CB-CZ 4.31Å; E323-F357 HydrophobicContact CG-CE2 4.01Å; E323-F357 VanDerWaalsContact O-CZ 3.29Å; E323-F357 WeakPolarHBondContact O-CZ 3.34Å; E323-Y360 HydrophobicContact CG-CD1 3.86Å; E323-Y360 HydrophobicContact CG-CE1 3.83Å; E323-I361 HydrophobicContact CG-CD1 3.78Å; E323-I361 WeakPolarHBondContact OE1-CD1 3.33Å; E323-R364 IonicContact OE1-CZ 3.4Å; E323-R364 IonicContact OE1-NH1 3.82Å; E323-R364 PolarHBondContact OE1-NH1 2.94Å; E323-R364 IonicContact OE2-CZ 2.72Å; E323-R364 IonicContact OE2-NH1 3.48Å; E323-R364 PolarHBondContact OE2-NH1 2.87Å; E323-R364 IonicContact OE2-NH2 3.65Å; E323-R364 PolarHBondContact OE2-NH2 3.29Å; E323-H366 IonicContact OE1-CD2 2.9Å; E323-H366 IonicContact OE1-CE1 3.42Å; E323-H366 IonicContact OE1-NE2 2.68Å; E323-H366 PolarHBondContact OE1-NE2 3.36Å; E323-H366 IonicContact OE2-NE2 3.2Å
324	V	97.5	Very high	96.3	Very high	6 Å²	6	20.2 Å²	20.2	4%	0.036	12%	0.122	C	C	.	.	H	α-helix	trans	-67.7	-38.6	174.2	179.4	0	0	0	0	110.8	L269 V273 L319 D320 S322 Q328	L269-V324 HydrophobicContact CD2-CG1 4.5Å; L269-V324 HydrophobicContact CG-CG1 4.48Å; V273-V324 HydrophobicContact CB-CG2 4.49Å; V273-V324 HydrophobicContact CG1-CG1 4.36Å; V273-V324 HydrophobicContact CG1-CG2 3.85Å; V273-V324 HydrophobicContact CG2-CG1 4.46Å; L319-V324 HydrophobicContact CB-CG2 3.89Å; L319-V324 HydrophobicContact CD1-CG2 4.19Å; D320-V324 WeakPolarHBondContact O-CG2 3.34Å; D320-V324 PolarHBondContact O-N 3.38Å; D320-V324 VanDerWaalsContact O-N 3.09Å; S322-V324 VanDerWaalsContact C-N 3.34Å; S322-V324 PolarHBondContact O-N 3.39Å; V324-Q328 WeakPolarHBondContact O-CG 3.36Å; V324-Q328 PolarHBondContact O-N 3.2Å; V324-Q328 PolarHBondContact O-NE2 2.76Å
325	A	98.3	Very high	96.4	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.5	-48	176.3	0	0	0	0	0	112.5	V150 H154 D321 S322 L327 Q328 A329	V150-A325 HydrophobicContact CB-CB 4.46Å; V150-A325 HydrophobicContact CG1-CB 4.06Å; V150-A325 HydrophobicContact CG2-CB 4.04Å; V150-A325 WeakPolarHBondContact CG2-O 3.24Å; V150-A325 WeakPolarHBondContact O-CB 3.49Å; H154-A325 HydrophobicContact CB-CB 3.54Å; D321-A325 WeakPolarHBondContact O-CB 3.31Å; D321-A325 PolarHBondContact O-N 2.86Å; S322-A325 WeakPolarHBondContact O-CB 3.31Å; S322-A325 PolarHBondContact O-N 3.35Å; A325-L327 PolarHBondContact O-N 2.88Å; A325-Q328 WeakPolarHBondContact O-CB 3.41Å; A325-Q328 PolarHBondContact O-N 3.1Å; A325-A329 PolarHBondContact O-N 3.46Å
326	L	98.5	Very high	96.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.7	-42.6	177.4	-69.9	159.2	0	0	0	111.3	I147 V150 S322 Q328 A329 V330 F353 F357 Y360	I147-L326 HydrophobicContact CG1-CD1 4.18Å; I147-L326 HydrophobicContact CG1-CD2 4.18Å; I147-L326 HydrophobicContact CG2-CD1 4.48Å; V150-L326 HydrophobicContact CG1-CD2 3.85Å; V150-L326 HydrophobicContact CG1-CG 4.07Å; S322-L326 WeakPolarHBondContact O-CB 3.4Å; S322-L326 WeakPolarHBondContact O-CD1 3.47Å; S322-L326 VanDerWaalsContact O-CG 3.24Å; S322-L326 WeakPolarHBondContact O-CG 3.46Å; S322-L326 PolarHBondContact O-N 3.17Å; L326-Q328 VanDerWaalsContact C-N 3.32Å; L326-Q328 PolarHBondContact O-N 3.3Å; L326-A329 PolarHBondContact O-N 2.91Å; L326-A329 VanDerWaalsContact O-N 3.16Å; L326-V330 WeakPolarHBondContact O-CG2 3.49Å; L326-V330 PolarHBondContact O-N 3.33Å; L326-F353 HydrophobicContact CD2-CD1 4Å; L326-F357 HydrophobicContact CB-CB 4.02Å; L326-F357 HydrophobicContact CB-CD1 3.77Å; L326-F357 HydrophobicContact CB-CD2 3.85Å; L326-F357 HydrophobicContact CB-CE1 4.07Å; L326-F357 HydrophobicContact CB-CE2 4.15Å; L326-F357 HydrophobicContact CB-CG 3.64Å; L326-F357 HydrophobicContact CB-CZ 4.24Å; L326-F357 HydrophobicContact CD1-CB 4.07Å; L326-F357 HydrophobicContact CD1-CD2 3.67Å; L326-F357 HydrophobicContact CD1-CE2 4.3Å; L326-F357 HydrophobicContact CD1-CG 4.02Å; L326-F357 HydrophobicContact CD2-CB 4.34Å; L326-F357 HydrophobicContact CG-CB 4.37Å; L326-F357 HydrophobicContact CG-CD2 4.38Å; L326-F357 HydrophobicContact CG-CG 4.36Å; L326-Y360 HydrophobicContact CD1-CD1 4.29Å; L326-Y360 HydrophobicContact CD1-CG 4.44Å
327	L	98.3	Very high	96.8	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.8	-39.4	175.7	-169.7	63.4	0	0	0	112	L269 E323 A325 V330 I331 F357 L375 V379	L269-L327 HydrophobicContact CD1-CD2 3.76Å; L269-L327 HydrophobicContact CD2-CB 4.14Å; L269-L327 HydrophobicContact CD2-CD2 3.76Å; L269-L327 HydrophobicContact CD2-CG 3.88Å; L269-L327 HydrophobicContact CG-CD2 4.44Å; E323-L327 VanDerWaalsContact O-CB 3.31Å; E323-L327 WeakPolarHBondContact O-CB 3.27Å; E323-L327 PolarHBondContact O-N 2.75Å; A325-L327 PolarHBondContact O-N 2.88Å; L327-V330 PolarHBondContact O-N 3.22Å; L327-I331 HydrophobicContact CG-CD1 4.13Å; L327-I331 WeakPolarHBondContact O-CB 3.45Å; L327-I331 VanDerWaalsContact O-CD1 3.31Å; L327-I331 WeakPolarHBondContact O-CD1 3.46Å; L327-I331 VanDerWaalsContact O-CG1 3.24Å; L327-I331 WeakPolarHBondContact O-CG1 3.35Å; L327-I331 PolarHBondContact O-N 3.38Å; L327-F357 HydrophobicContact CB-CE1 3.95Å; L327-F357 HydrophobicContact CB-CZ 4.18Å; L327-F357 HydrophobicContact CD1-CE1 4.12Å; L327-L375 HydrophobicContact CD2-CD1 4.39Å; L327-V379 HydrophobicContact CD1-CG2 3.49Å; L327-V379 VanDerWaalsContact CD1-CG2 3.49Å
328	Q	98.4	Very high	96.9	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.2	-40.1	173.4	-73.6	164.2	99.9	0	0	112.5	H154 F240 I266 L269 R270 V324 A325 L326 I331 L332	H154-Q328 PolarHBondContact CE1-NE2 3.15Å; H154-Q328 VanDerWaalsContact CE1-NE2 3.33Å; H154-Q328 PolarHBondContact ND1-NE2 2.89Å; H154-Q328 PolarHBondContact ND1-OE1 3.01Å; F240-Q328 HydrophobicContact CE1-CB 3.67Å; F240-Q328 HydrophobicContact CZ-CB 3.68Å; I266-Q328 HydrophobicContact CD1-CB 4.41Å; I266-Q328 HydrophobicContact CG1-CB 4.45Å; I266-Q328 HydrophobicContact CG1-CG 4.35Å; I266-Q328 HydrophobicContact CG2-CG 4.09Å; L269-Q328 HydrophobicContact CD2-CG 3.79Å; R270-Q328 VanDerWaalsContact CZ-OE1 3.28Å; V324-Q328 WeakPolarHBondContact O-CG 3.36Å; V324-Q328 PolarHBondContact O-N 3.2Å; V324-Q328 PolarHBondContact O-NE2 2.76Å; A325-Q328 WeakPolarHBondContact O-CB 3.41Å; A325-Q328 PolarHBondContact O-N 3.1Å; L326-Q328 VanDerWaalsContact C-N 3.32Å; L326-Q328 PolarHBondContact O-N 3.3Å; Q328-I331 PolarHBondContact O-N 2.91Å; Q328-L332 WeakPolarHBondContact O-CB 3.4Å; Q328-L332 PolarHBondContact O-N 2.92Å
329	A	98.5	Very high	97.2	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-65.9	-41.8	177.9	0	0	0	0	0	112	V150 L244 A325 L326 I331 L332 L333 F353	V150-A329 HydrophobicContact CG2-CB 3.85Å; L244-A329 HydrophobicContact CD1-CB 4.28Å; A325-A329 PolarHBondContact O-N 3.46Å; L326-A329 PolarHBondContact O-N 2.91Å; L326-A329 VanDerWaalsContact O-N 3.16Å; A329-I331 VanDerWaalsContact C-N 3.33Å; A329-I331 PolarHBondContact O-N 3.37Å; A329-L332 PolarHBondContact O-N 3.39Å; A329-L333 PolarHBondContact O-N 3.4Å; A329-F353 HydrophobicContact CB-CD1 3.8Å; A329-F353 HydrophobicContact CB-CD2 3.89Å; A329-F353 HydrophobicContact CB-CE1 3.84Å; A329-F353 HydrophobicContact CB-CE2 3.91Å; A329-F353 HydrophobicContact CB-CG 3.82Å; A329-F353 HydrophobicContact CB-CZ 3.88Å
330	V	98.3	Very high	97.3	Very high	5 Å²	5	22.2 Å²	22.2	3%	0.03	14%	0.14	C	C	.	.	H	α-helix	trans	-60.1	-43.6	173.6	172.1	0	0	0	0	111	L326 L327 Q350 F353 L354 V379	L326-V330 WeakPolarHBondContact O-CG2 3.49Å; L326-V330 PolarHBondContact O-N 3.33Å; L327-V330 PolarHBondContact O-N 3.22Å; V330-Q350 HydrophobicContact CG1-CG 4.34Å; V330-Q350 PolarHBondContact O-NE2 3.33Å; V330-F353 HydrophobicContact CG2-CB 4.22Å; V330-L354 HydrophobicContact CG1-CD2 3.96Å; V330-L354 HydrophobicContact CG1-CG 4.4Å; V330-L354 HydrophobicContact CG2-CD2 3.79Å; V330-L354 HydrophobicContact CG2-CG 3.94Å; V330-V379 HydrophobicContact CG1-CG2 4.41Å
331	I	98.3	Very high	97.5	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65	-42.5	176.8	-73.3	162.1	0	0	0	111.9	C262 E265 I266 L269 L327 Q328 A329 S334 V379 L382	C262-I331 HydrophobicContact CB-CG2 3.92Å; E265-I331 HydrophobicContact CB-CG2 3.78Å; E265-I331 VanDerWaalsContact OE2-CG2 3.28Å; E265-I331 WeakPolarHBondContact OE2-CG2 3.37Å; I266-I331 HydrophobicContact CD1-CG2 4.39Å; I266-I331 HydrophobicContact CG1-CB 4.45Å; I266-I331 HydrophobicContact CG1-CG2 3.79Å; L269-I331 HydrophobicContact CD2-CD1 3.99Å; L327-I331 HydrophobicContact CG-CD1 4.13Å; L327-I331 WeakPolarHBondContact O-CB 3.45Å; L327-I331 VanDerWaalsContact O-CD1 3.31Å; L327-I331 WeakPolarHBondContact O-CD1 3.46Å; L327-I331 VanDerWaalsContact O-CG1 3.24Å; L327-I331 WeakPolarHBondContact O-CG1 3.35Å; L327-I331 PolarHBondContact O-N 3.38Å; Q328-I331 PolarHBondContact O-N 2.91Å; A329-I331 VanDerWaalsContact C-N 3.33Å; A329-I331 PolarHBondContact O-N 3.37Å; I331-S334 PolarHBondContact O-OG 3.02Å; I331-V379 HydrophobicContact CG1-CG1 4.37Å; I331-L382 HydrophobicContact CD1-CD1 3.43Å; I331-L382 VanDerWaalsContact CD1-CD1 3.43Å
332	L	98.5	Very high	97.6	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-61.8	-46.3	178.9	175.2	65.4	0	0	0	111.6	F240 A241 L244 F247 L258 L259 C262 I266 Q328 A329 S334	F240-L332 HydrophobicContact CE1-CD2 4.47Å; A241-L332 HydrophobicContact CB-CD1 4.01Å; A241-L332 HydrophobicContact CB-CD2 3.65Å; L244-L332 HydrophobicContact CD1-CD2 3.88Å; F247-L332 HydrophobicContact CB-CD2 4.48Å; F247-L332 HydrophobicContact CD2-CD1 4.15Å; F247-L332 HydrophobicContact CD2-CD2 3.98Å; F247-L332 HydrophobicContact CD2-CG 4.14Å; F247-L332 HydrophobicContact CE2-CD1 3.94Å; F247-L332 HydrophobicContact CE2-CG 4.44Å; F247-L332 HydrophobicContact CG-CD2 4.29Å; L258-L332 WeakPolarHBondContact CD2-O 3.43Å; L259-L332 HydrophobicContact CD2-CD1 4.27Å; C262-L332 VanDerWaalsContact SG-CD1 3.53Å; I266-L332 HydrophobicContact CD1-CB 4.31Å; Q328-L332 WeakPolarHBondContact O-CB 3.4Å; Q328-L332 PolarHBondContact O-N 2.92Å; A329-L332 PolarHBondContact O-N 3.39Å; L332-S334 PolarHBondContact O-N 3.32Å
333	L	97.9	Very high	97.6	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	51.8	-174.3	-66	167.8	0	0	0	112.2	L250 L258 A329 I346 C349 Q350 F353	L250-L333 HydrophobicContact CD1-CD2 4.32Å; L258-L333 HydrophobicContact CD1-CD2 4.49Å; A329-L333 PolarHBondContact O-N 3.4Å; L333-I346 HydrophobicContact CB-CG2 4.22Å; L333-I346 HydrophobicContact CD2-CG2 4.47Å; L333-I346 WeakPolarHBondContact O-CG2 3.28Å; L333-C349 HydrophobicContact CD1-CB 3.91Å; L333-C349 HydrophobicContact CD2-CB 4.47Å; L333-Q350 HydrophobicContact CB-CB 3.97Å; L333-Q350 HydrophobicContact CB-CG 4.22Å; L333-Q350 WeakPolarHBondContact O-CB 3.5Å; L333-Q350 WeakPolarHBondContact O-CG 3.35Å; L333-Q350 PolarHBondContact O-NE2 3.45Å; L333-F353 HydrophobicContact CD1-CD2 3.52Å; L333-F353 HydrophobicContact CD1-CE2 3.47Å; L333-F353 VanDerWaalsContact CD1-CE2 3.47Å
334	S	97	Very high	97.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.2	C	C	.	.			trans	-87.2	107.9	-178.9	-70.7	0	0	0	0	111.1	L258 I331 L332 D336 R337 R383	L258-S334 WeakPolarHBondContact CD2-O 3.26Å; I331-S334 PolarHBondContact O-OG 3.02Å; L332-S334 PolarHBondContact O-N 3.32Å; S334-D336 VanDerWaalsContact C-N 3.28Å; S334-D336 PolarHBondContact O-N 2.89Å; S334-R337 WeakPolarHBondContact O-CG 3.29Å; S334-R383 VanDerWaalsContact OG-CZ 3.28Å; S334-R383 PolarHBondContact OG-NH2 3.36Å
335	S	96.9	Very high	97.6	Very high	19 Å²	19	37 Å²	37	13%	0.133	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-12.6	-174.9	70.8	0	0	0	0	114.8	R337 L340 E347	S335-R337 VanDerWaalsContact C-N 3.26Å; S335-R337 PolarHBondContact O-N 3.47Å; S335-L340 WeakPolarHBondContact O-CD1 3.4Å; S335-E347 WeakPolarHBondContact OG-CG 3.49Å; S335-E347 PolarHBondContact OG-OE1 3.37Å
336	D	95.9	Very high	97.6	Very high	103 Å²	103	37 Å²	37	55%	0.551	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	6.2	-177.1	63.7	-54.4	0	0	0	113.8	S334 R383	S334-D336 VanDerWaalsContact C-N 3.28Å; S334-D336 PolarHBondContact O-N 2.89Å; D336-R383 VanDerWaalsContact CG-NH1 3.31Å; D336-R383 IonicContact OD1-CZ 2.9Å; D336-R383 IonicContact OD1-NH1 3.87Å; D336-R383 PolarHBondContact OD1-NH1 3.24Å; D336-R383 VanDerWaalsContact OD1-NH1 3.07Å; D336-R383 IonicContact OD1-NH2 2.72Å; D336-R383 PolarHBondContact OD1-NH2 3.15Å; D336-R383 IonicContact OD2-CZ 3.92Å; D336-R383 IonicContact OD2-NH1 3.06Å; D336-R383 PolarHBondContact OD2-NH1 3.08Å; D336-R383 IonicContact OD2-NH2 3.24Å
337	R	95.7	Very high	97.6	Very high	39 Å²	39	40.8 Å²	40.8	15%	0.147	23%	0.232	C	C	.	.	S	Bend	trans	-74.5	135.8	178.3	-54.6	-65.5	179.9	176	-2	110.7	I257 L258 G261 E265 S334 S335 L340	I257-R337 HydrophobicContact CG2-CB 3.67Å; L258-R337 HydrophobicContact CD2-CG 4.31Å; G261-R337 VanDerWaalsContact O-CZ 3.27Å; G261-R337 PolarHBondContact O-NH1 3.03Å; G261-R337 VanDerWaalsContact O-NH1 3.12Å; G261-R337 PolarHBondContact O-NH2 2.81Å; E265-R337 IonicContact OE1-CZ 3.07Å; E265-R337 IonicContact OE1-NH1 2.58Å; E265-R337 PolarHBondContact OE1-NH1 3.37Å; E265-R337 IonicContact OE1-NH2 3.93Å; E265-R337 PolarHBondContact OE1-NH2 3.23Å; E265-R337 IonicContact OE2-NH2 2.79Å; E265-R337 PolarHBondContact OE2-NH2 3.47Å; S334-R337 WeakPolarHBondContact O-CG 3.29Å; S335-R337 VanDerWaalsContact C-N 3.26Å; S335-R337 PolarHBondContact O-N 3.47Å; R337-L340 HydrophobicContact CB-CD1 3.77Å; R337-L340 HydrophobicContact CB-CG 4.07Å; R337-L340 HydrophobicContact CG-CD1 4.43Å; R337-L340 WeakPolarHBondContact O-CD1 3.47Å; R337-L340 WeakPolarHBondContact O-CG 3.47Å
338	P	95.6	Very high	97.5	Very high	117 Å²	117	47.2 Å²	47.2	76%	0.76	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	139.8	-178.7	28.1	-34.4	0	0	0	111.4
339	G	96.8	Very high	97.5	Very high	62 Å²	62	47.8 Å²	47.8	64%	0.639	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.7	-1.5	176.4	0	0	0	0	0	115.6	I257	I257-G339 WeakPolarHBondContact CD1-O 3.11Å
340	L	98.1	Very high	97.4	Very high	20 Å²	20	49.4 Å²	49.4	11%	0.105	27%	0.267	C	S	.	.			trans	-65.1	139.1	176.1	-70.1	174.5	0	0	0	112.1	D254 I257 L258 S335 R337 V343 I346	D254-L340 HydrophobicContact CB-CD2 3.92Å; I257-L340 HydrophobicContact CB-CD2 3.92Å; I257-L340 HydrophobicContact CD1-CD2 4.4Å; I257-L340 HydrophobicContact CG2-CD2 3.69Å; I257-L340 HydrophobicContact CG2-CG 3.97Å; L258-L340 HydrophobicContact CD2-CD1 4.03Å; L258-L340 HydrophobicContact CD2-CD2 4.1Å; L258-L340 HydrophobicContact CG-CD2 4.06Å; S335-L340 WeakPolarHBondContact O-CD1 3.4Å; R337-L340 HydrophobicContact CB-CD1 3.77Å; R337-L340 HydrophobicContact CB-CG 4.07Å; R337-L340 HydrophobicContact CG-CD1 4.43Å; R337-L340 WeakPolarHBondContact O-CD1 3.47Å; R337-L340 WeakPolarHBondContact O-CG 3.47Å; L340-V343 HydrophobicContact CB-CG2 3.94Å; L340-I346 HydrophobicContact CD1-CD1 3.9Å; L340-I346 HydrophobicContact CD2-CD1 3.86Å; L340-I346 HydrophobicContact CG-CD1 4.32Å
341	T	98.1	Very high	97.4	Very high	101 Å²	101	54.6 Å²	54.6	62%	0.62	29%	0.292	S	S	*	.	S	Bend	trans	-99.2	-36.5	178.7	61.2	0	0	0	0	112.4	D254 V343	D254-T341 VanDerWaalsContact CG-OG1 3.23Å; D254-T341 PolarHBondContact OD1-N 3.17Å; D254-T341 PolarHBondContact OD1-OG1 3.17Å; D254-T341 PolarHBondContact OD2-OG1 2.95Å; T341-V343 PolarHBondContact O-N 2.88Å
342	S	97.4	Very high	97.3	Very high	27 Å²	27	58.9 Å²	58.9	19%	0.189	31%	0.312	C	S	.	.			trans	-100.2	41.6	-175.3	-47.7	0	0	0	0	113.6	P251 D254 E344 R345 I346	P251-S342 WeakPolarHBondContact CD-OG 3.39Å; P251-S342 WeakPolarHBondContact CG-OG 3.35Å; D254-S342 WeakPolarHBondContact OD2-CB 3.5Å; D254-S342 PolarHBondContact OD2-N 2.8Å; D254-S342 PolarHBondContact OD2-OG 2.71Å; S342-E344 PolarHBondContact O-N 2.95Å; S342-R345 WeakPolarHBondContact O-CB 3.48Å; S342-R345 PolarHBondContact O-N 2.76Å; S342-R345 VanDerWaalsContact O-N 3.09Å; S342-I346 WeakPolarHBondContact O-CG1 3.17Å; S342-I346 PolarHBondContact O-N 3.06Å
343	V	98.2	Very high	97.3	Very high	55 Å²	55	58.9 Å²	58.9	33%	0.333	31%	0.311	S	S	.	.	H	α-helix	trans	-50.6	-53.1	-171.8	-179.2	0	0	0	0	112.6	L340 T341 R345 I346 E347	L340-V343 HydrophobicContact CB-CG2 3.94Å; T341-V343 PolarHBondContact O-N 2.88Å; V343-R345 VanDerWaalsContact C-N 3.28Å; V343-R345 PolarHBondContact O-N 3Å; V343-I346 PolarHBondContact O-N 3.38Å; V343-I346 VanDerWaalsContact O-N 3.11Å; V343-E347 WeakPolarHBondContact O-CG 3.34Å; V343-E347 PolarHBondContact O-N 3.29Å
344	E	97.5	Very high	97.3	Very high	139 Å²	139	61 Å²	61	65%	0.65	32%	0.323	S	S	*	.	H	α-helix	trans	-62.5	-33.8	-177.4	-167	-171.1	167.1	0	0	112.8	S342 R348	S342-E344 PolarHBondContact O-N 2.95Å; E344-R348 PolarHBondContact O-N 3.26Å; E344-R348 VanDerWaalsContact O-N 3.13Å; E344-R348 IonicContact OE1-NH2 3.74Å
345	R	97.6	Very high	97.2	Very high	88 Å²	88	65.2 Å²	65.2	33%	0.332	34%	0.344	S	S	.	.	H	α-helix	trans	-70.2	-42.3	176.3	-176.8	178.6	-178.8	-172.6	4.8	110.9	E249 L250 S342 V343 E347 R348 C349	E249-R345 PolarHBondContact O-NH1 3.35Å; E249-R345 PolarHBondContact O-NH2 3.17Å; E249-R345 IonicContact OE2-NH2 2.95Å; E249-R345 PolarHBondContact OE2-NH2 3.45Å; L250-R345 HydrophobicContact CD2-CG 4.16Å; S342-R345 WeakPolarHBondContact O-CB 3.48Å; S342-R345 PolarHBondContact O-N 2.76Å; S342-R345 VanDerWaalsContact O-N 3.09Å; V343-R345 VanDerWaalsContact C-N 3.28Å; V343-R345 PolarHBondContact O-N 3Å; R345-E347 VanDerWaalsContact C-N 3.33Å; R345-R348 PolarHBondContact O-N 3.01Å; R345-C349 PolarHBondContact O-N 3.02Å; R345-C349 PolarHBondContact O-SG 3.26Å
346	I	98.4	Very high	97.3	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-63	-43.2	178.2	-65.4	163.2	0	0	0	110.1	L250 L258 L333 L340 S342 V343 C349 Q350	L250-I346 HydrophobicContact CD1-CD1 4.46Å; L250-I346 HydrophobicContact CD1-CG1 3.93Å; L250-I346 HydrophobicContact CD2-CG1 3.99Å; L258-I346 HydrophobicContact CD1-CD1 4.09Å; L258-I346 HydrophobicContact CD1-CG1 4.38Å; L258-I346 HydrophobicContact CD2-CD1 4.44Å; L258-I346 HydrophobicContact CD2-CG2 4.43Å; L333-I346 HydrophobicContact CB-CG2 4.22Å; L333-I346 HydrophobicContact CD2-CG2 4.47Å; L333-I346 WeakPolarHBondContact O-CG2 3.28Å; L340-I346 HydrophobicContact CD1-CD1 3.9Å; L340-I346 HydrophobicContact CD2-CD1 3.86Å; L340-I346 HydrophobicContact CG-CD1 4.32Å; S342-I346 WeakPolarHBondContact O-CG1 3.17Å; S342-I346 PolarHBondContact O-N 3.06Å; V343-I346 PolarHBondContact O-N 3.38Å; V343-I346 VanDerWaalsContact O-N 3.11Å; I346-C349 PolarHBondContact O-N 2.9Å; I346-Q350 WeakPolarHBondContact O-CB 3.46Å; I346-Q350 PolarHBondContact O-N 3.22Å
347	E	97.8	Very high	97.4	Very high	80 Å²	80	59.4 Å²	59.4	37%	0.374	31%	0.312	S	S	.	.	H	α-helix	trans	-58.2	-49	175.4	-71.8	177.7	167	0	0	111.7	S335 V343 R345 C349 Q350 E351	S335-E347 WeakPolarHBondContact OG-CG 3.49Å; S335-E347 PolarHBondContact OG-OE1 3.37Å; V343-E347 WeakPolarHBondContact O-CG 3.34Å; V343-E347 PolarHBondContact O-N 3.29Å; R345-E347 VanDerWaalsContact C-N 3.33Å; E347-C349 VanDerWaalsContact C-N 3.35Å; E347-C349 PolarHBondContact O-N 3.36Å; E347-Q350 WeakPolarHBondContact O-CB 3.33Å; E347-Q350 PolarHBondContact O-N 3.03Å; E347-Q350 VanDerWaalsContact O-N 3.09Å; E347-E351 WeakPolarHBondContact O-CG 3.47Å; E347-E351 PolarHBondContact O-N 2.91Å
348	R	97.3	Very high	97.4	Very high	135 Å²	135	61 Å²	61	51%	0.509	32%	0.321	S	S	.	.	H	α-helix	trans	-59.1	-45.1	177.7	-166.5	-175.5	-50.6	164.9	5.3	112.4	E344 R345 Q350 E351 E352	E344-R348 PolarHBondContact O-N 3.26Å; E344-R348 VanDerWaalsContact O-N 3.13Å; E344-R348 IonicContact OE1-NH2 3.74Å; R345-R348 PolarHBondContact O-N 3.01Å; R348-Q350 VanDerWaalsContact C-N 3.31Å; R348-Q350 PolarHBondContact O-N 3.3Å; R348-E351 PolarHBondContact O-N 3.07Å; R348-E352 PolarHBondContact O-N 3.21Å; R348-E352 VanDerWaalsContact O-N 3.13Å
349	C	96.8	Very high	97.4	Very high	11 Å²	11	56.6 Å²	56.6	7%	0.074	29%	0.29	C	S	.	.	H	α-helix	trans	-63.1	-38.6	176	-66.5	0	0	0	0	111.7	M246 L333 R345 I346 E347 F353	M246-C349 HydrophobicContact CB-CB 4.31Å; M246-C349 HydrophobicContact SD-CB 3.83Å; L333-C349 HydrophobicContact CD1-CB 3.91Å; L333-C349 HydrophobicContact CD2-CB 4.47Å; R345-C349 PolarHBondContact O-N 3.02Å; R345-C349 PolarHBondContact O-SG 3.26Å; I346-C349 PolarHBondContact O-N 2.9Å; E347-C349 VanDerWaalsContact C-N 3.35Å; E347-C349 PolarHBondContact O-N 3.36Å; C349-F353 VanDerWaalsContact O-CD2 3.29Å; C349-F353 WeakPolarHBondContact O-CD2 3.49Å; C349-F353 PolarHBondContact O-N 2.97Å
350	Q	97.9	Very high	97.4	Very high	34 Å²	34	54.5 Å²	54.5	16%	0.159	26%	0.263	C	S	.	.	H	α-helix	trans	-66.9	-39.8	176.7	-163.9	-171.6	50.4	0	0	111.7	V330 L333 I346 E347 R348 E352 F353 L354	V330-Q350 HydrophobicContact CG1-CG 4.34Å; V330-Q350 PolarHBondContact O-NE2 3.33Å; L333-Q350 HydrophobicContact CB-CB 3.97Å; L333-Q350 HydrophobicContact CB-CG 4.22Å; L333-Q350 WeakPolarHBondContact O-CB 3.5Å; L333-Q350 WeakPolarHBondContact O-CG 3.35Å; L333-Q350 PolarHBondContact O-NE2 3.45Å; I346-Q350 WeakPolarHBondContact O-CB 3.46Å; I346-Q350 PolarHBondContact O-N 3.22Å; E347-Q350 WeakPolarHBondContact O-CB 3.33Å; E347-Q350 PolarHBondContact O-N 3.03Å; E347-Q350 VanDerWaalsContact O-N 3.09Å; R348-Q350 VanDerWaalsContact C-N 3.31Å; R348-Q350 PolarHBondContact O-N 3.3Å; Q350-E352 PolarHBondContact O-N 3.38Å; Q350-F353 PolarHBondContact O-N 3.08Å; Q350-L354 HydrophobicContact CG-CD1 4.25Å; Q350-L354 WeakPolarHBondContact O-CG 3.5Å; Q350-L354 PolarHBondContact O-N 3.38Å
351	E	97.1	Very high	97.2	Very high	115 Å²	115	53.7 Å²	53.7	54%	0.537	26%	0.259	S	S	.	.	H	α-helix	trans	-60.4	-42.1	176.3	-75.9	177.2	176.5	0	0	112	E347 R348 F353 L354 L355	E347-E351 WeakPolarHBondContact O-CG 3.47Å; E347-E351 PolarHBondContact O-N 2.91Å; R348-E351 PolarHBondContact O-N 3.07Å; E351-F353 VanDerWaalsContact C-N 3.32Å; E351-F353 PolarHBondContact O-N 3.35Å; E351-L354 PolarHBondContact O-N 3.4Å; E351-L354 VanDerWaalsContact O-N 3.17Å; E351-L355 WeakPolarHBondContact O-CB 3.25Å; E351-L355 WeakPolarHBondContact O-CG 3.37Å; E351-L355 PolarHBondContact O-N 3.08Å
352	E	97.1	Very high	96.9	Very high	90 Å²	90	49.7 Å²	49.7	42%	0.421	23%	0.234	S	C	.	.	H	α-helix	trans	-58.5	-43.3	175.3	-72	178.7	-156.2	0	0	111.9	L146 R348 Q350 A356	L146-E352 HydrophobicContact CD2-CB 4.32Å; R348-E352 PolarHBondContact O-N 3.21Å; R348-E352 VanDerWaalsContact O-N 3.13Å; Q350-E352 PolarHBondContact O-N 3.38Å; E352-A356 WeakPolarHBondContact O-CB 3.35Å; E352-A356 PolarHBondContact O-N 3.26Å; E352-A356 VanDerWaalsContact O-N 3.1Å
353	F	98	Very high	96.7	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-68.2	-39.2	174.4	-77.6	-65.8	0	0	0	112.9	L146 V150 L244 M246 L326 A329 V330 L333 C349 Q350 E351 F357	L146-F353 HydrophobicContact CD1-CD1 4.25Å; L146-F353 HydrophobicContact CD1-CE1 3.52Å; L146-F353 HydrophobicContact CD1-CZ 3.8Å; L146-F353 HydrophobicContact CD2-CD1 3.96Å; L146-F353 HydrophobicContact CD2-CE1 4.1Å; L146-F353 HydrophobicContact CD2-CG 4.49Å; L146-F353 HydrophobicContact CG-CD1 4.03Å; L146-F353 HydrophobicContact CG-CE1 3.75Å; L146-F353 HydrophobicContact CG-CZ 4.48Å; V150-F353 HydrophobicContact CB-CE1 3.95Å; V150-F353 HydrophobicContact CG1-CE1 4.27Å; V150-F353 HydrophobicContact CG2-CE1 4.09Å; L244-F353 HydrophobicContact CD1-CZ 4.35Å; M246-F353 HydrophobicContact CE-CD2 3.94Å; M246-F353 HydrophobicContact CE-CE1 4.15Å; M246-F353 HydrophobicContact CE-CE2 3.13Å; M246-F353 HydrophobicContact CE-CZ 3.27Å; M246-F353 HydrophobicContact SD-CE2 4.29Å; L326-F353 HydrophobicContact CD2-CD1 4Å; A329-F353 HydrophobicContact CB-CD1 3.8Å; A329-F353 HydrophobicContact CB-CD2 3.89Å; A329-F353 HydrophobicContact CB-CE1 3.84Å; A329-F353 HydrophobicContact CB-CE2 3.91Å; A329-F353 HydrophobicContact CB-CG 3.82Å; A329-F353 HydrophobicContact CB-CZ 3.88Å; V330-F353 HydrophobicContact CG2-CB 4.22Å; L333-F353 HydrophobicContact CD1-CD2 3.52Å; L333-F353 HydrophobicContact CD1-CE2 3.47Å; L333-F353 VanDerWaalsContact CD1-CE2 3.47Å; C349-F353 VanDerWaalsContact O-CD2 3.29Å; C349-F353 WeakPolarHBondContact O-CD2 3.49Å; C349-F353 PolarHBondContact O-N 2.97Å; Q350-F353 PolarHBondContact O-N 3.08Å; E351-F353 VanDerWaalsContact C-N 3.32Å; E351-F353 PolarHBondContact O-N 3.35Å; F353-F357 WeakPolarHBondContact O-CB 3.46Å; F353-F357 PolarHBondContact O-N 3.37Å
354	L	97.5	Very high	96.4	Very high	46 Å²	46	54 Å²	54	24%	0.241	24%	0.241	C	C	.	.	H	α-helix	trans	-63.8	-42.5	178.5	-79.1	167.1	0	0	0	111.9	V330 Q350 E351 F357 E358 W372 L376	V330-L354 HydrophobicContact CG1-CD2 3.96Å; V330-L354 HydrophobicContact CG1-CG 4.4Å; V330-L354 HydrophobicContact CG2-CD2 3.79Å; V330-L354 HydrophobicContact CG2-CG 3.94Å; Q350-L354 HydrophobicContact CG-CD1 4.25Å; Q350-L354 WeakPolarHBondContact O-CG 3.5Å; Q350-L354 PolarHBondContact O-N 3.38Å; E351-L354 PolarHBondContact O-N 3.4Å; E351-L354 VanDerWaalsContact O-N 3.17Å; L354-F357 PolarHBondContact O-N 3.44Å; L354-E358 PolarHBondContact O-N 2.79Å; L354-W372 HydrophobicContact CD2-CH2 4.29Å; L354-W372 HydrophobicContact CD2-CZ2 4.43Å; L354-L376 HydrophobicContact CD2-CD2 3.81Å
355	L	96.3	Very high	95.9	Very high	88 Å²	88	54.1 Å²	54.1	46%	0.461	24%	0.239	S	C	.	.	H	α-helix	trans	-64.3	-51.6	176.6	-72.3	170.5	0	0	0	111.2	E351 F357 E358 H359	E351-L355 WeakPolarHBondContact O-CB 3.25Å; E351-L355 WeakPolarHBondContact O-CG 3.37Å; E351-L355 PolarHBondContact O-N 3.08Å; L355-F357 PolarHBondContact O-N 3.4Å; L355-E358 PolarHBondContact O-N 3.33Å; L355-H359 PolarHBondContact O-N 3.46Å
356	A	97.8	Very high	95.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-56.8	-38	175.8	0	0	0	0	0	111.4	E143 L146 I147 E352 Y360	E143-A356 HydrophobicContact CB-CB 3.93Å; E143-A356 HydrophobicContact CG-CB 3.93Å; L146-A356 HydrophobicContact CD2-CB 4.27Å; I147-A356 HydrophobicContact CD1-CB 4.33Å; I147-A356 HydrophobicContact CG1-CB 4.15Å; E352-A356 WeakPolarHBondContact O-CB 3.35Å; E352-A356 PolarHBondContact O-N 3.26Å; E352-A356 VanDerWaalsContact O-N 3.1Å; A356-Y360 VanDerWaalsContact O-CB 3.27Å; A356-Y360 WeakPolarHBondContact O-CB 3.32Å; A356-Y360 PolarHBondContact O-N 3.05Å
357	F	97.7	Very high	94.8	Very high	0 Å²	0	62 Å²	62	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-69.3	-46.6	178.6	-166.6	-173.8	0	0	0	112.7	E323 L326 L327 F353 L354 L355 H359 Y360 I361 W372 L375	E323-F357 HydrophobicContact CB-CE2 3.9Å; E323-F357 HydrophobicContact CB-CZ 4.31Å; E323-F357 HydrophobicContact CG-CE2 4.01Å; E323-F357 VanDerWaalsContact O-CZ 3.29Å; E323-F357 WeakPolarHBondContact O-CZ 3.34Å; L326-F357 HydrophobicContact CB-CB 4.02Å; L326-F357 HydrophobicContact CB-CD1 3.77Å; L326-F357 HydrophobicContact CB-CD2 3.85Å; L326-F357 HydrophobicContact CB-CE1 4.07Å; L326-F357 HydrophobicContact CB-CE2 4.15Å; L326-F357 HydrophobicContact CB-CG 3.64Å; L326-F357 HydrophobicContact CB-CZ 4.24Å; L326-F357 HydrophobicContact CD1-CB 4.07Å; L326-F357 HydrophobicContact CD1-CD2 3.67Å; L326-F357 HydrophobicContact CD1-CE2 4.3Å; L326-F357 HydrophobicContact CD1-CG 4.02Å; L326-F357 HydrophobicContact CD2-CB 4.34Å; L326-F357 HydrophobicContact CG-CB 4.37Å; L326-F357 HydrophobicContact CG-CD2 4.38Å; L326-F357 HydrophobicContact CG-CG 4.36Å; L327-F357 HydrophobicContact CB-CE1 3.95Å; L327-F357 HydrophobicContact CB-CZ 4.18Å; L327-F357 HydrophobicContact CD1-CE1 4.12Å; F353-F357 WeakPolarHBondContact O-CB 3.46Å; F353-F357 PolarHBondContact O-N 3.37Å; L354-F357 PolarHBondContact O-N 3.44Å; L355-F357 PolarHBondContact O-N 3.4Å; F357-H359 VanDerWaalsContact C-N 3.31Å; F357-H359 PolarHBondContact O-N 2.89Å; F357-Y360 PolarHBondContact O-N 3Å; F357-Y360 VanDerWaalsContact O-N 3.16Å; F357-I361 HydrophobicContact CD2-CD1 3.98Å; F357-I361 HydrophobicContact CD2-CG1 3.86Å; F357-I361 HydrophobicContact CE2-CD1 3.62Å; F357-I361 HydrophobicContact CE2-CG1 3.91Å; F357-I361 WeakPolarHBondContact O-CG1 3.31Å; F357-I361 PolarHBondContact O-N 3.2Å; F357-W372 HydrophobicContact CB-CH2 3.87Å; F357-W372 HydrophobicContact CB-CZ3 4.03Å; F357-W372 AromaticContact CD1-CH2 3.8Å; F357-W372 HydrophobicContact CD1-CH2 3.8Å; F357-W372 AromaticContact CD1-CZ3 3.62Å; F357-W372 HydrophobicContact CD1-CZ3 3.62Å; F357-W372 AromaticContact CD2-CZ3 3.93Å; F357-W372 HydrophobicContact CD2-CZ3 3.93Å; F357-W372 HydrophobicContact CE1-CZ3 4.08Å; F357-W372 HydrophobicContact CE2-CZ3 4.36Å; F357-W372 AromaticContact CG-CH2 3.82Å; F357-W372 HydrophobicContact CG-CH2 3.82Å; F357-W372 AromaticContact CG-CZ3 3.54Å; F357-W372 HydrophobicContact CG-CZ3 3.54Å; F357-W372 HydrophobicContact CZ-CZ3 4.45Å; F357-L375 HydrophobicContact CE1-CD2 4.33Å; F357-L375 HydrophobicContact CE2-CD2 3.88Å; F357-L375 HydrophobicContact CZ-CD2 3.49Å; F357-L375 VanDerWaalsContact CZ-CD2 3.49Å; F357-L375 HydrophobicContact CZ-CG 4.26Å
358	E	95.7	Very high	94.2	Very high	74 Å²	74	61 Å²	61	35%	0.346	28%	0.276	S	S	.	.	H	α-helix	trans	-57.4	-46.3	175.4	-177.7	166.9	-153.1	0	0	111.3	L354 L355 Y360 I361 N362 W372	L354-E358 PolarHBondContact O-N 2.79Å; L355-E358 PolarHBondContact O-N 3.33Å; E358-Y360 VanDerWaalsContact C-N 3.34Å; E358-Y360 PolarHBondContact O-N 3.36Å; E358-I361 PolarHBondContact O-N 3.18Å; E358-N362 VanDerWaalsContact O-CG 3.24Å; E358-N362 PolarHBondContact O-N 2.73Å; E358-N362 PolarHBondContact O-ND2 3.07Å; E358-W372 HydrophobicContact CB-CD2 4.35Å; E358-W372 HydrophobicContact CB-CH2 4.12Å; E358-W372 HydrophobicContact CB-CZ2 3.69Å; E358-W372 HydrophobicContact CG-CD2 4.39Å; E358-W372 HydrophobicContact CG-CZ2 4.38Å
359	H	95.4	Very high	93.6	Very high	24 Å²	24	57.5 Å²	57.5	11%	0.111	28%	0.276	C	S	.	.	H	α-helix	trans	-63.8	-39.6	177	-65.7	166.6	0	0	0	112	L137 P139 E143 L355 F357 I361 N362 Y363	L137-H359 WeakPolarHBondContact CB-NE2 3.42Å; L137-H359 WeakPolarHBondContact O-CA 3.5Å; L137-H359 PolarHBondContact O-CD2 3.14Å; P139-H359 HydrophobicContact CB-CB 4.21Å; P139-H359 WeakPolarHBondContact CD-O 3.39Å; P139-H359 HydrophobicContact CG-CB 3.91Å; E143-H359 IonicContact OE1-CE1 3.05Å; E143-H359 PolarHBondContact OE1-CE1 3.19Å; E143-H359 VanDerWaalsContact OE1-CE1 3.3Å; E143-H359 IonicContact OE1-CG 2.83Å; E143-H359 IonicContact OE1-ND1 2.77Å; E143-H359 PolarHBondContact OE1-ND1 3.18Å; E143-H359 IonicContact OE2-CE1 3.23Å; E143-H359 IonicContact OE2-CG 2.9Å; E143-H359 IonicContact OE2-ND1 3.89Å; E143-H359 PolarHBondContact OE2-ND1 3.23Å; L355-H359 PolarHBondContact O-N 3.46Å; F357-H359 VanDerWaalsContact C-N 3.31Å; F357-H359 PolarHBondContact O-N 2.89Å; H359-I361 PolarHBondContact O-N 3.12Å; H359-N362 WeakPolarHBondContact O-CB 3.28Å; H359-N362 PolarHBondContact O-N 2.71Å; H359-Y363 PolarHBondContact O-N 3.15Å
360	Y	96.9	Very high	93.1	Very high	17 Å²	17	63.2 Å²	63.2	7%	0.067	30%	0.301	C	S	.	.	H	α-helix	trans	-65.3	-40.3	176.9	-169.2	-107.8	0	0	0	112	P139 W144 I147 D320 E323 L326 A356 F357 E358 N362 Y363 R364	P139-Y360 HydrophobicContact CG-CD2 4.38Å; W144-Y360 AromaticContact CH2-CD2 3.86Å; W144-Y360 HydrophobicContact CH2-CD2 3.86Å; W144-Y360 AromaticContact CH2-CE2 3.53Å; W144-Y360 HydrophobicContact CH2-CE2 3.53Å; W144-Y360 AromaticContact CZ3-CD2 3.97Å; W144-Y360 HydrophobicContact CZ3-CD2 3.97Å; W144-Y360 AromaticContact CZ3-CE2 3.56Å; W144-Y360 HydrophobicContact CZ3-CE2 3.56Å; I147-Y360 HydrophobicContact CD1-CD2 3.87Å; I147-Y360 HydrophobicContact CD1-CG 4.17Å; I147-Y360 HydrophobicContact CG2-CD2 4.29Å; I147-Y360 HydrophobicContact CG2-CE2 4.33Å; D320-Y360 PolarHBondContact OD2-OH 2.9Å; E323-Y360 HydrophobicContact CG-CD1 3.86Å; E323-Y360 HydrophobicContact CG-CE1 3.83Å; L326-Y360 HydrophobicContact CD1-CD1 4.29Å; L326-Y360 HydrophobicContact CD1-CG 4.44Å; A356-Y360 VanDerWaalsContact O-CB 3.27Å; A356-Y360 WeakPolarHBondContact O-CB 3.32Å; A356-Y360 PolarHBondContact O-N 3.05Å; F357-Y360 PolarHBondContact O-N 3Å; F357-Y360 VanDerWaalsContact O-N 3.16Å; E358-Y360 VanDerWaalsContact C-N 3.34Å; E358-Y360 PolarHBondContact O-N 3.36Å; Y360-N362 VanDerWaalsContact C-N 3.29Å; Y360-N362 PolarHBondContact O-N 3.03Å; Y360-Y363 HydrophobicContact CD2-CD1 4.39Å; Y360-Y363 HydrophobicContact CE2-CD1 4.2Å; Y360-Y363 WeakPolarHBondContact O-CB 3.2Å; Y360-Y363 PolarHBondContact O-N 2.77Å; Y360-R364 HydrophobicContact CD1-CG 4.01Å; Y360-R364 HydrophobicContact CE1-CG 3.67Å; Y360-R364 WeakPolarHBondContact O-CG 3.25Å; Y360-R364 PolarHBondContact O-N 3.23Å
361	I	94.9	Very high	92.8	Very high	4 Å²	4	62 Å²	62	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-60.7	-40.9	172.9	-68.3	-40.2	0	0	0	111.2	E323 F357 E358 H359 Y363 R364 K365 F371 W372 L375	E323-I361 HydrophobicContact CG-CD1 3.78Å; E323-I361 WeakPolarHBondContact OE1-CD1 3.33Å; F357-I361 HydrophobicContact CD2-CD1 3.98Å; F357-I361 HydrophobicContact CD2-CG1 3.86Å; F357-I361 HydrophobicContact CE2-CD1 3.62Å; F357-I361 HydrophobicContact CE2-CG1 3.91Å; F357-I361 WeakPolarHBondContact O-CG1 3.31Å; F357-I361 PolarHBondContact O-N 3.2Å; E358-I361 PolarHBondContact O-N 3.18Å; H359-I361 PolarHBondContact O-N 3.12Å; I361-Y363 VanDerWaalsContact C-N 3.34Å; I361-R364 PolarHBondContact O-N 3.05Å; I361-K365 PolarHBondContact O-N 2.66Å; I361-F371 HydrophobicContact CD1-CD1 4.35Å; I361-F371 HydrophobicContact CD1-CE1 3.64Å; I361-F371 HydrophobicContact CG1-CD1 4.44Å; I361-F371 HydrophobicContact CG1-CE1 4.17Å; I361-F371 HydrophobicContact CG2-CD1 3.56Å; I361-F371 HydrophobicContact CG2-CE1 4.02Å; I361-W372 HydrophobicContact CB-CE3 4.44Å; I361-W372 HydrophobicContact CG1-CE3 3.81Å; I361-W372 HydrophobicContact CG1-CZ3 4.11Å; I361-W372 HydrophobicContact CG2-CB 4.3Å; I361-L375 HydrophobicContact CD1-CD2 4.15Å; I361-L375 HydrophobicContact CG1-CD2 4.48Å
362	N	91.8	Very high	92.6	Very high	17 Å²	17	58.2 Å²	58.2	9%	0.091	28%	0.276	C	S	.	.	H	α-helix	trans	-63	-40.6	175.9	-69.4	-27.8	0	0	0	111.9	R136 L137 E358 H359 Y360 K365	R136-N362 HydrophobicContact CB-CB 4Å; R136-N362 WeakPolarHBondContact CD-OD1 3.14Å; L137-N362 WeakPolarHBondContact O-CB 3.28Å; L137-N362 PolarHBondContact O-ND2 2.73Å; L137-N362 VanDerWaalsContact O-ND2 3.14Å; E358-N362 VanDerWaalsContact O-CG 3.24Å; E358-N362 PolarHBondContact O-N 2.73Å; E358-N362 PolarHBondContact O-ND2 3.07Å; H359-N362 WeakPolarHBondContact O-CB 3.28Å; H359-N362 PolarHBondContact O-N 2.71Å; Y360-N362 VanDerWaalsContact C-N 3.29Å; Y360-N362 PolarHBondContact O-N 3.03Å; N362-K365 WeakPolarHBondContact O-CG 3.38Å; N362-K365 PolarHBondContact O-N 2.81Å
363	Y	92.8	Very high	92.5	Very high	106 Å²	106	57.3 Å²	57.3	42%	0.416	28%	0.278	S	S	.	.	H	α-helix	trans	-64.4	-42.5	174	171	-98	0	0	0	112.6	W144 H359 Y360 I361 K365	W144-Y363 AromaticContact CH2-CD1 3.88Å; W144-Y363 HydrophobicContact CH2-CD1 3.88Å; W144-Y363 AromaticContact CH2-CE1 3.77Å; W144-Y363 HydrophobicContact CH2-CE1 3.77Å; W144-Y363 HydrophobicContact CH2-CG 4.42Å; W144-Y363 HydrophobicContact CZ2-CD1 4.07Å; W144-Y363 HydrophobicContact CZ2-CD2 4.24Å; W144-Y363 HydrophobicContact CZ2-CE1 4.1Å; W144-Y363 HydrophobicContact CZ2-CE2 4.26Å; W144-Y363 HydrophobicContact CZ2-CG 4.14Å; H359-Y363 PolarHBondContact O-N 3.15Å; Y360-Y363 HydrophobicContact CD2-CD1 4.39Å; Y360-Y363 HydrophobicContact CE2-CD1 4.2Å; Y360-Y363 WeakPolarHBondContact O-CB 3.2Å; Y360-Y363 PolarHBondContact O-N 2.77Å; I361-Y363 VanDerWaalsContact C-N 3.34Å; Y363-K365 WeakPolarHBondContact O-CG 3.41Å; Y363-K365 PolarHBondContact O-N 3.01Å
364	R	92.9	Very high	92.3	Very high	66 Å²	66	61.9 Å²	61.9	25%	0.249	30%	0.298	C	S	.	.	H	α-helix	trans	-66.7	-20.7	179.5	-73.9	-69.3	-60	-67.6	-12.2	114	D320 E323 Y360 I361 H366	D320-R364 VanDerWaalsContact CB-NH1 3.34Å; D320-R364 IonicContact OD1-NH1 3.41Å; D320-R364 PolarHBondContact OD1-NH1 3.29Å; D320-R364 VanDerWaalsContact OD1-NH1 3.09Å; D320-R364 IonicContact OD2-CZ 2.8Å; D320-R364 IonicContact OD2-NH1 3.6Å; D320-R364 PolarHBondContact OD2-NH1 3.42Å; E323-R364 IonicContact OE1-CZ 3.4Å; E323-R364 IonicContact OE1-NH1 3.82Å; E323-R364 PolarHBondContact OE1-NH1 2.94Å; E323-R364 IonicContact OE2-CZ 2.72Å; E323-R364 IonicContact OE2-NH1 3.48Å; E323-R364 PolarHBondContact OE2-NH1 2.87Å; E323-R364 IonicContact OE2-NH2 3.65Å; E323-R364 PolarHBondContact OE2-NH2 3.29Å; Y360-R364 HydrophobicContact CD1-CG 4.01Å; Y360-R364 HydrophobicContact CE1-CG 3.67Å; Y360-R364 WeakPolarHBondContact O-CG 3.25Å; Y360-R364 PolarHBondContact O-N 3.23Å; I361-R364 PolarHBondContact O-N 3.05Å; R364-H366 VanDerWaalsContact C-N 3.33Å; R364-H366 PolarHBondContact O-N 3.04Å
365	K	86.4	Confident	92.2	Very high	141 Å²	141	59.7 Å²	59.7	61%	0.613	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	47.8	173.6	-65.1	171.5	-172.9	163.4	0	112.5	E138 I361 N362 Y363 K367	E138-K365 WeakPolarHBondContact OE1-CE 3.44Å; E138-K365 IonicContact OE1-NZ 3.7Å; E138-K365 PolarHBondContact OE1-NZ 3.46Å; I361-K365 PolarHBondContact O-N 2.66Å; N362-K365 WeakPolarHBondContact O-CG 3.38Å; N362-K365 PolarHBondContact O-N 2.81Å; Y363-K365 WeakPolarHBondContact O-CG 3.41Å; Y363-K365 PolarHBondContact O-N 3.01Å; K365-K367 PolarHBondContact O-N 3.06Å
366	H	88.3	Confident	92.1	Very high	41 Å²	41	57.7 Å²	57.7	19%	0.19	28%	0.276	C	S	.	.			trans	-51.4	135.1	174.8	-78.7	-75.3	0	0	0	111.9	E323 R364 V368 F371	E323-H366 IonicContact OE1-CD2 2.9Å; E323-H366 IonicContact OE1-CE1 3.42Å; E323-H366 IonicContact OE1-NE2 2.68Å; E323-H366 PolarHBondContact OE1-NE2 3.36Å; E323-H366 IonicContact OE2-NE2 3.2Å; R364-H366 VanDerWaalsContact C-N 3.33Å; R364-H366 PolarHBondContact O-N 3.04Å; H366-V368 VanDerWaalsContact C-N 3.27Å; H366-V368 PolarHBondContact O-N 2.95Å; H366-F371 HydrophobicContact CB-CB 4.08Å; H366-F371 HydrophobicContact CB-CD1 4.11Å; H366-F371 HydrophobicContact CB-CD2 3.67Å; H366-F371 HydrophobicContact CB-CE1 4.45Å; H366-F371 HydrophobicContact CB-CE2 4.02Å; H366-F371 HydrophobicContact CB-CG 3.68Å; H366-F371 HydrophobicContact CB-CZ 4.39Å; H366-F371 AromaticContact CD2-CD1 3.75Å; H366-F371 AromaticContact CD2-CE1 3.36Å; H366-F371 WeakPolarHBondContact CD2-CE1 3.44Å; H366-F371 AromaticContact CD2-CE2 3.88Å; H366-F371 AromaticContact CD2-CZ 3.41Å; H366-F371 VanDerWaalsContact CD2-CZ 3.41Å; H366-F371 WeakPolarHBondContact CD2-CZ 3.38Å; H366-F371 AromaticContact CE1-CE2 3.71Å; H366-F371 AromaticContact CE1-CZ 3.46Å; H366-F371 VanDerWaalsContact CE1-CZ 3.46Å; H366-F371 WeakPolarHBondContact CE1-CZ 3.35Å; H366-F371 AromaticContact CG-CD1 3.98Å; H366-F371 AromaticContact CG-CD2 3.71Å; H366-F371 AromaticContact CG-CE1 3.83Å; H366-F371 AromaticContact CG-CE2 3.52Å; H366-F371 AromaticContact CG-CG 3.91Å; H366-F371 AromaticContact CG-CZ 3.58Å; H366-F371 AromaticContact ND1-CE2 3.47Å; H366-F371 WeakPolarHBondContact ND1-CE2 3.38Å; H366-F371 AromaticContact ND1-CZ 3.67Å; H366-F371 AromaticContact NE2-CE1 3.63Å; H366-F371 AromaticContact NE2-CE2 3.97Å; H366-F371 AromaticContact NE2-CZ 3.32Å; H366-F371 VanDerWaalsContact NE2-CZ 3.32Å; H366-F371 WeakPolarHBondContact NE2-CZ 3.45Å
367	K	84.7	Confident	92.1	Very high	214 Å²	214	62.9 Å²	62.9	93%	0.93	30%	0.301	S	S	*	.	S	Bend	trans	-80.9	-7.3	-176.9	-63.4	-176.2	-178.3	176.8	0	113.5	K365	K365-K367 PolarHBondContact O-N 3.06Å
368	V	84.8	Confident	92	Very high	59 Å²	59	64.2 Å²	64.2	36%	0.358	31%	0.307	S	S	.	.	S	Bend	trans	-78.6	127.5	-179.9	-179	0	0	0	0	109.6	H366 H370 F371 K374	H366-V368 VanDerWaalsContact C-N 3.27Å; H366-V368 PolarHBondContact O-N 2.95Å; V368-H370 PolarHBondContact O-N 3.3Å; V368-F371 HydrophobicContact CB-CB 4.34Å; V368-F371 HydrophobicContact CB-CD2 3.95Å; V368-F371 HydrophobicContact CG2-CD2 4.29Å; V368-F371 WeakPolarHBondContact O-CB 3.44Å; V368-F371 PolarHBondContact O-N 3.15Å; V368-K374 HydrophobicContact CG1-CD 4.46Å
369	A	83.9	Confident	92	Very high	61 Å²	61	61.7 Å²	61.7	50%	0.504	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	134.6	175.3	0	0	0	0	0	111.2	F371 K374	A369-F371 VanDerWaalsContact C-N 3.27Å; A369-F371 PolarHBondContact O-N 2.99Å; A369-K374 WeakPolarHBondContact O-CE 3.29Å; A369-K374 PolarHBondContact O-NZ 3.01Å
370	H	87.9	Confident	92	Very high	130 Å²	130	64 Å²	64	60%	0.602	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	38.6	-178	-48.1	-73.8	0	0	0	113.2	V368 W372 P373 K374	V368-H370 PolarHBondContact O-N 3.3Å; H370-W372 PolarHBondContact O-N 2.9Å; H370-P373 WeakPolarHBondContact O-CD 3.34Å; H370-K374 WeakPolarHBondContact O-CB 3.5Å; H370-K374 VanDerWaalsContact O-CG 3.28Å; H370-K374 WeakPolarHBondContact O-CG 3.49Å; H370-K374 PolarHBondContact O-N 3.05Å
371	F	91.4	Very high	92	Very high	9 Å²	9	66.3 Å²	66.3	4%	0.039	33%	0.326	C	S	.	.	H	α-helix	trans	-54.7	-51.1	-177.8	-176.7	-88.2	0	0	0	113	F317 L319 I361 H366 V368 A369 K374 L375	F317-F371 HydrophobicContact CB-CE2 3.99Å; F317-F371 HydrophobicContact CB-CZ 4.39Å; F317-F371 AromaticContact CD1-CD2 3.93Å; F317-F371 HydrophobicContact CD1-CD2 3.93Å; F317-F371 AromaticContact CD1-CE2 3.37Å; F317-F371 HydrophobicContact CD1-CE2 3.37Å; F317-F371 AromaticContact CD1-CZ 3.73Å; F317-F371 HydrophobicContact CD1-CZ 3.73Å; F317-F371 HydrophobicContact CE1-CD2 4.3Å; F317-F371 HydrophobicContact CE1-CE2 4.18Å; F317-F371 AromaticContact CG-CE2 3.99Å; F317-F371 HydrophobicContact CG-CE2 3.99Å; L319-F371 HydrophobicContact CD2-CZ 3.76Å; I361-F371 HydrophobicContact CD1-CD1 4.35Å; I361-F371 HydrophobicContact CD1-CE1 3.64Å; I361-F371 HydrophobicContact CG1-CD1 4.44Å; I361-F371 HydrophobicContact CG1-CE1 4.17Å; I361-F371 HydrophobicContact CG2-CD1 3.56Å; I361-F371 HydrophobicContact CG2-CE1 4.02Å; H366-F371 HydrophobicContact CB-CB 4.08Å; H366-F371 HydrophobicContact CB-CD1 4.11Å; H366-F371 HydrophobicContact CB-CD2 3.67Å; H366-F371 HydrophobicContact CB-CE1 4.45Å; H366-F371 HydrophobicContact CB-CE2 4.02Å; H366-F371 HydrophobicContact CB-CG 3.68Å; H366-F371 HydrophobicContact CB-CZ 4.39Å; H366-F371 AromaticContact CD2-CD1 3.75Å; H366-F371 AromaticContact CD2-CE1 3.36Å; H366-F371 WeakPolarHBondContact CD2-CE1 3.44Å; H366-F371 AromaticContact CD2-CE2 3.88Å; H366-F371 AromaticContact CD2-CZ 3.41Å; H366-F371 VanDerWaalsContact CD2-CZ 3.41Å; H366-F371 WeakPolarHBondContact CD2-CZ 3.38Å; H366-F371 AromaticContact CE1-CE2 3.71Å; H366-F371 AromaticContact CE1-CZ 3.46Å; H366-F371 VanDerWaalsContact CE1-CZ 3.46Å; H366-F371 WeakPolarHBondContact CE1-CZ 3.35Å; H366-F371 AromaticContact CG-CD1 3.98Å; H366-F371 AromaticContact CG-CD2 3.71Å; H366-F371 AromaticContact CG-CE1 3.83Å; H366-F371 AromaticContact CG-CE2 3.52Å; H366-F371 AromaticContact CG-CG 3.91Å; H366-F371 AromaticContact CG-CZ 3.58Å; H366-F371 AromaticContact ND1-CE2 3.47Å; H366-F371 WeakPolarHBondContact ND1-CE2 3.38Å; H366-F371 AromaticContact ND1-CZ 3.67Å; H366-F371 AromaticContact NE2-CE1 3.63Å; H366-F371 AromaticContact NE2-CE2 3.97Å; H366-F371 AromaticContact NE2-CZ 3.32Å; H366-F371 VanDerWaalsContact NE2-CZ 3.32Å; H366-F371 WeakPolarHBondContact NE2-CZ 3.45Å; V368-F371 HydrophobicContact CB-CB 4.34Å; V368-F371 HydrophobicContact CB-CD2 3.95Å; V368-F371 HydrophobicContact CG2-CD2 4.29Å; V368-F371 WeakPolarHBondContact O-CB 3.44Å; V368-F371 PolarHBondContact O-N 3.15Å; A369-F371 VanDerWaalsContact C-N 3.27Å; A369-F371 PolarHBondContact O-N 2.99Å; F371-K374 PolarHBondContact O-N 3.2Å; F371-L375 HydrophobicContact CD1-CD2 4.48Å; F371-L375 HydrophobicContact CE1-CB 4.36Å; F371-L375 HydrophobicContact CE1-CD2 3.65Å; F371-L375 HydrophobicContact CZ-CD2 4.17Å; F371-L375 WeakPolarHBondContact O-CB 3.35Å; F371-L375 PolarHBondContact O-N 2.83Å
372	W	93.1	Very high	92.2	Very high	35 Å²	35	66.1 Å²	66.1	13%	0.133	33%	0.325	C	S	.	.	H	α-helix	trans	-57.5	-55.1	-176.9	172.1	-121.6	0	0	0	113.6	L354 F357 E358 I361 H370 K374 L375 L376	L354-W372 HydrophobicContact CD2-CH2 4.29Å; L354-W372 HydrophobicContact CD2-CZ2 4.43Å; F357-W372 HydrophobicContact CB-CH2 3.87Å; F357-W372 HydrophobicContact CB-CZ3 4.03Å; F357-W372 AromaticContact CD1-CH2 3.8Å; F357-W372 HydrophobicContact CD1-CH2 3.8Å; F357-W372 AromaticContact CD1-CZ3 3.62Å; F357-W372 HydrophobicContact CD1-CZ3 3.62Å; F357-W372 AromaticContact CD2-CZ3 3.93Å; F357-W372 HydrophobicContact CD2-CZ3 3.93Å; F357-W372 HydrophobicContact CE1-CZ3 4.08Å; F357-W372 HydrophobicContact CE2-CZ3 4.36Å; F357-W372 AromaticContact CG-CH2 3.82Å; F357-W372 HydrophobicContact CG-CH2 3.82Å; F357-W372 AromaticContact CG-CZ3 3.54Å; F357-W372 HydrophobicContact CG-CZ3 3.54Å; F357-W372 HydrophobicContact CZ-CZ3 4.45Å; E358-W372 HydrophobicContact CB-CD2 4.35Å; E358-W372 HydrophobicContact CB-CH2 4.12Å; E358-W372 HydrophobicContact CB-CZ2 3.69Å; E358-W372 HydrophobicContact CG-CD2 4.39Å; E358-W372 HydrophobicContact CG-CZ2 4.38Å; I361-W372 HydrophobicContact CB-CE3 4.44Å; I361-W372 HydrophobicContact CG1-CE3 3.81Å; I361-W372 HydrophobicContact CG1-CZ3 4.11Å; I361-W372 HydrophobicContact CG2-CB 4.3Å; H370-W372 PolarHBondContact O-N 2.9Å; W372-K374 VanDerWaalsContact C-N 3.29Å; W372-K374 PolarHBondContact O-N 3.47Å; W372-L375 PolarHBondContact O-N 3.31Å; W372-L375 VanDerWaalsContact O-N 3.13Å; W372-L376 HydrophobicContact CD2-CD1 4.16Å; W372-L376 HydrophobicContact CD2-CG 4.16Å; W372-L376 HydrophobicContact CE3-CG 4.33Å; W372-L376 HydrophobicContact CH2-CD1 4.34Å; W372-L376 HydrophobicContact CH2-CD2 3.78Å; W372-L376 HydrophobicContact CH2-CG 4.13Å; W372-L376 HydrophobicContact CZ2-CD1 3.65Å; W372-L376 HydrophobicContact CZ2-CD2 3.92Å; W372-L376 HydrophobicContact CZ2-CG 3.93Å; W372-L376 HydrophobicContact CZ3-CD2 4.18Å; W372-L376 HydrophobicContact CZ3-CG 4.32Å; W372-L376 PolarHBondContact O-N 3.25Å
373	P	93.9	Very high	92.4	Very high	72 Å²	72	67.9 Å²	67.9	47%	0.468	33%	0.33	S	S	.	.	H	α-helix	trans	-57.7	-39.6	174.8	-26.4	33.4	0	0	0	113.5	H370 L375 L376 M377	H370-P373 WeakPolarHBondContact O-CD 3.34Å; P373-L375 VanDerWaalsContact C-N 3.32Å; P373-L375 PolarHBondContact O-N 3.26Å; P373-L376 PolarHBondContact O-N 2.81Å; P373-M377 VanDerWaalsContact O-CG 3.31Å; P373-M377 WeakPolarHBondContact O-CG 3.49Å; P373-M377 PolarHBondContact O-N 3.49Å; P373-M377 VanDerWaalsContact O-N 3.1Å
374	K	94.6	Very high	92.6	Very high	96 Å²	96	68.2 Å²	68.2	42%	0.417	34%	0.337	S	S	.	.	H	α-helix	trans	-65.7	-35.6	178.6	-74.3	175.2	174.8	170.4	0	112.5	F317 V368 A369 H370 F371 W372	F317-K374 HydrophobicContact CE1-CB 4.1Å; F317-K374 HydrophobicContact CZ-CB 3.88Å; V368-K374 HydrophobicContact CG1-CD 4.46Å; A369-K374 WeakPolarHBondContact O-CE 3.29Å; A369-K374 PolarHBondContact O-NZ 3.01Å; H370-K374 WeakPolarHBondContact O-CB 3.5Å; H370-K374 VanDerWaalsContact O-CG 3.28Å; H370-K374 WeakPolarHBondContact O-CG 3.49Å; H370-K374 PolarHBondContact O-N 3.05Å; F371-K374 PolarHBondContact O-N 3.2Å; W372-K374 VanDerWaalsContact C-N 3.29Å; W372-K374 PolarHBondContact O-N 3.47Å
375	L	95.5	Very high	92.8	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-70.9	-43.3	176.9	-176.6	56.1	0	0	0	110.8	F317 L319 L327 F357 I361 F371 W372 P373 M377 K378	F317-L375 HydrophobicContact CD1-CB 4.33Å; F317-L375 HydrophobicContact CD1-CD1 4.04Å; F317-L375 HydrophobicContact CE1-CB 3.95Å; F317-L375 HydrophobicContact CE1-CD1 4.23Å; L319-L375 HydrophobicContact CD1-CD1 4.04Å; L319-L375 HydrophobicContact CD2-CD1 4.06Å; L319-L375 HydrophobicContact CD2-CD2 4.1Å; L327-L375 HydrophobicContact CD2-CD1 4.39Å; F357-L375 HydrophobicContact CE1-CD2 4.33Å; F357-L375 HydrophobicContact CE2-CD2 3.88Å; F357-L375 HydrophobicContact CZ-CD2 3.49Å; F357-L375 VanDerWaalsContact CZ-CD2 3.49Å; F357-L375 HydrophobicContact CZ-CG 4.26Å; I361-L375 HydrophobicContact CD1-CD2 4.15Å; I361-L375 HydrophobicContact CG1-CD2 4.48Å; F371-L375 HydrophobicContact CD1-CD2 4.48Å; F371-L375 HydrophobicContact CE1-CB 4.36Å; F371-L375 HydrophobicContact CE1-CD2 3.65Å; F371-L375 HydrophobicContact CZ-CD2 4.17Å; F371-L375 WeakPolarHBondContact O-CB 3.35Å; F371-L375 PolarHBondContact O-N 2.83Å; W372-L375 PolarHBondContact O-N 3.31Å; W372-L375 VanDerWaalsContact O-N 3.13Å; P373-L375 VanDerWaalsContact C-N 3.32Å; P373-L375 PolarHBondContact O-N 3.26Å; L375-M377 VanDerWaalsContact C-N 3.27Å; L375-M377 PolarHBondContact O-N 3.39Å; L375-K378 WeakPolarHBondContact O-CA 3.43Å; L375-K378 WeakPolarHBondContact O-CB 3.5Å; L375-K378 WeakPolarHBondContact O-CG 3.3Å; L375-K378 PolarHBondContact O-N 3.4Å
376	L	94.6	Very high	93.3	Very high	45 Å²	45	59.2 Å²	59.2	24%	0.236	30%	0.304	C	S	.	.	H	α-helix	trans	-60.9	-34.6	175.8	-74.7	-178.5	0	0	0	112.8	L354 W372 P373 K378 V379	L354-L376 HydrophobicContact CD2-CD2 3.81Å; W372-L376 HydrophobicContact CD2-CD1 4.16Å; W372-L376 HydrophobicContact CD2-CG 4.16Å; W372-L376 HydrophobicContact CE3-CG 4.33Å; W372-L376 HydrophobicContact CH2-CD1 4.34Å; W372-L376 HydrophobicContact CH2-CD2 3.78Å; W372-L376 HydrophobicContact CH2-CG 4.13Å; W372-L376 HydrophobicContact CZ2-CD1 3.65Å; W372-L376 HydrophobicContact CZ2-CD2 3.92Å; W372-L376 HydrophobicContact CZ2-CG 3.93Å; W372-L376 HydrophobicContact CZ3-CD2 4.18Å; W372-L376 HydrophobicContact CZ3-CG 4.32Å; W372-L376 PolarHBondContact O-N 3.25Å; P373-L376 PolarHBondContact O-N 2.81Å; L376-K378 PolarHBondContact O-N 3.12Å; L376-K378 VanDerWaalsContact O-N 3.12Å; L376-V379 VanDerWaalsContact O-CB 3.27Å; L376-V379 WeakPolarHBondContact O-CB 3.46Å; L376-V379 WeakPolarHBondContact O-CG2 3.41Å; L376-V379 PolarHBondContact O-N 3.41Å
377	M	96.1	Very high	93.6	Very high	110 Å²	110	60.1 Å²	60.1	54%	0.542	32%	0.319	S	S	.	.	H	α-helix	trans	-61.6	-18.6	172.9	-66.4	-66.3	87.5	0	0	113.5	P373 L375 V379 T380 D381	P373-M377 VanDerWaalsContact O-CG 3.31Å; P373-M377 WeakPolarHBondContact O-CG 3.49Å; P373-M377 PolarHBondContact O-N 3.49Å; P373-M377 VanDerWaalsContact O-N 3.1Å; L375-M377 VanDerWaalsContact C-N 3.27Å; L375-M377 PolarHBondContact O-N 3.39Å; M377-V379 VanDerWaalsContact C-N 3.27Å; M377-V379 PolarHBondContact O-N 3.13Å; M377-T380 WeakPolarHBondContact O-CB 3.22Å; M377-T380 PolarHBondContact O-N 3.23Å; M377-T380 VanDerWaalsContact O-N 3.13Å; M377-D381 PolarHBondContact O-N 3.15Å; M377-D381 VanDerWaalsContact O-N 3.17Å
378	K	96.6	Very high	94.1	Very high	28 Å²	28	52.6 Å²	52.6	12%	0.122	29%	0.292	C	S	.	.	H	α-helix	trans	-70.6	-22.8	172.4	-55.5	-51.7	-179.8	179.7	0	113.2	L310 S313 L314 L375 L376 T380 D381 L382	L310-K378 HydrophobicContact CD1-CB 4.33Å; L310-K378 HydrophobicContact CD1-CD 3.88Å; L310-K378 HydrophobicContact CD1-CG 4.47Å; S313-K378 WeakPolarHBondContact OG-CE 3.37Å; S313-K378 PolarHBondContact OG-NZ 3.4Å; L314-K378 HydrophobicContact CD2-CG 3.99Å; L375-K378 WeakPolarHBondContact O-CA 3.43Å; L375-K378 WeakPolarHBondContact O-CB 3.5Å; L375-K378 WeakPolarHBondContact O-CG 3.3Å; L375-K378 PolarHBondContact O-N 3.4Å; L376-K378 PolarHBondContact O-N 3.12Å; L376-K378 VanDerWaalsContact O-N 3.12Å; K378-T380 VanDerWaalsContact C-N 3.31Å; K378-D381 WeakPolarHBondContact CD-OD2 3.27Å; K378-D381 IonicContact NZ-OD2 3.58Å; K378-D381 PolarHBondContact NZ-OD2 2.9Å; K378-D381 PolarHBondContact O-N 2.95Å; K378-L382 WeakPolarHBondContact O-CB 3.49Å; K378-L382 WeakPolarHBondContact O-CD1 3.38Å; K378-L382 VanDerWaalsContact O-CG 3.27Å; K378-L382 WeakPolarHBondContact O-CG 3.46Å; K378-L382 PolarHBondContact O-N 3.38Å
379	V	96.3	Very high	94.7	Very high	21 Å²	21	50 Å²	50	13%	0.127	28%	0.276	C	S	.	.	H	α-helix	trans	-62.5	-43	167.9	-178.2	0	0	0	0	109.8	L327 V330 I331 L376 M377 L382 R383	L327-V379 HydrophobicContact CD1-CG2 3.49Å; L327-V379 VanDerWaalsContact CD1-CG2 3.49Å; V330-V379 HydrophobicContact CG1-CG2 4.41Å; I331-V379 HydrophobicContact CG1-CG1 4.37Å; L376-V379 VanDerWaalsContact O-CB 3.27Å; L376-V379 WeakPolarHBondContact O-CB 3.46Å; L376-V379 WeakPolarHBondContact O-CG2 3.41Å; L376-V379 PolarHBondContact O-N 3.41Å; M377-V379 VanDerWaalsContact C-N 3.27Å; M377-V379 PolarHBondContact O-N 3.13Å; V379-L382 PolarHBondContact O-N 3.29Å; V379-R383 WeakPolarHBondContact O-CG 3.47Å; V379-R383 PolarHBondContact O-N 3.13Å
380	T	95.4	Very high	95.2	Very high	73 Å²	73	49.7 Å²	49.7	45%	0.448	27%	0.274	S	S	.	.	H	α-helix	trans	-62.7	-45.3	177	-49.2	0	0	0	0	111.8	M377 K378 L382 R383 M384	M377-T380 WeakPolarHBondContact O-CB 3.22Å; M377-T380 PolarHBondContact O-N 3.23Å; M377-T380 VanDerWaalsContact O-N 3.13Å; K378-T380 VanDerWaalsContact C-N 3.31Å; T380-L382 VanDerWaalsContact C-N 3.26Å; T380-L382 PolarHBondContact O-N 2.79Å; T380-R383 PolarHBondContact O-N 3.24Å; T380-M384 WeakPolarHBondContact O-CG 3.4Å; T380-M384 PolarHBondContact O-N 3.43Å
381	D	96.9	Very high	95.4	Very high	64 Å²	64	46.9 Å²	46.9	34%	0.342	27%	0.269	S	S	.	.	H	α-helix	trans	-56.3	-43.1	175	-65.5	-19.6	0	0	0	110.8	L310 M377 K378 M384 I385	L310-D381 HydrophobicContact CD1-CB 4.3Å; M377-D381 PolarHBondContact O-N 3.15Å; M377-D381 VanDerWaalsContact O-N 3.17Å; K378-D381 WeakPolarHBondContact CD-OD2 3.27Å; K378-D381 IonicContact NZ-OD2 3.58Å; K378-D381 PolarHBondContact NZ-OD2 2.9Å; K378-D381 PolarHBondContact O-N 2.95Å; D381-M384 PolarHBondContact O-N 2.95Å; D381-I385 WeakPolarHBondContact O-CG1 3.15Å; D381-I385 PolarHBondContact O-N 3.38Å
382	L	98.1	Very high	95.5	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.8	-41.3	178.8	-74.7	164.6	0	0	0	113.2	E265 L269 L310 I331 K378 V379 T380 M384 I385 G386	E265-L382 HydrophobicContact CB-CB 4.34Å; E265-L382 WeakPolarHBondContact O-CD2 3.5Å; L269-L382 HydrophobicContact CB-CD1 3.99Å; L269-L382 HydrophobicContact CB-CD2 4.02Å; L269-L382 HydrophobicContact CD1-CD1 4.23Å; L269-L382 HydrophobicContact CD2-CD1 4.33Å; L269-L382 HydrophobicContact CG-CD1 4.41Å; L310-L382 HydrophobicContact CD2-CD1 4.48Å; L310-L382 HydrophobicContact CD2-CD2 3.38Å; L310-L382 HydrophobicContact CD2-CG 3.82Å; I331-L382 HydrophobicContact CD1-CD1 3.43Å; I331-L382 VanDerWaalsContact CD1-CD1 3.43Å; K378-L382 WeakPolarHBondContact O-CB 3.49Å; K378-L382 WeakPolarHBondContact O-CD1 3.38Å; K378-L382 VanDerWaalsContact O-CG 3.27Å; K378-L382 WeakPolarHBondContact O-CG 3.46Å; K378-L382 PolarHBondContact O-N 3.38Å; V379-L382 PolarHBondContact O-N 3.29Å; T380-L382 VanDerWaalsContact C-N 3.26Å; T380-L382 PolarHBondContact O-N 2.79Å; L382-M384 VanDerWaalsContact C-N 3.28Å; L382-M384 PolarHBondContact O-N 3.3Å; L382-I385 HydrophobicContact CD2-CD1 4.36Å; L382-I385 WeakPolarHBondContact O-CB 3.43Å; L382-I385 PolarHBondContact O-N 3.5Å; L382-G386 PolarHBondContact O-N 2.89Å
383	R	96.4	Very high	95.5	Very high	54 Å²	54	46.8 Å²	46.8	20%	0.204	27%	0.269	C	S	.	.	H	α-helix	trans	-58.3	-42.4	172.7	-68.7	-51.8	-168.3	96.6	17.3	111.5	E265 S334 D336 V379 T380 G386 A387	E265-R383 VanDerWaalsContact CD-CD 3.49Å; E265-R383 WeakPolarHBondContact OE1-CD 3.36Å; E265-R383 IonicContact OE1-NE 2.82Å; E265-R383 VanDerWaalsContact OE2-CD 3.28Å; E265-R383 WeakPolarHBondContact OE2-CD 3.1Å; E265-R383 IonicContact OE2-NE 2.73Å; S334-R383 VanDerWaalsContact OG-CZ 3.28Å; S334-R383 PolarHBondContact OG-NH2 3.36Å; D336-R383 VanDerWaalsContact CG-NH1 3.31Å; D336-R383 IonicContact OD1-CZ 2.9Å; D336-R383 IonicContact OD1-NH1 3.87Å; D336-R383 PolarHBondContact OD1-NH1 3.24Å; D336-R383 VanDerWaalsContact OD1-NH1 3.07Å; D336-R383 IonicContact OD1-NH2 2.72Å; D336-R383 PolarHBondContact OD1-NH2 3.15Å; D336-R383 IonicContact OD2-CZ 3.92Å; D336-R383 IonicContact OD2-NH1 3.06Å; D336-R383 PolarHBondContact OD2-NH1 3.08Å; D336-R383 IonicContact OD2-NH2 3.24Å; V379-R383 WeakPolarHBondContact O-CG 3.47Å; V379-R383 PolarHBondContact O-N 3.13Å; T380-R383 PolarHBondContact O-N 3.24Å; R383-G386 PolarHBondContact O-N 3.31Å; R383-A387 PolarHBondContact O-N 3.06Å
384	M	96.4	Very high	95.4	Very high	113 Å²	113	48.9 Å²	48.9	56%	0.557	28%	0.275	S	S	*	.	H	α-helix	trans	-64.2	-42.1	176.7	-69.8	-56.2	-56.8	0	0	111.8	T380 D381 L382 G386 A387 C388	T380-M384 WeakPolarHBondContact O-CG 3.4Å; T380-M384 PolarHBondContact O-N 3.43Å; D381-M384 PolarHBondContact O-N 2.95Å; L382-M384 VanDerWaalsContact C-N 3.28Å; L382-M384 PolarHBondContact O-N 3.3Å; M384-G386 VanDerWaalsContact C-N 3.32Å; M384-G386 PolarHBondContact O-N 3Å; M384-A387 PolarHBondContact O-N 3.37Å; M384-C388 WeakPolarHBondContact O-CB 3.3Å; M384-C388 PolarHBondContact O-N 2.89Å; M384-C388 PolarHBondContact O-SG 3.4Å; M384-C388 VanDerWaalsContact O-SG 3.33Å
385	I	97.8	Very high	95.2	Very high	4 Å²	4	49.1 Å²	49.1	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-57.8	-45.2	173.3	-71.1	165.7	0	0	0	110.9	M264 S268 V303 A306 I307 L310 D381 L382 C388 H389	M264-I385 HydrophobicContact CE-CG2 4.48Å; S268-I385 WeakPolarHBondContact OG-CG2 3.45Å; V303-I385 HydrophobicContact CG1-CG2 3.97Å; A306-I385 HydrophobicContact CB-CD1 4.23Å; A306-I385 HydrophobicContact CB-CG1 3.7Å; I307-I385 HydrophobicContact CG1-CD1 4.28Å; I307-I385 HydrophobicContact CG1-CG2 4.03Å; L310-I385 HydrophobicContact CB-CD1 4.38Å; L310-I385 HydrophobicContact CD2-CD1 3.94Å; D381-I385 WeakPolarHBondContact O-CG1 3.15Å; D381-I385 PolarHBondContact O-N 3.38Å; L382-I385 HydrophobicContact CD2-CD1 4.36Å; L382-I385 WeakPolarHBondContact O-CB 3.43Å; L382-I385 PolarHBondContact O-N 3.5Å; I385-C388 PolarHBondContact O-N 3.45Å; I385-H389 WeakPolarHBondContact O-CB 3.39Å; I385-H389 PolarHBondContact O-N 2.96Å
386	G	96.5	Very high	95	Very high	14 Å²	14	49.3 Å²	49.3	14%	0.144	28%	0.278	C	S	.	.	H	α-helix	trans	-58.1	-47.9	176.1	0	0	0	0	0	112.8	L382 R383 M384 H389 A390	L382-G386 PolarHBondContact O-N 2.89Å; R383-G386 PolarHBondContact O-N 3.31Å; M384-G386 VanDerWaalsContact C-N 3.32Å; M384-G386 PolarHBondContact O-N 3Å; G386-H389 PolarHBondContact O-N 3.32Å; G386-A390 PolarHBondContact O-N 2.95Å
387	A	94.9	Very high	94.8	Very high	60 Å²	60	50.9 Å²	50.9	50%	0.496	28%	0.284	S	S	.	.	H	α-helix	trans	-63.9	-43.7	177.7	0	0	0	0	0	112.7	R383 M384 H389 A390 S391	R383-A387 PolarHBondContact O-N 3.06Å; M384-A387 PolarHBondContact O-N 3.37Å; A387-H389 VanDerWaalsContact C-N 3.31Å; A387-H389 PolarHBondContact O-N 2.87Å; A387-A390 PolarHBondContact O-N 3.09Å; A387-S391 PolarHBondContact O-N 3.14Å
388	C	95.9	Very high	94.6	Very high	56 Å²	56	51.9 Å²	51.9	38%	0.378	30%	0.295	S	S	.	.	H	α-helix	trans	-63.7	-37.6	175.8	-70.6	0	0	0	0	111.9	V303 M384 I385 S391 R392	V303-C388 HydrophobicContact CG2-CB 4.05Å; M384-C388 WeakPolarHBondContact O-CB 3.3Å; M384-C388 PolarHBondContact O-N 2.89Å; M384-C388 PolarHBondContact O-SG 3.4Å; M384-C388 VanDerWaalsContact O-SG 3.33Å; I385-C388 PolarHBondContact O-N 3.45Å; C388-S391 PolarHBondContact O-N 3.37Å; C388-R392 WeakPolarHBondContact O-CB 3.37Å; C388-R392 PolarHBondContact O-N 3.13Å
389	H	96.3	Very high	94.2	Very high	4 Å²	4	53.8 Å²	53.8	2%	0.019	31%	0.305	C	S	.	.	H	α-helix	trans	-63.4	-43.8	174.9	175.5	-96.4	0	0	0	112.4	M264 V303 I385 G386 A387 S391 R392 F393 F413	M264-H389 HydrophobicContact CE-CB 4.15Å; M264-H389 HydrophobicContact CG-CB 3.69Å; M264-H389 HydrophobicContact SD-CB 4.46Å; V303-H389 HydrophobicContact CG1-CB 4.32Å; V303-H389 HydrophobicContact CG2-CB 4.5Å; I385-H389 WeakPolarHBondContact O-CB 3.39Å; I385-H389 PolarHBondContact O-N 2.96Å; G386-H389 PolarHBondContact O-N 3.32Å; A387-H389 VanDerWaalsContact C-N 3.31Å; A387-H389 PolarHBondContact O-N 2.87Å; H389-S391 VanDerWaalsContact C-N 3.3Å; H389-S391 PolarHBondContact O-N 2.99Å; H389-R392 CarbonylContact O-C 3.58Å; H389-R392 PolarHBondContact O-N 3.08Å; H389-R392 VanDerWaalsContact O-N 3.08Å; H389-F393 WeakPolarHBondContact O-CB 3.48Å; H389-F393 PolarHBondContact O-N 3.04Å; H389-F413 AromaticContact CE1-CD1 3.65Å; H389-F413 AromaticContact CE1-CE1 3.9Å; H389-F413 AromaticContact CE1-CG 3.78Å; H389-F413 AromaticContact ND1-CD1 3.89Å
390	A	94	Very high	93.9	Very high	56 Å²	56	53.1 Å²	53.1	46%	0.463	30%	0.301	S	S	.	.	H	α-helix	trans	-57.1	-44.5	177	0	0	0	0	0	111.6	G386 A387 F393	G386-A390 PolarHBondContact O-N 2.95Å; A387-A390 PolarHBondContact O-N 3.09Å; A390-F393 PolarHBondContact O-N 3.11Å
391	S	93.1	Very high	93.6	Very high	71 Å²	71	52.3 Å²	52.3	50%	0.497	30%	0.297	S	S	.	.	H	α-helix	trans	-63.5	-44.3	173.3	176.8	0	0	0	0	112.1	A387 C388 H389 F393 L394 H395	A387-S391 PolarHBondContact O-N 3.14Å; C388-S391 PolarHBondContact O-N 3.37Å; H389-S391 VanDerWaalsContact C-N 3.3Å; H389-S391 PolarHBondContact O-N 2.99Å; S391-F393 VanDerWaalsContact C-N 3.31Å; S391-F393 PolarHBondContact O-N 3.27Å; S391-L394 PolarHBondContact O-N 2.58Å; S391-H395 PolarHBondContact O-CD2 3.45Å
392	R	93.8	Very high	93.2	Very high	36 Å²	36	53.9 Å²	53.9	14%	0.136	31%	0.309	C	S	.	.	H	α-helix	trans	-64.8	-33.9	179.6	-179.3	58.4	-173	147.6	9.5	112.8	V218 G299 V303 C388 H389 L394 H395 M396 E399	V218-R392 VanDerWaalsContact CG2-NH2 3.28Å; G299-R392 PolarHBondContact O-NE 3.21Å; G299-R392 PolarHBondContact O-NH2 3.14Å; V303-R392 HydrophobicContact CG2-CB 3.93Å; V303-R392 HydrophobicContact CG2-CG 4.33Å; C388-R392 WeakPolarHBondContact O-CB 3.37Å; C388-R392 PolarHBondContact O-N 3.13Å; H389-R392 CarbonylContact O-C 3.58Å; H389-R392 PolarHBondContact O-N 3.08Å; H389-R392 VanDerWaalsContact O-N 3.08Å; R392-L394 VanDerWaalsContact C-N 3.28Å; R392-L394 PolarHBondContact O-N 2.98Å; R392-H395 VanDerWaalsContact NH1-CB 3.34Å; R392-H395 WeakPolarHBondContact O-CB 2.97Å; R392-H395 PolarHBondContact O-N 2.96Å; R392-H395 VanDerWaalsContact O-N 3.08Å; R392-M396 HydrophobicContact CG-CG 4.33Å; R392-M396 PolarHBondContact O-N 2.92Å; R392-E399 IonicContact CZ-OE2 3.18Å; R392-E399 VanDerWaalsContact CZ-OE2 3.24Å; R392-E399 IonicContact NH1-OE1 3.58Å; R392-E399 PolarHBondContact NH1-OE1 3.11Å; R392-E399 IonicContact NH1-OE2 3.45Å; R392-E399 PolarHBondContact NH1-OE2 3.03Å; R392-E399 IonicContact NH2-OE2 3.97Å; R392-E399 PolarHBondContact NH2-OE2 3.27Å
393	F	93.3	Very high	92.8	Very high	6 Å²	6	62 Å²	62	3%	0.026	35%	0.347	C	S	.	.	H	α-helix	trans	-58.9	-38.7	179	174.3	-104.1	0	0	0	112.5	H389 A390 S391 H395 M396 K397 F405 F409 L410 F413 E414	H389-F393 WeakPolarHBondContact O-CB 3.48Å; H389-F393 PolarHBondContact O-N 3.04Å; A390-F393 PolarHBondContact O-N 3.11Å; S391-F393 VanDerWaalsContact C-N 3.31Å; S391-F393 PolarHBondContact O-N 3.27Å; F393-H395 VanDerWaalsContact C-N 3.31Å; F393-H395 PolarHBondContact O-N 3.03Å; F393-M396 HydrophobicContact CB-CE 3.99Å; F393-M396 HydrophobicContact CD2-CE 4.04Å; F393-M396 PolarHBondContact O-N 3.39Å; F393-K397 HydrophobicContact CD1-CD 4.48Å; F393-K397 HydrophobicContact CE1-CD 3.8Å; F393-K397 HydrophobicContact CE1-CG 4.31Å; F393-K397 HydrophobicContact CE2-CG 4.39Å; F393-K397 HydrophobicContact CZ-CD 3.88Å; F393-K397 HydrophobicContact CZ-CG 4.14Å; F393-K397 PolarHBondContact O-N 2.98Å; F393-F405 HydrophobicContact CE2-CD1 4.29Å; F393-F405 HydrophobicContact CE2-CE1 4.22Å; F393-F409 AromaticContact CD2-CE1 3.64Å; F393-F409 HydrophobicContact CD2-CE1 3.64Å; F393-F409 AromaticContact CD2-CZ 3.86Å; F393-F409 HydrophobicContact CD2-CZ 3.86Å; F393-F409 AromaticContact CE2-CD1 3.99Å; F393-F409 HydrophobicContact CE2-CD1 3.99Å; F393-F409 AromaticContact CE2-CE1 3.37Å; F393-F409 HydrophobicContact CE2-CE1 3.37Å; F393-F409 HydrophobicContact CE2-CZ 4.03Å; F393-L410 HydrophobicContact CE2-CD2 4.16Å; F393-L410 HydrophobicContact CZ-CD2 3.81Å; F393-F413 HydrophobicContact CD2-CB 4.31Å; F393-F413 WeakPolarHBondContact CE1-O 3.32Å; F393-F413 HydrophobicContact CE2-CB 4.28Å; F393-F413 HydrophobicContact CG-CB 4.46Å; F393-F413 HydrophobicContact CZ-CB 4.37Å; F393-E414 HydrophobicContact CE1-CB 4.21Å; F393-E414 HydrophobicContact CZ-CB 4.35Å
394	L	91.5	Very high	92.6	Very high	116 Å²	116	61.5 Å²	61.5	61%	0.607	35%	0.348	S	S	*	.	H	α-helix	trans	-60.6	-39.7	174.7	-61.4	177.4	0	0	0	112.4	S391 R392	S391-L394 PolarHBondContact O-N 2.58Å; R392-L394 VanDerWaalsContact C-N 3.28Å; R392-L394 PolarHBondContact O-N 2.98Å
395	H	90.8	Very high	92.4	Very high	100 Å²	100	56.8 Å²	56.8	46%	0.463	32%	0.324	S	S	.	.	H	α-helix	trans	-69.7	-41.3	175.4	-67.1	-80.4	0	0	0	112	S391 R392 F393 K397 V398 E399	S391-H395 PolarHBondContact O-CD2 3.45Å; R392-H395 VanDerWaalsContact NH1-CB 3.34Å; R392-H395 WeakPolarHBondContact O-CB 2.97Å; R392-H395 PolarHBondContact O-N 2.96Å; R392-H395 VanDerWaalsContact O-N 3.08Å; F393-H395 VanDerWaalsContact C-N 3.31Å; F393-H395 PolarHBondContact O-N 3.03Å; H395-K397 VanDerWaalsContact C-N 3.26Å; H395-K397 PolarHBondContact O-N 3.27Å; H395-V398 PolarHBondContact O-N 3.31Å; H395-E399 WeakPolarHBondContact O-CG 3.44Å; H395-E399 PolarHBondContact O-N 3.09Å
396	M	90.4	Very high	92.2	Very high	4 Å²	4	57.5 Å²	57.5	2%	0.02	33%	0.329	C	S	.	.	H	α-helix	trans	-57	-40.2	176.2	-69.8	-169.8	-70.9	0	0	111.7	F223 G299 R392 F393 V398 E399 C400 F405 F409	F223-M396 HydrophobicContact CE2-SD 4.11Å; G299-M396 WeakPolarHBondContact O-CG 2.97Å; R392-M396 HydrophobicContact CG-CG 4.33Å; R392-M396 PolarHBondContact O-N 2.92Å; F393-M396 HydrophobicContact CB-CE 3.99Å; F393-M396 HydrophobicContact CD2-CE 4.04Å; F393-M396 PolarHBondContact O-N 3.39Å; M396-V398 PolarHBondContact O-N 3.05Å; M396-E399 PolarHBondContact O-N 3.31Å; M396-C400 WeakPolarHBondContact O-CB 3.36Å; M396-C400 PolarHBondContact O-N 3.27Å; M396-F405 HydrophobicContact CB-CE1 4.26Å; M396-F405 HydrophobicContact CB-CZ 4.1Å; M396-F405 WeakPolarHBondContact O-CZ 3.42Å; M396-F409 HydrophobicContact CE-CZ 4.3Å
397	K	90.8	Very high	92.1	Very high	79 Å²	79	62 Å²	62	34%	0.343	36%	0.356	S	S	.	.	H	α-helix	trans	-62.1	-24.5	177.9	-73.4	-169.4	72	-179.7	0	114	F393 H395 F405 E414	F393-K397 HydrophobicContact CD1-CD 4.48Å; F393-K397 HydrophobicContact CE1-CD 3.8Å; F393-K397 HydrophobicContact CE1-CG 4.31Å; F393-K397 HydrophobicContact CE2-CG 4.39Å; F393-K397 HydrophobicContact CZ-CD 3.88Å; F393-K397 HydrophobicContact CZ-CG 4.14Å; F393-K397 PolarHBondContact O-N 2.98Å; H395-K397 VanDerWaalsContact C-N 3.26Å; H395-K397 PolarHBondContact O-N 3.27Å; K397-F405 HydrophobicContact CG-CZ 4.45Å; K397-E414 IonicContact NZ-OE1 3.3Å; K397-E414 PolarHBondContact NZ-OE1 2.94Å
398	V	90.8	Very high	92.1	Very high	130 Å²	130	61.4 Å²	61.4	79%	0.788	34%	0.344	S	S	*	.	H	α-helix	trans	-88.9	-38	177.2	-179.7	0	0	0	0	111	H395 M396	H395-V398 PolarHBondContact O-N 3.31Å; M396-V398 PolarHBondContact O-N 3.05Å
399	E	89.4	Confident	92	Very high	69 Å²	69	59 Å²	59	32%	0.322	33%	0.327	S	S	.	.	H	α-helix	trans	-82.1	-27.3	-173.9	-68.4	164.9	-165.7	0	0	113.4	V218 R392 H395 M396	V218-E399 HydrophobicContact CG2-CB 4.09Å; V218-E399 WeakPolarHBondContact CG2-OE2 3.5Å; R392-E399 IonicContact CZ-OE2 3.18Å; R392-E399 VanDerWaalsContact CZ-OE2 3.24Å; R392-E399 IonicContact NH1-OE1 3.58Å; R392-E399 PolarHBondContact NH1-OE1 3.11Å; R392-E399 IonicContact NH1-OE2 3.45Å; R392-E399 PolarHBondContact NH1-OE2 3.03Å; R392-E399 IonicContact NH2-OE2 3.97Å; R392-E399 PolarHBondContact NH2-OE2 3.27Å; H395-E399 WeakPolarHBondContact O-CG 3.44Å; H395-E399 PolarHBondContact O-N 3.09Å; M396-E399 PolarHBondContact O-N 3.31Å
400	C	90	Very high	91.9	Very high	7 Å²	7	60.5 Å²	60.5	5%	0.047	34%	0.335	C	S	.	.	S	Bend	trans	-112.8	146	-174	-62.3	0	0	0	0	112.8	V218 F223 M396 T402 F405	V218-C400 VanDerWaalsContact CG1-SG 3.6Å; F223-C400 HydrophobicContact CD1-CB 4.1Å; F223-C400 HydrophobicContact CE1-CB 3.72Å; F223-C400 HydrophobicContact CZ-CB 4.1Å; M396-C400 WeakPolarHBondContact O-CB 3.36Å; M396-C400 PolarHBondContact O-N 3.27Å; C400-T402 PolarHBondContact O-N 2.81Å; C400-F405 HydrophobicContact CB-CE2 3.69Å; C400-F405 HydrophobicContact CB-CZ 3.85Å
401	P	89.4	Confident	92	Very high	55 Å²	55	64.2 Å²	64.2	36%	0.357	34%	0.343	S	S	.	.			trans	-57.2	134.3	171.3	-22.4	30.9	0	0	0	112.5	E403 L404 F405	P401-E403 PolarHBondContact O-N 3.27Å; P401-L404 HydrophobicContact CB-CD1 4.34Å; P401-L404 HydrophobicContact CB-CG 4.27Å; P401-L404 HydrophobicContact CG-CD1 4.09Å; P401-L404 PolarHBondContact O-N 3.44Å; P401-L404 VanDerWaalsContact O-N 3.14Å; P401-F405 WeakPolarHBondContact O-CD2 3.3Å
402	T	88.5	Confident	92.1	Very high	98 Å²	98	61.8 Å²	61.8	60%	0.601	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-60.9	-30.7	-178.1	-50.8	0	0	0	0	112.5	C400 L404 F405	C400-T402 PolarHBondContact O-N 2.81Å; T402-L404 PolarHBondContact O-N 3.06Å; T402-F405 PolarHBondContact O-N 3.21Å
403	E	89.6	Confident	92.1	Very high	171 Å²	171	61.2 Å²	61.2	80%	0.799	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-67.5	-17.2	-179.3	-50.8	99.6	172.7	0	0	113.6	P401 F405	P401-E403 PolarHBondContact O-N 3.27Å; E403-F405 VanDerWaalsContact C-N 3.35Å
404	L	90.6	Very high	91.8	Very high	43 Å²	43	64.6 Å²	64.6	23%	0.225	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-80.1	-17.7	178.4	-64.8	-178.8	0	0	0	112.9	I220 F223 T227 P401 T402 P406	I220-L404 HydrophobicContact CG2-CD1 3.72Å; F223-L404 HydrophobicContact CD1-CB 4.1Å; F223-L404 HydrophobicContact CD1-CD1 3.93Å; F223-L404 HydrophobicContact CE1-CB 3.75Å; F223-L404 HydrophobicContact CE1-CD1 4.32Å; T227-L404 WeakPolarHBondContact CB-O 3.35Å; T227-L404 VanDerWaalsContact CG2-O 3.23Å; T227-L404 WeakPolarHBondContact CG2-O 3.49Å; T227-L404 PolarHBondContact OG1-O 3.28Å; P401-L404 HydrophobicContact CB-CD1 4.34Å; P401-L404 HydrophobicContact CB-CG 4.27Å; P401-L404 HydrophobicContact CG-CD1 4.09Å; P401-L404 PolarHBondContact O-N 3.44Å; P401-L404 VanDerWaalsContact O-N 3.14Å; T402-L404 PolarHBondContact O-N 3.06Å; L404-P406 WeakPolarHBondContact O-CD 3.45Å
405	F	92.8	Very high	91	Very high	13 Å²	13	69.4 Å²	69.4	6%	0.057	37%	0.366	C	S	.	.	S	Bend	trans	-80.1	119.5	-178.9	-68.6	-96.6	0	0	0	110.6	F223 F393 M396 K397 C400 P401 T402 E403 F409 L410	F223-F405 HydrophobicContact CE1-CE2 4.23Å; F223-F405 HydrophobicContact CE1-CZ 4.23Å; F223-F405 HydrophobicContact CE2-CE1 4.49Å; F223-F405 HydrophobicContact CZ-CD1 4.13Å; F223-F405 HydrophobicContact CZ-CD2 4.49Å; F223-F405 AromaticContact CZ-CE1 3.68Å; F223-F405 HydrophobicContact CZ-CE1 3.68Å; F223-F405 HydrophobicContact CZ-CE2 4.09Å; F223-F405 AromaticContact CZ-CZ 3.65Å; F223-F405 HydrophobicContact CZ-CZ 3.65Å; F393-F405 HydrophobicContact CE2-CD1 4.29Å; F393-F405 HydrophobicContact CE2-CE1 4.22Å; M396-F405 HydrophobicContact CB-CE1 4.26Å; M396-F405 HydrophobicContact CB-CZ 4.1Å; M396-F405 WeakPolarHBondContact O-CZ 3.42Å; K397-F405 HydrophobicContact CG-CZ 4.45Å; C400-F405 HydrophobicContact CB-CE2 3.69Å; C400-F405 HydrophobicContact CB-CZ 3.85Å; P401-F405 WeakPolarHBondContact O-CD2 3.3Å; T402-F405 PolarHBondContact O-N 3.21Å; E403-F405 VanDerWaalsContact C-N 3.35Å; F405-F409 AromaticContact CD1-CD1 3.77Å; F405-F409 HydrophobicContact CD1-CD1 3.77Å; F405-F409 AromaticContact CD1-CE1 3.66Å; F405-F409 HydrophobicContact CD1-CE1 3.66Å; F405-F409 AromaticContact CE1-CE1 3.98Å; F405-F409 HydrophobicContact CE1-CE1 3.98Å; F405-L410 HydrophobicContact CB-CD1 4.05Å; F405-L410 HydrophobicContact CB-CD2 3.79Å; F405-L410 HydrophobicContact CB-CG 3.9Å; F405-L410 HydrophobicContact CD1-CD2 4.04Å; F405-L410 HydrophobicContact CG-CD2 4.1Å
406	P	94.2	Very high	91	Very high	19 Å²	19	67.9 Å²	67.9	12%	0.123	36%	0.361	C	S	.	.			trans	-64.8	142.7	176.7	-22.6	35.2	0	0	0	111.4	T227 I230 T231 L404 L408 F409 L410	T227-P406 WeakPolarHBondContact O-CG 3.36Å; I230-P406 HydrophobicContact CG2-CG 3.87Å; T231-P406 WeakPolarHBondContact OG1-CB 3.32Å; L404-P406 WeakPolarHBondContact O-CD 3.45Å; P406-L408 VanDerWaalsContact C-N 3.32Å; P406-L408 PolarHBondContact O-N 3.1Å; P406-F409 HydrophobicContact CB-CB 4.15Å; P406-F409 HydrophobicContact CG-CB 4.36Å; P406-F409 WeakPolarHBondContact O-CA 3.42Å; P406-F409 VanDerWaalsContact O-CB 3.31Å; P406-F409 WeakPolarHBondContact O-CB 3.41Å; P406-F409 PolarHBondContact O-N 2.82Å; P406-L410 PolarHBondContact O-N 3.49Å; P406-L410 VanDerWaalsContact O-N 3.15Å
407	P	95.1	Very high	91	Very high	109 Å²	109	71.3 Å²	71.3	71%	0.708	38%	0.379	S	S	*	.	H	α-helix	trans	-55.1	-43.5	-178.3	-28.7	35.2	0	0	0	113.9	F409 L410 E411	P407-F409 VanDerWaalsContact C-N 3.27Å; P407-F409 PolarHBondContact O-N 3.29Å; P407-L410 PolarHBondContact O-N 2.83Å; P407-E411 PolarHBondContact O-N 3.12Å
408	L	94	Very high	91	Very high	47 Å²	47	70.8 Å²	70.8	25%	0.246	38%	0.381	C	S	.	.	H	α-helix	trans	-65.1	-31.2	177.8	-176.3	62.8	0	0	0	112.5	T231 I234 P406 V412	T231-L408 HydrophobicContact CG2-CB 4.38Å; T231-L408 HydrophobicContact CG2-CD2 3.99Å; I234-L408 HydrophobicContact CB-CD2 4.1Å; I234-L408 HydrophobicContact CD1-CG 4.48Å; I234-L408 HydrophobicContact CG2-CD1 4.48Å; I234-L408 HydrophobicContact CG2-CD2 3.73Å; I234-L408 HydrophobicContact CG2-CG 3.92Å; P406-L408 VanDerWaalsContact C-N 3.32Å; P406-L408 PolarHBondContact O-N 3.1Å; L408-V412 HydrophobicContact CD1-CG2 4.23Å; L408-V412 WeakPolarHBondContact O-CB 3.33Å; L408-V412 VanDerWaalsContact O-CG2 3.3Å; L408-V412 WeakPolarHBondContact O-CG2 3.45Å; L408-V412 PolarHBondContact O-N 2.88Å; L408-V412 VanDerWaalsContact O-N 3.15Å
409	F	94.4	Very high	91	Very high	6 Å²	6	67.4 Å²	67.4	3%	0.026	36%	0.357	C	S	.	.	H	α-helix	trans	-68.1	-42.5	176.5	178.1	-102	0	0	0	110.7	I230 I234 F393 M396 F405 P406 P407 F413	I230-F409 HydrophobicContact CD1-CD2 3.35Å; I230-F409 HydrophobicContact CD1-CE2 3.22Å; I230-F409 HydrophobicContact CD1-CG 4.41Å; I230-F409 HydrophobicContact CD1-CZ 4.16Å; I230-F409 HydrophobicContact CG1-CD2 3.78Å; I230-F409 HydrophobicContact CG1-CE2 4.13Å; I230-F409 HydrophobicContact CG2-CB 4.2Å; I230-F409 HydrophobicContact CG2-CD2 4.09Å; I230-F409 HydrophobicContact CG2-CG 4.32Å; I234-F409 HydrophobicContact CD1-CB 4.21Å; I234-F409 HydrophobicContact CD1-CD2 4.15Å; F393-F409 AromaticContact CD2-CE1 3.64Å; F393-F409 HydrophobicContact CD2-CE1 3.64Å; F393-F409 AromaticContact CD2-CZ 3.86Å; F393-F409 HydrophobicContact CD2-CZ 3.86Å; F393-F409 AromaticContact CE2-CD1 3.99Å; F393-F409 HydrophobicContact CE2-CD1 3.99Å; F393-F409 AromaticContact CE2-CE1 3.37Å; F393-F409 HydrophobicContact CE2-CE1 3.37Å; F393-F409 HydrophobicContact CE2-CZ 4.03Å; M396-F409 HydrophobicContact CE-CZ 4.3Å; F405-F409 AromaticContact CD1-CD1 3.77Å; F405-F409 HydrophobicContact CD1-CD1 3.77Å; F405-F409 AromaticContact CD1-CE1 3.66Å; F405-F409 HydrophobicContact CD1-CE1 3.66Å; F405-F409 AromaticContact CE1-CE1 3.98Å; F405-F409 HydrophobicContact CE1-CE1 3.98Å; P406-F409 HydrophobicContact CB-CB 4.15Å; P406-F409 HydrophobicContact CG-CB 4.36Å; P406-F409 WeakPolarHBondContact O-CA 3.42Å; P406-F409 VanDerWaalsContact O-CB 3.31Å; P406-F409 WeakPolarHBondContact O-CB 3.41Å; P406-F409 PolarHBondContact O-N 2.82Å; P407-F409 VanDerWaalsContact C-N 3.27Å; P407-F409 PolarHBondContact O-N 3.29Å; F409-F413 AromaticContact CD2-CD2 3.34Å; F409-F413 HydrophobicContact CD2-CD2 3.34Å; F409-F413 AromaticContact CD2-CE2 3.53Å; F409-F413 HydrophobicContact CD2-CE2 3.53Å; F409-F413 AromaticContact CE2-CD2 3.26Å; F409-F413 HydrophobicContact CE2-CD2 3.26Å; F409-F413 AromaticContact CE2-CE2 3.49Å; F409-F413 HydrophobicContact CE2-CE2 3.49Å; F409-F413 VanDerWaalsContact CE2-CE2 3.49Å; F409-F413 HydrophobicContact CE2-CG 4.27Å; F409-F413 HydrophobicContact CG-CD2 4.06Å; F409-F413 AromaticContact CZ-CD2 4Å; F409-F413 HydrophobicContact CZ-CD2 4Å; F409-F413 WeakPolarHBondContact O-CD2 3.34Å; F409-F413 PolarHBondContact O-N 2.87Å; F409-F413 VanDerWaalsContact O-N 3.08Å
410	L	94.7	Very high	91.1	Very high	35 Å²	35	67.3 Å²	67.3	18%	0.183	36%	0.359	C	S	.	.	H	α-helix	trans	-63.5	-48.7	173.1	-63.4	176.7	0	0	0	110.9	F393 F405 P406 P407 V412 F413 E414	F393-L410 HydrophobicContact CE2-CD2 4.16Å; F393-L410 HydrophobicContact CZ-CD2 3.81Å; F405-L410 HydrophobicContact CB-CD1 4.05Å; F405-L410 HydrophobicContact CB-CD2 3.79Å; F405-L410 HydrophobicContact CB-CG 3.9Å; F405-L410 HydrophobicContact CD1-CD2 4.04Å; F405-L410 HydrophobicContact CG-CD2 4.1Å; P406-L410 PolarHBondContact O-N 3.49Å; P406-L410 VanDerWaalsContact O-N 3.15Å; P407-L410 PolarHBondContact O-N 2.83Å; L410-V412 PolarHBondContact O-N 3.46Å; L410-V412 VanDerWaalsContact O-N 3.13Å; L410-F413 PolarHBondContact O-N 3.25Å; L410-E414 WeakPolarHBondContact O-CA 3.38Å; L410-E414 WeakPolarHBondContact O-CB 3.09Å; L410-E414 PolarHBondContact O-N 2.94Å
411	E	94.7	Very high	91.2	Very high	134 Å²	134	71.3 Å²	71.3	63%	0.626	38%	0.38	S	S	*	.	H	α-helix	trans	-54.5	-38.1	179.8	-173.7	-177.6	160.3	0	0	113.1	K260 P407	K260-E411 WeakPolarHBondContact CE-O 3.49Å; K260-E411 PolarHBondContact NZ-O 2.82Å; P407-E411 PolarHBondContact O-N 3.12Å
412	V	94.8	Very high	91.3	Very high	20 Å²	20	72.4 Å²	72.4	12%	0.121	38%	0.382	C	S	.	.	H	α-helix	trans	-81.5	-39.9	-177.6	172.1	0	0	0	0	113.1	I234 K260 C263 L408 L410	I234-V412 HydrophobicContact CG2-CG2 3.93Å; K260-V412 WeakPolarHBondContact CG-O 3.4Å; C263-V412 HydrophobicContact CB-CG1 3.76Å; L408-V412 HydrophobicContact CD1-CG2 4.23Å; L408-V412 WeakPolarHBondContact O-CB 3.33Å; L408-V412 VanDerWaalsContact O-CG2 3.3Å; L408-V412 WeakPolarHBondContact O-CG2 3.45Å; L408-V412 PolarHBondContact O-N 2.88Å; L408-V412 VanDerWaalsContact O-N 3.15Å; L410-V412 PolarHBondContact O-N 3.46Å; L410-V412 VanDerWaalsContact O-N 3.13Å
413	F	94	Very high	91.5	Very high	25 Å²	25	70.5 Å²	70.5	11%	0.11	37%	0.365	C	S	.	.	H	α-helix	trans	-107.9	-8.3	-170.3	-63.5	-63.6	0	0	0	114.9	I234 C263 M264 M267 H389 F393 F409 L410	I234-F413 HydrophobicContact CD1-CE2 4.04Å; I234-F413 HydrophobicContact CG1-CE2 4.47Å; C263-F413 HydrophobicContact CB-CE1 4.12Å; C263-F413 HydrophobicContact CB-CZ 3.91Å; M264-F413 HydrophobicContact CB-CE1 3.78Å; M264-F413 HydrophobicContact CB-CZ 4.13Å; M267-F413 HydrophobicContact CE-CE2 4.07Å; M267-F413 HydrophobicContact CE-CZ 3.66Å; H389-F413 AromaticContact CE1-CD1 3.65Å; H389-F413 AromaticContact CE1-CE1 3.9Å; H389-F413 AromaticContact CE1-CG 3.78Å; H389-F413 AromaticContact ND1-CD1 3.89Å; F393-F413 HydrophobicContact CD2-CB 4.31Å; F393-F413 WeakPolarHBondContact CE1-O 3.32Å; F393-F413 HydrophobicContact CE2-CB 4.28Å; F393-F413 HydrophobicContact CG-CB 4.46Å; F393-F413 HydrophobicContact CZ-CB 4.37Å; F409-F413 AromaticContact CD2-CD2 3.34Å; F409-F413 HydrophobicContact CD2-CD2 3.34Å; F409-F413 AromaticContact CD2-CE2 3.53Å; F409-F413 HydrophobicContact CD2-CE2 3.53Å; F409-F413 AromaticContact CE2-CD2 3.26Å; F409-F413 HydrophobicContact CE2-CD2 3.26Å; F409-F413 AromaticContact CE2-CE2 3.49Å; F409-F413 HydrophobicContact CE2-CE2 3.49Å; F409-F413 VanDerWaalsContact CE2-CE2 3.49Å; F409-F413 HydrophobicContact CE2-CG 4.27Å; F409-F413 HydrophobicContact CG-CD2 4.06Å; F409-F413 AromaticContact CZ-CD2 4Å; F409-F413 HydrophobicContact CZ-CD2 4Å; F409-F413 WeakPolarHBondContact O-CD2 3.34Å; F409-F413 PolarHBondContact O-N 2.87Å; F409-F413 VanDerWaalsContact O-N 3.08Å; L410-F413 PolarHBondContact O-N 3.25Å
414	E	87.8	Confident	91.7	Very high	77 Å²	77	62.1 Å²	62.1	36%	0.36	33%	0.329	S	S	.	.			trans	-87.1	126.9	167.5	-161.1	161	-159	0	0	108.7	K260 F393 K397 L410	K260-E414 PolarHBondContact NZ-O 2.78Å; F393-E414 HydrophobicContact CE1-CB 4.21Å; F393-E414 HydrophobicContact CZ-CB 4.35Å; K397-E414 IonicContact NZ-OE1 3.3Å; K397-E414 PolarHBondContact NZ-OE1 2.94Å; L410-E414 WeakPolarHBondContact O-CA 3.38Å; L410-E414 WeakPolarHBondContact O-CB 3.09Å; L410-E414 PolarHBondContact O-N 2.94Å
415	D	73.5	Confident	91.8	Very high	217 Å²	217	63.8 Å²	63.8	100%	1.16	34%	0.338	S	S	*	.			trans	-64.4	0	-177.7	-75.7	-34.1	0	0	0	112.3

Retrieved 415 of 415 residues in 89 ms (Link to these results)

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