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Isobutyryl-CoA dehydrogenase, mitochondrial

Isobutyryl-CoA dehydrogenase which catalyzes the conversion of 2-methylpropanoyl-CoA to (2E)-2-methylpropenoyl-CoA in the valine catabolic pathway. To a lesser extent, also able to catalyze the oxidation of (2S)-2-methylbutanoyl-CoA.

AlphaFold DB , UniProt , Accession A0A060WP40, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene acad8, Length 418 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	35.9	Very low	31.1	Very low	240 Å²	240	154.6 Å²	154.6	100%	1.182	84%	0.841	S	S	*	*				0	96.7	0	-68.3	-176.7	-167.8	0	0	106.7
2	A	32.2	Very low	30.9	Very low	91 Å²	91	155.4 Å²	155.4	75%	0.752	84%	0.843	S	S	*	*				72.6	96.5	106.8	0	0	0	0	0	111.2
3	M	29.8	Very low	30.7	Very low	202 Å²	202	150.9 Å²	150.9	100%	0.995	83%	0.83	S	S	*	*				86.9	126	95.8	-89.2	-166.3	-178.7	0	0	112.7
4	G	31.4	Very low	30.4	Very low	78 Å²	78	147.4 Å²	147.4	80%	0.804	82%	0.822	S	S	*	*			trans	173.3	66.1	175.6	0	0	0	0	0	113.4
5	T	35.7	Very low	30.2	Very low	130 Å²	130	146.6 Å²	146.6	80%	0.798	83%	0.828	S	S	*	*			trans	-61	142.5	169.2	2.3	0	0	0	0	112
6	L	31.7	Very low	30.4	Very low	167 Å²	167	148.4 Å²	148.4	87%	0.874	83%	0.832	S	S	*	*				176.7	111.8	118.5	-106.8	124.1	0	0	0	113.7
7	S	29.1	Very low	30.2	Very low	98 Å²	98	143.6 Å²	143.6	69%	0.685	82%	0.824	S	S	*	*			trans	3.2	128.7	143.7	-176.3	0	0	0	0	119.9
8	R	28.9	Very low	30.1	Very low	238 Å²	238	149.2 Å²	149.2	90%	0.898	83%	0.829	S	S	*	*			trans	-148.9	90.6	135.6	-114.2	178.2	-174.9	-170.6	1.5	111.2
9	V	30.8	Very low	30.1	Very low	121 Å²	121	147.1 Å²	147.1	73%	0.733	83%	0.826	S	S	*	*			trans	-75.6	118.2	160	173.1	0	0	0	0	107.4	R11	V9-R11 HydrophobicContact CG1-CG 4.42Å
10	V	30	Very low	30.1	Very low	116 Å²	116	151.5 Å²	151.5	70%	0.703	83%	0.829	S	S	*	*			trans	-104.3	100.7	166.3	178	0	0	0	0	107.8	L12	V10-L12 HydrophobicContact CG1-CD1 4.09Å; V10-L12 HydrophobicContact CG1-CG 4.38Å
11	R	27.4	Very low	30	Very low	220 Å²	220	154.7 Å²	154.7	83%	0.83	83%	0.829	S	S	*	*			trans	-80.7	128.9	155.8	-81.2	-179.2	176.3	-175.3	-1.2	107.5	V9	V9-R11 HydrophobicContact CG1-CG 4.42Å
12	L	28	Very low	29.6	Very low	164 Å²	164	150.4 Å²	150.4	86%	0.859	81%	0.81	S	S	*	*			trans	-121.3	109	159.2	-94.4	154.3	0	0	0	107.6	V10	V10-L12 HydrophobicContact CG1-CD1 4.09Å; V10-L12 HydrophobicContact CG1-CG 4.38Å
13	S	28.3	Very low	29.4	Very low	97 Å²	97	152.9 Å²	152.9	68%	0.678	81%	0.809	S	S	*	*			trans	-80.4	140.4	175.9	-57.2	0	0	0	0	111.1
14	S	27.3	Very low	29.4	Very low	102 Å²	102	152.1 Å²	152.1	71%	0.713	80%	0.8	S	S	*	*			trans	36.1	110.3	139.6	64.7	0	0	0	0	119.9
15	C	26.8	Very low	29.2	Very low	135 Å²	135	155.1 Å²	155.1	91%	0.912	80%	0.798	S	S	*	*			trans	-127	106	142.4	-80	0	0	0	0	110.1
16	I	33.1	Very low	29.2	Very low	175 Å²	175	154.5 Å²	154.5	90%	0.897	80%	0.799	S	S	*	*			trans	-64.9	130.7	161.4	-70.5	162.6	0	0	0	107.8
17	G	26.7	Very low	29.3	Very low	67 Å²	67	152.2 Å²	152.2	69%	0.691	79%	0.792	S	S	*	*			trans	-177.5	88.6	177.9	0	0	0	0	0	116.6
18	R	28.8	Very low	29.8	Very low	245 Å²	245	156.6 Å²	156.6	93%	0.925	80%	0.802	S	S	*	*			trans	71.1	94.5	151.3	-70.1	-179.7	172.1	-179.4	-2.9	119	R20	R18-R20 PolarHBondContact O-N 3Å
19	S	29.6	Very low	30.3	Very low	108 Å²	108	156.2 Å²	156.2	76%	0.755	80%	0.8	S	S	*	*			trans	-41.3	114	145.3	-179.1	0	0	0	0	111.8
20	R	30	Very low	30.9	Very low	236 Å²	236	161.8 Å²	161.8	89%	0.891	81%	0.808	S	S	*	*			trans	-93.5	92.8	158.3	-80.3	-173.8	177.4	-157.3	-0.2	107.4	R18 L22	R18-R20 PolarHBondContact O-N 3Å; R20-L22 PolarHBondContact O-N 2.86Å
21	R	28.7	Very low	31.6	Very low	219 Å²	219	159.7 Å²	159.7	83%	0.826	81%	0.81	S	S	*	*			trans	-61.6	104.3	158.2	-81.1	-178.2	-179.5	-175.6	-0	107.4	I23	R21-I23 VanDerWaalsContact C-N 3.34Å; R21-I23 PolarHBondContact O-N 3.35Å; R21-I23 VanDerWaalsContact O-N 3.1Å
22	L	27.5	Very low	32.9	Very low	149 Å²	149	157.1 Å²	157.1	78%	0.78	81%	0.811	S	S	*	*			trans	-68.4	100	158.2	-85.4	156.4	0	0	0	106.4	R20 F24	R20-L22 PolarHBondContact O-N 2.86Å; L22-F24 VanDerWaalsContact C-N 3.31Å; L22-F24 PolarHBondContact O-N 2.7Å
23	I	29.2	Very low	35	Very low	144 Å²	144	153 Å²	153	74%	0.738	80%	0.8	S	S	*	*			trans	-65.4	97.8	166.2	-61.6	173.2	0	0	0	105.5	R21 N25	R21-I23 VanDerWaalsContact C-N 3.34Å; R21-I23 PolarHBondContact O-N 3.35Å; R21-I23 VanDerWaalsContact O-N 3.1Å; I23-N25 PolarHBondContact O-N 2.89Å
24	F	28.8	Very low	38	Very low	185 Å²	185	151.3 Å²	151.3	81%	0.811	79%	0.789	S	S	*	*			trans	-67.3	101.3	163.9	-94.9	-90.8	0	0	0	106.8	L22 S26	L22-F24 VanDerWaalsContact C-N 3.31Å; L22-F24 PolarHBondContact O-N 2.7Å; F24-S26 PolarHBondContact O-N 3.15Å
25	N	27	Very low	41.2	Very low	141 Å²	141	151.7 Å²	151.7	75%	0.754	79%	0.79	S	S	*	*			trans	-56.9	107.1	161.5	-97.5	-15.2	0	0	0	107.5	I23 T27	I23-N25 PolarHBondContact O-N 2.89Å; N25-T27 PolarHBondContact O-N 2.91Å
26	S	35.9	Very low	44.6	Very low	117 Å²	117	145.8 Å²	145.8	82%	0.818	75%	0.749	S	S	*	*			trans	-68.8	77.8	170.7	58.7	0	0	0	0	109.2	F24 Q28	F24-S26 PolarHBondContact O-N 3.15Å; S26-Q28 VanDerWaalsContact C-N 3.33Å; S26-Q28 PolarHBondContact O-N 2.89Å
27	T	33.4	Very low	47.6	Very low	120 Å²	120	140.2 Å²	140.2	74%	0.736	72%	0.721	S	S	*	*			trans	-76.9	98.7	152.9	24.3	0	0	0	0	105.8	N25 R29	N25-T27 PolarHBondContact O-N 2.91Å; T27-R29 PolarHBondContact O-N 3.29Å
28	Q	39.4	Very low	50.9	Low	190 Å²	190	138 Å²	138	89%	0.888	69%	0.694	S	S	*	*			trans	-60.2	84.1	172.1	-154.6	174.4	18.2	0	0	107.5	S26 R30	S26-Q28 VanDerWaalsContact C-N 3.33Å; S26-Q28 PolarHBondContact O-N 2.89Å; Q28-R30 PolarHBondContact O-N 2.86Å
29	R	39.4	Very low	54.1	Low	230 Å²	230	127.2 Å²	127.2	87%	0.868	66%	0.658	S	S	*	*			trans	-58.9	113	163.3	-77.4	-173.8	178	-169.2	-0.6	104.4	T27 G31	T27-R29 PolarHBondContact O-N 3.29Å; R29-G31 VanDerWaalsContact C-N 3.32Å; R29-G31 PolarHBondContact O-N 3.48Å
30	R	43.7	Very low	57.2	Low	238 Å²	238	128.8 Å²	128.8	90%	0.898	65%	0.653	S	S	*	*			trans	-48.5	104.8	165.2	-80.6	179.1	172.7	175	-3.1	106	Q28 I32	Q28-R30 PolarHBondContact O-N 2.86Å; R30-I32 PolarHBondContact O-N 2.99Å
31	G	44.7	Very low	60.2	Low	71 Å²	71	121 Å²	121	73%	0.732	65%	0.645	S	S	*	*			trans	-58.4	117.1	178.6	0	0	0	0	0	106.8	R29 A33	R29-G31 VanDerWaalsContact C-N 3.32Å; R29-G31 PolarHBondContact O-N 3.48Å; G31-A33 PolarHBondContact O-N 3.07Å
32	I	54.3	Low	63.5	Low	167 Å²	167	111.1 Å²	111.1	86%	0.856	61%	0.609	S	S	*	*			trans	-65.9	111.8	172	-62.2	174	0	0	0	104.8	R30 S34	R30-I32 PolarHBondContact O-N 2.99Å; I32-S34 PolarHBondContact O-N 3.4Å
33	A	72.4	Confident	66.8	Low	76 Å²	76	106.6 Å²	106.6	63%	0.628	59%	0.59	S	S	*	*			trans	-55.6	136	174.5	0	0	0	0	0	108.9	G31 C35	G31-A33 PolarHBondContact O-N 3.07Å; A33-C35 PolarHBondContact O-N 3.43Å
34	S	90.9	Very high	70.1	Confident	63 Å²	63	105.1 Å²	105.1	44%	0.441	58%	0.583	S	S	.	*			trans	-58.8	137.7	179.1	177.1	0	0	0	0	110.1	I32 I36 D37	I32-S34 PolarHBondContact O-N 3.4Å; S34-I36 PolarHBondContact O-N 3.02Å; S34-I36 VanDerWaalsContact O-N 3.11Å; S34-I36 VanDerWaalsContact OG-CG1 3.32Å; S34-I36 WeakPolarHBondContact OG-CG1 3.41Å; S34-I36 PolarHBondContact OG-N 2.87Å; S34-D37 VanDerWaalsContact O-CB 3.29Å; S34-D37 WeakPolarHBondContact O-CB 3.49Å; S34-D37 PolarHBondContact O-N 2.97Å; S34-D37 VanDerWaalsContact O-N 3.09Å
35	C	95.2	Very high	73.4	Confident	109 Å²	109	102 Å²	102	74%	0.736	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-11.3	175.9	60.3	0	0	0	0	113.6	A33 V328	A33-C35 PolarHBondContact O-N 3.43Å; C35-V328 WeakPolarHBondContact O-CG2 3.47Å
36	I	96.9	Very high	76.8	Confident	11 Å²	11	96.2 Å²	96.2	6%	0.056	54%	0.54	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	17.9	175.9	61.3	169.2	0	0	0	112.3	S34 P38 V293 A324 L327 V328 R331	S34-I36 PolarHBondContact O-N 3.02Å; S34-I36 VanDerWaalsContact O-N 3.11Å; S34-I36 VanDerWaalsContact OG-CG1 3.32Å; S34-I36 WeakPolarHBondContact OG-CG1 3.41Å; S34-I36 PolarHBondContact OG-N 2.87Å; I36-P38 WeakPolarHBondContact O-CD 3.34Å; I36-P38 VanDerWaalsContact O-N 3.09Å; I36-V293 HydrophobicContact CD1-CG1 3.78Å; I36-A324 HydrophobicContact CG2-CB 3.72Å; I36-L327 HydrophobicContact CB-CD2 4.21Å; I36-L327 HydrophobicContact CD1-CD2 4.49Å; I36-L327 HydrophobicContact CG2-CD2 4.28Å; I36-V328 HydrophobicContact CG2-CG2 4.16Å; I36-R331 PolarHBondContact O-NH1 3.4Å
37	D	97.2	Very high	79.8	Confident	58 Å²	58	94.5 Å²	94.5	31%	0.31	52%	0.518	S	S	.	.			trans	-49.7	113.8	-178.2	-177.5	2.9	0	0	0	111.2	S34 A39 H40	S34-D37 VanDerWaalsContact O-CB 3.29Å; S34-D37 WeakPolarHBondContact O-CB 3.49Å; S34-D37 PolarHBondContact O-N 2.97Å; S34-D37 VanDerWaalsContact O-N 3.09Å; D37-A39 PolarHBondContact O-N 3.44Å; D37-A39 VanDerWaalsContact OD1-CB 3.32Å; D37-A39 WeakPolarHBondContact OD1-CB 3.09Å; D37-A39 PolarHBondContact OD1-N 3.27Å; D37-H40 PolarHBondContact O-N 2.8Å
38	P	96.1	Very high	82.9	Confident	20 Å²	20	95.2 Å²	95.2	13%	0.13	51%	0.513	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-12.4	-178	33.8	-34.6	0	0	0	111.8	I36 Q50 F54 R335	I36-P38 WeakPolarHBondContact O-CD 3.34Å; I36-P38 VanDerWaalsContact O-N 3.09Å; P38-Q50 PolarHBondContact O-NE2 2.97Å; P38-F54 HydrophobicContact CG-CE2 4.25Å; P38-F54 HydrophobicContact CG-CZ 4.34Å; P38-R335 PolarHBondContact O-NH1 2.81Å; P38-R335 VanDerWaalsContact O-NH1 3.14Å; P38-R335 PolarHBondContact O-NH2 2.79Å
39	A	96.6	Very high	85.7	Confident	19 Å²	19	87.8 Å²	87.8	16%	0.157	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-8.5	178.2	0	0	0	0	0	113.5	D37 G41 L42 K47	D37-A39 PolarHBondContact O-N 3.44Å; D37-A39 VanDerWaalsContact OD1-CB 3.32Å; D37-A39 WeakPolarHBondContact OD1-CB 3.09Å; D37-A39 PolarHBondContact OD1-N 3.27Å; A39-G41 PolarHBondContact O-N 3.18Å; A39-L42 WeakPolarHBondContact O-CB 3.29Å; A39-L42 PolarHBondContact O-N 3.11Å; A39-K47 HydrophobicContact CB-CG 4.16Å
40	H	93.1	Very high	88.5	Confident	142 Å²	142	77.4 Å²	77.4	66%	0.657	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	132.2	-177.4	-172.8	76.8	0	0	0	111.7	D37 L42 R335	D37-H40 PolarHBondContact O-N 2.8Å; H40-L42 VanDerWaalsContact C-N 3.26Å; H40-L42 PolarHBondContact O-N 2.6Å; H40-R335 PolarHBondContact O-NH1 2.97Å
41	G	93.6	Very high	91.2	Very high	71 Å²	71	72 Å²	72	73%	0.732	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	2.5	179.8	0	0	0	0	0	115.5	A39	A39-G41 PolarHBondContact O-N 3.18Å
42	L	97.6	Very high	93.7	Very high	13 Å²	13	72.4 Å²	72.4	7%	0.068	41%	0.406	C	S	.	.			trans	-87.1	149.4	177.3	-60.9	-172.7	0	0	0	112.1	A39 H40 Q46 K47 V108 R335	A39-L42 WeakPolarHBondContact O-CB 3.29Å; A39-L42 PolarHBondContact O-N 3.11Å; H40-L42 VanDerWaalsContact C-N 3.26Å; H40-L42 PolarHBondContact O-N 2.6Å; L42-Q46 HydrophobicContact CB-CB 3.84Å; L42-Q46 HydrophobicContact CD1-CB 4.33Å; L42-Q46 HydrophobicContact CD2-CB 4.37Å; L42-Q46 HydrophobicContact CG-CB 4.4Å; L42-K47 HydrophobicContact CB-CG 4.06Å; L42-K47 WeakPolarHBondContact O-CE 3.32Å; L42-V108 HydrophobicContact CD1-CG1 3.98Å; L42-V108 HydrophobicContact CD1-CG2 3.88Å; L42-V108 HydrophobicContact CD2-CG2 3.74Å; L42-V108 HydrophobicContact CG-CG2 4.5Å; L42-R335 VanDerWaalsContact CD2-NH1 3.31Å
43	S	98.3	Very high	95.8	Very high	53 Å²	53	64.4 Å²	64.4	37%	0.371	37%	0.365	S	S	.	.			trans	-65.6	165.7	165.9	74.6	0	0	0	0	111	E45 Q46 K47	S43-E45 VanDerWaalsContact C-N 3.34Å; S43-Q46 PolarHBondContact O-N 2.76Å; S43-Q46 WeakPolarHBondContact OG-CB 3.14Å; S43-Q46 WeakPolarHBondContact OG-CG 3.34Å; S43-Q46 PolarHBondContact OG-N 3.34Å; S43-Q46 VanDerWaalsContact OG-N 3.11Å; S43-Q46 PolarHBondContact OG-OE1 3.49Å; S43-K47 WeakPolarHBondContact O-CG 3.44Å; S43-K47 PolarHBondContact O-N 2.75Å
44	D	98.1	Very high	97.1	Very high	113 Å²	113	63 Å²	63	60%	0.604	34%	0.344	S	S	*	.	H	α-helix	trans	-66.1	-38.3	178.4	-67	-26.6	0	0	0	112	Q46 K47 E48	D44-Q46 PolarHBondContact O-N 2.88Å; D44-K47 WeakPolarHBondContact O-CB 3.26Å; D44-K47 PolarHBondContact O-N 3.08Å; D44-K47 VanDerWaalsContact O-N 3.17Å; D44-K47 IonicContact OD1-NZ 3.44Å; D44-K47 PolarHBondContact OD1-NZ 2.88Å; D44-E48 PolarHBondContact O-N 2.72Å
45	E	97.9	Very high	97.5	Very high	119 Å²	119	63.1 Å²	63.1	56%	0.556	34%	0.34	S	S	*	.	H	α-helix	trans	-60.5	-43.9	172.5	-175	177.4	-158.1	0	0	111.9	S43 K47 E48 F49	S43-E45 VanDerWaalsContact C-N 3.34Å; E45-K47 VanDerWaalsContact C-N 3.29Å; E45-K47 PolarHBondContact O-N 2.73Å; E45-E48 WeakPolarHBondContact O-CB 3.4Å; E45-E48 PolarHBondContact O-N 3.5Å; E45-F49 HydrophobicContact CG-CD2 4.4Å; E45-F49 HydrophobicContact CG-CE1 4.25Å; E45-F49 HydrophobicContact CG-CE2 3.62Å; E45-F49 HydrophobicContact CG-CZ 3.52Å; E45-F49 WeakPolarHBondContact O-CG 3.25Å; E45-F49 PolarHBondContact O-N 3.02Å
46	Q	98.6	Very high	97.7	Very high	21 Å²	21	58.8 Å²	58.8	10%	0.098	31%	0.309	C	S	.	.	H	α-helix	trans	-63	-34.4	175.2	-79.3	169.3	-14.9	0	0	113	L42 S43 D44 E48 Q50 D105	L42-Q46 HydrophobicContact CB-CB 3.84Å; L42-Q46 HydrophobicContact CD1-CB 4.33Å; L42-Q46 HydrophobicContact CD2-CB 4.37Å; L42-Q46 HydrophobicContact CG-CB 4.4Å; S43-Q46 PolarHBondContact O-N 2.76Å; S43-Q46 WeakPolarHBondContact OG-CB 3.14Å; S43-Q46 WeakPolarHBondContact OG-CG 3.34Å; S43-Q46 PolarHBondContact OG-N 3.34Å; S43-Q46 VanDerWaalsContact OG-N 3.11Å; S43-Q46 PolarHBondContact OG-OE1 3.49Å; D44-Q46 PolarHBondContact O-N 2.88Å; Q46-E48 VanDerWaalsContact C-N 3.32Å; Q46-Q50 VanDerWaalsContact O-CB 3.25Å; Q46-Q50 WeakPolarHBondContact O-CB 3.36Å; Q46-Q50 PolarHBondContact O-N 2.86Å; Q46-D105 WeakPolarHBondContact CG-OD1 3.43Å; Q46-D105 PolarHBondContact NE2-OD1 3.19Å
47	K	98.5	Very high	97.7	Very high	80 Å²	80	58.2 Å²	58.2	35%	0.348	31%	0.306	S	S	.	.	H	α-helix	trans	-67.9	-34.2	173.5	-67.6	169.9	-158.7	152.8	0	111.5	A39 L42 S43 D44 E45 K51	A39-K47 HydrophobicContact CB-CG 4.16Å; L42-K47 HydrophobicContact CB-CG 4.06Å; L42-K47 WeakPolarHBondContact O-CE 3.32Å; S43-K47 WeakPolarHBondContact O-CG 3.44Å; S43-K47 PolarHBondContact O-N 2.75Å; D44-K47 WeakPolarHBondContact O-CB 3.26Å; D44-K47 PolarHBondContact O-N 3.08Å; D44-K47 VanDerWaalsContact O-N 3.17Å; D44-K47 IonicContact OD1-NZ 3.44Å; D44-K47 PolarHBondContact OD1-NZ 2.88Å; E45-K47 VanDerWaalsContact C-N 3.29Å; E45-K47 PolarHBondContact O-N 2.73Å; K47-K51 VanDerWaalsContact O-CB 3.27Å; K47-K51 WeakPolarHBondContact O-CB 3.39Å; K47-K51 PolarHBondContact O-N 2.7Å
48	E	98.5	Very high	97.8	Very high	135 Å²	135	58 Å²	58	63%	0.631	31%	0.312	S	S	*	.	H	α-helix	trans	-66.7	-46.2	174.3	-70	179.5	-177.3	0	0	111.4	D44 E45 Q46 Q50 K51 M52	D44-E48 PolarHBondContact O-N 2.72Å; E45-E48 WeakPolarHBondContact O-CB 3.4Å; E45-E48 PolarHBondContact O-N 3.5Å; Q46-E48 VanDerWaalsContact C-N 3.32Å; E48-Q50 VanDerWaalsContact C-N 3.34Å; E48-Q50 PolarHBondContact O-N 3.01Å; E48-K51 PolarHBondContact O-N 2.85Å; E48-M52 WeakPolarHBondContact O-CB 3.5Å; E48-M52 PolarHBondContact O-N 3.09Å
49	F	98.5	Very high	97.9	Very high	35 Å²	35	63.1 Å²	63.1	15%	0.154	33%	0.334	C	S	.	.	H	α-helix	trans	-58.9	-45.7	172.9	-60.3	-31.6	0	0	0	111.8	E45 K51 M52 A53 L101 D105 I109	E45-F49 HydrophobicContact CG-CD2 4.4Å; E45-F49 HydrophobicContact CG-CE1 4.25Å; E45-F49 HydrophobicContact CG-CE2 3.62Å; E45-F49 HydrophobicContact CG-CZ 3.52Å; E45-F49 WeakPolarHBondContact O-CG 3.25Å; E45-F49 PolarHBondContact O-N 3.02Å; F49-K51 PolarHBondContact O-N 3.19Å; F49-M52 PolarHBondContact O-N 2.82Å; F49-A53 WeakPolarHBondContact O-CB 3.11Å; F49-A53 PolarHBondContact O-N 3.36Å; F49-L101 HydrophobicContact CD2-CD1 4.37Å; F49-L101 HydrophobicContact CE1-CD2 4.5Å; F49-L101 HydrophobicContact CE2-CD1 4.18Å; F49-L101 HydrophobicContact CE2-CD2 3.79Å; F49-L101 HydrophobicContact CZ-CD1 4.27Å; F49-L101 HydrophobicContact CZ-CD2 3.67Å; F49-D105 HydrophobicContact CD2-CB 4.19Å; F49-D105 HydrophobicContact CE2-CB 4.44Å; F49-I109 HydrophobicContact CB-CD1 4.31Å; F49-I109 HydrophobicContact CB-CG1 4.11Å
50	Q	98.7	Very high	98	Very high	11 Å²	11	64.8 Å²	64.8	5%	0.051	34%	0.339	C	S	.	.	H	α-helix	trans	-57	-49.7	176.1	-177.2	171.4	67.5	0	0	111.3	P38 Q46 E48 A53 F54 V108	P38-Q50 PolarHBondContact O-NE2 2.97Å; Q46-Q50 VanDerWaalsContact O-CB 3.25Å; Q46-Q50 WeakPolarHBondContact O-CB 3.36Å; Q46-Q50 PolarHBondContact O-N 2.86Å; E48-Q50 VanDerWaalsContact C-N 3.34Å; E48-Q50 PolarHBondContact O-N 3.01Å; Q50-A53 PolarHBondContact O-N 2.94Å; Q50-F54 HydrophobicContact CG-CD2 3.55Å; Q50-F54 HydrophobicContact CG-CE2 3.47Å; Q50-F54 VanDerWaalsContact CG-CE2 3.47Å; Q50-F54 VanDerWaalsContact O-CD2 3.26Å; Q50-F54 WeakPolarHBondContact O-CD2 3.38Å; Q50-F54 PolarHBondContact O-N 2.97Å; Q50-V108 HydrophobicContact CB-CG1 3.48Å; Q50-V108 VanDerWaalsContact CB-CG1 3.48Å; Q50-V108 HydrophobicContact CG-CG1 3.99Å
51	K	98.6	Very high	98.3	Very high	125 Å²	125	58 Å²	58	54%	0.543	31%	0.308	S	S	.	.	H	α-helix	trans	-62.1	-47.1	-179	-175.7	-175.9	-179.1	-59.1	0	111.1	K47 E48 F49 A53 F54 D55	K47-K51 VanDerWaalsContact O-CB 3.27Å; K47-K51 WeakPolarHBondContact O-CB 3.39Å; K47-K51 PolarHBondContact O-N 2.7Å; E48-K51 PolarHBondContact O-N 2.85Å; F49-K51 PolarHBondContact O-N 3.19Å; K51-A53 VanDerWaalsContact C-N 3.32Å; K51-A53 PolarHBondContact O-N 2.87Å; K51-F54 PolarHBondContact O-N 2.99Å; K51-D55 IonicContact NZ-OD2 2.8Å; K51-D55 PolarHBondContact NZ-OD2 2.85Å; K51-D55 WeakPolarHBondContact O-CB 3.43Å; K51-D55 VanDerWaalsContact O-CG 3.27Å; K51-D55 PolarHBondContact O-N 2.85Å
52	M	98.7	Very high	98.6	Very high	79 Å²	79	57.5 Å²	57.5	39%	0.389	29%	0.293	S	S	.	.	H	α-helix	trans	-57.5	-46.2	177.9	-175.1	-168.5	-60.6	0	0	111.3	E48 F49 D55 F56 L85 F87	E48-M52 WeakPolarHBondContact O-CB 3.5Å; E48-M52 PolarHBondContact O-N 3.09Å; F49-M52 PolarHBondContact O-N 2.82Å; M52-D55 PolarHBondContact O-N 2.78Å; M52-F56 WeakPolarHBondContact O-CB 3.48Å; M52-F56 PolarHBondContact O-N 3.44Å; M52-L85 HydrophobicContact CG-CD1 4.36Å; M52-L85 HydrophobicContact SD-CB 4.07Å; M52-L85 HydrophobicContact SD-CD2 4.29Å; M52-F87 HydrophobicContact CG-CZ 4.29Å; M52-F87 HydrophobicContact SD-CZ 4.04Å
53	A	98.9	Very high	98.6	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-67.1	-39.8	178.9	0	0	0	0	0	112.7	F49 Q50 K51 F56 A57 F87 I109 A112 L113	F49-A53 WeakPolarHBondContact O-CB 3.11Å; F49-A53 PolarHBondContact O-N 3.36Å; Q50-A53 PolarHBondContact O-N 2.94Å; K51-A53 VanDerWaalsContact C-N 3.32Å; K51-A53 PolarHBondContact O-N 2.87Å; A53-F56 PolarHBondContact O-N 2.86Å; A53-A57 VanDerWaalsContact O-CB 3.29Å; A53-A57 WeakPolarHBondContact O-CB 3.45Å; A53-A57 PolarHBondContact O-N 2.89Å; A53-F87 HydrophobicContact CB-CE2 4.27Å; A53-F87 HydrophobicContact CB-CZ 4Å; A53-I109 HydrophobicContact CB-CB 4.5Å; A53-I109 HydrophobicContact CB-CG2 4.15Å; A53-A112 HydrophobicContact CB-CB 3.61Å; A53-L113 HydrophobicContact CB-CD2 4.23Å; A53-L113 HydrophobicContact CB-CG 4.19Å
54	F	98.8	Very high	98.6	Very high	45 Å²	45	61.8 Å²	61.8	20%	0.197	31%	0.314	C	S	.	.	H	α-helix	trans	-64.1	-45.1	174.2	-90.5	-63.8	0	0	0	112.1	P38 Q50 K51 F56 A57 A58 A112 T115	P38-F54 HydrophobicContact CG-CE2 4.25Å; P38-F54 HydrophobicContact CG-CZ 4.34Å; Q50-F54 HydrophobicContact CG-CD2 3.55Å; Q50-F54 HydrophobicContact CG-CE2 3.47Å; Q50-F54 VanDerWaalsContact CG-CE2 3.47Å; Q50-F54 VanDerWaalsContact O-CD2 3.26Å; Q50-F54 WeakPolarHBondContact O-CD2 3.38Å; Q50-F54 PolarHBondContact O-N 2.97Å; K51-F54 PolarHBondContact O-N 2.99Å; F54-F56 VanDerWaalsContact C-N 3.32Å; F54-F56 PolarHBondContact O-N 2.74Å; F54-A57 PolarHBondContact O-N 3.06Å; F54-A58 WeakPolarHBondContact O-CB 3.35Å; F54-A58 PolarHBondContact O-N 2.97Å; F54-A112 HydrophobicContact CB-CB 4.43Å; F54-A112 HydrophobicContact CD1-CB 4.04Å; F54-A112 HydrophobicContact CD2-CB 3.63Å; F54-A112 HydrophobicContact CE1-CB 4.21Å; F54-A112 HydrophobicContact CE2-CB 3.79Å; F54-A112 HydrophobicContact CG-CB 3.75Å; F54-A112 HydrophobicContact CZ-CB 4.07Å; F54-T115 HydrophobicContact CD1-CG2 4.32Å; F54-T115 HydrophobicContact CE1-CG2 3.51Å; F54-T115 HydrophobicContact CZ-CG2 4.31Å
55	D	98.8	Very high	98.7	Very high	67 Å²	67	56.8 Å²	56.8	36%	0.358	29%	0.287	S	S	.	.	H	α-helix	trans	-61.4	-44.9	178.1	-71.9	-21.1	0	0	0	109.9	K51 M52 A58 H59	K51-D55 IonicContact NZ-OD2 2.8Å; K51-D55 PolarHBondContact NZ-OD2 2.85Å; K51-D55 WeakPolarHBondContact O-CB 3.43Å; K51-D55 VanDerWaalsContact O-CG 3.27Å; K51-D55 PolarHBondContact O-N 2.85Å; M52-D55 PolarHBondContact O-N 2.78Å; D55-A58 PolarHBondContact O-N 3.06Å; D55-H59 PolarHBondContact O-N 3.01Å; D55-H59 VanDerWaalsContact O-N 3.1Å; D55-H59 PolarHBondContact O-ND1 2.79Å
56	F	98.9	Very high	98.7	Very high	17 Å²	17	53.6 Å²	53.6	8%	0.075	28%	0.281	C	S	.	.	H	α-helix	trans	-60.5	-47.5	174.5	-176	-93.3	0	0	0	112.1	M52 A53 F54 A58 H59 E60 M61 T78 K81 A82 L85 L113	M52-F56 WeakPolarHBondContact O-CB 3.48Å; M52-F56 PolarHBondContact O-N 3.44Å; A53-F56 PolarHBondContact O-N 2.86Å; F54-F56 VanDerWaalsContact C-N 3.32Å; F54-F56 PolarHBondContact O-N 2.74Å; F56-A58 VanDerWaalsContact C-N 3.3Å; F56-A58 PolarHBondContact O-N 2.77Å; F56-H59 PolarHBondContact O-N 2.51Å; F56-E60 HydrophobicContact CD1-CB 4.43Å; F56-E60 HydrophobicContact CD2-CB 4Å; F56-E60 HydrophobicContact CD2-CG 3.84Å; F56-E60 HydrophobicContact CE1-CB 4.14Å; F56-E60 HydrophobicContact CE2-CB 3.69Å; F56-E60 HydrophobicContact CE2-CG 3.69Å; F56-E60 HydrophobicContact CG-CB 4.37Å; F56-E60 HydrophobicContact CZ-CB 3.76Å; F56-E60 HydrophobicContact CZ-CG 4.28Å; F56-E60 WeakPolarHBondContact O-CB 3.33Å; F56-E60 PolarHBondContact O-N 3.27Å; F56-M61 HydrophobicContact CD1-CG 4.16Å; F56-M61 HydrophobicContact CD1-SD 3.89Å; F56-M61 HydrophobicContact CE1-CG 3.84Å; F56-M61 HydrophobicContact CE1-SD 3.83Å; F56-T78 HydrophobicContact CE1-CG2 4.05Å; F56-T78 HydrophobicContact CZ-CG2 3.76Å; F56-T78 WeakPolarHBondContact CZ-O 3.32Å; F56-K81 HydrophobicContact CE2-CB 3.83Å; F56-K81 HydrophobicContact CZ-CB 4.12Å; F56-A82 HydrophobicContact CD1-CB 4.48Å; F56-A82 HydrophobicContact CE1-CB 3.66Å; F56-A82 HydrophobicContact CE2-CB 4.4Å; F56-A82 HydrophobicContact CZ-CB 3.61Å; F56-L85 HydrophobicContact CB-CD1 4.01Å; F56-L85 HydrophobicContact CD2-CD1 3.46Å; F56-L85 VanDerWaalsContact CD2-CD1 3.46Å; F56-L85 HydrophobicContact CE2-CD1 4.18Å; F56-L85 HydrophobicContact CG-CD1 3.9Å; F56-L113 HydrophobicContact CD1-CD2 3.68Å; F56-L113 HydrophobicContact CE1-CD2 4.45Å
57	A	98.9	Very high	98.7	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.294	C	S	.	.	I	π-helix	trans	-58.7	-42.3	178.9	0	0	0	0	0	112.2	A53 F54 M61 S62	A53-A57 VanDerWaalsContact O-CB 3.29Å; A53-A57 WeakPolarHBondContact O-CB 3.45Å; A53-A57 PolarHBondContact O-N 2.89Å; F54-A57 PolarHBondContact O-N 3.06Å; A57-M61 HydrophobicContact CB-SD 4.35Å; A57-M61 WeakPolarHBondContact O-CB 3.44Å; A57-M61 PolarHBondContact O-N 3.32Å; A57-S62 WeakPolarHBondContact O-CB 3.35Å; A57-S62 PolarHBondContact O-N 3.39Å
58	A	98.7	Very high	98.7	Very high	53 Å²	53	53.3 Å²	53.3	44%	0.438	28%	0.28	S	S	.	.	I	π-helix	trans	-69.2	-36.8	-178.7	0	0	0	0	0	113	F54 D55 F56 P63	F54-A58 WeakPolarHBondContact O-CB 3.35Å; F54-A58 PolarHBondContact O-N 2.97Å; D55-A58 PolarHBondContact O-N 3.06Å; F56-A58 VanDerWaalsContact C-N 3.3Å; F56-A58 PolarHBondContact O-N 2.77Å; A58-P63 WeakPolarHBondContact O-CD 3.41Å
59	H	98.6	Very high	98.8	Very high	128 Å²	128	47 Å²	47	59%	0.593	25%	0.251	S	S	*	.	I	π-helix	trans	-97.5	-32.3	-173.1	-63.2	91.4	0	0	0	113.9	D55 F56	D55-H59 PolarHBondContact O-N 3.01Å; D55-H59 VanDerWaalsContact O-N 3.1Å; D55-H59 PolarHBondContact O-ND1 2.79Å; F56-H59 PolarHBondContact O-N 2.51Å
60	E	98.8	Very high	98.8	Very high	54 Å²	54	52.7 Å²	52.7	25%	0.252	28%	0.278	S	S	.	.	I	π-helix	trans	-113.5	-13.3	-170.3	-62.6	-71.6	162.7	0	0	113.3	F56 W68 T78 K81	F56-E60 HydrophobicContact CD1-CB 4.43Å; F56-E60 HydrophobicContact CD2-CB 4Å; F56-E60 HydrophobicContact CD2-CG 3.84Å; F56-E60 HydrophobicContact CE1-CB 4.14Å; F56-E60 HydrophobicContact CE2-CB 3.69Å; F56-E60 HydrophobicContact CE2-CG 3.69Å; F56-E60 HydrophobicContact CG-CB 4.37Å; F56-E60 HydrophobicContact CZ-CB 3.76Å; F56-E60 HydrophobicContact CZ-CG 4.28Å; F56-E60 WeakPolarHBondContact O-CB 3.33Å; F56-E60 PolarHBondContact O-N 3.27Å; E60-W68 WeakPolarHBondContact O-CH2 3.43Å; E60-T78 HydrophobicContact CB-CG2 4.21Å; E60-T78 VanDerWaalsContact O-CG2 3.31Å; E60-T78 WeakPolarHBondContact O-CG2 3.49Å; E60-K81 IonicContact OE1-NZ 2.75Å; E60-K81 WeakPolarHBondContact OE2-CD 3.12Å; E60-K81 IonicContact OE2-NZ 3.26Å; E60-K81 PolarHBondContact OE2-NZ 3.34Å
61	M	98.9	Very high	98.8	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.3	C	S	.	.	I	π-helix	trans	-117.2	-57.4	-178.2	-56.5	175.3	67.5	0	0	113	F56 A57 P63 H64 M65 W68 T78 L113 C117 T120 T121	F56-M61 HydrophobicContact CD1-CG 4.16Å; F56-M61 HydrophobicContact CD1-SD 3.89Å; F56-M61 HydrophobicContact CE1-CG 3.84Å; F56-M61 HydrophobicContact CE1-SD 3.83Å; A57-M61 HydrophobicContact CB-SD 4.35Å; A57-M61 WeakPolarHBondContact O-CB 3.44Å; A57-M61 PolarHBondContact O-N 3.32Å; M61-P63 VanDerWaalsContact C-CD 3.45Å; M61-H64 PolarHBondContact O-N 3.46Å; M61-M65 PolarHBondContact O-N 2.69Å; M61-W68 HydrophobicContact CB-CH2 4.47Å; M61-W68 HydrophobicContact CB-CZ3 4.27Å; M61-T78 HydrophobicContact CG-CG2 4.12Å; M61-L113 HydrophobicContact SD-CB 4.39Å; M61-L113 HydrophobicContact SD-CD2 3.89Å; M61-C117 HydrophobicContact CB-CB 4.36Å; M61-C117 HydrophobicContact CE-CB 3.9Å; M61-T120 HydrophobicContact CE-CG2 4.18Å; M61-T121 WeakPolarHBondContact CE-OG1 3.32Å
62	S	98.6	Very high	98.8	Very high	60 Å²	60	53.6 Å²	53.6	42%	0.42	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-52.8	-44.5	-175.5	-174.3	0	0	0	0	113.6	A57 H64 M65	A57-S62 WeakPolarHBondContact O-CB 3.35Å; A57-S62 PolarHBondContact O-N 3.39Å; S62-H64 PolarHBondContact O-N 2.99Å; S62-H64 VanDerWaalsContact O-N 3.13Å; S62-M65 PolarHBondContact O-N 2.78Å
63	P	98.6	Very high	98.8	Very high	87 Å²	87	52.7 Å²	52.7	57%	0.565	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-63	-22.3	179.8	-23.8	36.7	0	0	0	114.3	A58 M61	A58-P63 WeakPolarHBondContact O-CD 3.41Å; M61-P63 VanDerWaalsContact C-CD 3.45Å
64	H	98.8	Very high	98.8	Very high	69 Å²	69	54.1 Å²	54.1	32%	0.319	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-108.5	-8.7	-175.1	-57.5	-68.3	0	0	0	113.5	M61 S62 A66 E67 W68	M61-H64 PolarHBondContact O-N 3.46Å; S62-H64 PolarHBondContact O-N 2.99Å; S62-H64 VanDerWaalsContact O-N 3.13Å; H64-A66 VanDerWaalsContact C-N 3.31Å; H64-A66 PolarHBondContact O-N 3.23Å; H64-E67 PolarHBondContact O-N 3.11Å; H64-E67 VanDerWaalsContact O-N 3.12Å; H64-W68 HydrophobicContact CB-CD2 3.84Å; H64-W68 HydrophobicContact CB-CE3 4.27Å; H64-W68 HydrophobicContact CB-CG 4.46Å; H64-W68 HydrophobicContact CB-CH2 3.78Å; H64-W68 HydrophobicContact CB-CZ2 3.31Å; H64-W68 HydrophobicContact CB-CZ3 4.25Å; H64-W68 AromaticContact CG-CZ2 3.88Å; H64-W68 PolarHBondContact O-N 3.23Å
65	M	98.8	Very high	98.8	Very high	7 Å²	7	52.3 Å²	52.3	3%	0.034	28%	0.277	C	S	.	.	H	α-helix	trans	-52.4	-45.6	-172.9	-179.6	-176.9	68.7	0	0	113.1	M61 S62 D69 G116 C117 A384 Q387 F388	M61-M65 PolarHBondContact O-N 2.69Å; S62-M65 PolarHBondContact O-N 2.78Å; M65-D69 PolarHBondContact O-N 3.38Å; M65-D69 VanDerWaalsContact O-N 3.13Å; M65-G116 WeakPolarHBondContact CB-O 3.2Å; M65-C117 HydrophobicContact CB-CB 4.2Å; M65-C117 HydrophobicContact CG-CB 3.9Å; M65-C117 HydrophobicContact SD-CB 4.37Å; M65-A384 HydrophobicContact CE-CB 3.6Å; M65-Q387 HydrophobicContact CE-CB 4.28Å; M65-Q387 VanDerWaalsContact CG-CD 3.47Å; M65-Q387 PolarHBondContact O-NE2 2.81Å; M65-Q387 PolarHBondContact O-OE1 3.39Å; M65-Q387 HydrophobicContact SD-CG 4.3Å; M65-F388 HydrophobicContact SD-CE1 4.26Å; M65-F388 HydrophobicContact SD-CZ 4.37Å
66	A	98.8	Very high	98.8	Very high	52 Å²	52	51.1 Å²	51.1	43%	0.43	27%	0.272	S	S	.	.	H	α-helix	trans	-69.3	-40.6	-178.7	0	0	0	0	0	112.2	H64 D69 E70	H64-A66 VanDerWaalsContact C-N 3.31Å; H64-A66 PolarHBondContact O-N 3.23Å; A66-D69 PolarHBondContact O-N 3.24Å; A66-E70 WeakPolarHBondContact O-CB 3.46Å; A66-E70 PolarHBondContact O-N 2.92Å
67	E	98.8	Very high	98.8	Very high	80 Å²	80	57.7 Å²	57.7	37%	0.374	30%	0.303	S	S	.	.	H	α-helix	trans	-65.5	-43.9	178	179.4	175	-165.4	0	0	111.2	H64 D69 E70 K71 I73	H64-E67 PolarHBondContact O-N 3.11Å; H64-E67 VanDerWaalsContact O-N 3.12Å; E67-D69 VanDerWaalsContact C-N 3.3Å; E67-D69 PolarHBondContact O-N 3.33Å; E67-E70 PolarHBondContact O-N 3.19Å; E67-K71 HydrophobicContact CG-CD 3.83Å; E67-K71 HydrophobicContact CG-CG 4.47Å; E67-K71 WeakPolarHBondContact O-CB 3.44Å; E67-K71 PolarHBondContact O-N 2.73Å; E67-K71 IonicContact OE1-NZ 3.9Å; E67-K71 PolarHBondContact OE1-NZ 3.13Å; E67-I73 HydrophobicContact CG-CD1 4.32Å
68	W	98.9	Very high	98.8	Very high	15 Å²	15	58.4 Å²	58.4	6%	0.057	31%	0.307	C	S	.	.	H	α-helix	trans	-63.9	-35.7	177.2	-61.5	-23.1	0	0	0	112.6	E60 M61 H64 E72 I73 P75 T78 C117	E60-W68 WeakPolarHBondContact O-CH2 3.43Å; M61-W68 HydrophobicContact CB-CH2 4.47Å; M61-W68 HydrophobicContact CB-CZ3 4.27Å; H64-W68 HydrophobicContact CB-CD2 3.84Å; H64-W68 HydrophobicContact CB-CE3 4.27Å; H64-W68 HydrophobicContact CB-CG 4.46Å; H64-W68 HydrophobicContact CB-CH2 3.78Å; H64-W68 HydrophobicContact CB-CZ2 3.31Å; H64-W68 HydrophobicContact CB-CZ3 4.25Å; H64-W68 AromaticContact CG-CZ2 3.88Å; H64-W68 PolarHBondContact O-N 3.23Å; W68-E72 CarbonylContact O-C 3.49Å; W68-E72 WeakPolarHBondContact O-CA 3.15Å; W68-E72 PolarHBondContact O-N 3.47Å; W68-I73 HydrophobicContact CB-CB 4.5Å; W68-I73 PolarHBondContact O-N 3.09Å; W68-P75 HydrophobicContact CD2-CB 3.79Å; W68-P75 HydrophobicContact CD2-CG 4.19Å; W68-P75 HydrophobicContact CE3-CB 4.17Å; W68-P75 HydrophobicContact CE3-CG 4.17Å; W68-P75 HydrophobicContact CG-CB 4.36Å; W68-P75 HydrophobicContact CH2-CB 4.06Å; W68-P75 HydrophobicContact CZ2-CB 3.65Å; W68-P75 HydrophobicContact CZ3-CB 4.3Å; W68-P75 HydrophobicContact CZ3-CG 4.35Å; W68-T78 HydrophobicContact CH2-CG2 3.84Å; W68-T78 HydrophobicContact CZ2-CG2 4.42Å; W68-T78 VanDerWaalsContact CZ2-OG1 3.31Å; W68-T78 WeakPolarHBondContact CZ2-OG1 3.39Å; W68-C117 HydrophobicContact CZ3-CB 4.34Å
69	D	98.9	Very high	98.8	Very high	3 Å²	3	55.9 Å²	55.9	2%	0.016	29%	0.287	C	S	.	.	H	α-helix	trans	-65.4	-51.5	174.2	178	73.5	0	0	0	112.1	M65 A66 E67 E72 N240 K381 R390	M65-D69 PolarHBondContact O-N 3.38Å; M65-D69 VanDerWaalsContact O-N 3.13Å; A66-D69 PolarHBondContact O-N 3.24Å; E67-D69 VanDerWaalsContact C-N 3.3Å; E67-D69 PolarHBondContact O-N 3.33Å; D69-E72 PolarHBondContact O-N 3.38Å; D69-N240 WeakPolarHBondContact O-CB 3.3Å; D69-N240 WeakPolarHBondContact OD1-CB 3.48Å; D69-N240 PolarHBondContact OD1-ND2 3.24Å; D69-K381 IonicContact OD2-NZ 3.08Å; D69-K381 PolarHBondContact OD2-NZ 3.05Å; D69-R390 IonicContact OD1-CZ 3.58Å; D69-R390 IonicContact OD1-NH1 2.89Å; D69-R390 PolarHBondContact OD1-NH1 2.82Å; D69-R390 IonicContact OD1-NH2 2.68Å; D69-R390 PolarHBondContact OD1-NH2 3.29Å; D69-R390 IonicContact OD2-CZ 2.8Å; D69-R390 IonicContact OD2-NH1 2.68Å; D69-R390 PolarHBondContact OD2-NH1 3.21Å; D69-R390 IonicContact OD2-NH2 2.7Å; D69-R390 PolarHBondContact OD2-NH2 3.47Å
70	E	98.8	Very high	98.8	Very high	154 Å²	154	54.2 Å²	54.2	72%	0.72	28%	0.275	S	S	*	.	H	α-helix	trans	-65.7	-44.7	-174.7	-179.1	176.1	-154.1	0	0	111.9	A66 E67 E72	A66-E70 WeakPolarHBondContact O-CB 3.46Å; A66-E70 PolarHBondContact O-N 2.92Å; E67-E70 PolarHBondContact O-N 3.19Å; E70-E72 VanDerWaalsContact C-N 3.33Å
71	K	98.8	Very high	98.8	Very high	118 Å²	118	55.8 Å²	55.8	51%	0.513	28%	0.281	S	S	.	.	H	α-helix	trans	-89.3	-2.4	-177.5	-62.3	-179.3	-175.7	173.2	0	113	E67 I73	E67-K71 HydrophobicContact CG-CD 3.83Å; E67-K71 HydrophobicContact CG-CG 4.47Å; E67-K71 WeakPolarHBondContact O-CB 3.44Å; E67-K71 PolarHBondContact O-N 2.73Å; E67-K71 IonicContact OE1-NZ 3.9Å; E67-K71 PolarHBondContact OE1-NZ 3.13Å; K71-I73 VanDerWaalsContact C-N 3.29Å; K71-I73 HydrophobicContact CB-CD1 3.61Å; K71-I73 HydrophobicContact CB-CG1 3.66Å; K71-I73 HydrophobicContact CD-CD1 3.81Å; K71-I73 HydrophobicContact CG-CD1 4.34Å; K71-I73 PolarHBondContact O-N 2.87Å
72	E	98.8	Very high	98.8	Very high	38 Å²	38	55.8 Å²	55.8	18%	0.178	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	48.3	-176.3	-57.9	170.2	139.6	0	0	111.9	W68 D69 E70 K233 K235 N240	W68-E72 CarbonylContact O-C 3.49Å; W68-E72 WeakPolarHBondContact O-CA 3.15Å; W68-E72 PolarHBondContact O-N 3.47Å; D69-E72 PolarHBondContact O-N 3.38Å; E70-E72 VanDerWaalsContact C-N 3.33Å; E72-K233 PolarHBondContact O-NZ 3.27Å; E72-K233 WeakPolarHBondContact OE2-CE 3.3Å; E72-K233 IonicContact OE2-NZ 3.64Å; E72-K233 PolarHBondContact OE2-NZ 2.81Å; E72-K235 VanDerWaalsContact OE1-CD 3.26Å; E72-K235 WeakPolarHBondContact OE1-CD 3.4Å; E72-K235 IonicContact OE1-NZ 2.7Å; E72-K235 PolarHBondContact OE1-NZ 3.12Å; E72-K235 IonicContact OE2-NZ 2.76Å; E72-K235 PolarHBondContact OE2-NZ 3.21Å; E72-N240 VanDerWaalsContact CA-O 3.28Å; E72-N240 WeakPolarHBondContact CA-O 3.49Å; E72-N240 HydrophobicContact CG-CB 4.24Å
73	I	98.8	Very high	98.8	Very high	60 Å²	60	53.3 Å²	53.3	31%	0.308	27%	0.265	S	S	.	.			trans	-85.8	130.8	-176.3	-68.2	166.4	0	0	0	109.7	E67 W68 K71 P75 S241	E67-I73 HydrophobicContact CG-CD1 4.32Å; W68-I73 HydrophobicContact CB-CB 4.5Å; W68-I73 PolarHBondContact O-N 3.09Å; K71-I73 VanDerWaalsContact C-N 3.29Å; K71-I73 HydrophobicContact CB-CD1 3.61Å; K71-I73 HydrophobicContact CB-CG1 3.66Å; K71-I73 HydrophobicContact CD-CD1 3.81Å; K71-I73 HydrophobicContact CG-CD1 4.34Å; K71-I73 PolarHBondContact O-N 2.87Å; I73-P75 VanDerWaalsContact O-CD 3.31Å; I73-P75 WeakPolarHBondContact O-CD 3.24Å; I73-S241 CarbonylContact O-C 3.57Å; I73-S241 VanDerWaalsContact O-CA 3.26Å; I73-S241 WeakPolarHBondContact O-CA 3.45Å; I73-S241 WeakPolarHBondContact O-CB 3.25Å; I73-S241 VanDerWaalsContact O-O 3.06Å
74	F	98.8	Very high	98.8	Very high	30 Å²	30	56.9 Å²	56.9	13%	0.132	27%	0.274	C	S	.	.			trans	-82.7	107.6	168.1	-170.3	-130.1	0	0	0	110	V76 M79 Y123 F156 D198 S241 P243	F74-V76 VanDerWaalsContact C-N 3.26Å; F74-V76 HydrophobicContact CD1-CG2 3.58Å; F74-V76 HydrophobicContact CE1-CG2 3.85Å; F74-V76 HydrophobicContact CG-CG2 4.44Å; F74-V76 PolarHBondContact O-N 3.27Å; F74-M79 HydrophobicContact CD1-CE 4.26Å; F74-M79 HydrophobicContact CD2-CE 3.76Å; F74-M79 HydrophobicContact CE1-CE 3.87Å; F74-M79 HydrophobicContact CE2-CE 3.32Å; F74-M79 HydrophobicContact CE2-SD 4.11Å; F74-M79 HydrophobicContact CG-CE 4.2Å; F74-M79 HydrophobicContact CZ-CE 3.36Å; F74-M79 HydrophobicContact CZ-SD 4.41Å; F74-Y123 AromaticContact CE2-CD1 3.67Å; F74-Y123 HydrophobicContact CE2-CD1 3.67Å; F74-Y123 HydrophobicContact CE2-CD2 4.17Å; F74-Y123 AromaticContact CE2-CE1 3.42Å; F74-Y123 HydrophobicContact CE2-CE1 3.42Å; F74-Y123 VanDerWaalsContact CE2-CE1 3.42Å; F74-Y123 AromaticContact CE2-CE2 3.96Å; F74-Y123 HydrophobicContact CE2-CE2 3.96Å; F74-Y123 HydrophobicContact CE2-CG 4.04Å; F74-Y123 AromaticContact CE2-CZ 3.59Å; F74-Y123 HydrophobicContact CZ-CD1 4.14Å; F74-Y123 AromaticContact CZ-CE1 3.4Å; F74-Y123 HydrophobicContact CZ-CE1 3.4Å; F74-Y123 HydrophobicContact CZ-CE2 4.09Å; F74-Y123 AromaticContact CZ-CZ 3.38Å; F74-Y123 WeakPolarHBondContact CZ-OH 3.4Å; F74-F156 HydrophobicContact CE1-CD1 4.47Å; F74-F156 HydrophobicContact CE1-CD2 4.45Å; F74-F156 HydrophobicContact CE1-CG 4.3Å; F74-F156 HydrophobicContact CZ-CD1 4.09Å; F74-F156 HydrophobicContact CZ-CE1 4.44Å; F74-F156 HydrophobicContact CZ-CG 4.28Å; F74-D198 HydrophobicContact CD1-CB 4.21Å; F74-S241 VanDerWaalsContact CA-O 3.31Å; F74-S241 WeakPolarHBondContact CA-O 3.49Å; F74-S241 WeakPolarHBondContact CD2-O 3.49Å; F74-P243 HydrophobicContact CD2-CG 4.48Å; F74-P243 HydrophobicContact CG-CG 4.42Å
75	P	98.7	Very high	98.8	Very high	6 Å²	6	57 Å²	57	4%	0.039	28%	0.277	C	S	.	.			trans	-84.7	63.8	-163.6	35.2	-36.5	0	0	0	112.4	W68 I73 E77 T78 M79 T120 S241	W68-P75 HydrophobicContact CD2-CB 3.79Å; W68-P75 HydrophobicContact CD2-CG 4.19Å; W68-P75 HydrophobicContact CE3-CB 4.17Å; W68-P75 HydrophobicContact CE3-CG 4.17Å; W68-P75 HydrophobicContact CG-CB 4.36Å; W68-P75 HydrophobicContact CH2-CB 4.06Å; W68-P75 HydrophobicContact CZ2-CB 3.65Å; W68-P75 HydrophobicContact CZ3-CB 4.3Å; W68-P75 HydrophobicContact CZ3-CG 4.35Å; I73-P75 VanDerWaalsContact O-CD 3.31Å; I73-P75 WeakPolarHBondContact O-CD 3.24Å; P75-E77 VanDerWaalsContact C-N 3.32Å; P75-E77 PolarHBondContact O-N 3.2Å; P75-T78 PolarHBondContact O-N 2.79Å; P75-M79 HydrophobicContact CG-CE 4.3Å; P75-M79 HydrophobicContact CG-CG 4.35Å; P75-M79 HydrophobicContact CG-SD 4.47Å; P75-M79 WeakPolarHBondContact O-CG 3.49Å; P75-M79 PolarHBondContact O-N 3.29Å; P75-T120 HydrophobicContact CG-CG2 3.62Å; P75-S241 WeakPolarHBondContact CD-O 3.5Å
76	V	98.8	Very high	98.8	Very high	42 Å²	42	57.5 Å²	57.5	26%	0.255	28%	0.283	S	S	.	.	H	α-helix	trans	-51.8	-47.5	-175.7	169.8	0	0	0	0	112.4	F74 M79 R80 F156	F74-V76 VanDerWaalsContact C-N 3.26Å; F74-V76 HydrophobicContact CD1-CG2 3.58Å; F74-V76 HydrophobicContact CE1-CG2 3.85Å; F74-V76 HydrophobicContact CG-CG2 4.44Å; F74-V76 PolarHBondContact O-N 3.27Å; V76-M79 PolarHBondContact O-N 3.04Å; V76-R80 WeakPolarHBondContact O-CG 3.35Å; V76-R80 PolarHBondContact O-N 2.72Å; V76-F156 HydrophobicContact CB-CE2 4.4Å; V76-F156 HydrophobicContact CB-CZ 4.39Å; V76-F156 HydrophobicContact CG1-CE2 3.77Å; V76-F156 HydrophobicContact CG1-CZ 3.99Å; V76-F156 HydrophobicContact CG2-CE2 4.13Å; V76-F156 HydrophobicContact CG2-CZ 4.34Å
77	E	98.6	Very high	98.8	Very high	156 Å²	156	55.3 Å²	55.3	73%	0.729	26%	0.264	S	S	*	.	H	α-helix	trans	-62.3	-46.8	-177.9	-65	-175.1	174.3	0	0	111.9	P75 M79 R80 K81	P75-E77 VanDerWaalsContact C-N 3.32Å; P75-E77 PolarHBondContact O-N 3.2Å; E77-M79 PolarHBondContact O-N 3.16Å; E77-R80 PolarHBondContact O-N 3.26Å; E77-K81 WeakPolarHBondContact O-CG 3.48Å; E77-K81 PolarHBondContact O-N 2.88Å
78	T	98.9	Very high	98.7	Very high	14 Å²	14	51.5 Å²	51.5	9%	0.086	25%	0.246	C	C	.	.	H	α-helix	trans	-63.8	-42.2	176.5	-58.2	0	0	0	0	111.4	F56 E60 M61 W68 P75 R80 K81 A82	F56-T78 HydrophobicContact CE1-CG2 4.05Å; F56-T78 HydrophobicContact CZ-CG2 3.76Å; F56-T78 WeakPolarHBondContact CZ-O 3.32Å; E60-T78 HydrophobicContact CB-CG2 4.21Å; E60-T78 VanDerWaalsContact O-CG2 3.31Å; E60-T78 WeakPolarHBondContact O-CG2 3.49Å; M61-T78 HydrophobicContact CG-CG2 4.12Å; W68-T78 HydrophobicContact CH2-CG2 3.84Å; W68-T78 HydrophobicContact CZ2-CG2 4.42Å; W68-T78 VanDerWaalsContact CZ2-OG1 3.31Å; W68-T78 WeakPolarHBondContact CZ2-OG1 3.39Å; P75-T78 PolarHBondContact O-N 2.79Å; T78-R80 VanDerWaalsContact C-N 3.31Å; T78-R80 PolarHBondContact O-N 2.86Å; T78-K81 WeakPolarHBondContact O-CB 3.44Å; T78-K81 PolarHBondContact O-N 3.5Å; T78-K81 VanDerWaalsContact O-N 3.15Å; T78-A82 PolarHBondContact O-N 3.01Å
79	M	98.9	Very high	98.7	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-63.5	-37.7	178.9	-69.8	-174.4	-64.9	0	0	112	F74 P75 V76 E77 A82 A83 T120 Y123 I124 M153 F156	F74-M79 HydrophobicContact CD1-CE 4.26Å; F74-M79 HydrophobicContact CD2-CE 3.76Å; F74-M79 HydrophobicContact CE1-CE 3.87Å; F74-M79 HydrophobicContact CE2-CE 3.32Å; F74-M79 HydrophobicContact CE2-SD 4.11Å; F74-M79 HydrophobicContact CG-CE 4.2Å; F74-M79 HydrophobicContact CZ-CE 3.36Å; F74-M79 HydrophobicContact CZ-SD 4.41Å; P75-M79 HydrophobicContact CG-CE 4.3Å; P75-M79 HydrophobicContact CG-CG 4.35Å; P75-M79 HydrophobicContact CG-SD 4.47Å; P75-M79 WeakPolarHBondContact O-CG 3.49Å; P75-M79 PolarHBondContact O-N 3.29Å; V76-M79 PolarHBondContact O-N 3.04Å; E77-M79 PolarHBondContact O-N 3.16Å; M79-A82 WeakPolarHBondContact O-CB 3.24Å; M79-A82 PolarHBondContact O-N 2.82Å; M79-A82 VanDerWaalsContact O-N 3.17Å; M79-A83 PolarHBondContact O-N 2.94Å; M79-T120 HydrophobicContact CG-CG2 3.93Å; M79-T120 HydrophobicContact SD-CG2 4.19Å; M79-Y123 HydrophobicContact CE-CD1 4.27Å; M79-Y123 HydrophobicContact CE-CE1 4.08Å; M79-Y123 HydrophobicContact SD-CD1 3.38Å; M79-Y123 WeakPolarHBondContact SD-CD1 3.35Å; M79-Y123 HydrophobicContact SD-CE1 3.6Å; M79-I124 HydrophobicContact CG-CD1 4.25Å; M79-I124 HydrophobicContact CG-CG1 4.17Å; M79-I124 HydrophobicContact SD-CG1 4.25Å; M79-M153 HydrophobicContact CB-SD 3.72Å; M79-F156 HydrophobicContact CB-CE1 3.94Å; M79-F156 HydrophobicContact CB-CZ 4.23Å; M79-F156 HydrophobicContact CE-CD1 4.36Å; M79-F156 HydrophobicContact CE-CE1 3.65Å; M79-F156 HydrophobicContact CE-CZ 4.04Å; M79-F156 HydrophobicContact SD-CE1 4.14Å
80	R	98.9	Very high	98.7	Very high	93 Å²	93	50.7 Å²	50.7	35%	0.351	24%	0.244	S	C	.	.	H	α-helix	trans	-64.5	-38.7	171.8	-75.5	176.4	178.4	163.5	-3.5	112.9	V76 E77 T78 A82 A83 Q84 M153 D154 F156	V76-R80 WeakPolarHBondContact O-CG 3.35Å; V76-R80 PolarHBondContact O-N 2.72Å; E77-R80 PolarHBondContact O-N 3.26Å; T78-R80 VanDerWaalsContact C-N 3.31Å; T78-R80 PolarHBondContact O-N 2.86Å; R80-A82 VanDerWaalsContact C-N 3.3Å; R80-A82 PolarHBondContact O-N 2.8Å; R80-A83 WeakPolarHBondContact O-CB 3.49Å; R80-A83 PolarHBondContact O-N 2.88Å; R80-Q84 WeakPolarHBondContact O-CG 3.27Å; R80-Q84 PolarHBondContact O-N 3.2Å; R80-M153 HydrophobicContact CG-CB 4.08Å; R80-M153 VanDerWaalsContact CG-O 3.27Å; R80-M153 WeakPolarHBondContact CG-O 3.35Å; R80-M153 PolarHBondContact NE-O 3.09Å; R80-D154 PolarHBondContact NH2-O 2.82Å; R80-F156 HydrophobicContact CG-CZ 4.4Å
81	K	98.8	Very high	98.7	Very high	86 Å²	86	44.2 Å²	44.2	37%	0.374	21%	0.212	S	C	.	.	H	α-helix	trans	-62.1	-38.6	171	-66.1	-178.4	-173.5	-178.1	0	111.8	F56 E60 E77 T78 A83 Q84	F56-K81 HydrophobicContact CE2-CB 3.83Å; F56-K81 HydrophobicContact CZ-CB 4.12Å; E60-K81 IonicContact OE1-NZ 2.75Å; E60-K81 WeakPolarHBondContact OE2-CD 3.12Å; E60-K81 IonicContact OE2-NZ 3.26Å; E60-K81 PolarHBondContact OE2-NZ 3.34Å; E77-K81 WeakPolarHBondContact O-CG 3.48Å; E77-K81 PolarHBondContact O-N 2.88Å; T78-K81 WeakPolarHBondContact O-CB 3.44Å; T78-K81 PolarHBondContact O-N 3.5Å; T78-K81 VanDerWaalsContact O-N 3.15Å; K81-A83 VanDerWaalsContact C-N 3.32Å; K81-Q84 WeakPolarHBondContact O-CB 3.1Å; K81-Q84 PolarHBondContact O-N 2.96Å
82	A	98.8	Very high	98.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.4	-40.6	173.8	0	0	0	0	0	111.1	F56 T78 M79 R80 Q84 L85 F87 I124	F56-A82 HydrophobicContact CD1-CB 4.48Å; F56-A82 HydrophobicContact CE1-CB 3.66Å; F56-A82 HydrophobicContact CE2-CB 4.4Å; F56-A82 HydrophobicContact CZ-CB 3.61Å; T78-A82 PolarHBondContact O-N 3.01Å; M79-A82 WeakPolarHBondContact O-CB 3.24Å; M79-A82 PolarHBondContact O-N 2.82Å; M79-A82 VanDerWaalsContact O-N 3.17Å; R80-A82 VanDerWaalsContact C-N 3.3Å; R80-A82 PolarHBondContact O-N 2.8Å; A82-Q84 VanDerWaalsContact C-N 3.32Å; A82-Q84 PolarHBondContact O-N 2.84Å; A82-L85 WeakPolarHBondContact O-CB 3.33Å; A82-L85 PolarHBondContact O-N 2.9Å; A82-F87 HydrophobicContact CB-CB 4.18Å; A82-F87 HydrophobicContact CB-CD2 4.15Å; A82-F87 WeakPolarHBondContact O-CB 3.3Å; A82-F87 PolarHBondContact O-N 3.49Å; A82-I124 HydrophobicContact CB-CD1 4.46Å
83	A	98.8	Very high	98.7	Very high	9 Å²	9	41.2 Å²	41.2	7%	0.074	20%	0.2	C	C	.	.	H	α-helix	trans	-63.1	-34.8	176.5	0	0	0	0	0	113.2	M79 R80 K81 L85 G86 T152 M153	M79-A83 PolarHBondContact O-N 2.94Å; R80-A83 WeakPolarHBondContact O-CB 3.49Å; R80-A83 PolarHBondContact O-N 2.88Å; K81-A83 VanDerWaalsContact C-N 3.32Å; A83-L85 PolarHBondContact O-N 3.17Å; A83-G86 WeakPolarHBondContact O-CA 3.37Å; A83-G86 PolarHBondContact O-N 3.16Å; A83-T152 WeakPolarHBondContact CB-O 3.06Å; A83-M153 HydrophobicContact CB-CB 3.87Å; A83-M153 HydrophobicContact CB-CG 3.83Å; A83-M153 HydrophobicContact CB-SD 4.06Å
84	Q	98.6	Very high	98.7	Very high	162 Å²	162	42 Å²	42	76%	0.757	21%	0.209	S	C	*	.	H	α-helix	trans	-61.6	-22	172.4	-68.5	169.1	6.5	0	0	113.3	R80 K81 A82 G86	R80-Q84 WeakPolarHBondContact O-CG 3.27Å; R80-Q84 PolarHBondContact O-N 3.2Å; K81-Q84 WeakPolarHBondContact O-CB 3.1Å; K81-Q84 PolarHBondContact O-N 2.96Å; A82-Q84 VanDerWaalsContact C-N 3.32Å; A82-Q84 PolarHBondContact O-N 2.84Å; Q84-G86 VanDerWaalsContact C-N 3.33Å
85	L	98.6	Very high	98.6	Very high	72 Å²	72	46.6 Å²	46.6	38%	0.377	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	3.7	172.7	-57.1	178.1	0	0	0	113	M52 F56 A82 A83 F87	M52-L85 HydrophobicContact CG-CD1 4.36Å; M52-L85 HydrophobicContact SD-CB 4.07Å; M52-L85 HydrophobicContact SD-CD2 4.29Å; F56-L85 HydrophobicContact CB-CD1 4.01Å; F56-L85 HydrophobicContact CD2-CD1 3.46Å; F56-L85 VanDerWaalsContact CD2-CD1 3.46Å; F56-L85 HydrophobicContact CE2-CD1 4.18Å; F56-L85 HydrophobicContact CG-CD1 3.9Å; A82-L85 WeakPolarHBondContact O-CB 3.33Å; A82-L85 PolarHBondContact O-N 2.9Å; A83-L85 PolarHBondContact O-N 3.17Å; L85-F87 HydrophobicContact CB-CD2 4.1Å; L85-F87 HydrophobicContact CB-CE1 4.49Å; L85-F87 HydrophobicContact CB-CE2 3.91Å; L85-F87 HydrophobicContact CB-CG 4.47Å; L85-F87 HydrophobicContact CB-CZ 4.12Å; L85-F87 HydrophobicContact CD1-CD2 4.45Å; L85-F87 HydrophobicContact CD1-CE2 3.89Å
86	G	98.5	Very high	98.6	Very high	17 Å²	17	46.8 Å²	46.8	18%	0.175	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.4	-1.3	-176.2	0	0	0	0	0	114.7	A83 Q84 G88 G89 S99	A83-G86 WeakPolarHBondContact O-CA 3.37Å; A83-G86 PolarHBondContact O-N 3.16Å; Q84-G86 VanDerWaalsContact C-N 3.33Å; G86-G88 PolarHBondContact O-N 3.01Å; G86-G89 PolarHBondContact O-N 2.9Å; G86-S99 VanDerWaalsContact CA-OG 3.3Å; G86-S99 WeakPolarHBondContact CA-OG 3.41Å; G86-S99 PolarHBondContact O-OG 2.87Å; G86-S99 VanDerWaalsContact O-OG 3.07Å
87	F	98.8	Very high	98.6	Very high	5 Å²	5	47.3 Å²	47.3	2%	0.022	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-2.9	-172.4	-52.8	-28.8	0	0	0	114.9	M52 A53 A82 L85 I90 I109 L113 I124 N128	M52-F87 HydrophobicContact CG-CZ 4.29Å; M52-F87 HydrophobicContact SD-CZ 4.04Å; A53-F87 HydrophobicContact CB-CE2 4.27Å; A53-F87 HydrophobicContact CB-CZ 4Å; A82-F87 HydrophobicContact CB-CB 4.18Å; A82-F87 HydrophobicContact CB-CD2 4.15Å; A82-F87 WeakPolarHBondContact O-CB 3.3Å; A82-F87 PolarHBondContact O-N 3.49Å; L85-F87 HydrophobicContact CB-CD2 4.1Å; L85-F87 HydrophobicContact CB-CE1 4.49Å; L85-F87 HydrophobicContact CB-CE2 3.91Å; L85-F87 HydrophobicContact CB-CG 4.47Å; L85-F87 HydrophobicContact CB-CZ 4.12Å; L85-F87 HydrophobicContact CD1-CD2 4.45Å; L85-F87 HydrophobicContact CD1-CE2 3.89Å; F87-I90 HydrophobicContact CB-CD1 4.38Å; F87-I90 HydrophobicContact CB-CG1 4.38Å; F87-I90 HydrophobicContact CD1-CD1 4.44Å; F87-I90 HydrophobicContact CD1-CG1 4.37Å; F87-I109 HydrophobicContact CD1-CD1 4.31Å; F87-I109 HydrophobicContact CD1-CG2 3.74Å; F87-I109 HydrophobicContact CE1-CD1 3.97Å; F87-I109 HydrophobicContact CE1-CG1 4.2Å; F87-I109 HydrophobicContact CE1-CG2 3.74Å; F87-I109 HydrophobicContact CG-CG2 4.19Å; F87-I109 HydrophobicContact CZ-CG2 4.18Å; F87-L113 HydrophobicContact CD2-CD1 4.09Å; F87-L113 HydrophobicContact CD2-CD2 4.19Å; F87-L113 HydrophobicContact CE2-CD2 4.16Å; F87-L113 HydrophobicContact CG-CD1 4.4Å; F87-I124 WeakPolarHBondContact O-CG2 3.46Å; F87-N128 PolarHBondContact O-ND2 3.45Å
88	G	98.4	Very high	98.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-23.7	173.7	0	0	0	0	0	114	G86 H127 C151	G86-G88 PolarHBondContact O-N 3.01Å; G88-H127 PolarHBondContact O-CD2 3.44Å; G88-H127 VanDerWaalsContact O-CD2 3.26Å; G88-H127 PolarHBondContact O-NE2 3.39Å; G88-C151 WeakPolarHBondContact CA-O 3.16Å
89	G	98.6	Very high	98.6	Very high	2 Å²	2	41.8 Å²	41.8	2%	0.021	23%	0.227	C	C	.	.	S	Bend	trans	-147	55.9	-178.7	0	0	0	0	0	111.9	G86 Y91 V92 G98 S99 N128	G86-G89 PolarHBondContact O-N 2.9Å; G89-Y91 PolarHBondContact O-N 2.8Å; G89-V92 PolarHBondContact O-N 3.03Å; G89-G98 CarbonylContact O-C 3.53Å; G89-G98 VanDerWaalsContact O-CA 3.31Å; G89-G98 WeakPolarHBondContact O-CA 3.45Å; G89-S99 PolarHBondContact O-N 3.17Å; G89-N128 WeakPolarHBondContact CA-OD1 3.21Å
90	I	98.8	Very high	98.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-51.6	-170.9	-63.9	174.9	0	0	0	111.7	F87 S99 G100 L101 T106 I109 F110 N128	F87-I90 HydrophobicContact CB-CD1 4.38Å; F87-I90 HydrophobicContact CB-CG1 4.38Å; F87-I90 HydrophobicContact CD1-CD1 4.44Å; F87-I90 HydrophobicContact CD1-CG1 4.37Å; I90-S99 WeakPolarHBondContact O-CB 3.21Å; I90-G100 PolarHBondContact O-N 3.23Å; I90-L101 HydrophobicContact CG2-CB 4.04Å; I90-L101 HydrophobicContact CG2-CD1 4.18Å; I90-L101 WeakPolarHBondContact O-CB 3.14Å; I90-L101 PolarHBondContact O-N 2.88Å; I90-T106 HydrophobicContact CG2-CG2 4.13Å; I90-T106 VanDerWaalsContact CG2-OG1 3.27Å; I90-T106 WeakPolarHBondContact CG2-OG1 3.26Å; I90-I109 HydrophobicContact CD1-CB 4.42Å; I90-I109 HydrophobicContact CD1-CG2 3.83Å; I90-I109 HydrophobicContact CG2-CD1 4.08Å; I90-F110 HydrophobicContact CD1-CD1 4.29Å; I90-F110 HydrophobicContact CD1-CE1 3.57Å; I90-F110 HydrophobicContact CD1-CE2 4.34Å; I90-F110 HydrophobicContact CD1-CZ 3.6Å; I90-N128 PolarHBondContact N-OD1 2.74Å
91	Y	98.4	Very high	98.5	Very high	17 Å²	17	40.7 Å²	40.7	7%	0.067	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.3	29.2	-177.1	54.5	-90.2	0	0	0	112.1	G89 L101 T106 F110 N128 M129 W132 N280	G89-Y91 PolarHBondContact O-N 2.8Å; Y91-L101 WeakPolarHBondContact CB-O 3.5Å; Y91-T106 HydrophobicContact CD1-CG2 3.54Å; Y91-T106 WeakPolarHBondContact CD1-OG1 3Å; Y91-T106 HydrophobicContact CE1-CG2 3.67Å; Y91-F110 HydrophobicContact CE1-CE2 4.49Å; Y91-N128 HydrophobicContact CE1-CB 3.77Å; Y91-N128 VanDerWaalsContact OH-C 3.29Å; Y91-M129 VanDerWaalsContact OH-CA 3.32Å; Y91-M129 WeakPolarHBondContact OH-CA 3.26Å; Y91-M129 PolarHBondContact OH-N 3.27Å; Y91-M129 VanDerWaalsContact OH-N 3.09Å; Y91-W132 HydrophobicContact CD2-CB 3.74Å; Y91-W132 AromaticContact CD2-CD1 3.47Å; Y91-W132 VanDerWaalsContact CD2-CD1 3.47Å; Y91-W132 AromaticContact CD2-CG 3.63Å; Y91-W132 HydrophobicContact CD2-CG 3.63Å; Y91-W132 HydrophobicContact CE2-CB 3.31Å; Y91-W132 AromaticContact CE2-CD1 3.79Å; Y91-W132 HydrophobicContact CE2-CD2 4.2Å; Y91-W132 AromaticContact CE2-CG 3.43Å; Y91-W132 HydrophobicContact CE2-CG 3.43Å; Y91-W132 VanDerWaalsContact CE2-CG 3.43Å; Y91-N280 PolarHBondContact OH-ND2 3.45Å
92	V	98.8	Very high	98.5	Very high	0 Å²	0	38 Å²	38	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	-95.8	147.1	170.2	174.1	0	0	0	0	108.1	G89 V96 G98 S99 G100 N131 W132 D135	G89-V92 PolarHBondContact O-N 3.03Å; V92-V96 HydrophobicContact CG1-CG2 3.72Å; V92-G98 CarbonylContact O-C 3.43Å; V92-G98 WeakPolarHBondContact O-CA 3.36Å; V92-S99 PolarHBondContact O-N 3.26Å; V92-G100 WeakPolarHBondContact O-CA 3.04Å; V92-G100 PolarHBondContact O-N 3.25Å; V92-N131 HydrophobicContact CG2-CB 3.93Å; V92-W132 HydrophobicContact CG2-CB 4.45Å; V92-D135 HydrophobicContact CG1-CB 4Å
93	Q	98.5	Very high	98.5	Very high	94 Å²	94	39.3 Å²	39.3	44%	0.439	23%	0.234	S	C	.	.			trans	-64.6	143.1	-175.3	-66.1	-62.8	-7.1	0	0	113.3	E95 V96 G98 D135	Q93-E95 VanDerWaalsContact C-N 3.28Å; Q93-E95 VanDerWaalsContact CB-CD 3.43Å; Q93-E95 HydrophobicContact CB-CG 4.14Å; Q93-E95 WeakPolarHBondContact CB-OE1 3.22Å; Q93-E95 WeakPolarHBondContact CB-OE2 3.16Å; Q93-E95 PolarHBondContact O-N 3.41Å; Q93-V96 WeakPolarHBondContact O-CG2 3.45Å; Q93-V96 PolarHBondContact O-N 2.91Å; Q93-G98 PolarHBondContact O-N 3.33Å; Q93-G98 VanDerWaalsContact O-N 3.1Å; Q93-D135 WeakPolarHBondContact CG-OD2 3.37Å; Q93-D135 PolarHBondContact N-OD2 3.46Å
94	P	98.3	Very high	98.5	Very high	75 Å²	75	39.8 Å²	39.8	49%	0.487	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-60.4	-31.2	-179.9	-25.6	35.8	0	0	0	114.8	V96 G97 G98	P94-V96 PolarHBondContact O-N 3.2Å; P94-G97 PolarHBondContact O-N 3.08Å; P94-G98 WeakPolarHBondContact CA-O 3.33Å
95	E	97.9	Very high	98.5	Very high	127 Å²	127	33 Å²	33	59%	0.593	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-60.1	-20.1	179.6	59.4	-104.2	-154.3	0	0	114.3	Q93 R143	Q93-E95 VanDerWaalsContact C-N 3.28Å; Q93-E95 VanDerWaalsContact CB-CD 3.43Å; Q93-E95 HydrophobicContact CB-CG 4.14Å; Q93-E95 WeakPolarHBondContact CB-OE1 3.22Å; Q93-E95 WeakPolarHBondContact CB-OE2 3.16Å; Q93-E95 PolarHBondContact O-N 3.41Å; E95-R143 IonicContact OE1-CZ 3.41Å; E95-R143 IonicContact OE1-NH1 2.75Å; E95-R143 IonicContact OE1-NH2 3.45Å; E95-R143 PolarHBondContact OE1-NH2 3.03Å
96	V	98.4	Very high	98.6	Very high	10 Å²	10	29.5 Å²	29.5	6%	0.061	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-116.4	24.1	177	-62.2	0	0	0	0	112.5	V92 Q93 P94 R143 C147	V92-V96 HydrophobicContact CG1-CG2 3.72Å; Q93-V96 WeakPolarHBondContact O-CG2 3.45Å; Q93-V96 PolarHBondContact O-N 2.91Å; P94-V96 PolarHBondContact O-N 3.2Å; V96-R143 HydrophobicContact CG1-CB 4.14Å; V96-C147 HydrophobicContact CB-CB 3.78Å; V96-C147 HydrophobicContact CG2-CB 3.63Å
97	G	98.3	Very high	98.6	Very high	53 Å²	53	28.7 Å²	28.7	55%	0.546	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	88	6	173.3	0	0	0	0	0	115.4	P94 C151	P94-G97 PolarHBondContact O-N 3.08Å; G97-C151 VanDerWaalsContact C-SG 3.57Å; G97-C151 WeakPolarHBondContact O-CB 3.02Å
98	G	98.6	Very high	98.6	Very high	11 Å²	11	28.5 Å²	28.5	11%	0.113	18%	0.177	C	C	.	.			trans	-76.6	173.5	174.6	0	0	0	0	0	113.3	G89 V92 Q93 P94	G89-G98 CarbonylContact O-C 3.53Å; G89-G98 VanDerWaalsContact O-CA 3.31Å; G89-G98 WeakPolarHBondContact O-CA 3.45Å; V92-G98 CarbonylContact O-C 3.43Å; V92-G98 WeakPolarHBondContact O-CA 3.36Å; Q93-G98 PolarHBondContact O-N 3.33Å; Q93-G98 VanDerWaalsContact O-N 3.1Å; P94-G98 WeakPolarHBondContact CA-O 3.33Å
99	S	98.7	Very high	98.6	Very high	43 Å²	43	28.5 Å²	28.5	30%	0.301	18%	0.177	S	C	.	.			trans	-91.6	-11.7	177.8	-55	0	0	0	0	113.9	G86 G89 I90 V92 L101	G86-S99 VanDerWaalsContact CA-OG 3.3Å; G86-S99 WeakPolarHBondContact CA-OG 3.41Å; G86-S99 PolarHBondContact O-OG 2.87Å; G86-S99 VanDerWaalsContact O-OG 3.07Å; G89-S99 PolarHBondContact O-N 3.17Å; I90-S99 WeakPolarHBondContact O-CB 3.21Å; V92-S99 PolarHBondContact O-N 3.26Å; S99-L101 PolarHBondContact O-N 2.9Å
100	G	98.3	Very high	98.6	Very high	38 Å²	38	28.4 Å²	28.4	39%	0.392	18%	0.176	S	C	.	.			trans	62.9	21.8	177.3	0	0	0	0	0	115.1	I90 V92	I90-G100 PolarHBondContact O-N 3.23Å; V92-G100 WeakPolarHBondContact O-CA 3.04Å; V92-G100 PolarHBondContact O-N 3.25Å
101	L	98.6	Very high	98.6	Very high	33 Å²	33	28.4 Å²	28.4	17%	0.173	18%	0.176	C	C	.	.			trans	-80.7	157.2	-174.7	-58.3	-176.4	0	0	0	112.5	F49 I90 Y91 S99 D105 I109	F49-L101 HydrophobicContact CD2-CD1 4.37Å; F49-L101 HydrophobicContact CE1-CD2 4.5Å; F49-L101 HydrophobicContact CE2-CD1 4.18Å; F49-L101 HydrophobicContact CE2-CD2 3.79Å; F49-L101 HydrophobicContact CZ-CD1 4.27Å; F49-L101 HydrophobicContact CZ-CD2 3.67Å; I90-L101 HydrophobicContact CG2-CB 4.04Å; I90-L101 HydrophobicContact CG2-CD1 4.18Å; I90-L101 WeakPolarHBondContact O-CB 3.14Å; I90-L101 PolarHBondContact O-N 2.88Å; Y91-L101 WeakPolarHBondContact CB-O 3.5Å; S99-L101 PolarHBondContact O-N 2.9Å; L101-D105 HydrophobicContact CB-CB 3.95Å; L101-D105 HydrophobicContact CD1-CB 4.48Å; L101-I109 HydrophobicContact CD1-CD1 3.73Å
102	S	98.7	Very high	98.7	Very high	31 Å²	31	27.6 Å²	27.6	22%	0.217	17%	0.173	C	C	.	.			trans	-75.7	173.8	-176.8	77.1	0	0	0	0	113.1	L104 D105 T106 Q342	S102-L104 VanDerWaalsContact C-N 3.34Å; S102-L104 PolarHBondContact OG-N 2.93Å; S102-D105 VanDerWaalsContact CB-OD2 3.23Å; S102-D105 WeakPolarHBondContact CB-OD2 3.23Å; S102-D105 PolarHBondContact N-OD2 3.37Å; S102-D105 PolarHBondContact O-N 3.11Å; S102-D105 PolarHBondContact OG-N 3.07Å; S102-D105 PolarHBondContact OG-OD1 2.98Å; S102-D105 PolarHBondContact OG-OD2 2.97Å; S102-T106 WeakPolarHBondContact O-CB 3.48Å; S102-T106 PolarHBondContact O-N 3.48Å; S102-T106 PolarHBondContact O-OG1 3.35Å; S102-Q342 PolarHBondContact OG-OE1 3.3Å
103	R	98.7	Very high	98.7	Very high	27 Å²	27	27.6 Å²	27.6	10%	0.102	17%	0.173	C	C	.	.	H	α-helix	trans	-66.3	-37.4	175.1	-67.9	-63.4	-176.5	-166	-5.6	111.8	S107 A338 L341 Q342	R103-S107 PolarHBondContact O-N 3.37Å; R103-A338 HydrophobicContact CB-CB 4.31Å; R103-A338 WeakPolarHBondContact CB-O 3.46Å; R103-L341 HydrophobicContact CG-CB 4.44Å; R103-L341 HydrophobicContact CG-CD2 4.14Å; R103-L341 HydrophobicContact CG-CG 4.26Å; R103-Q342 HydrophobicContact CB-CB 4.09Å; R103-Q342 HydrophobicContact CG-CB 4.07Å
104	L	98.8	Very high	98.7	Very high	19 Å²	19	23.1 Å²	23.1	10%	0.099	15%	0.152	C	C	.	.	H	α-helix	trans	-66.4	-45.4	176	179.4	56.6	0	0	0	111.3	S102 T106 S107 V108 R335 A338 V339	S102-L104 VanDerWaalsContact C-N 3.34Å; S102-L104 PolarHBondContact OG-N 2.93Å; L104-T106 VanDerWaalsContact C-N 3.29Å; L104-T106 PolarHBondContact O-N 3.3Å; L104-S107 PolarHBondContact O-N 3.22Å; L104-S107 VanDerWaalsContact O-N 3.15Å; L104-V108 HydrophobicContact CD1-CG2 4.4Å; L104-V108 WeakPolarHBondContact O-CG2 3.49Å; L104-V108 PolarHBondContact O-N 3.43Å; L104-R335 HydrophobicContact CD1-CB 3.83Å; L104-R335 HydrophobicContact CD1-CG 3.63Å; L104-A338 HydrophobicContact CB-CB 4.47Å; L104-V339 HydrophobicContact CB-CG2 4.46Å; L104-V339 HydrophobicContact CD2-CG2 3.89Å
105	D	98.9	Very high	98.7	Very high	18 Å²	18	20.8 Å²	20.8	10%	0.096	14%	0.136	C	C	.	.	H	α-helix	trans	-59.9	-43.6	177.6	-51.8	-32.2	0	0	0	110.7	Q46 F49 L101 S102 S107 V108 I109	Q46-D105 WeakPolarHBondContact CG-OD1 3.43Å; Q46-D105 PolarHBondContact NE2-OD1 3.19Å; F49-D105 HydrophobicContact CD2-CB 4.19Å; F49-D105 HydrophobicContact CE2-CB 4.44Å; L101-D105 HydrophobicContact CB-CB 3.95Å; L101-D105 HydrophobicContact CD1-CB 4.48Å; S102-D105 VanDerWaalsContact CB-OD2 3.23Å; S102-D105 WeakPolarHBondContact CB-OD2 3.23Å; S102-D105 PolarHBondContact N-OD2 3.37Å; S102-D105 PolarHBondContact O-N 3.11Å; S102-D105 PolarHBondContact OG-N 3.07Å; S102-D105 PolarHBondContact OG-OD1 2.98Å; S102-D105 PolarHBondContact OG-OD2 2.97Å; D105-S107 PolarHBondContact O-N 2.8Å; D105-V108 WeakPolarHBondContact O-CB 3.37Å; D105-V108 PolarHBondContact O-N 3.01Å; D105-I109 WeakPolarHBondContact O-CG1 3.34Å; D105-I109 PolarHBondContact O-N 3.41Å
106	T	98.9	Very high	98.8	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-57.6	-47.2	174.9	-57.3	0	0	0	0	111.9	I90 Y91 S102 L104 V108 I109 F110	I90-T106 HydrophobicContact CG2-CG2 4.13Å; I90-T106 VanDerWaalsContact CG2-OG1 3.27Å; I90-T106 WeakPolarHBondContact CG2-OG1 3.26Å; Y91-T106 HydrophobicContact CD1-CG2 3.54Å; Y91-T106 WeakPolarHBondContact CD1-OG1 3Å; Y91-T106 HydrophobicContact CE1-CG2 3.67Å; S102-T106 WeakPolarHBondContact O-CB 3.48Å; S102-T106 PolarHBondContact O-N 3.48Å; S102-T106 PolarHBondContact O-OG1 3.35Å; L104-T106 VanDerWaalsContact C-N 3.29Å; L104-T106 PolarHBondContact O-N 3.3Å; T106-V108 VanDerWaalsContact C-N 3.29Å; T106-V108 PolarHBondContact O-N 3Å; T106-I109 PolarHBondContact O-N 3.42Å; T106-F110 HydrophobicContact CG2-CD2 3.6Å; T106-F110 HydrophobicContact CG2-CE2 3.35Å; T106-F110 HydrophobicContact CG2-CZ 4.24Å; T106-F110 PolarHBondContact O-N 2.92Å
107	S	98.9	Very high	98.8	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-61.8	-38.3	177.9	177	0	0	0	0	111.8	R103 L104 D105 E111 S283	R103-S107 PolarHBondContact O-N 3.37Å; L104-S107 PolarHBondContact O-N 3.22Å; L104-S107 VanDerWaalsContact O-N 3.15Å; D105-S107 PolarHBondContact O-N 2.8Å; S107-E111 VanDerWaalsContact O-CB 3.24Å; S107-E111 WeakPolarHBondContact O-CB 3.48Å; S107-E111 PolarHBondContact O-N 3.06Å; S107-S283 WeakPolarHBondContact CA-OG 3.05Å; S107-S283 WeakPolarHBondContact CB-OG 3.36Å; S107-S283 WeakPolarHBondContact O-CB 3.25Å; S107-S283 PolarHBondContact OG-OG 3.4Å
108	V	98.9	Very high	98.8	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-66	-44.1	178.2	168.4	0	0	0	0	111.1	L42 Q50 L104 D105 T106 A112	L42-V108 HydrophobicContact CD1-CG1 3.98Å; L42-V108 HydrophobicContact CD1-CG2 3.88Å; L42-V108 HydrophobicContact CD2-CG2 3.74Å; L42-V108 HydrophobicContact CG-CG2 4.5Å; Q50-V108 HydrophobicContact CB-CG1 3.48Å; Q50-V108 VanDerWaalsContact CB-CG1 3.48Å; Q50-V108 HydrophobicContact CG-CG1 3.99Å; L104-V108 HydrophobicContact CD1-CG2 4.4Å; L104-V108 WeakPolarHBondContact O-CG2 3.49Å; L104-V108 PolarHBondContact O-N 3.43Å; D105-V108 WeakPolarHBondContact O-CB 3.37Å; D105-V108 PolarHBondContact O-N 3.01Å; T106-V108 VanDerWaalsContact C-N 3.29Å; T106-V108 PolarHBondContact O-N 3Å; V108-A112 PolarHBondContact O-N 2.9Å; V108-A112 VanDerWaalsContact O-N 3.12Å
109	I	98.9	Very high	98.8	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-63.7	-49.2	177.5	-69	163.5	0	0	0	110.6	F49 A53 F87 I90 L101 D105 T106 E111 A112 L113	F49-I109 HydrophobicContact CB-CD1 4.31Å; F49-I109 HydrophobicContact CB-CG1 4.11Å; A53-I109 HydrophobicContact CB-CB 4.5Å; A53-I109 HydrophobicContact CB-CG2 4.15Å; F87-I109 HydrophobicContact CD1-CD1 4.31Å; F87-I109 HydrophobicContact CD1-CG2 3.74Å; F87-I109 HydrophobicContact CE1-CD1 3.97Å; F87-I109 HydrophobicContact CE1-CG1 4.2Å; F87-I109 HydrophobicContact CE1-CG2 3.74Å; F87-I109 HydrophobicContact CG-CG2 4.19Å; F87-I109 HydrophobicContact CZ-CG2 4.18Å; I90-I109 HydrophobicContact CD1-CB 4.42Å; I90-I109 HydrophobicContact CD1-CG2 3.83Å; I90-I109 HydrophobicContact CG2-CD1 4.08Å; L101-I109 HydrophobicContact CD1-CD1 3.73Å; D105-I109 WeakPolarHBondContact O-CG1 3.34Å; D105-I109 PolarHBondContact O-N 3.41Å; T106-I109 PolarHBondContact O-N 3.42Å; I109-E111 PolarHBondContact O-N 2.94Å; I109-A112 PolarHBondContact O-N 3.11Å; I109-L113 HydrophobicContact CG2-CD1 3.79Å; I109-L113 HydrophobicContact CG2-CG 4.21Å; I109-L113 WeakPolarHBondContact O-CG 3.43Å; I109-L113 PolarHBondContact O-N 3.48Å
110	F	98.9	Very high	98.8	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-68.4	-32.2	-179.9	-70.9	-34.7	0	0	0	113.7	I90 Y91 T106 L113 S114 T121 I124 N128 N280	I90-F110 HydrophobicContact CD1-CD1 4.29Å; I90-F110 HydrophobicContact CD1-CE1 3.57Å; I90-F110 HydrophobicContact CD1-CE2 4.34Å; I90-F110 HydrophobicContact CD1-CZ 3.6Å; Y91-F110 HydrophobicContact CE1-CE2 4.49Å; T106-F110 HydrophobicContact CG2-CD2 3.6Å; T106-F110 HydrophobicContact CG2-CE2 3.35Å; T106-F110 HydrophobicContact CG2-CZ 4.24Å; T106-F110 PolarHBondContact O-N 2.92Å; F110-L113 HydrophobicContact CD1-CD1 4.24Å; F110-S114 VanDerWaalsContact O-CB 3.22Å; F110-S114 WeakPolarHBondContact O-CB 3.49Å; F110-S114 PolarHBondContact O-N 2.78Å; F110-S114 VanDerWaalsContact O-N 3.11Å; F110-S114 PolarHBondContact O-OG 3.48Å; F110-T121 HydrophobicContact CB-CG2 4.2Å; F110-T121 HydrophobicContact CD1-CG2 3.7Å; F110-T121 HydrophobicContact CG-CG2 4.3Å; F110-I124 HydrophobicContact CE1-CB 4.47Å; F110-I124 HydrophobicContact CE1-CG2 3.88Å; F110-N128 HydrophobicContact CZ-CB 4.41Å; F110-N280 HydrophobicContact CD2-CB 3.74Å; F110-N280 HydrophobicContact CE2-CB 3.95Å
111	E	98.9	Very high	98.9	Very high	1 Å²	1	7.4 Å²	7.4	1%	0.005	4%	0.041	C	C	.	.	H	α-helix	trans	-58.5	-48.2	169.6	178	-179.4	-168.6	0	0	110.5	S107 I109 S283 L286 G287 R331 R335	S107-E111 VanDerWaalsContact O-CB 3.24Å; S107-E111 WeakPolarHBondContact O-CB 3.48Å; S107-E111 PolarHBondContact O-N 3.06Å; I109-E111 PolarHBondContact O-N 2.94Å; E111-S283 WeakPolarHBondContact CA-O 3.44Å; E111-L286 VanDerWaalsContact CD-CD2 3.42Å; E111-L286 HydrophobicContact CG-CB 4.46Å; E111-L286 HydrophobicContact CG-CD2 4.08Å; E111-L286 HydrophobicContact CG-CG 4.18Å; E111-L286 VanDerWaalsContact OE1-CD2 3.3Å; E111-L286 WeakPolarHBondContact OE1-CD2 3.19Å; E111-L286 WeakPolarHBondContact OE1-CG 3.34Å; E111-G287 WeakPolarHBondContact O-CA 3.25Å; E111-R331 IonicContact OE1-CZ 2.89Å; E111-R331 IonicContact OE1-NE 2.76Å; E111-R331 PolarHBondContact OE1-NE 3.32Å; E111-R331 IonicContact OE1-NH2 3.68Å; E111-R331 PolarHBondContact OE1-NH2 2.86Å; E111-R331 IonicContact OE2-NE 3.72Å; E111-R335 IonicContact OE2-NH2 2.73Å; E111-R335 PolarHBondContact OE2-NH2 3.01Å
112	A	98.9	Very high	98.9	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-67.4	-49	-179.1	0	0	0	0	0	112.7	A53 F54 V108 I109 S114 T115	A53-A112 HydrophobicContact CB-CB 3.61Å; F54-A112 HydrophobicContact CB-CB 4.43Å; F54-A112 HydrophobicContact CD1-CB 4.04Å; F54-A112 HydrophobicContact CD2-CB 3.63Å; F54-A112 HydrophobicContact CE1-CB 4.21Å; F54-A112 HydrophobicContact CE2-CB 3.79Å; F54-A112 HydrophobicContact CG-CB 3.75Å; F54-A112 HydrophobicContact CZ-CB 4.07Å; V108-A112 PolarHBondContact O-N 2.9Å; V108-A112 VanDerWaalsContact O-N 3.12Å; I109-A112 PolarHBondContact O-N 3.11Å; A112-S114 PolarHBondContact O-N 2.89Å; A112-T115 WeakPolarHBondContact O-CB 3.25Å; A112-T115 PolarHBondContact O-N 3.41Å; A112-T115 VanDerWaalsContact O-N 3.1Å; A112-T115 PolarHBondContact O-OG1 3.2Å
113	L	98.9	Very high	98.9	Very high	0 Å²	0	4.6 Å²	4.6	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-57.8	-36.8	178.3	-69.9	177.9	0	0	0	112.7	A53 F56 M61 F87 I109 F110 T115 G116 C117 T121	A53-L113 HydrophobicContact CB-CD2 4.23Å; A53-L113 HydrophobicContact CB-CG 4.19Å; F56-L113 HydrophobicContact CD1-CD2 3.68Å; F56-L113 HydrophobicContact CE1-CD2 4.45Å; M61-L113 HydrophobicContact SD-CB 4.39Å; M61-L113 HydrophobicContact SD-CD2 3.89Å; F87-L113 HydrophobicContact CD2-CD1 4.09Å; F87-L113 HydrophobicContact CD2-CD2 4.19Å; F87-L113 HydrophobicContact CE2-CD2 4.16Å; F87-L113 HydrophobicContact CG-CD1 4.4Å; I109-L113 HydrophobicContact CG2-CD1 3.79Å; I109-L113 HydrophobicContact CG2-CG 4.21Å; I109-L113 WeakPolarHBondContact O-CG 3.43Å; I109-L113 PolarHBondContact O-N 3.48Å; F110-L113 HydrophobicContact CD1-CD1 4.24Å; L113-T115 PolarHBondContact O-N 3.43Å; L113-G116 PolarHBondContact O-N 2.92Å; L113-C117 PolarHBondContact O-N 2.77Å; L113-T121 HydrophobicContact CB-CG2 3.57Å; L113-T121 WeakPolarHBondContact CB-OG1 3.45Å; L113-T121 HydrophobicContact CD1-CG2 4.35Å; L113-T121 PolarHBondContact O-OG1 2.65Å
114	S	98.9	Very high	98.9	Very high	0 Å²	0	3.4 Å²	3.4	0%	0	2%	0.02	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-12.3	-178.4	-65.1	0	0	0	0	114.1	F110 A112 V118 T121 C284 F388	F110-S114 VanDerWaalsContact O-CB 3.22Å; F110-S114 WeakPolarHBondContact O-CB 3.49Å; F110-S114 PolarHBondContact O-N 2.78Å; F110-S114 VanDerWaalsContact O-N 3.11Å; F110-S114 PolarHBondContact O-OG 3.48Å; A112-S114 PolarHBondContact O-N 2.89Å; S114-V118 WeakPolarHBondContact O-CG2 3.48Å; S114-T121 PolarHBondContact N-OG1 3.48Å; S114-T121 WeakPolarHBondContact OG-CB 3.29Å; S114-T121 VanDerWaalsContact OG-CG2 3.24Å; S114-T121 WeakPolarHBondContact OG-CG2 3.4Å; S114-C284 WeakPolarHBondContact CB-O 3.49Å; S114-C284 WeakPolarHBondContact OG-CA 3.45Å; S114-C284 WeakPolarHBondContact OG-CB 3.36Å; S114-C284 PolarHBondContact OG-SG 2.75Å; S114-F388 WeakPolarHBondContact O-CE1 3.18Å
115	T	98.9	Very high	98.9	Very high	25 Å²	25	2.9 Å²	2.9	15%	0.153	2%	0.018	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-20.3	169.2	69.2	0	0	0	0	113	F54 A112 L113 G287 A291	F54-T115 HydrophobicContact CD1-CG2 4.32Å; F54-T115 HydrophobicContact CE1-CG2 3.51Å; F54-T115 HydrophobicContact CZ-CG2 4.31Å; A112-T115 WeakPolarHBondContact O-CB 3.25Å; A112-T115 PolarHBondContact O-N 3.41Å; A112-T115 VanDerWaalsContact O-N 3.1Å; A112-T115 PolarHBondContact O-OG1 3.2Å; L113-T115 PolarHBondContact O-N 3.43Å; T115-G287 WeakPolarHBondContact CG2-O 3.39Å; T115-A291 HydrophobicContact CG2-CB 4.36Å
116	G	98.8	Very high	98.9	Very high	1 Å²	1	3 Å²	3	1%	0.01	2%	0.018	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-53.2	175	0	0	0	0	0	112.7	M65 L113	M65-G116 WeakPolarHBondContact CB-O 3.2Å; L113-G116 PolarHBondContact O-N 2.92Å
117	C	98.9	Very high	98.9	Very high	0 Å²	0	3 Å²	3	0%	0	2%	0.018	C	C	.	.			trans	-156.3	112.5	174.1	179.5	0	0	0	0	111	M61 M65 W68 L113 T120 T121	M61-C117 HydrophobicContact CB-CB 4.36Å; M61-C117 HydrophobicContact CE-CB 3.9Å; M65-C117 HydrophobicContact CB-CB 4.2Å; M65-C117 HydrophobicContact CG-CB 3.9Å; M65-C117 HydrophobicContact SD-CB 4.37Å; W68-C117 HydrophobicContact CZ3-CB 4.34Å; L113-C117 PolarHBondContact O-N 2.77Å; C117-T120 PolarHBondContact SG-N 3.45Å; C117-T120 PolarHBondContact SG-OG1 3.26Å; C117-T120 VanDerWaalsContact SG-OG1 3.35Å; C117-T121 WeakPolarHBondContact O-CB 3.44Å; C117-T121 PolarHBondContact O-N 2.7Å; C117-T121 PolarHBondContact O-OG1 2.89Å
118	V	98.9	Very high	98.9	Very high	0 Å²	0	3 Å²	3	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-62.9	-49.6	179	174.6	0	0	0	0	111.4	S114 T120 T121 A122 C284 A288 F388 D391 I392 H395	S114-V118 WeakPolarHBondContact O-CG2 3.48Å; V118-T120 VanDerWaalsContact C-N 3.31Å; V118-T120 PolarHBondContact O-N 2.85Å; V118-T121 PolarHBondContact O-N 2.78Å; V118-A122 WeakPolarHBondContact O-CB 3.21Å; V118-A122 PolarHBondContact O-N 3.47Å; V118-C284 HydrophobicContact CG1-CB 4.46Å; V118-A288 HydrophobicContact CG2-CB 3.58Å; V118-F388 HydrophobicContact CG2-CD1 3.64Å; V118-F388 HydrophobicContact CG2-CE1 3.98Å; V118-D391 HydrophobicContact CB-CB 3.82Å; V118-D391 HydrophobicContact CG1-CB 3.79Å; V118-I392 HydrophobicContact CG1-CG2 3.84Å; V118-I392 HydrophobicContact CG2-CG2 4.13Å; V118-H395 WeakPolarHBondContact CG1-CE1 3.4Å
119	S	98.9	Very high	98.9	Very high	0 Å²	0	3.1 Å²	3.1	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-52.3	-48.2	-179.4	174.4	0	0	0	0	112.3	Y123 W239 N240 S241 Q242 D391	S119-Y123 PolarHBondContact O-N 2.68Å; S119-W239 WeakPolarHBondContact OG-CA 3.44Å; S119-N240 PolarHBondContact OG-N 2.97Å; S119-S241 VanDerWaalsContact CB-OG 3.27Å; S119-S241 WeakPolarHBondContact CB-OG 3.47Å; S119-S241 PolarHBondContact OG-N 2.68Å; S119-S241 VanDerWaalsContact OG-N 3.15Å; S119-S241 PolarHBondContact OG-OG 2.77Å; S119-Q242 PolarHBondContact O-NE2 3.27Å; S119-D391 WeakPolarHBondContact CB-OD2 3.47Å; S119-D391 PolarHBondContact N-OD2 2.98Å
120	T	98.9	Very high	98.9	Very high	1 Å²	1	3.1 Å²	3.1	1%	0.006	2%	0.018	C	C	.	.	H	α-helix	trans	-70.8	-42.7	-179.9	-57.9	0	0	0	0	111.4	M61 P75 M79 C117 V118 A122 Y123 I124 S241	M61-T120 HydrophobicContact CE-CG2 4.18Å; P75-T120 HydrophobicContact CG-CG2 3.62Å; M79-T120 HydrophobicContact CG-CG2 3.93Å; M79-T120 HydrophobicContact SD-CG2 4.19Å; C117-T120 PolarHBondContact SG-N 3.45Å; C117-T120 PolarHBondContact SG-OG1 3.26Å; C117-T120 VanDerWaalsContact SG-OG1 3.35Å; V118-T120 VanDerWaalsContact C-N 3.31Å; V118-T120 PolarHBondContact O-N 2.85Å; T120-A122 PolarHBondContact O-N 2.73Å; T120-Y123 WeakPolarHBondContact O-CB 3.47Å; T120-Y123 PolarHBondContact O-N 2.99Å; T120-I124 HydrophobicContact CG2-CD1 4.27Å; T120-I124 WeakPolarHBondContact O-CG1 3.32Å; T120-I124 PolarHBondContact O-N 2.99Å; T120-S241 PolarHBondContact N-OG 3.36Å; T120-S241 WeakPolarHBondContact OG1-CB 3.32Å; T120-S241 PolarHBondContact OG1-OG 3.27Å
121	T	98.9	Very high	98.9	Very high	0 Å²	0	3.1 Å²	3.1	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-62.5	-42	178.6	-52.9	0	0	0	0	112.1	M61 F110 L113 S114 C117 V118 Y123 I124 S125	M61-T121 WeakPolarHBondContact CE-OG1 3.32Å; F110-T121 HydrophobicContact CB-CG2 4.2Å; F110-T121 HydrophobicContact CD1-CG2 3.7Å; F110-T121 HydrophobicContact CG-CG2 4.3Å; L113-T121 HydrophobicContact CB-CG2 3.57Å; L113-T121 WeakPolarHBondContact CB-OG1 3.45Å; L113-T121 HydrophobicContact CD1-CG2 4.35Å; L113-T121 PolarHBondContact O-OG1 2.65Å; S114-T121 PolarHBondContact N-OG1 3.48Å; S114-T121 WeakPolarHBondContact OG-CB 3.29Å; S114-T121 VanDerWaalsContact OG-CG2 3.24Å; S114-T121 WeakPolarHBondContact OG-CG2 3.4Å; C117-T121 WeakPolarHBondContact O-CB 3.44Å; C117-T121 PolarHBondContact O-N 2.7Å; C117-T121 PolarHBondContact O-OG1 2.89Å; V118-T121 PolarHBondContact O-N 2.78Å; T121-Y123 VanDerWaalsContact C-N 3.27Å; T121-Y123 PolarHBondContact O-N 2.9Å; T121-I124 WeakPolarHBondContact O-CB 3.37Å; T121-I124 PolarHBondContact O-N 3.4Å; T121-I124 VanDerWaalsContact O-N 3.15Å; T121-S125 PolarHBondContact O-N 2.73Å
122	A	98.9	Very high	98.9	Very high	3 Å²	3	4.2 Å²	4.2	3%	0.025	2%	0.022	C	C	.	.	H	α-helix	trans	-61.6	-38	177.1	0	0	0	0	0	111.8	V118 T120 S125 I126 W239	V118-A122 WeakPolarHBondContact O-CB 3.21Å; V118-A122 PolarHBondContact O-N 3.47Å; T120-A122 PolarHBondContact O-N 2.73Å; A122-S125 WeakPolarHBondContact O-CB 3.49Å; A122-S125 PolarHBondContact O-N 3.39Å; A122-I126 WeakPolarHBondContact O-CG1 3.46Å; A122-I126 PolarHBondContact O-N 3.28Å; A122-I126 VanDerWaalsContact O-N 3.08Å; A122-W239 HydrophobicContact CB-CH2 3.82Å; A122-W239 HydrophobicContact CB-CZ2 3.29Å
123	Y	98.9	Very high	98.9	Very high	2 Å²	2	4.2 Å²	4.2	1%	0.008	2%	0.022	C	C	.	.	H	α-helix	trans	-65.4	-44.1	172.6	174.4	-93.6	0	0	0	112.4	F74 M79 S119 T120 T121 S125 I126 H127 F156 A157 T199 Q242	F74-Y123 AromaticContact CE2-CD1 3.67Å; F74-Y123 HydrophobicContact CE2-CD1 3.67Å; F74-Y123 HydrophobicContact CE2-CD2 4.17Å; F74-Y123 AromaticContact CE2-CE1 3.42Å; F74-Y123 HydrophobicContact CE2-CE1 3.42Å; F74-Y123 VanDerWaalsContact CE2-CE1 3.42Å; F74-Y123 AromaticContact CE2-CE2 3.96Å; F74-Y123 HydrophobicContact CE2-CE2 3.96Å; F74-Y123 HydrophobicContact CE2-CG 4.04Å; F74-Y123 AromaticContact CE2-CZ 3.59Å; F74-Y123 HydrophobicContact CZ-CD1 4.14Å; F74-Y123 AromaticContact CZ-CE1 3.4Å; F74-Y123 HydrophobicContact CZ-CE1 3.4Å; F74-Y123 HydrophobicContact CZ-CE2 4.09Å; F74-Y123 AromaticContact CZ-CZ 3.38Å; F74-Y123 WeakPolarHBondContact CZ-OH 3.4Å; M79-Y123 HydrophobicContact CE-CD1 4.27Å; M79-Y123 HydrophobicContact CE-CE1 4.08Å; M79-Y123 HydrophobicContact SD-CD1 3.38Å; M79-Y123 WeakPolarHBondContact SD-CD1 3.35Å; M79-Y123 HydrophobicContact SD-CE1 3.6Å; S119-Y123 PolarHBondContact O-N 2.68Å; T120-Y123 WeakPolarHBondContact O-CB 3.47Å; T120-Y123 PolarHBondContact O-N 2.99Å; T121-Y123 VanDerWaalsContact C-N 3.27Å; T121-Y123 PolarHBondContact O-N 2.9Å; Y123-S125 PolarHBondContact O-N 3.28Å; Y123-I126 PolarHBondContact O-N 3.49Å; Y123-H127 HydrophobicContact CE1-CB 4.44Å; Y123-H127 PolarHBondContact O-N 3.03Å; Y123-F156 AromaticContact CE1-CD1 3.88Å; Y123-F156 HydrophobicContact CE1-CD1 3.88Å; Y123-F156 HydrophobicContact CE1-CE1 4.4Å; Y123-F156 WeakPolarHBondContact OH-CB 3.49Å; Y123-A157 PolarHBondContact OH-O 3.23Å; Y123-T199 HydrophobicContact CE2-CG2 4.27Å; Y123-T199 WeakPolarHBondContact OH-CG2 3.49Å; Y123-Q242 HydrophobicContact CD2-CB 4.21Å; Y123-Q242 HydrophobicContact CG-CB 4.35Å
124	I	98.9	Very high	98.9	Very high	2 Å²	2	4.2 Å²	4.2	1%	0.01	2%	0.022	C	C	.	.	H	α-helix	trans	-56.4	-39.2	174.4	-64.6	169.8	0	0	0	110.4	M79 A82 F87 F110 T120 T121 H127 N128 M153	M79-I124 HydrophobicContact CG-CD1 4.25Å; M79-I124 HydrophobicContact CG-CG1 4.17Å; M79-I124 HydrophobicContact SD-CG1 4.25Å; A82-I124 HydrophobicContact CB-CD1 4.46Å; F87-I124 WeakPolarHBondContact O-CG2 3.46Å; F110-I124 HydrophobicContact CE1-CB 4.47Å; F110-I124 HydrophobicContact CE1-CG2 3.88Å; T120-I124 HydrophobicContact CG2-CD1 4.27Å; T120-I124 WeakPolarHBondContact O-CG1 3.32Å; T120-I124 PolarHBondContact O-N 2.99Å; T121-I124 WeakPolarHBondContact O-CB 3.37Å; T121-I124 PolarHBondContact O-N 3.4Å; T121-I124 VanDerWaalsContact O-N 3.15Å; I124-H127 PolarHBondContact O-N 3Å; I124-N128 WeakPolarHBondContact O-CB 3.36Å; I124-N128 PolarHBondContact O-N 2.97Å; I124-N128 PolarHBondContact O-ND2 3.19Å; I124-M153 HydrophobicContact CB-CE 4.4Å; I124-M153 HydrophobicContact CG1-CE 4.15Å; I124-M153 HydrophobicContact CG2-CE 4.05Å
125	S	98.9	Very high	98.9	Very high	8 Å²	8	4.6 Å²	4.6	6%	0.056	3%	0.025	C	C	.	.	H	α-helix	trans	-62.5	-44.3	173.6	173.2	0	0	0	0	113	T121 A122 Y123 H127 N128 M129 N280	T121-S125 PolarHBondContact O-N 2.73Å; A122-S125 WeakPolarHBondContact O-CB 3.49Å; A122-S125 PolarHBondContact O-N 3.39Å; Y123-S125 PolarHBondContact O-N 3.28Å; S125-H127 VanDerWaalsContact C-N 3.33Å; S125-N128 PolarHBondContact O-N 3.29Å; S125-M129 PolarHBondContact O-N 2.94Å; S125-N280 WeakPolarHBondContact OG-CB 3.45Å; S125-N280 PolarHBondContact OG-ND2 3.15Å; S125-N280 VanDerWaalsContact OG-ND2 3.15Å
126	I	98.9	Very high	98.9	Very high	20 Å²	20	6 Å²	6	10%	0.103	3%	0.033	C	C	.	.	H	α-helix	trans	-62.1	-44.9	177.8	-67.8	166	0	0	0	110.1	A122 Y123 N128 M129 C130 W239	A122-I126 WeakPolarHBondContact O-CG1 3.46Å; A122-I126 PolarHBondContact O-N 3.28Å; A122-I126 VanDerWaalsContact O-N 3.08Å; Y123-I126 PolarHBondContact O-N 3.49Å; I126-N128 PolarHBondContact O-N 2.97Å; I126-M129 WeakPolarHBondContact O-CB 3.4Å; I126-M129 PolarHBondContact O-N 2.81Å; I126-M129 VanDerWaalsContact O-N 3.15Å; I126-C130 PolarHBondContact O-N 3.21Å; I126-C130 PolarHBondContact O-SG 3.33Å; I126-W239 HydrophobicContact CD1-CH2 4.28Å; I126-W239 HydrophobicContact CD1-CZ3 4.06Å
127	H	98.9	Very high	98.9	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-57.2	-48.2	174.9	170.8	93.4	0	0	0	111.8	G88 Y123 I124 S125 M129 C130 N131 L150 M153 A157	G88-H127 PolarHBondContact O-CD2 3.44Å; G88-H127 VanDerWaalsContact O-CD2 3.26Å; G88-H127 PolarHBondContact O-NE2 3.39Å; Y123-H127 HydrophobicContact CE1-CB 4.44Å; Y123-H127 PolarHBondContact O-N 3.03Å; I124-H127 PolarHBondContact O-N 3Å; S125-H127 VanDerWaalsContact C-N 3.33Å; H127-M129 VanDerWaalsContact C-N 3.28Å; H127-M129 PolarHBondContact O-N 2.77Å; H127-C130 WeakPolarHBondContact O-CB 3.5Å; H127-C130 PolarHBondContact O-N 2.82Å; H127-C130 VanDerWaalsContact O-N 3.16Å; H127-N131 PolarHBondContact O-N 2.91Å; H127-L150 PolarHBondContact CE1-O 3.17Å; H127-L150 VanDerWaalsContact CE1-O 3.32Å; H127-L150 PolarHBondContact NE2-O 3.39Å; H127-M153 HydrophobicContact CB-CE 4.17Å; H127-M153 WeakPolarHBondContact CD2-CE 3.47Å; H127-A157 PolarHBondContact ND1-N 3.39Å
128	N	98.9	Very high	98.8	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-60.4	-37.2	176.1	-88.8	-98.3	0	0	0	112.1	F87 G89 I90 Y91 F110 I124 S125 I126 N131 W132	F87-N128 PolarHBondContact O-ND2 3.45Å; G89-N128 WeakPolarHBondContact CA-OD1 3.21Å; I90-N128 PolarHBondContact N-OD1 2.74Å; Y91-N128 HydrophobicContact CE1-CB 3.77Å; Y91-N128 VanDerWaalsContact OH-C 3.29Å; F110-N128 HydrophobicContact CZ-CB 4.41Å; I124-N128 WeakPolarHBondContact O-CB 3.36Å; I124-N128 PolarHBondContact O-N 2.97Å; I124-N128 PolarHBondContact O-ND2 3.19Å; S125-N128 PolarHBondContact O-N 3.29Å; I126-N128 PolarHBondContact O-N 2.97Å; N128-N131 PolarHBondContact O-N 3.03Å; N128-W132 VanDerWaalsContact O-CB 3.26Å; N128-W132 WeakPolarHBondContact O-CB 3.25Å; N128-W132 PolarHBondContact O-N 3.5Å
129	M	98.8	Very high	98.8	Very high	2 Å²	2	12.1 Å²	12.1	1%	0.01	7%	0.068	C	C	.	.	H	α-helix	trans	-64.1	-43.4	175.2	-177.7	-178.7	69.1	0	0	111.7	Y91 S125 I126 H127 W132 M133 Y159	Y91-M129 VanDerWaalsContact OH-CA 3.32Å; Y91-M129 WeakPolarHBondContact OH-CA 3.26Å; Y91-M129 PolarHBondContact OH-N 3.27Å; Y91-M129 VanDerWaalsContact OH-N 3.09Å; S125-M129 PolarHBondContact O-N 2.94Å; I126-M129 WeakPolarHBondContact O-CB 3.4Å; I126-M129 PolarHBondContact O-N 2.81Å; I126-M129 VanDerWaalsContact O-N 3.15Å; H127-M129 VanDerWaalsContact C-N 3.28Å; H127-M129 PolarHBondContact O-N 2.77Å; M129-W132 PolarHBondContact O-N 3.27Å; M129-M133 HydrophobicContact CE-CE 4.32Å; M129-M133 HydrophobicContact CG-CE 3.92Å; M129-M133 WeakPolarHBondContact O-CG 3.33Å; M129-M133 PolarHBondContact O-N 3Å; M129-M133 HydrophobicContact SD-CE 4.02Å; M129-Y159 HydrophobicContact CE-CD1 3.46Å; M129-Y159 VanDerWaalsContact CE-CD1 3.46Å; M129-Y159 HydrophobicContact CE-CD2 4.11Å; M129-Y159 HydrophobicContact CE-CE1 3.99Å; M129-Y159 HydrophobicContact CE-CG 3.52Å
130	C	98.9	Very high	98.8	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-60.5	-48.9	175.4	-69.4	0	0	0	0	111.8	I126 H127 W132 M133 I134 A157 Y159 I203	I126-C130 PolarHBondContact O-N 3.21Å; I126-C130 PolarHBondContact O-SG 3.33Å; H127-C130 WeakPolarHBondContact O-CB 3.5Å; H127-C130 PolarHBondContact O-N 2.82Å; H127-C130 VanDerWaalsContact O-N 3.16Å; C130-W132 PolarHBondContact O-N 3.36Å; C130-M133 WeakPolarHBondContact O-CB 3.28Å; C130-M133 PolarHBondContact O-N 3.4Å; C130-I134 PolarHBondContact O-N 2.89Å; C130-A157 HydrophobicContact CB-CB 3.55Å; C130-Y159 PolarHBondContact SG-N 3.1Å; C130-I203 HydrophobicContact CB-CD1 4.49Å; C130-I203 HydrophobicContact CB-CG1 3.64Å
131	N	98.8	Very high	98.8	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.9	-46	179.6	-165.5	-4.3	0	0	0	111.1	V92 H127 N128 M133 I134 D135 C147 L150 C151	V92-N131 HydrophobicContact CG2-CB 3.93Å; H127-N131 PolarHBondContact O-N 2.91Å; N128-N131 PolarHBondContact O-N 3.03Å; N131-M133 VanDerWaalsContact C-N 3.31Å; N131-M133 PolarHBondContact O-N 3.17Å; N131-I134 PolarHBondContact O-N 2.89Å; N131-I134 VanDerWaalsContact O-N 3.11Å; N131-D135 WeakPolarHBondContact O-CB 3.38Å; N131-D135 PolarHBondContact O-N 3.25Å; N131-C147 WeakPolarHBondContact OD1-CA 3.35Å; N131-C147 WeakPolarHBondContact OD1-CB 3.23Å; N131-C147 PolarHBondContact OD1-SG 2.75Å; N131-C147 VanDerWaalsContact OD1-SG 3.34Å; N131-L150 HydrophobicContact CB-CB 4.2Å; N131-L150 HydrophobicContact CB-CD1 4.17Å; N131-L150 WeakPolarHBondContact ND2-CB 3.35Å; N131-C151 PolarHBondContact ND2-N 3.2Å; N131-C151 PolarHBondContact ND2-SG 3.36Å
132	W	98.8	Very high	98.7	Very high	24 Å²	24	22.4 Å²	22.4	9%	0.091	12%	0.121	C	C	.	.	H	α-helix	trans	-60.4	-35.5	174.9	171.8	81.5	0	0	0	114	Y91 V92 N128 M129 C130 I134 D135 T136 F137 R272	Y91-W132 HydrophobicContact CD2-CB 3.74Å; Y91-W132 AromaticContact CD2-CD1 3.47Å; Y91-W132 VanDerWaalsContact CD2-CD1 3.47Å; Y91-W132 AromaticContact CD2-CG 3.63Å; Y91-W132 HydrophobicContact CD2-CG 3.63Å; Y91-W132 HydrophobicContact CE2-CB 3.31Å; Y91-W132 AromaticContact CE2-CD1 3.79Å; Y91-W132 HydrophobicContact CE2-CD2 4.2Å; Y91-W132 AromaticContact CE2-CG 3.43Å; Y91-W132 HydrophobicContact CE2-CG 3.43Å; Y91-W132 VanDerWaalsContact CE2-CG 3.43Å; V92-W132 HydrophobicContact CG2-CB 4.45Å; N128-W132 VanDerWaalsContact O-CB 3.26Å; N128-W132 WeakPolarHBondContact O-CB 3.25Å; N128-W132 PolarHBondContact O-N 3.5Å; M129-W132 PolarHBondContact O-N 3.27Å; C130-W132 PolarHBondContact O-N 3.36Å; W132-I134 VanDerWaalsContact C-N 3.34Å; W132-D135 PolarHBondContact O-N 3.48Å; W132-T136 VanDerWaalsContact CE2-OG1 3.26Å; W132-T136 HydrophobicContact CZ2-CG2 4.09Å; W132-T136 PolarHBondContact NE1-OG1 3.35Å; W132-T136 WeakPolarHBondContact O-CB 3.37Å; W132-T136 PolarHBondContact O-N 2.76Å; W132-T136 PolarHBondContact O-OG1 3Å; W132-F137 AromaticContact CH2-CE2 3.64Å; W132-F137 HydrophobicContact CH2-CE2 3.64Å; W132-F137 HydrophobicContact CH2-CZ 4.05Å; W132-F137 HydrophobicContact CZ2-CE2 4.31Å; W132-F137 AromaticContact CZ3-CE2 3.84Å; W132-F137 HydrophobicContact CZ3-CE2 3.84Å; W132-R272 HydrophobicContact CH2-CB 3.87Å
133	M	98.9	Very high	98.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.9	-41.2	175.3	-75.8	-178.4	-177.7	0	0	111.3	M129 C130 N131 F137 Y159 I203 M205 L260 I269	M129-M133 HydrophobicContact CE-CE 4.32Å; M129-M133 HydrophobicContact CG-CE 3.92Å; M129-M133 WeakPolarHBondContact O-CG 3.33Å; M129-M133 PolarHBondContact O-N 3Å; M129-M133 HydrophobicContact SD-CE 4.02Å; C130-M133 WeakPolarHBondContact O-CB 3.28Å; C130-M133 PolarHBondContact O-N 3.4Å; N131-M133 VanDerWaalsContact C-N 3.31Å; N131-M133 PolarHBondContact O-N 3.17Å; M133-F137 WeakPolarHBondContact O-CB 3.19Å; M133-F137 WeakPolarHBondContact O-CD2 3.31Å; M133-F137 PolarHBondContact O-N 2.93Å; M133-F137 VanDerWaalsContact O-N 3.12Å; M133-Y159 HydrophobicContact CE-CD2 4.22Å; M133-Y159 HydrophobicContact CE-CE2 3.71Å; M133-Y159 HydrophobicContact SD-CD2 4.17Å; M133-Y159 HydrophobicContact SD-CE2 3.91Å; M133-I203 HydrophobicContact SD-CG2 3.9Å; M133-M205 HydrophobicContact SD-CE 4.27Å; M133-L260 HydrophobicContact CB-CD1 4.49Å; M133-I269 HydrophobicContact CB-CG2 4.41Å; M133-I269 HydrophobicContact CG-CG2 4.07Å; M133-I269 HydrophobicContact SD-CG2 4.1Å
134	I	98.9	Very high	98.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-66.6	-49.1	175.2	-58.3	173.7	0	0	0	109.8	C130 N131 W132 T136 G138 Q142 F146 L150 V201 I203 V220 L260	C130-I134 PolarHBondContact O-N 2.89Å; N131-I134 PolarHBondContact O-N 2.89Å; N131-I134 VanDerWaalsContact O-N 3.11Å; W132-I134 VanDerWaalsContact C-N 3.34Å; I134-T136 VanDerWaalsContact C-N 3.32Å; I134-T136 PolarHBondContact O-N 3.13Å; I134-G138 VanDerWaalsContact O-CA 3.22Å; I134-G138 WeakPolarHBondContact O-CA 3.31Å; I134-G138 PolarHBondContact O-N 3Å; I134-Q142 HydrophobicContact CG2-CB 4.41Å; I134-F146 HydrophobicContact CD1-CB 3.66Å; I134-F146 HydrophobicContact CD1-CD2 4.27Å; I134-F146 HydrophobicContact CD1-CG 4.09Å; I134-F146 HydrophobicContact CG2-CB 4.21Å; I134-F146 HydrophobicContact CG2-CD2 4.26Å; I134-L150 HydrophobicContact CD1-CD1 3.91Å; I134-V201 HydrophobicContact CD1-CG1 4.4Å; I134-I203 HydrophobicContact CD1-CD1 3.84Å; I134-I203 HydrophobicContact CG1-CD1 3.78Å; I134-V220 HydrophobicContact CD1-CG2 4.4Å; I134-V220 HydrophobicContact CG1-CG2 4.27Å; I134-L260 HydrophobicContact CG1-CD1 4.04Å; I134-L260 HydrophobicContact CG2-CD2 4.46Å
135	D	98.8	Very high	98.7	Very high	9 Å²	9	35 Å²	35	5%	0.048	18%	0.176	C	C	.	.	H	α-helix	trans	-58.5	-42.1	-178.7	-177.8	37.5	0	0	0	113	V92 Q93 N131 W132 R143	V92-D135 HydrophobicContact CG1-CB 4Å; Q93-D135 WeakPolarHBondContact CG-OD2 3.37Å; Q93-D135 PolarHBondContact N-OD2 3.46Å; N131-D135 WeakPolarHBondContact O-CB 3.38Å; N131-D135 PolarHBondContact O-N 3.25Å; W132-D135 PolarHBondContact O-N 3.48Å; D135-R143 VanDerWaalsContact O-CD 3.3Å; D135-R143 WeakPolarHBondContact O-CD 3.38Å; D135-R143 PolarHBondContact O-NE 3.36Å; D135-R143 VanDerWaalsContact O-NE 3.13Å; D135-R143 IonicContact OD1-CZ 3.42Å; D135-R143 VanDerWaalsContact OD1-CZ 3.26Å; D135-R143 IonicContact OD1-NE 2.7Å; D135-R143 PolarHBondContact OD1-NE 2.98Å; D135-R143 IonicContact OD1-NH2 3.1Å; D135-R143 PolarHBondContact OD1-NH2 3Å
136	T	98.6	Very high	98.7	Very high	53 Å²	53	34.8 Å²	34.8	33%	0.325	17%	0.174	S	C	.	.	H	α-helix	trans	-82.7	-33.9	-174.1	-59.1	0	0	0	0	113.5	W132 I134	W132-T136 VanDerWaalsContact CE2-OG1 3.26Å; W132-T136 HydrophobicContact CZ2-CG2 4.09Å; W132-T136 PolarHBondContact NE1-OG1 3.35Å; W132-T136 WeakPolarHBondContact O-CB 3.37Å; W132-T136 PolarHBondContact O-N 2.76Å; W132-T136 PolarHBondContact O-OG1 3Å; I134-T136 VanDerWaalsContact C-N 3.32Å; I134-T136 PolarHBondContact O-N 3.13Å
137	F	98.7	Very high	98.7	Very high	40 Å²	40	33.8 Å²	33.8	18%	0.175	17%	0.169	C	C	.	.	H	α-helix	trans	-118.2	-7.9	-170.5	-57.1	-77.3	0	0	0	114.1	W132 M133 L260 G261 I269 R272	W132-F137 AromaticContact CH2-CE2 3.64Å; W132-F137 HydrophobicContact CH2-CE2 3.64Å; W132-F137 HydrophobicContact CH2-CZ 4.05Å; W132-F137 HydrophobicContact CZ2-CE2 4.31Å; W132-F137 AromaticContact CZ3-CE2 3.84Å; W132-F137 HydrophobicContact CZ3-CE2 3.84Å; M133-F137 WeakPolarHBondContact O-CB 3.19Å; M133-F137 WeakPolarHBondContact O-CD2 3.31Å; M133-F137 PolarHBondContact O-N 2.93Å; M133-F137 VanDerWaalsContact O-N 3.12Å; F137-L260 HydrophobicContact CB-CB 4.49Å; F137-G261 PolarHBondContact O-N 3.44Å; F137-I269 HydrophobicContact CB-CD1 4.07Å; F137-I269 HydrophobicContact CB-CG1 4.32Å; F137-I269 HydrophobicContact CD1-CD1 4.36Å; F137-I269 HydrophobicContact CD1-CG1 3.84Å; F137-I269 HydrophobicContact CD2-CB 4.37Å; F137-I269 HydrophobicContact CD2-CG1 4.01Å; F137-I269 HydrophobicContact CD2-CG2 3.71Å; F137-I269 HydrophobicContact CE1-CG1 4.07Å; F137-I269 HydrophobicContact CE2-CB 4.39Å; F137-I269 HydrophobicContact CE2-CG1 4.27Å; F137-I269 HydrophobicContact CE2-CG2 3.9Å; F137-I269 HydrophobicContact CG-CD1 4.1Å; F137-I269 HydrophobicContact CG-CG1 3.8Å; F137-I269 HydrophobicContact CG-CG2 4.3Å; F137-I269 HydrophobicContact CZ-CG1 4.29Å; F137-R272 HydrophobicContact CZ-CB 4.2Å
138	G	98.4	Very high	98.7	Very high	16 Å²	16	36.2 Å²	36.2	17%	0.165	19%	0.185	C	C	.	.	S	Bend	trans	-79.8	156.8	174.6	0	0	0	0	0	112.4	I134	I134-G138 VanDerWaalsContact O-CA 3.22Å; I134-G138 WeakPolarHBondContact O-CA 3.31Å; I134-G138 PolarHBondContact O-N 3Å
139	N	98.4	Very high	98.6	Very high	75 Å²	75	39.9 Å²	39.9	40%	0.401	20%	0.202	S	C	.	.			trans	-75.1	173.3	165.5	63.7	24.5	0	0	0	110.9	E141 Q142 R143	N139-E141 VanDerWaalsContact C-N 3.29Å; N139-E141 PolarHBondContact O-N 3.09Å; N139-E141 PolarHBondContact OD1-N 3.32Å; N139-E141 PolarHBondContact OD1-OE2 3.28Å; N139-Q142 PolarHBondContact O-N 3.11Å; N139-Q142 WeakPolarHBondContact OD1-CB 3.2Å; N139-Q142 WeakPolarHBondContact OD1-CG 3.42Å; N139-Q142 PolarHBondContact OD1-N 2.68Å; N139-Q142 PolarHBondContact OD1-OE1 3.43Å; N139-R143 VanDerWaalsContact O-CG 3.26Å; N139-R143 WeakPolarHBondContact O-CG 3.36Å; N139-R143 PolarHBondContact O-N 3.4Å
140	T	98.4	Very high	98.6	Very high	79 Å²	79	39.8 Å²	39.8	49%	0.485	20%	0.202	S	C	.	.	H	α-helix	trans	-53.1	-46.3	-179	-56.1	0	0	0	0	112.1	Q142 R143 E144	T140-Q142 PolarHBondContact O-N 2.96Å; T140-R143 PolarHBondContact O-N 2.98Å; T140-E144 HydrophobicContact CG2-CG 4.29Å; T140-E144 WeakPolarHBondContact CG2-OE1 3.4Å; T140-E144 WeakPolarHBondContact O-CB 3.46Å; T140-E144 WeakPolarHBondContact O-CG 3.02Å; T140-E144 PolarHBondContact O-N 3.03Å
141	E	98.3	Very high	98.6	Very high	128 Å²	128	40.1 Å²	40.1	60%	0.598	20%	0.204	S	C	*	.	H	α-helix	trans	-64	-40.1	-177.8	-62.2	80.7	179.8	0	0	112.3	N139 K145	N139-E141 VanDerWaalsContact C-N 3.29Å; N139-E141 PolarHBondContact O-N 3.09Å; N139-E141 PolarHBondContact OD1-N 3.32Å; N139-E141 PolarHBondContact OD1-OE2 3.28Å; E141-K145 WeakPolarHBondContact O-CB 3.09Å; E141-K145 PolarHBondContact O-N 3.13Å
142	Q	98.6	Very high	98.6	Very high	10 Å²	10	43.2 Å²	43.2	5%	0.047	22%	0.223	C	C	.	.	H	α-helix	trans	-66.4	-43.8	175.8	-72.7	166.1	-26.8	0	0	111.4	I134 N139 T140 K145 F146 T257 R259	I134-Q142 HydrophobicContact CG2-CB 4.41Å; N139-Q142 PolarHBondContact O-N 3.11Å; N139-Q142 WeakPolarHBondContact OD1-CB 3.2Å; N139-Q142 WeakPolarHBondContact OD1-CG 3.42Å; N139-Q142 PolarHBondContact OD1-N 2.68Å; N139-Q142 PolarHBondContact OD1-OE1 3.43Å; T140-Q142 PolarHBondContact O-N 2.96Å; Q142-K145 PolarHBondContact O-N 2.87Å; Q142-F146 HydrophobicContact CB-CD2 4.47Å; Q142-F146 VanDerWaalsContact O-CD2 3.23Å; Q142-F146 WeakPolarHBondContact O-CD2 3.16Å; Q142-F146 PolarHBondContact O-N 3Å; Q142-T257 PolarHBondContact NE2-O 3.01Å; Q142-R259 PolarHBondContact NE2-O 3.43Å
143	R	98.8	Very high	98.6	Very high	46 Å²	46	42.1 Å²	42.1	17%	0.174	22%	0.219	C	C	.	.	H	α-helix	trans	-62.3	-49.3	179.2	-66.3	176.6	67.1	-143.1	5.2	110.8	E95 V96 D135 N139 T140 K145 C147 P148	E95-R143 IonicContact OE1-CZ 3.41Å; E95-R143 IonicContact OE1-NH1 2.75Å; E95-R143 IonicContact OE1-NH2 3.45Å; E95-R143 PolarHBondContact OE1-NH2 3.03Å; V96-R143 HydrophobicContact CG1-CB 4.14Å; D135-R143 VanDerWaalsContact O-CD 3.3Å; D135-R143 WeakPolarHBondContact O-CD 3.38Å; D135-R143 PolarHBondContact O-NE 3.36Å; D135-R143 VanDerWaalsContact O-NE 3.13Å; D135-R143 IonicContact OD1-CZ 3.42Å; D135-R143 VanDerWaalsContact OD1-CZ 3.26Å; D135-R143 IonicContact OD1-NE 2.7Å; D135-R143 PolarHBondContact OD1-NE 2.98Å; D135-R143 IonicContact OD1-NH2 3.1Å; D135-R143 PolarHBondContact OD1-NH2 3Å; N139-R143 VanDerWaalsContact O-CG 3.26Å; N139-R143 WeakPolarHBondContact O-CG 3.36Å; N139-R143 PolarHBondContact O-N 3.4Å; T140-R143 PolarHBondContact O-N 2.98Å; R143-K145 VanDerWaalsContact C-N 3.34Å; R143-K145 PolarHBondContact O-N 2.83Å; R143-C147 VanDerWaalsContact O-CB 3.23Å; R143-C147 WeakPolarHBondContact O-CB 3.16Å; R143-C147 PolarHBondContact O-N 3.01Å; R143-C147 PolarHBondContact O-SG 3.2Å; R143-P148 WeakPolarHBondContact O-CD 3.38Å
144	E	98.4	Very high	98.6	Very high	128 Å²	128	46.3 Å²	46.3	60%	0.598	24%	0.241	S	C	*	.	H	α-helix	trans	-65.8	-35	178.6	-70.6	176.9	174.6	0	0	112.6	T140 P148	T140-E144 HydrophobicContact CG2-CG 4.29Å; T140-E144 WeakPolarHBondContact CG2-OE1 3.4Å; T140-E144 WeakPolarHBondContact O-CB 3.46Å; T140-E144 WeakPolarHBondContact O-CG 3.02Å; T140-E144 PolarHBondContact O-N 3.03Å; E144-P148 WeakPolarHBondContact O-CD 3.44Å
145	K	98.3	Very high	98.6	Very high	96 Å²	96	49.3 Å²	49.3	42%	0.417	25%	0.254	S	S	.	.	H	α-helix	trans	-68.8	-46.1	178.4	178.5	178.7	173.4	-174.3	0	112.8	E141 Q142 R143 E222	E141-K145 WeakPolarHBondContact O-CB 3.09Å; E141-K145 PolarHBondContact O-N 3.13Å; Q142-K145 PolarHBondContact O-N 2.87Å; R143-K145 VanDerWaalsContact C-N 3.34Å; R143-K145 PolarHBondContact O-N 2.83Å; K145-E222 IonicContact NZ-OE1 3.76Å; K145-E222 IonicContact NZ-OE2 3.58Å; K145-E222 PolarHBondContact NZ-OE2 3.18Å
146	F	98.7	Very high	98.6	Very high	4 Å²	4	49 Å²	49	2%	0.018	25%	0.253	C	S	.	.	H	α-helix	trans	-105.5	-42.7	-166.5	-63.2	-65.7	0	0	0	113.9	I134 Q142 L150 V201 V220 E222	I134-F146 HydrophobicContact CD1-CB 3.66Å; I134-F146 HydrophobicContact CD1-CD2 4.27Å; I134-F146 HydrophobicContact CD1-CG 4.09Å; I134-F146 HydrophobicContact CG2-CB 4.21Å; I134-F146 HydrophobicContact CG2-CD2 4.26Å; Q142-F146 HydrophobicContact CB-CD2 4.47Å; Q142-F146 VanDerWaalsContact O-CD2 3.23Å; Q142-F146 WeakPolarHBondContact O-CD2 3.16Å; Q142-F146 PolarHBondContact O-N 3Å; F146-L150 HydrophobicContact CB-CD1 4.48Å; F146-L150 VanDerWaalsContact O-CG 3.32Å; F146-L150 WeakPolarHBondContact O-CG 3.43Å; F146-L150 PolarHBondContact O-N 2.68Å; F146-V201 HydrophobicContact CD1-CG1 4.5Å; F146-V201 HydrophobicContact CD1-CG2 4.33Å; F146-V220 HydrophobicContact CD1-CG1 4.41Å; F146-V220 HydrophobicContact CD2-CG1 4.38Å; F146-V220 HydrophobicContact CE1-CG1 3.95Å; F146-V220 HydrophobicContact CE2-CB 4.23Å; F146-V220 HydrophobicContact CE2-CG1 3.93Å; F146-V220 HydrophobicContact CE2-CG2 4.43Å; F146-V220 HydrophobicContact CZ-CB 4.27Å; F146-V220 HydrophobicContact CZ-CG1 3.69Å; F146-E222 HydrophobicContact CE1-CG 3.84Å; F146-E222 HydrophobicContact CZ-CG 4.36Å
147	C	98.8	Very high	98.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.3	-41.9	-168.1	-61.2	0	0	0	0	113.7	V96 N131 R143 E149 L150 C151	V96-C147 HydrophobicContact CB-CB 3.78Å; V96-C147 HydrophobicContact CG2-CB 3.63Å; N131-C147 WeakPolarHBondContact OD1-CA 3.35Å; N131-C147 WeakPolarHBondContact OD1-CB 3.23Å; N131-C147 PolarHBondContact OD1-SG 2.75Å; N131-C147 VanDerWaalsContact OD1-SG 3.34Å; R143-C147 VanDerWaalsContact O-CB 3.23Å; R143-C147 WeakPolarHBondContact O-CB 3.16Å; R143-C147 PolarHBondContact O-N 3.01Å; R143-C147 PolarHBondContact O-SG 3.2Å; C147-E149 PolarHBondContact O-N 2.77Å; C147-L150 PolarHBondContact O-N 3.15Å; C147-C151 WeakPolarHBondContact O-CB 3.43Å; C147-C151 PolarHBondContact O-N 3.4Å; C147-C151 PolarHBondContact O-SG 2.89Å
148	P	98.8	Very high	98.7	Very high	51 Å²	51	44.6 Å²	44.6	33%	0.331	23%	0.229	S	C	.	.	H	α-helix	trans	-58.6	-49.1	-177.1	-27.7	36.3	0	0	0	113.9	R143 E144 L150 C151 T152	R143-P148 WeakPolarHBondContact O-CD 3.38Å; E144-P148 WeakPolarHBondContact O-CD 3.44Å; P148-L150 VanDerWaalsContact C-N 3.26Å; P148-L150 PolarHBondContact O-N 2.65Å; P148-C151 PolarHBondContact O-N 3.46Å; P148-T152 PolarHBondContact O-N 3.33Å; P148-T152 VanDerWaalsContact O-N 3.13Å; P148-T152 PolarHBondContact O-OG1 3.05Å
149	E	98.6	Very high	98.7	Very high	76 Å²	76	45 Å²	45	36%	0.355	23%	0.226	S	C	.	.	H	α-helix	trans	-70	-24	-179.8	-65.5	-174.6	139.3	0	0	112.7	C147 T152 M153 D154 K155	C147-E149 PolarHBondContact O-N 2.77Å; E149-T152 PolarHBondContact O-OG1 3.47Å; E149-M153 PolarHBondContact O-N 3.41Å; E149-D154 HydrophobicContact CB-CB 4.45Å; E149-D154 PolarHBondContact O-N 3.5Å; E149-K155 HydrophobicContact CB-CB 4.18Å; E149-K155 HydrophobicContact CB-CD 4.4Å; E149-K155 HydrophobicContact CB-CG 4.27Å; E149-K155 PolarHBondContact O-N 3.35Å; E149-K155 WeakPolarHBondContact OE2-CD 3.37Å; E149-K155 WeakPolarHBondContact OE2-CE 3.22Å; E149-K155 IonicContact OE2-NZ 3.47Å; E149-K155 PolarHBondContact OE2-NZ 3.13Å
150	L	98.9	Very high	98.7	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-75.6	-43.8	171.2	-65.2	177.8	0	0	0	110.6	H127 N131 I134 F146 C147 P148 T152 M153 K155 A157 V201	H127-L150 PolarHBondContact CE1-O 3.17Å; H127-L150 VanDerWaalsContact CE1-O 3.32Å; H127-L150 PolarHBondContact NE2-O 3.39Å; N131-L150 HydrophobicContact CB-CB 4.2Å; N131-L150 HydrophobicContact CB-CD1 4.17Å; N131-L150 WeakPolarHBondContact ND2-CB 3.35Å; I134-L150 HydrophobicContact CD1-CD1 3.91Å; F146-L150 HydrophobicContact CB-CD1 4.48Å; F146-L150 VanDerWaalsContact O-CG 3.32Å; F146-L150 WeakPolarHBondContact O-CG 3.43Å; F146-L150 PolarHBondContact O-N 2.68Å; C147-L150 PolarHBondContact O-N 3.15Å; P148-L150 VanDerWaalsContact C-N 3.26Å; P148-L150 PolarHBondContact O-N 2.65Å; L150-T152 VanDerWaalsContact C-N 3.26Å; L150-T152 PolarHBondContact O-N 2.8Å; L150-M153 WeakPolarHBondContact O-CA 3.47Å; L150-M153 PolarHBondContact O-N 2.95Å; L150-K155 HydrophobicContact CD2-CB 4.1Å; L150-K155 WeakPolarHBondContact CD2-O 3.44Å; L150-A157 HydrophobicContact CD1-CB 4.33Å; L150-A157 HydrophobicContact CD2-CB 3.8Å; L150-V201 HydrophobicContact CD2-CB 4.44Å; L150-V201 HydrophobicContact CD2-CG2 4.22Å
151	C	98.9	Very high	98.7	Very high	7 Å²	7	38.3 Å²	38.3	5%	0.047	19%	0.187	C	C	.	.	H	α-helix	trans	-58.4	-37.2	177.4	-71.2	0	0	0	0	112.5	G88 G97 N131 C147 P148 M153	G88-C151 WeakPolarHBondContact CA-O 3.16Å; G97-C151 VanDerWaalsContact C-SG 3.57Å; G97-C151 WeakPolarHBondContact O-CB 3.02Å; N131-C151 PolarHBondContact ND2-N 3.2Å; N131-C151 PolarHBondContact ND2-SG 3.36Å; C147-C151 WeakPolarHBondContact O-CB 3.43Å; C147-C151 PolarHBondContact O-N 3.4Å; C147-C151 PolarHBondContact O-SG 2.89Å; P148-C151 PolarHBondContact O-N 3.46Å; C151-M153 VanDerWaalsContact C-N 3.32Å
152	T	98.8	Very high	98.7	Very high	65 Å²	65	34.5 Å²	34.5	40%	0.399	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-9.8	174.9	60.5	0	0	0	0	113.6	A83 P148 E149 L150 D154	A83-T152 WeakPolarHBondContact CB-O 3.06Å; P148-T152 PolarHBondContact O-N 3.33Å; P148-T152 VanDerWaalsContact O-N 3.13Å; P148-T152 PolarHBondContact O-OG1 3.05Å; E149-T152 PolarHBondContact O-OG1 3.47Å; L150-T152 VanDerWaalsContact C-N 3.26Å; L150-T152 PolarHBondContact O-N 2.8Å; T152-D154 WeakPolarHBondContact CB-OD2 3.38Å; T152-D154 PolarHBondContact O-N 2.81Å; T152-D154 PolarHBondContact OG1-N 3.47Å; T152-D154 PolarHBondContact OG1-OD2 3.16Å
153	M	98.8	Very high	98.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	30.2	-168.3	-68.7	-176.7	157.2	0	0	113.3	M79 R80 A83 I124 H127 E149 L150 C151 K155 F156	M79-M153 HydrophobicContact CB-SD 3.72Å; R80-M153 HydrophobicContact CG-CB 4.08Å; R80-M153 VanDerWaalsContact CG-O 3.27Å; R80-M153 WeakPolarHBondContact CG-O 3.35Å; R80-M153 PolarHBondContact NE-O 3.09Å; A83-M153 HydrophobicContact CB-CB 3.87Å; A83-M153 HydrophobicContact CB-CG 3.83Å; A83-M153 HydrophobicContact CB-SD 4.06Å; I124-M153 HydrophobicContact CB-CE 4.4Å; I124-M153 HydrophobicContact CG1-CE 4.15Å; I124-M153 HydrophobicContact CG2-CE 4.05Å; H127-M153 HydrophobicContact CB-CE 4.17Å; H127-M153 WeakPolarHBondContact CD2-CE 3.47Å; E149-M153 PolarHBondContact O-N 3.41Å; L150-M153 WeakPolarHBondContact O-CA 3.47Å; L150-M153 PolarHBondContact O-N 2.95Å; C151-M153 VanDerWaalsContact C-N 3.32Å; M153-K155 WeakPolarHBondContact CA-O 3.33Å; M153-F156 HydrophobicContact CB-CD1 4.46Å; M153-F156 HydrophobicContact CB-CE1 3.81Å; M153-F156 HydrophobicContact CB-CZ 3.88Å; M153-F156 HydrophobicContact CE-CE1 4.47Å; M153-F156 HydrophobicContact CG-CD1 4.45Å; M153-F156 HydrophobicContact CG-CE1 4Å; M153-F156 WeakPolarHBondContact O-CE2 3.5Å; M153-F156 HydrophobicContact SD-CE1 3.87Å
154	D	98.6	Very high	98.7	Very high	89 Å²	89	37.2 Å²	37.2	48%	0.476	20%	0.195	S	C	.	.	S	Bend	trans	-65.2	-39.5	164.2	-72.1	-40.4	0	0	0	109.5	R80 E149 T152	R80-D154 PolarHBondContact NH2-O 2.82Å; E149-D154 HydrophobicContact CB-CB 4.45Å; E149-D154 PolarHBondContact O-N 3.5Å; T152-D154 WeakPolarHBondContact CB-OD2 3.38Å; T152-D154 PolarHBondContact O-N 2.81Å; T152-D154 PolarHBondContact OG1-N 3.47Å; T152-D154 PolarHBondContact OG1-OD2 3.16Å
155	K	98.8	Very high	98.6	Very high	62 Å²	62	34.6 Å²	34.6	27%	0.27	20%	0.203	S	C	.	.	S	Bend	trans	-110.9	153.6	165.3	-74.5	-173.1	-176.3	154.4	0	111.7	E149 L150 M153 D200 V201	E149-K155 HydrophobicContact CB-CB 4.18Å; E149-K155 HydrophobicContact CB-CD 4.4Å; E149-K155 HydrophobicContact CB-CG 4.27Å; E149-K155 PolarHBondContact O-N 3.35Å; E149-K155 WeakPolarHBondContact OE2-CD 3.37Å; E149-K155 WeakPolarHBondContact OE2-CE 3.22Å; E149-K155 IonicContact OE2-NZ 3.47Å; E149-K155 PolarHBondContact OE2-NZ 3.13Å; L150-K155 HydrophobicContact CD2-CB 4.1Å; L150-K155 WeakPolarHBondContact CD2-O 3.44Å; M153-K155 WeakPolarHBondContact CA-O 3.33Å; K155-D200 VanDerWaalsContact CA-OD2 3.29Å; K155-D200 WeakPolarHBondContact CA-OD2 3.44Å; K155-D200 HydrophobicContact CB-CB 3.91Å; K155-D200 HydrophobicContact CD-CB 3.95Å; K155-D200 HydrophobicContact CG-CB 3.84Å; K155-V201 HydrophobicContact CD-CG2 4.46Å
156	F	98.9	Very high	98.4	Very high	4 Å²	4	30.1 Å²	30.1	2%	0.018	18%	0.184	C	C	.	.			trans	-117.5	157	177.7	-70.3	-84.9	0	0	0	111.9	F74 V76 M79 R80 Y123 M153 T199 D200 V201	F74-F156 HydrophobicContact CE1-CD1 4.47Å; F74-F156 HydrophobicContact CE1-CD2 4.45Å; F74-F156 HydrophobicContact CE1-CG 4.3Å; F74-F156 HydrophobicContact CZ-CD1 4.09Å; F74-F156 HydrophobicContact CZ-CE1 4.44Å; F74-F156 HydrophobicContact CZ-CG 4.28Å; V76-F156 HydrophobicContact CB-CE2 4.4Å; V76-F156 HydrophobicContact CB-CZ 4.39Å; V76-F156 HydrophobicContact CG1-CE2 3.77Å; V76-F156 HydrophobicContact CG1-CZ 3.99Å; V76-F156 HydrophobicContact CG2-CE2 4.13Å; V76-F156 HydrophobicContact CG2-CZ 4.34Å; M79-F156 HydrophobicContact CB-CE1 3.94Å; M79-F156 HydrophobicContact CB-CZ 4.23Å; M79-F156 HydrophobicContact CE-CD1 4.36Å; M79-F156 HydrophobicContact CE-CE1 3.65Å; M79-F156 HydrophobicContact CE-CZ 4.04Å; M79-F156 HydrophobicContact SD-CE1 4.14Å; R80-F156 HydrophobicContact CG-CZ 4.4Å; Y123-F156 AromaticContact CE1-CD1 3.88Å; Y123-F156 HydrophobicContact CE1-CD1 3.88Å; Y123-F156 HydrophobicContact CE1-CE1 4.4Å; Y123-F156 WeakPolarHBondContact OH-CB 3.49Å; M153-F156 HydrophobicContact CB-CD1 4.46Å; M153-F156 HydrophobicContact CB-CE1 3.81Å; M153-F156 HydrophobicContact CB-CZ 3.88Å; M153-F156 HydrophobicContact CE-CE1 4.47Å; M153-F156 HydrophobicContact CG-CD1 4.45Å; M153-F156 HydrophobicContact CG-CE1 4Å; M153-F156 WeakPolarHBondContact O-CE2 3.5Å; M153-F156 HydrophobicContact SD-CE1 3.87Å; F156-T199 HydrophobicContact CB-CG2 3.67Å; F156-D200 PolarHBondContact N-OD2 3.34Å; F156-D200 PolarHBondContact O-N 3.27Å; F156-V201 PolarHBondContact O-N 2.87Å
157	A	98.9	Very high	98.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	147	-173	0	0	0	0	0	112.8	Y123 H127 C130 L150 V201	Y123-A157 PolarHBondContact OH-O 3.23Å; H127-A157 PolarHBondContact ND1-N 3.39Å; C130-A157 HydrophobicContact CB-CB 3.55Å; L150-A157 HydrophobicContact CD1-CB 4.33Å; L150-A157 HydrophobicContact CD2-CB 3.8Å; A157-V201 CarbonylContact C-O 3.52Å; A157-V201 WeakPolarHBondContact CA-O 3.44Å; A157-V201 HydrophobicContact CB-CB 4.23Å
158	S	98.9	Very high	98	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	139.7	178.9	-73.3	0	0	0	0	111.4	S194 T199 V201 Y202 I203	S158-S194 WeakPolarHBondContact CB-O 3.32Å; S158-S194 PolarHBondContact OG-O 3.44Å; S158-T199 WeakPolarHBondContact OG-CG2 3.42Å; S158-T199 PolarHBondContact OG-OG1 3.21Å; S158-V201 PolarHBondContact N-O 3.28Å; S158-Y202 WeakPolarHBondContact O-CA 3.4Å; S158-I203 PolarHBondContact O-N 3.08Å
159	Y	98.9	Very high	97.9	Very high	25 Å²	25	38 Å²	38	10%	0.098	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	124.7	177.3	-179.3	-122.3	0	0	0	111.6	M129 C130 M133 L161 I193 I203 M205 A270	M129-Y159 HydrophobicContact CE-CD1 3.46Å; M129-Y159 VanDerWaalsContact CE-CD1 3.46Å; M129-Y159 HydrophobicContact CE-CD2 4.11Å; M129-Y159 HydrophobicContact CE-CE1 3.99Å; M129-Y159 HydrophobicContact CE-CG 3.52Å; C130-Y159 PolarHBondContact SG-N 3.1Å; M133-Y159 HydrophobicContact CE-CD2 4.22Å; M133-Y159 HydrophobicContact CE-CE2 3.71Å; M133-Y159 HydrophobicContact SD-CD2 4.17Å; M133-Y159 HydrophobicContact SD-CE2 3.91Å; Y159-L161 HydrophobicContact CD1-CB 4.31Å; Y159-L161 HydrophobicContact CE1-CB 3.58Å; Y159-L161 HydrophobicContact CE1-CD2 4.01Å; Y159-L161 HydrophobicContact CE1-CG 4.45Å; Y159-L161 HydrophobicContact CE2-CB 4.49Å; Y159-L161 WeakPolarHBondContact OH-CD2 3.45Å; Y159-I193 WeakPolarHBondContact O-CD1 3.35Å; Y159-I203 HydrophobicContact CD2-CB 4.2Å; Y159-I203 HydrophobicContact CD2-CG2 4.26Å; Y159-M205 HydrophobicContact CE2-CE 3.86Å; Y159-M205 HydrophobicContact CE2-CG 4.21Å; Y159-A270 WeakPolarHBondContact OH-CB 3.31Å
160	C	98.9	Very high	97.7	Very high	0 Å²	0	35 Å²	35	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	80.9	-168.8	-69.9	0	0	0	0	112	K190 I193 I203 V204 M205	C160-K190 HydrophobicContact CB-CG 4.11Å; C160-K190 WeakPolarHBondContact O-CE 3.32Å; C160-I193 HydrophobicContact CB-CD1 4.41Å; C160-I203 WeakPolarHBondContact CA-O 3.31Å; C160-I203 WeakPolarHBondContact CB-O 3.37Å; C160-I203 PolarHBondContact N-O 2.83Å; C160-V204 HydrophobicContact CB-CB 4.26Å; C160-V204 HydrophobicContact CB-CG1 4.45Å; C160-V204 HydrophobicContact CB-CG2 3.85Å; C160-M205 PolarHBondContact O-N 3.29Å
161	L	98.7	Very high	97.6	Very high	13 Å²	13	35.6 Å²	35.6	7%	0.068	23%	0.232	C	C	.	.			trans	-109.2	-59.7	177	176.3	61.2	0	0	0	112.4	Y159 A170 L173 K190 M205	Y159-L161 HydrophobicContact CD1-CB 4.31Å; Y159-L161 HydrophobicContact CE1-CB 3.58Å; Y159-L161 HydrophobicContact CE1-CD2 4.01Å; Y159-L161 HydrophobicContact CE1-CG 4.45Å; Y159-L161 HydrophobicContact CE2-CB 4.49Å; Y159-L161 WeakPolarHBondContact OH-CD2 3.45Å; L161-A170 HydrophobicContact CD1-CB 4.16Å; L161-A170 HydrophobicContact CD2-CB 3.9Å; L161-A170 HydrophobicContact CG-CB 4.15Å; L161-L173 HydrophobicContact CD1-CD2 3.92Å; L161-K190 PolarHBondContact O-NZ 3.48Å; L161-M205 HydrophobicContact CB-CG 4.49Å; L161-M205 HydrophobicContact CD1-CB 3.74Å; L161-M205 HydrophobicContact CD1-CG 3.93Å
162	T	98.6	Very high	97.5	Very high	47 Å²	47	37.3 Å²	37.3	29%	0.288	24%	0.244	S	C	.	.			trans	-62.3	142.5	-171.8	-58.4	0	0	0	0	112.6	S166 K190 A191 F192	T162-S166 WeakPolarHBondContact CA-O 3.37Å; T162-K190 CarbonylContact O-C 3.58Å; T162-K190 VanDerWaalsContact O-CA 3.24Å; T162-K190 WeakPolarHBondContact O-CA 3.5Å; T162-K190 WeakPolarHBondContact O-CB 3.49Å; T162-A191 PolarHBondContact O-N 2.93Å; T162-F192 HydrophobicContact CG2-CD2 4.05Å
163	E	98.8	Very high	97.5	Very high	12 Å²	12	34.2 Å²	34.2	6%	0.056	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-127.3	163.3	175.4	-50.1	-168.8	165.8	0	0	109.6	G165 S166 L173 L174 T175 K190	E163-G165 PolarHBondContact O-N 3.35Å; E163-G165 VanDerWaalsContact O-N 3.11Å; E163-S166 WeakPolarHBondContact CB-OG 3.45Å; E163-S166 WeakPolarHBondContact CG-OG 3.31Å; E163-S166 PolarHBondContact N-O 3.04Å; E163-S166 CarbonylContact O-C 3.57Å; E163-S166 PolarHBondContact O-N 3.08Å; E163-L173 HydrophobicContact CG-CB 4.29Å; E163-L173 WeakPolarHBondContact OE1-CB 3.48Å; E163-L174 VanDerWaalsContact CD-N 3.35Å; E163-L174 PolarHBondContact OE1-N 3.27Å; E163-L174 PolarHBondContact OE2-N 3.2Å; E163-T175 WeakPolarHBondContact OE1-CB 3.31Å; E163-T175 PolarHBondContact OE1-N 2.92Å; E163-T175 PolarHBondContact OE1-OG1 2.85Å; E163-T175 PolarHBondContact OE2-N 3.34Å; E163-K190 HydrophobicContact CG-CD 3.78Å; E163-K190 IonicContact OE1-NZ 3.85Å; E163-K190 PolarHBondContact OE1-NZ 3.37Å
164	P	97.8	Very high	97.5	Very high	101 Å²	101	40.3 Å²	40.3	66%	0.656	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-34.5	176	-27.1	35.5	0	0	0	113.5	A191	P164-A191 HydrophobicContact CG-CB 4.14Å
165	G	96.4	Very high	97.5	Very high	73 Å²	73	36.1 Å²	36.1	75%	0.753	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-8	178.9	0	0	0	0	0	115.7	E163	E163-G165 PolarHBondContact O-N 3.35Å; E163-G165 VanDerWaalsContact O-N 3.11Å
166	S	94.1	Very high	97.5	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.021	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-143.8	99.5	-173.5	66.3	0	0	0	0	112.3	T162 E163 L173	T162-S166 WeakPolarHBondContact CA-O 3.37Å; E163-S166 WeakPolarHBondContact CB-OG 3.45Å; E163-S166 WeakPolarHBondContact CG-OG 3.31Å; E163-S166 PolarHBondContact N-O 3.04Å; E163-S166 CarbonylContact O-C 3.57Å; E163-S166 PolarHBondContact O-N 3.08Å; S166-L173 WeakPolarHBondContact OG-CA 3.49Å
167	G	95.6	Very high	97.5	Very high	40 Å²	40	36 Å²	36	41%	0.412	24%	0.24	S	C	.	.	S	Bend	trans	-108.3	-89.3	172.2	0	0	0	0	0	111.5	D169 A170	G167-D169 PolarHBondContact O-N 3.16Å; G167-A170 PolarHBondContact O-N 3Å
168	S	94.3	Very high	97.5	Very high	79 Å²	79	42.1 Å²	42.1	55%	0.552	27%	0.267	S	S	*	.	S	Bend	trans	-58.8	-35.3	177.3	-59.6	0	0	0	0	113.1	A170	S168-A170 VanDerWaalsContact C-N 3.29Å; S168-A170 PolarHBondContact O-N 3.47Å
169	D	95	Very high	97.4	Very high	100 Å²	100	46.5 Å²	46.5	54%	0.535	29%	0.29	S	S	.	.	S	Bend	trans	-88.7	62.7	170.4	-177.2	25.7	0	0	0	110.8	G167 A171 S172	G167-D169 PolarHBondContact O-N 3.16Å; D169-A171 PolarHBondContact O-N 3.44Å; D169-A171 VanDerWaalsContact O-N 3.11Å; D169-S172 PolarHBondContact O-N 3Å; D169-S172 PolarHBondContact O-OG 3.49Å; D169-S172 WeakPolarHBondContact OD2-CB 3.26Å; D169-S172 PolarHBondContact OD2-OG 3Å
170	A	95	Very high	97.4	Very high	13 Å²	13	49.5 Å²	49.5	11%	0.107	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-62	-22.1	-173.7	0	0	0	0	0	114	L161 G167 S168 S172 F267	L161-A170 HydrophobicContact CD1-CB 4.16Å; L161-A170 HydrophobicContact CD2-CB 3.9Å; L161-A170 HydrophobicContact CG-CB 4.15Å; G167-A170 PolarHBondContact O-N 3Å; S168-A170 VanDerWaalsContact C-N 3.29Å; S168-A170 PolarHBondContact O-N 3.47Å; A170-S172 VanDerWaalsContact C-N 3.25Å; A170-S172 PolarHBondContact O-N 3.15Å; A170-F267 HydrophobicContact CB-CE2 4.17Å
171	A	96.5	Very high	97.3	Very high	15 Å²	15	53 Å²	53	12%	0.124	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-74.5	-14.5	-179.1	0	0	0	0	0	113.5	D169 L173 R207 P213 F267	D169-A171 PolarHBondContact O-N 3.44Å; D169-A171 VanDerWaalsContact O-N 3.11Å; A171-L173 VanDerWaalsContact C-N 3.33Å; A171-R207 PolarHBondContact O-NH2 3.21Å; A171-P213 HydrophobicContact CB-CG 3.88Å; A171-F267 HydrophobicContact CB-CD2 4.29Å; A171-F267 HydrophobicContact CB-CE2 3.71Å; A171-F267 HydrophobicContact CB-CZ 3.88Å
172	S	97.6	Very high	97.3	Very high	43 Å²	43	57.9 Å²	57.9	30%	0.301	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-90.3	8.8	178.7	63	0	0	0	0	114.4	D169 A170	D169-S172 PolarHBondContact O-N 3Å; D169-S172 PolarHBondContact O-OG 3.49Å; D169-S172 WeakPolarHBondContact OD2-CB 3.26Å; D169-S172 PolarHBondContact OD2-OG 3Å; A170-S172 VanDerWaalsContact C-N 3.25Å; A170-S172 PolarHBondContact O-N 3.15Å
173	L	98.5	Very high	97.3	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	37%	0.365	C	S	.	.			trans	-47.2	142.7	176.4	71.9	83.3	0	0	0	113	L161 E163 S166 A171 M205 R207 I216	L161-L173 HydrophobicContact CD1-CD2 3.92Å; E163-L173 HydrophobicContact CG-CB 4.29Å; E163-L173 WeakPolarHBondContact OE1-CB 3.48Å; S166-L173 WeakPolarHBondContact OG-CA 3.49Å; A171-L173 VanDerWaalsContact C-N 3.33Å; L173-M205 HydrophobicContact CD2-CB 4.01Å; L173-R207 HydrophobicContact CD1-CB 4.12Å; L173-R207 VanDerWaalsContact O-CZ 3.28Å; L173-R207 PolarHBondContact O-NE 3.24Å; L173-R207 PolarHBondContact O-NH2 3.21Å; L173-I216 HydrophobicContact CD1-CG1 4.31Å; L173-I216 HydrophobicContact CD2-CD1 3.7Å; L173-I216 HydrophobicContact CD2-CG1 4.1Å; L173-I216 HydrophobicContact CD2-CG2 4.04Å; L173-I216 HydrophobicContact CG-CD1 3.9Å; L173-I216 HydrophobicContact CG-CG1 4.16Å
174	L	98.6	Very high	97.3	Very high	128 Å²	128	57.6 Å²	57.6	67%	0.67	36%	0.363	S	S	*	.			trans	-110.4	-16.2	-173.1	-62.4	-179.1	0	0	0	113.3	E163 T176	E163-L174 VanDerWaalsContact CD-N 3.35Å; E163-L174 PolarHBondContact OE1-N 3.27Å; E163-L174 PolarHBondContact OE2-N 3.2Å; L174-T176 WeakPolarHBondContact O-CG2 3.05Å; L174-T176 PolarHBondContact O-N 3.36Å; L174-T176 VanDerWaalsContact O-N 3.08Å
175	T	98.9	Very high	97.3	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.006	33%	0.334	C	S	.	.			trans	-53.9	119.1	173.8	-60.8	0	0	0	0	109.3	E163 N187 K190 C206 R207 L249	E163-T175 WeakPolarHBondContact OE1-CB 3.31Å; E163-T175 PolarHBondContact OE1-N 2.92Å; E163-T175 PolarHBondContact OE1-OG1 2.85Å; E163-T175 PolarHBondContact OE2-N 3.34Å; T175-N187 CarbonylContact C-O 3.54Å; T175-N187 WeakPolarHBondContact CA-O 3.35Å; T175-K190 WeakPolarHBondContact OG1-CE 3.32Å; T175-K190 PolarHBondContact OG1-NZ 3.42Å; T175-C206 HydrophobicContact CG2-CB 4.09Å; T175-C206 CarbonylContact O-C 3.52Å; T175-C206 WeakPolarHBondContact O-CA 3.45Å; T175-R207 PolarHBondContact O-N 3.21Å; T175-L249 HydrophobicContact CG2-CD1 3.87Å
176	T	98.8	Very high	97.4	Very high	61 Å²	61	49.8 Å²	49.8	37%	0.374	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	154.4	-178.4	57.1	0	0	0	0	111.3	L174 L186 N187 R207	L174-T176 WeakPolarHBondContact O-CG2 3.05Å; L174-T176 PolarHBondContact O-N 3.36Å; L174-T176 VanDerWaalsContact O-N 3.08Å; T176-L186 VanDerWaalsContact O-CA 3.26Å; T176-L186 WeakPolarHBondContact O-CA 3.38Å; T176-N187 PolarHBondContact N-O 3.18Å; T176-N187 PolarHBondContact O-N 3.09Å; T176-N187 PolarHBondContact OG1-O 2.99Å; T176-R207 CarbonylContact C-O 3.55Å; T176-R207 WeakPolarHBondContact CA-O 3.29Å
177	A	98.8	Very high	97.7	Very high	3 Å²	3	52.2 Å²	52.2	3%	0.025	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	101.1	167.4	0	0	0	0	0	108.4	Y184 I185 L186 C206 R207 T208	A177-Y184 HydrophobicContact CB-CD1 4.01Å; A177-Y184 HydrophobicContact CB-CG 4.24Å; A177-I185 WeakPolarHBondContact CA-O 3.48Å; A177-L186 HydrophobicContact CB-CD1 3.87Å; A177-L186 HydrophobicContact CB-CG 3.97Å; A177-C206 HydrophobicContact CB-CB 3.97Å; A177-C206 WeakPolarHBondContact CB-SG 3.17Å; A177-R207 PolarHBondContact N-O 2.93Å; A177-T208 HydrophobicContact CB-CG2 3.75Å
178	K	98.6	Very high	97.8	Very high	128 Å²	128	51.7 Å²	51.7	56%	0.557	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	126.9	-178.4	-176.6	-173	172.6	-154.6	0	109.8	E180 Y184 I185	K178-E180 HydrophobicContact CD-CG 4.38Å; K178-E180 WeakPolarHBondContact CE-OE1 3.16Å; K178-E180 HydrophobicContact CG-CG 4.4Å; K178-E180 IonicContact NZ-OE1 2.7Å; K178-E180 PolarHBondContact NZ-OE1 2.91Å; K178-E180 PolarHBondContact O-N 3.33Å; K178-Y184 CarbonylContact O-C 3.6Å; K178-Y184 VanDerWaalsContact O-CA 3.32Å; K178-Y184 WeakPolarHBondContact O-CA 3.19Å; K178-I185 PolarHBondContact N-O 2.93Å; K178-I185 PolarHBondContact O-N 3.42Å
179	L	98.4	Very high	98	Very high	91 Å²	91	50.2 Å²	50.2	48%	0.476	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	124	175.8	-176.5	65.4	0	0	0	110.7	Y184 V256	L179-Y184 HydrophobicContact CB-CD1 4.22Å; L179-Y184 HydrophobicContact CB-CE1 3.98Å; L179-Y184 HydrophobicContact CD1-CD1 4.4Å; L179-Y184 HydrophobicContact CD1-CE1 4.12Å; L179-V256 HydrophobicContact CD1-CG2 3.33Å
180	E	97.9	Very high	98.2	Very high	88 Å²	88	45.5 Å²	45.5	41%	0.411	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	101.3	173.5	-64.5	-165.3	171.9	0	0	109.5	K178 D182 H183 I185	K178-E180 HydrophobicContact CD-CG 4.38Å; K178-E180 WeakPolarHBondContact CE-OE1 3.16Å; K178-E180 HydrophobicContact CG-CG 4.4Å; K178-E180 IonicContact NZ-OE1 2.7Å; K178-E180 PolarHBondContact NZ-OE1 2.91Å; K178-E180 PolarHBondContact O-N 3.33Å; E180-D182 PolarHBondContact O-N 3.22Å; E180-H183 PolarHBondContact N-O 3.01Å; E180-H183 PolarHBondContact O-N 3.29Å; E180-I185 HydrophobicContact CB-CD1 4.45Å; E180-I185 HydrophobicContact CB-CG1 4.06Å; E180-I185 HydrophobicContact CG-CG1 3.85Å
181	G	97	Very high	98.4	Very high	75 Å²	75	45.4 Å²	45.4	77%	0.773	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	-119.1	-174.3	0	0	0	0	0	111.8
182	D	97.6	Very high	98.5	Very high	114 Å²	114	51.6 Å²	51.6	61%	0.61	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	9.6	178.7	63.3	-22.2	0	0	0	113.4	E180 V256	E180-D182 PolarHBondContact O-N 3.22Å; D182-V256 WeakPolarHBondContact O-CG2 3.48Å; D182-V256 PolarHBondContact O-N 3.02Å
183	H	98.4	Very high	98.5	Very high	54 Å²	54	49.8 Å²	49.8	25%	0.25	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	153.8	179.1	-68.4	72.7	0	0	0	112.4	E180 V254	E180-H183 PolarHBondContact N-O 3.01Å; E180-H183 PolarHBondContact O-N 3.29Å; H183-V254 CarbonylContact C-O 3.57Å; H183-V254 WeakPolarHBondContact CA-O 3.42Å
184	Y	98.8	Very high	98.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	136.6	158	-71.2	-71.5	0	0	0	110.2	A177 K178 L179 T208 V219 V254 V256 R259 E263	A177-Y184 HydrophobicContact CB-CD1 4.01Å; A177-Y184 HydrophobicContact CB-CG 4.24Å; K178-Y184 CarbonylContact O-C 3.6Å; K178-Y184 VanDerWaalsContact O-CA 3.32Å; K178-Y184 WeakPolarHBondContact O-CA 3.19Å; L179-Y184 HydrophobicContact CB-CD1 4.22Å; L179-Y184 HydrophobicContact CB-CE1 3.98Å; L179-Y184 HydrophobicContact CD1-CD1 4.4Å; L179-Y184 HydrophobicContact CD1-CE1 4.12Å; Y184-T208 HydrophobicContact CD1-CG2 4.26Å; Y184-T208 HydrophobicContact CE1-CG2 3.77Å; Y184-V219 HydrophobicContact CD2-CG2 4.46Å; Y184-V254 PolarHBondContact N-O 3.22Å; Y184-V254 PolarHBondContact O-N 3.13Å; Y184-V256 HydrophobicContact CD2-CG2 4.02Å; Y184-V256 HydrophobicContact CE2-CB 4.25Å; Y184-V256 HydrophobicContact CE2-CG1 4.23Å; Y184-V256 HydrophobicContact CE2-CG2 3.85Å; Y184-R259 HydrophobicContact CE2-CB 4.22Å; Y184-R259 PolarHBondContact OH-NH1 3.49Å; Y184-E263 WeakPolarHBondContact CE1-OE1 3.47Å; Y184-E263 VanDerWaalsContact OH-CD 3.23Å; Y184-E263 VanDerWaalsContact OH-CG 3.24Å; Y184-E263 WeakPolarHBondContact OH-CG 3.27Å; Y184-E263 PolarHBondContact OH-OE1 2.79Å
185	I	98.8	Very high	98.5	Very high	10 Å²	10	44.3 Å²	44.3	5%	0.051	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	108.8	169.3	-46.7	-51.4	0	0	0	108	A177 K178 E180 D251 H253	A177-I185 WeakPolarHBondContact CA-O 3.48Å; K178-I185 PolarHBondContact N-O 2.93Å; K178-I185 PolarHBondContact O-N 3.42Å; E180-I185 HydrophobicContact CB-CD1 4.45Å; E180-I185 HydrophobicContact CB-CG1 4.06Å; E180-I185 HydrophobicContact CG-CG1 3.85Å; I185-D251 HydrophobicContact CG2-CB 4.22Å; I185-H253 HydrophobicContact CD1-CB 4.4Å; I185-H253 WeakPolarHBondContact CD1-CE1 3.24Å; I185-H253 WeakPolarHBondContact CD1-ND1 3.46Å
186	L	98.9	Very high	98.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	131.8	-177.9	-80.8	69.5	0	0	0	110.6	T176 A177 V204 V221 L249 D251 C252 V254	T176-L186 VanDerWaalsContact O-CA 3.26Å; T176-L186 WeakPolarHBondContact O-CA 3.38Å; A177-L186 HydrophobicContact CB-CD1 3.87Å; A177-L186 HydrophobicContact CB-CG 3.97Å; L186-V204 HydrophobicContact CD2-CG1 4.23Å; L186-V221 HydrophobicContact CD2-CG2 3.97Å; L186-L249 HydrophobicContact CB-CB 4.18Å; L186-L249 HydrophobicContact CB-CD1 4.36Å; L186-L249 HydrophobicContact CB-CD2 4.2Å; L186-L249 HydrophobicContact CB-CG 4.48Å; L186-L249 HydrophobicContact CD2-CD1 4.18Å; L186-L249 HydrophobicContact CD2-CD2 4.25Å; L186-D251 PolarHBondContact O-N 3.39Å; L186-C252 HydrophobicContact CB-CB 4.06Å; L186-C252 PolarHBondContact N-O 3.37Å; L186-C252 PolarHBondContact O-N 3.28Å; L186-V254 HydrophobicContact CD1-CB 4.06Å; L186-V254 HydrophobicContact CD1-CG2 3.85Å; L186-V254 HydrophobicContact CD2-CG2 4.34Å
187	N	98.9	Very high	98.2	Very high	54 Å²	54	42 Å²	42	29%	0.289	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	124.4	176.8	-87.2	-69	0	0	0	110.2	T175 T176 L249 D251	T175-N187 CarbonylContact C-O 3.54Å; T175-N187 WeakPolarHBondContact CA-O 3.35Å; T176-N187 PolarHBondContact N-O 3.18Å; T176-N187 PolarHBondContact O-N 3.09Å; T176-N187 PolarHBondContact OG1-O 2.99Å; N187-L249 CarbonylContact C-O 3.55Å; N187-L249 VanDerWaalsContact CA-O 3.29Å; N187-L249 WeakPolarHBondContact CA-O 3.39Å; N187-D251 PolarHBondContact ND2-OD1 2.83Å; N187-D251 PolarHBondContact OD1-N 3.31Å
188	G	98.7	Very high	98.1	Very high	28 Å²	28	44.9 Å²	44.9	29%	0.289	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	156.5	-174.9	178.6	0	0	0	0	0	114.2	L249	G188-L249 PolarHBondContact N-O 3.32Å; G188-L249 PolarHBondContact O-N 2.87Å
189	S	98.6	Very high	98.1	Very high	49 Å²	49	38.8 Å²	38.8	34%	0.343	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	133.4	175.4	62.6	0	0	0	0	111.1	V247	S189-V247 WeakPolarHBondContact CA-O 3.5Å
190	K	98.9	Very high	98.1	Very high	1 Å²	1	36.6 Å²	36.6	0%	0.004	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	148	172.9	-55.6	-57.8	-164.5	177.3	0	109.7	C160 L161 T162 E163 T175 I193 M205 A246 V247	C160-K190 HydrophobicContact CB-CG 4.11Å; C160-K190 WeakPolarHBondContact O-CE 3.32Å; L161-K190 PolarHBondContact O-NZ 3.48Å; T162-K190 CarbonylContact O-C 3.58Å; T162-K190 VanDerWaalsContact O-CA 3.24Å; T162-K190 WeakPolarHBondContact O-CA 3.5Å; T162-K190 WeakPolarHBondContact O-CB 3.49Å; E163-K190 HydrophobicContact CG-CD 3.78Å; E163-K190 IonicContact OE1-NZ 3.85Å; E163-K190 PolarHBondContact OE1-NZ 3.37Å; T175-K190 WeakPolarHBondContact OG1-CE 3.32Å; T175-K190 PolarHBondContact OG1-NZ 3.42Å; K190-I193 HydrophobicContact CB-CD1 3.9Å; K190-I193 HydrophobicContact CB-CG1 3.85Å; K190-M205 VanDerWaalsContact CE-O 3.27Å; K190-M205 WeakPolarHBondContact CE-O 3.11Å; K190-M205 PolarHBondContact NZ-O 3.49Å; K190-A246 CarbonylContact O-C 3.57Å; K190-A246 WeakPolarHBondContact O-CA 3.43Å; K190-A246 WeakPolarHBondContact O-CB 3.43Å; K190-V247 HydrophobicContact CB-CB 4.19Å; K190-V247 PolarHBondContact N-O 3.31Å; K190-V247 PolarHBondContact O-N 3.48Å
191	A	98.6	Very high	98.2	Very high	11 Å²	11	32.4 Å²	32.4	9%	0.091	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	150	-176	0	0	0	0	0	111.1	T162 P164 I193	T162-A191 PolarHBondContact O-N 2.93Å; P164-A191 HydrophobicContact CG-CB 4.14Å; A191-I193 VanDerWaalsContact C-N 3.34Å; A191-I193 WeakPolarHBondContact O-CD1 3.34Å; A191-I193 PolarHBondContact O-N 3.22Å
192	F	98.6	Very high	98.3	Very high	145 Å²	145	28.9 Å²	28.9	64%	0.636	16%	0.162	S	C	*	.	E	Extended strand (participates in β ladder)	trans	61.2	35.9	176	-47.5	-74.2	0	0	0	114.6	T162 S194 T244	T162-F192 HydrophobicContact CG2-CD2 4.05Å; F192-S194 PolarHBondContact O-N 3.34Å; F192-T244 HydrophobicContact CB-CG2 4.24Å
193	I	98.9	Very high	98.3	Very high	4 Å²	4	23.4 Å²	23.4	2%	0.021	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	108.9	-176.3	-54	-47.9	0	0	0	110.3	Y159 C160 K190 A191 G196 T244 R245 V247	Y159-I193 WeakPolarHBondContact O-CD1 3.35Å; C160-I193 HydrophobicContact CB-CD1 4.41Å; K190-I193 HydrophobicContact CB-CD1 3.9Å; K190-I193 HydrophobicContact CB-CG1 3.85Å; A191-I193 VanDerWaalsContact C-N 3.34Å; A191-I193 WeakPolarHBondContact O-CD1 3.34Å; A191-I193 PolarHBondContact O-N 3.22Å; I193-G196 PolarHBondContact O-N 2.88Å; I193-T244 WeakPolarHBondContact O-CA 3.5Å; I193-R245 PolarHBondContact N-O 3.08Å; I193-R245 PolarHBondContact O-N 3.11Å; I193-V247 HydrophobicContact CB-CG2 3.78Å; I193-V247 HydrophobicContact CG1-CB 4.23Å; I193-V247 HydrophobicContact CG1-CG2 3.69Å; I193-V247 HydrophobicContact CG2-CG2 3.85Å
194	S	98.8	Very high	98.3	Very high	14 Å²	14	20.9 Å²	20.9	10%	0.098	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	127.9	171.4	-68.8	0	0	0	0	111.2	S158 F192 G196 Q242 P243	S158-S194 WeakPolarHBondContact CB-O 3.32Å; S158-S194 PolarHBondContact OG-O 3.44Å; F192-S194 PolarHBondContact O-N 3.34Å; S194-G196 PolarHBondContact O-N 2.79Å; S194-Q242 PolarHBondContact OG-OE1 3.39Å; S194-P243 CarbonylContact C-O 3.53Å
195	G	98.3	Very high	98.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	-9.3	-172	0	0	0	0	0	114.2	G197 D198 T199 P243	G195-G197 PolarHBondContact O-N 3.12Å; G195-D198 CarbonylContact O-C 3.56Å; G195-D198 PolarHBondContact O-N 3.1Å; G195-T199 WeakPolarHBondContact O-CG2 3.31Å; G195-T199 PolarHBondContact O-N 3.25Å; G195-T199 PolarHBondContact O-OG1 2.88Å; G195-P243 PolarHBondContact N-O 3.21Å
196	G	96.2	Very high	98.4	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	127.8	-172.1	0	0	0	0	0	113.4	I193 S194 D198 R245	I193-G196 PolarHBondContact O-N 2.88Å; S194-G196 PolarHBondContact O-N 2.79Å; G196-D198 PolarHBondContact O-N 3.11Å; G196-R245 WeakPolarHBondContact O-CD 3.49Å; G196-R245 VanDerWaalsContact O-CG 3.22Å; G196-R245 WeakPolarHBondContact O-CG 3.45Å; G196-R245 PolarHBondContact O-NE 3.4Å; G196-R245 VanDerWaalsContact O-NE 3.13Å
197	G	95.4	Very high	98.4	Very high	14 Å²	14	22 Å²	22	14%	0.144	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	-22.2	-178.2	0	0	0	0	0	114.5	G195 Y202 K223	G195-G197 PolarHBondContact O-N 3.12Å; G197-Y202 PolarHBondContact N-OH 2.89Å; G197-Y202 VanDerWaalsContact N-OH 3.09Å; G197-K223 PolarHBondContact O-NZ 3.28Å
198	D	96.4	Very high	98.3	Very high	63 Å²	63	21 Å²	21	34%	0.337	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.1	-6.1	-177.5	-64.4	-91.3	0	0	0	112	F74 G195 G196 P243 R245	F74-D198 HydrophobicContact CD1-CB 4.21Å; G195-D198 CarbonylContact O-C 3.56Å; G195-D198 PolarHBondContact O-N 3.1Å; G196-D198 PolarHBondContact O-N 3.11Å; D198-P243 HydrophobicContact CB-CG 3.63Å; D198-P243 WeakPolarHBondContact OD2-CB 3.39Å; D198-P243 VanDerWaalsContact OD2-CG 3.31Å; D198-P243 WeakPolarHBondContact OD2-CG 3.34Å; D198-R245 IonicContact OD1-NH2 3.54Å; D198-R245 IonicContact OD2-CZ 2.92Å; D198-R245 IonicContact OD2-NE 2.87Å; D198-R245 PolarHBondContact OD2-NE 3.02Å; D198-R245 IonicContact OD2-NH2 2.73Å; D198-R245 PolarHBondContact OD2-NH2 3.35Å
199	T	98.4	Very high	98.3	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.129	C	C	.	.			trans	-102.4	169.9	173.3	57.5	0	0	0	0	113.1	Y123 F156 S158 G195 Y202 K223	Y123-T199 HydrophobicContact CE2-CG2 4.27Å; Y123-T199 WeakPolarHBondContact OH-CG2 3.49Å; F156-T199 HydrophobicContact CB-CG2 3.67Å; S158-T199 WeakPolarHBondContact OG-CG2 3.42Å; S158-T199 PolarHBondContact OG-OG1 3.21Å; G195-T199 WeakPolarHBondContact O-CG2 3.31Å; G195-T199 PolarHBondContact O-N 3.25Å; G195-T199 PolarHBondContact O-OG1 2.88Å; T199-Y202 PolarHBondContact O-OH 3.39Å; T199-Y202 WeakPolarHBondContact OG1-CE1 3.37Å; T199-Y202 VanDerWaalsContact OG1-CZ 3.29Å; T199-Y202 PolarHBondContact OG1-OH 2.89Å; T199-K223 VanDerWaalsContact O-CD 3.31Å; T199-K223 WeakPolarHBondContact O-CD 3.35Å; T199-K223 PolarHBondContact O-NZ 3.37Å; T199-K223 VanDerWaalsContact O-NZ 3.11Å
200	D	98.8	Very high	98.1	Very high	44 Å²	44	21.9 Å²	21.9	24%	0.235	14%	0.138	C	C	.	.	S	Bend	trans	-109.7	-27.9	-168.8	-51.4	-70.5	0	0	0	113.1	K155 F156 K223	K155-D200 VanDerWaalsContact CA-OD2 3.29Å; K155-D200 WeakPolarHBondContact CA-OD2 3.44Å; K155-D200 HydrophobicContact CB-CB 3.91Å; K155-D200 HydrophobicContact CD-CB 3.95Å; K155-D200 HydrophobicContact CG-CB 3.84Å; F156-D200 PolarHBondContact N-OD2 3.34Å; F156-D200 PolarHBondContact O-N 3.27Å; D200-K223 WeakPolarHBondContact O-CB 3.26Å; D200-K223 PolarHBondContact O-N 3.35Å
201	V	98.8	Very high	98	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	129.1	-175	-176.5	0	0	0	0	110.5	I134 F146 L150 K155 F156 A157 S158 I203 V220	I134-V201 HydrophobicContact CD1-CG1 4.4Å; F146-V201 HydrophobicContact CD1-CG1 4.5Å; F146-V201 HydrophobicContact CD1-CG2 4.33Å; L150-V201 HydrophobicContact CD2-CB 4.44Å; L150-V201 HydrophobicContact CD2-CG2 4.22Å; K155-V201 HydrophobicContact CD-CG2 4.46Å; F156-V201 PolarHBondContact O-N 2.87Å; A157-V201 CarbonylContact C-O 3.52Å; A157-V201 WeakPolarHBondContact CA-O 3.44Å; A157-V201 HydrophobicContact CB-CB 4.23Å; S158-V201 PolarHBondContact N-O 3.28Å; V201-I203 HydrophobicContact CG1-CD1 4.36Å; V201-V220 HydrophobicContact CG1-CG1 3.44Å; V201-V220 VanDerWaalsContact CG1-CG1 3.44Å
202	Y	98.9	Very high	97.9	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	117.8	-177.1	-61.4	-95.5	0	0	0	110	S158 G197 T199 V204 V220 V221 K223 L228 F230 V247	S158-Y202 WeakPolarHBondContact O-CA 3.4Å; G197-Y202 PolarHBondContact N-OH 2.89Å; G197-Y202 VanDerWaalsContact N-OH 3.09Å; T199-Y202 PolarHBondContact O-OH 3.39Å; T199-Y202 WeakPolarHBondContact OG1-CE1 3.37Å; T199-Y202 VanDerWaalsContact OG1-CZ 3.29Å; T199-Y202 PolarHBondContact OG1-OH 2.89Å; Y202-V204 PolarHBondContact O-N 3.41Å; Y202-V220 WeakPolarHBondContact O-CA 3.34Å; Y202-V221 PolarHBondContact N-O 3.16Å; Y202-V221 PolarHBondContact O-N 3.5Å; Y202-K223 HydrophobicContact CE2-CB 4.23Å; Y202-L228 HydrophobicContact CD2-CD2 4.09Å; Y202-L228 HydrophobicContact CE2-CD2 4.14Å; Y202-F230 AromaticContact CE1-CE1 3.6Å; Y202-F230 HydrophobicContact CE1-CE1 3.6Å; Y202-F230 HydrophobicContact CE1-CZ 4.16Å; Y202-F230 HydrophobicContact CE2-CE1 4.19Å; Y202-F230 AromaticContact CE2-CZ 3.91Å; Y202-F230 HydrophobicContact CE2-CZ 3.91Å; Y202-F230 AromaticContact CZ-CE1 3.41Å; Y202-F230 VanDerWaalsContact CZ-CE1 3.41Å; Y202-F230 AromaticContact CZ-CZ 3.49Å; Y202-F230 VanDerWaalsContact CZ-CZ 3.49Å; Y202-F230 VanDerWaalsContact OH-CE1 3.23Å; Y202-F230 WeakPolarHBondContact OH-CE1 3.34Å; Y202-F230 WeakPolarHBondContact OH-CZ 3.33Å; Y202-V247 HydrophobicContact CD1-CG2 4.17Å; Y202-V247 HydrophobicContact CE1-CG2 4.04Å
203	I	98.9	Very high	97.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	97.3	174.4	-50.9	-56.6	0	0	0	108.3	C130 M133 I134 S158 Y159 C160 V201 C218 V220	C130-I203 HydrophobicContact CB-CD1 4.49Å; C130-I203 HydrophobicContact CB-CG1 3.64Å; M133-I203 HydrophobicContact SD-CG2 3.9Å; I134-I203 HydrophobicContact CD1-CD1 3.84Å; I134-I203 HydrophobicContact CG1-CD1 3.78Å; S158-I203 PolarHBondContact O-N 3.08Å; Y159-I203 HydrophobicContact CD2-CB 4.2Å; Y159-I203 HydrophobicContact CD2-CG2 4.26Å; C160-I203 WeakPolarHBondContact CA-O 3.31Å; C160-I203 WeakPolarHBondContact CB-O 3.37Å; C160-I203 PolarHBondContact N-O 2.83Å; V201-I203 HydrophobicContact CG1-CD1 4.36Å; I203-C218 WeakPolarHBondContact CG2-SG 3.2Å; I203-V220 HydrophobicContact CD1-CG1 4.41Å; I203-V220 HydrophobicContact CD1-CG2 3.96Å
204	V	98.9	Very high	97.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	123.2	-171.6	-174.7	0	0	0	0	111.2	C160 L186 Y202 C206 V219 V221 L249	C160-V204 HydrophobicContact CB-CB 4.26Å; C160-V204 HydrophobicContact CB-CG1 4.45Å; C160-V204 HydrophobicContact CB-CG2 3.85Å; L186-V204 HydrophobicContact CD2-CG1 4.23Å; Y202-V204 PolarHBondContact O-N 3.41Å; V204-C206 HydrophobicContact CG1-CB 4.38Å; V204-V219 PolarHBondContact N-O 2.89Å; V204-V219 PolarHBondContact O-N 3.1Å; V204-V221 HydrophobicContact CB-CG2 4.21Å; V204-V221 HydrophobicContact CG2-CB 4.22Å; V204-V221 HydrophobicContact CG2-CG2 3.63Å; V204-L249 HydrophobicContact CG1-CD1 4.06Å
205	M	98.9	Very high	97.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	116.4	168.6	-63.5	-66.8	171.3	0	0	109.2	M133 Y159 C160 L161 L173 K190 I216 S217 C218 I269 A270	M133-M205 HydrophobicContact SD-CE 4.27Å; Y159-M205 HydrophobicContact CE2-CE 3.86Å; Y159-M205 HydrophobicContact CE2-CG 4.21Å; C160-M205 PolarHBondContact O-N 3.29Å; L161-M205 HydrophobicContact CB-CG 4.49Å; L161-M205 HydrophobicContact CD1-CB 3.74Å; L161-M205 HydrophobicContact CD1-CG 3.93Å; L173-M205 HydrophobicContact CD2-CB 4.01Å; K190-M205 VanDerWaalsContact CE-O 3.27Å; K190-M205 WeakPolarHBondContact CE-O 3.11Å; K190-M205 PolarHBondContact NZ-O 3.49Å; M205-I216 HydrophobicContact CB-CG2 4.23Å; M205-I216 HydrophobicContact SD-CG2 4.47Å; M205-S217 WeakPolarHBondContact CA-O 3.44Å; M205-C218 HydrophobicContact CE-CB 3.91Å; M205-C218 VanDerWaalsContact CE-SG 3.56Å; M205-C218 HydrophobicContact SD-CB 3.82Å; M205-I269 HydrophobicContact CE-CB 4.36Å; M205-I269 HydrophobicContact CE-CG2 4.04Å; M205-A270 HydrophobicContact CE-CB 3.83Å; M205-A270 HydrophobicContact CG-CB 4.49Å; M205-A270 HydrophobicContact SD-CB 4.2Å
206	C	98.9	Very high	97.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.7	-173.3	55.8	0	0	0	0	111.6	T175 A177 V204 I216 S217	T175-C206 HydrophobicContact CG2-CB 4.09Å; T175-C206 CarbonylContact O-C 3.52Å; T175-C206 WeakPolarHBondContact O-CA 3.45Å; A177-C206 HydrophobicContact CB-CB 3.97Å; A177-C206 WeakPolarHBondContact CB-SG 3.17Å; V204-C206 HydrophobicContact CG1-CB 4.38Å; C206-I216 CarbonylContact O-C 3.56Å; C206-I216 WeakPolarHBondContact O-CA 3.32Å; C206-S217 PolarHBondContact N-O 3.22Å; C206-S217 PolarHBondContact O-N 2.92Å
207	R	98.8	Very high	97.9	Very high	34 Å²	34	36.7 Å²	36.7	13%	0.128	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	111.6	-179.4	-171.6	172.6	-58.4	-70.5	-4.6	110.4	A171 L173 T175 T176 A177 G209 G210 G212 G215	A171-R207 PolarHBondContact O-NH2 3.21Å; L173-R207 HydrophobicContact CD1-CB 4.12Å; L173-R207 VanDerWaalsContact O-CZ 3.28Å; L173-R207 PolarHBondContact O-NE 3.24Å; L173-R207 PolarHBondContact O-NH2 3.21Å; T175-R207 PolarHBondContact O-N 3.21Å; T176-R207 CarbonylContact C-O 3.55Å; T176-R207 WeakPolarHBondContact CA-O 3.29Å; A177-R207 PolarHBondContact N-O 2.93Å; R207-G209 WeakPolarHBondContact CG-O 3.27Å; R207-G210 PolarHBondContact NH1-O 3.15Å; R207-G212 PolarHBondContact NH1-O 3.45Å; R207-G212 VanDerWaalsContact NH1-O 3.09Å; R207-G215 CarbonylContact C-O 3.51Å; R207-G215 WeakPolarHBondContact CA-O 3.34Å
208	T	98.6	Very high	98.1	Very high	33 Å²	33	36 Å²	36	20%	0.202	21%	0.205	C	C	.	.	S	Bend	trans	-101.3	-19.4	171.8	59	0	0	0	0	112.1	A177 Y184 G215 S217	A177-T208 HydrophobicContact CB-CG2 3.75Å; Y184-T208 HydrophobicContact CD1-CG2 4.26Å; Y184-T208 HydrophobicContact CE1-CG2 3.77Å; T208-G215 PolarHBondContact N-O 3.38Å; T208-S217 WeakPolarHBondContact CG2-OG 3.36Å; T208-S217 PolarHBondContact OG1-OG 3.32Å
209	G	97.4	Very high	98.2	Very high	44 Å²	44	33 Å²	33	45%	0.454	19%	0.189	S	C	.	.	S	Bend	trans	-121.9	-151.2	-177.3	0	0	0	0	0	114	R207 G215	R207-G209 WeakPolarHBondContact CG-O 3.27Å; G209-G215 PolarHBondContact N-O 2.64Å
210	G	95.7	Very high	98.2	Very high	52 Å²	52	33 Å²	33	54%	0.536	19%	0.189	S	C	.	.	S	Bend	trans	-68.5	-168.6	-179.1	0	0	0	0	0	115	R207 G215	R207-G210 PolarHBondContact NH1-O 3.15Å; G210-G215 WeakPolarHBondContact O-CA 3.26Å
211	K	95.4	Very high	98.2	Very high	206 Å²	206	31 Å²	31	90%	0.896	18%	0.178	S	C	*	.	S	Bend	trans	-68.6	156.2	177.8	-67.1	-174.5	179.5	-178	0	112.1
212	G	96.3	Very high	98.2	Very high	25 Å²	25	33.4 Å²	33.4	26%	0.258	19%	0.189	S	C	.	.	S	Bend	trans	78.3	-171.6	174.3	0	0	0	0	0	114.6	R207 K214 G215	R207-G212 PolarHBondContact NH1-O 3.45Å; R207-G212 VanDerWaalsContact NH1-O 3.09Å; G212-K214 PolarHBondContact O-N 3.43Å; G212-G215 PolarHBondContact O-N 3.15Å
213	P	97.6	Very high	98.2	Very high	59 Å²	59	36 Å²	36	38%	0.383	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-57.1	-41	-171.3	-30.6	37.4	0	0	0	115.3	A171 G215 I216 F267	A171-P213 HydrophobicContact CB-CG 3.88Å; P213-G215 PolarHBondContact O-N 3.38Å; P213-I216 PolarHBondContact O-N 2.99Å; P213-F267 HydrophobicContact CB-CB 4.04Å; P213-F267 HydrophobicContact CB-CD1 3.59Å; P213-F267 HydrophobicContact CB-CE1 4.18Å; P213-F267 HydrophobicContact CB-CG 3.84Å; P213-F267 HydrophobicContact CG-CD1 4.11Å; P213-F267 HydrophobicContact CG-CE1 4.18Å; P213-F267 WeakPolarHBondContact O-CB 3.45Å
214	K	98.1	Very high	98.1	Very high	193 Å²	193	42.6 Å²	42.6	84%	0.839	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-69.9	-11.9	-175.8	-64.3	-174.9	179.2	-178	0	113.7	G212 G264	G212-K214 PolarHBondContact O-N 3.43Å; K214-G264 WeakPolarHBondContact O-CA 3.23Å
215	G	98.3	Very high	98.1	Very high	3 Å²	3	43.7 Å²	43.7	3%	0.031	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-92.9	2	176.8	0	0	0	0	0	114.4	R207 T208 G209 G210 G212 P213	R207-G215 CarbonylContact C-O 3.51Å; R207-G215 WeakPolarHBondContact CA-O 3.34Å; T208-G215 PolarHBondContact N-O 3.38Å; G209-G215 PolarHBondContact N-O 2.64Å; G210-G215 WeakPolarHBondContact O-CA 3.26Å; G212-G215 PolarHBondContact O-N 3.15Å; P213-G215 PolarHBondContact O-N 3.38Å
216	I	98.9	Very high	98	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	134.4	-174.9	-62	168.2	0	0	0	110	L173 M205 C206 P213 G264 Q265 G266 F267	L173-I216 HydrophobicContact CD1-CG1 4.31Å; L173-I216 HydrophobicContact CD2-CD1 3.7Å; L173-I216 HydrophobicContact CD2-CG1 4.1Å; L173-I216 HydrophobicContact CD2-CG2 4.04Å; L173-I216 HydrophobicContact CG-CD1 3.9Å; L173-I216 HydrophobicContact CG-CG1 4.16Å; M205-I216 HydrophobicContact CB-CG2 4.23Å; M205-I216 HydrophobicContact SD-CG2 4.47Å; C206-I216 CarbonylContact O-C 3.56Å; C206-I216 WeakPolarHBondContact O-CA 3.32Å; P213-I216 PolarHBondContact O-N 2.99Å; I216-G264 CarbonylContact O-C 3.55Å; I216-G264 WeakPolarHBondContact O-CA 3.35Å; I216-Q265 PolarHBondContact O-N 2.98Å; I216-G266 WeakPolarHBondContact O-CA 3.49Å; I216-G266 PolarHBondContact O-N 3.46Å; I216-F267 HydrophobicContact CB-CB 4.23Å; I216-F267 HydrophobicContact CD1-CB 4.23Å; I216-F267 HydrophobicContact CD1-CD2 3.74Å; I216-F267 HydrophobicContact CD1-CG 4.34Å
217	S	98.9	Very high	98	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	162.8	173.8	-62.9	0	0	0	0	110.5	M205 C206 T208 E263 G264	M205-S217 WeakPolarHBondContact CA-O 3.44Å; C206-S217 PolarHBondContact N-O 3.22Å; C206-S217 PolarHBondContact O-N 2.92Å; T208-S217 WeakPolarHBondContact CG2-OG 3.36Å; T208-S217 PolarHBondContact OG1-OG 3.32Å; S217-E263 VanDerWaalsContact OG-CA 3.3Å; S217-E263 WeakPolarHBondContact OG-CA 3.22Å; S217-G264 PolarHBondContact OG-N 3.4Å
218	C	98.9	Very high	98	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	126.5	176.6	-175.2	0	0	0	0	108.9	I203 M205 R259 L260 I269	I203-C218 WeakPolarHBondContact CG2-SG 3.2Å; M205-C218 HydrophobicContact CE-CB 3.91Å; M205-C218 VanDerWaalsContact CE-SG 3.56Å; M205-C218 HydrophobicContact SD-CB 3.82Å; C218-R259 CarbonylContact O-C 3.53Å; C218-R259 WeakPolarHBondContact O-CA 3.33Å; C218-R259 WeakPolarHBondContact O-CG 3.43Å; C218-L260 HydrophobicContact CB-CB 4.18Å; C218-L260 PolarHBondContact O-N 2.86Å; C218-I269 HydrophobicContact CB-CD1 3.97Å
219	V	98.9	Very high	98	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	135.5	-177.8	178.8	0	0	0	0	109.5	Y184 V204 V221 V254 N258 R259	Y184-V219 HydrophobicContact CD2-CG2 4.46Å; V204-V219 PolarHBondContact N-O 2.89Å; V204-V219 PolarHBondContact O-N 3.1Å; V219-V221 HydrophobicContact CG1-CG2 4.39Å; V219-V254 HydrophobicContact CG1-CB 4.23Å; V219-V254 HydrophobicContact CG1-CG1 3.48Å; V219-V254 VanDerWaalsContact CG1-CG1 3.48Å; V219-N258 HydrophobicContact CG1-CB 4.38Å; V219-R259 HydrophobicContact CG2-CB 4.41Å; V219-R259 HydrophobicContact CG2-CG 4.37Å
220	V	98.9	Very high	98.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	121.7	172.4	-173	0	0	0	0	109.4	I134 F146 V201 Y202 I203 V254 N258 L260	I134-V220 HydrophobicContact CD1-CG2 4.4Å; I134-V220 HydrophobicContact CG1-CG2 4.27Å; F146-V220 HydrophobicContact CD1-CG1 4.41Å; F146-V220 HydrophobicContact CD2-CG1 4.38Å; F146-V220 HydrophobicContact CE1-CG1 3.95Å; F146-V220 HydrophobicContact CE2-CB 4.23Å; F146-V220 HydrophobicContact CE2-CG1 3.93Å; F146-V220 HydrophobicContact CE2-CG2 4.43Å; F146-V220 HydrophobicContact CZ-CB 4.27Å; F146-V220 HydrophobicContact CZ-CG1 3.69Å; V201-V220 HydrophobicContact CG1-CG1 3.44Å; V201-V220 VanDerWaalsContact CG1-CG1 3.44Å; Y202-V220 WeakPolarHBondContact O-CA 3.34Å; I203-V220 HydrophobicContact CD1-CG1 4.41Å; I203-V220 HydrophobicContact CD1-CG2 3.96Å; V220-V254 WeakPolarHBondContact O-CG1 3.36Å; V220-N258 HydrophobicContact CB-CB 4.33Å; V220-N258 PolarHBondContact N-O 2.91Å; V220-N258 VanDerWaalsContact O-CB 3.25Å; V220-N258 WeakPolarHBondContact O-CB 3.49Å; V220-N258 PolarHBondContact O-ND2 2.92Å; V220-L260 HydrophobicContact CG2-CD1 3.97Å; V220-L260 HydrophobicContact CG2-CD2 3.76Å; V220-L260 HydrophobicContact CG2-CG 3.8Å
221	V	98.9	Very high	98.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	126.6	175.3	-171.5	0	0	0	0	108.4	L186 Y202 V204 V219 T225 L228 V254	L186-V221 HydrophobicContact CD2-CG2 3.97Å; Y202-V221 PolarHBondContact N-O 3.16Å; Y202-V221 PolarHBondContact O-N 3.5Å; V204-V221 HydrophobicContact CB-CG2 4.21Å; V204-V221 HydrophobicContact CG2-CB 4.22Å; V204-V221 HydrophobicContact CG2-CG2 3.63Å; V219-V221 HydrophobicContact CG1-CG2 4.39Å; V221-T225 HydrophobicContact CG1-CG2 4.49Å; V221-L228 HydrophobicContact CG1-CD2 4.09Å; V221-V254 HydrophobicContact CG1-CG2 4.14Å; V221-V254 HydrophobicContact CG2-CG1 4.48Å; V221-V254 HydrophobicContact CG2-CG2 3.92Å
222	E	98.8	Very high	98.4	Very high	52 Å²	52	46.9 Å²	46.9	24%	0.243	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	145.3	176.7	-68.2	175.1	97.8	0	0	109.6	K145 F146 T225	K145-E222 IonicContact NZ-OE1 3.76Å; K145-E222 IonicContact NZ-OE2 3.58Å; K145-E222 PolarHBondContact NZ-OE2 3.18Å; F146-E222 HydrophobicContact CE1-CG 3.84Å; F146-E222 HydrophobicContact CZ-CG 4.36Å; E222-T225 VanDerWaalsContact O-CB 3.3Å; E222-T225 WeakPolarHBondContact O-CB 3.43Å; E222-T225 PolarHBondContact O-N 2.94Å; E222-T225 PolarHBondContact O-OG1 3.23Å
223	K	98.1	Very high	98.5	Very high	56 Å²	56	48.9 Å²	48.9	24%	0.243	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	147.9	170.1	-165.6	-169.5	-162.6	127.1	0	109.7	G197 T199 D200 Y202 T225	G197-K223 PolarHBondContact O-NZ 3.28Å; T199-K223 VanDerWaalsContact O-CD 3.31Å; T199-K223 WeakPolarHBondContact O-CD 3.35Å; T199-K223 PolarHBondContact O-NZ 3.37Å; T199-K223 VanDerWaalsContact O-NZ 3.11Å; D200-K223 WeakPolarHBondContact O-CB 3.26Å; D200-K223 PolarHBondContact O-N 3.35Å; Y202-K223 HydrophobicContact CE2-CB 4.23Å; K223-T225 PolarHBondContact O-N 3.47Å
224	D	96.8	Very high	98.5	Very high	137 Å²	137	49.1 Å²	49.1	73%	0.733	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	5.7	-178.8	-47.6	-43	0	0	0	115.4	P226	D224-P226 WeakPolarHBondContact O-CD 3.31Å
225	T	98.6	Very high	98.5	Very high	24 Å²	24	47.5 Å²	47.5	15%	0.147	25%	0.25	C	C	.	.			trans	-59.1	124.4	167.1	-62.2	0	0	0	0	108.8	V221 E222 K223 G227 L228 H253 V254	V221-T225 HydrophobicContact CG1-CG2 4.49Å; E222-T225 VanDerWaalsContact O-CB 3.3Å; E222-T225 WeakPolarHBondContact O-CB 3.43Å; E222-T225 PolarHBondContact O-N 2.94Å; E222-T225 PolarHBondContact O-OG1 3.23Å; K223-T225 PolarHBondContact O-N 3.47Å; T225-G227 PolarHBondContact O-N 2.83Å; T225-L228 WeakPolarHBondContact O-CB 3.48Å; T225-L228 PolarHBondContact O-N 3.09Å; T225-H253 VanDerWaalsContact CG2-O 3.25Å; T225-H253 WeakPolarHBondContact CG2-O 3.3Å; T225-V254 HydrophobicContact CG2-CG2 4.42Å
226	P	98.4	Very high	98.5	Very high	103 Å²	103	50.2 Å²	50.2	67%	0.669	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	134.1	179.7	-27.4	35.6	0	0	0	111.8	D224 C252	D224-P226 WeakPolarHBondContact O-CD 3.31Å; P226-C252 WeakPolarHBondContact O-CA 3.19Å
227	G	98.4	Very high	98.5	Very high	30 Å²	30	55.4 Å²	55.4	31%	0.309	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.2	-11.1	-173.7	0	0	0	0	0	114.6	T225 L249 E250	T225-G227 PolarHBondContact O-N 2.83Å; G227-L249 WeakPolarHBondContact O-CA 3.41Å; G227-E250 WeakPolarHBondContact CA-O 3.38Å; G227-E250 PolarHBondContact O-N 2.91Å
228	L	98.8	Very high	98.5	Very high	22 Å²	22	55.8 Å²	55.8	12%	0.115	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	125.4	168	-179.8	64.9	0	0	0	110.4	Y202 V221 T225 F230 V247 L249	Y202-L228 HydrophobicContact CD2-CD2 4.09Å; Y202-L228 HydrophobicContact CE2-CD2 4.14Å; V221-L228 HydrophobicContact CG1-CD2 4.09Å; T225-L228 WeakPolarHBondContact O-CB 3.48Å; T225-L228 PolarHBondContact O-N 3.09Å; L228-F230 HydrophobicContact CD1-CE1 4.32Å; L228-F230 HydrophobicContact CD1-CZ 4.34Å; L228-F230 HydrophobicContact CD2-CZ 3.91Å; L228-F230 HydrophobicContact CG-CE1 4.39Å; L228-F230 HydrophobicContact CG-CE2 4.49Å; L228-F230 HydrophobicContact CG-CZ 3.93Å; L228-V247 HydrophobicContact CD1-CG1 3.44Å; L228-V247 VanDerWaalsContact CD1-CG1 3.44Å; L228-L249 HydrophobicContact CD1-CD2 3.89Å
229	S	98.8	Very high	98.5	Very high	48 Å²	48	56.4 Å²	56.4	34%	0.336	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	173.6	173	69.6	0	0	0	0	112.1	I248	S229-I248 PolarHBondContact N-O 3.3Å; S229-I248 PolarHBondContact O-N 3.24Å; S229-I248 WeakPolarHBondContact OG-CB 3.27Å
230	F	98.8	Very high	98.5	Very high	57 Å²	57	57.1 Å²	57.1	25%	0.25	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	142.5	-172.3	-53.7	-74.7	0	0	0	111.8	Y202 L228 A246 V247	Y202-F230 AromaticContact CE1-CE1 3.6Å; Y202-F230 HydrophobicContact CE1-CE1 3.6Å; Y202-F230 HydrophobicContact CE1-CZ 4.16Å; Y202-F230 HydrophobicContact CE2-CE1 4.19Å; Y202-F230 AromaticContact CE2-CZ 3.91Å; Y202-F230 HydrophobicContact CE2-CZ 3.91Å; Y202-F230 AromaticContact CZ-CE1 3.41Å; Y202-F230 VanDerWaalsContact CZ-CE1 3.41Å; Y202-F230 AromaticContact CZ-CZ 3.49Å; Y202-F230 VanDerWaalsContact CZ-CZ 3.49Å; Y202-F230 VanDerWaalsContact OH-CE1 3.23Å; Y202-F230 WeakPolarHBondContact OH-CE1 3.34Å; Y202-F230 WeakPolarHBondContact OH-CZ 3.33Å; L228-F230 HydrophobicContact CD1-CE1 4.32Å; L228-F230 HydrophobicContact CD1-CZ 4.34Å; L228-F230 HydrophobicContact CD2-CZ 3.91Å; L228-F230 HydrophobicContact CG-CE1 4.39Å; L228-F230 HydrophobicContact CG-CE2 4.49Å; L228-F230 HydrophobicContact CG-CZ 3.93Å; F230-A246 WeakPolarHBondContact CA-O 3.5Å; F230-V247 HydrophobicContact CD1-CG2 3.98Å; F230-V247 HydrophobicContact CE1-CG1 4.26Å; F230-V247 HydrophobicContact CE1-CG2 4Å
231	G	98.5	Very high	98.5	Very high	22 Å²	22	57.1 Å²	57.1	23%	0.227	30%	0.303	C	S	.	.			trans	-71.1	-174.7	171.2	0	0	0	0	0	113	R245 A246	G231-R245 WeakPolarHBondContact O-CD 3.11Å; G231-A246 PolarHBondContact N-O 3Å
232	K	98.3	Very high	98.5	Very high	153 Å²	153	57.1 Å²	57.1	67%	0.665	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-64.3	158.9	170.8	67.9	-179.4	-178.1	-179.4	0	111.2	E234	K232-E234 WeakPolarHBondContact CE-OE2 3.3Å; K232-E234 PolarHBondContact O-N 3.2Å
233	K	98.4	Very high	98.5	Very high	68 Å²	68	55 Å²	55	30%	0.296	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-69.7	119.1	167.2	-162.9	177.3	78.5	176.6	0	109.6	E72 P243	E72-K233 PolarHBondContact O-NZ 3.27Å; E72-K233 WeakPolarHBondContact OE2-CE 3.3Å; E72-K233 IonicContact OE2-NZ 3.64Å; E72-K233 PolarHBondContact OE2-NZ 2.81Å; K233-P243 HydrophobicContact CD-CB 4.25Å; K233-P243 HydrophobicContact CG-CB 4.37Å
234	E	98.6	Very high	98.5	Very high	63 Å²	63	52.7 Å²	52.7	29%	0.294	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-74	139	-179	-59.9	-58	166.3	0	0	111.8	K232 T244	K232-E234 WeakPolarHBondContact CE-OE2 3.3Å; K232-E234 PolarHBondContact O-N 3.2Å; E234-T244 WeakPolarHBondContact CB-O 3.41Å; E234-T244 WeakPolarHBondContact CG-O 3.3Å; E234-T244 PolarHBondContact N-O 3.15Å
235	K	98.5	Very high	98.6	Very high	159 Å²	159	49 Å²	49	69%	0.691	26%	0.26	S	S	*	.	P	Polyproline II helix	trans	-84.9	124.8	173.6	-66.7	-61.1	-175.3	179.2	0	109.6	E72	E72-K235 VanDerWaalsContact OE1-CD 3.26Å; E72-K235 WeakPolarHBondContact OE1-CD 3.4Å; E72-K235 IonicContact OE1-NZ 2.7Å; E72-K235 PolarHBondContact OE1-NZ 3.12Å; E72-K235 IonicContact OE2-NZ 2.76Å; E72-K235 PolarHBondContact OE2-NZ 3.21Å
236	K	98.7	Very high	98.6	Very high	60 Å²	60	49.1 Å²	49.1	26%	0.261	26%	0.263	S	S	.	.			trans	-126.7	163.9	-171.4	-55.6	-172.8	-59.2	-77.7	0	111.4	G238 W239 N240 Q242 T244	K236-G238 WeakPolarHBondContact CB-O 3.33Å; K236-G238 WeakPolarHBondContact CE-O 3.43Å; K236-W239 WeakPolarHBondContact CE-O 3.27Å; K236-W239 PolarHBondContact NZ-O 3.02Å; K236-N240 PolarHBondContact O-OD1 2.96Å; K236-Q242 PolarHBondContact NZ-O 2.99Å; K236-T244 HydrophobicContact CD-CG2 4.27Å; K236-T244 WeakPolarHBondContact CD-OG1 3.31Å; K236-T244 WeakPolarHBondContact CE-OG1 3.4Å; K236-T244 PolarHBondContact NZ-OG1 3.42Å
237	V	98.8	Very high	98.6	Very high	110 Å²	110	44.2 Å²	44.2	67%	0.667	23%	0.231	S	C	*	.	S	Bend	trans	-73.5	-42.7	175.9	176.1	0	0	0	0	111.3	R390	V237-R390 HydrophobicContact CG1-CB 4.2Å; V237-R390 HydrophobicContact CG1-CG 3.99Å; V237-R390 WeakPolarHBondContact O-CD 3.49Å; V237-R390 PolarHBondContact O-NH1 3.36Å
238	G	98.8	Very high	98.7	Very high	8 Å²	8	44.8 Å²	44.8	8%	0.082	23%	0.227	C	C	.	.	S	Bend	trans	-146.6	-167.9	177.3	0	0	0	0	0	109.5	K236 N240 D391	K236-G238 WeakPolarHBondContact CB-O 3.33Å; K236-G238 WeakPolarHBondContact CE-O 3.43Å; G238-N240 PolarHBondContact O-N 3.49Å; G238-D391 WeakPolarHBondContact CA-OD1 3.42Å
239	W	98.8	Very high	98.7	Very high	13 Å²	13	43.8 Å²	43.8	5%	0.049	22%	0.221	C	C	.	.			trans	56.5	39.5	-170.1	-80	24.1	0	0	0	112.2	S119 A122 I126 K236 Q242 I281 D391 V394 H395 L398	S119-W239 WeakPolarHBondContact OG-CA 3.44Å; A122-W239 HydrophobicContact CB-CH2 3.82Å; A122-W239 HydrophobicContact CB-CZ2 3.29Å; I126-W239 HydrophobicContact CD1-CH2 4.28Å; I126-W239 HydrophobicContact CD1-CZ3 4.06Å; K236-W239 WeakPolarHBondContact CE-O 3.27Å; K236-W239 PolarHBondContact NZ-O 3.02Å; W239-Q242 HydrophobicContact CB-CG 4.05Å; W239-Q242 HydrophobicContact CE3-CG 4.45Å; W239-Q242 WeakPolarHBondContact O-CG 3.43Å; W239-I281 HydrophobicContact CH2-CD1 4.2Å; W239-I281 HydrophobicContact CZ2-CD1 4.14Å; W239-D391 VanDerWaalsContact CD1-O 3.3Å; W239-D391 PolarHBondContact N-OD1 3.44Å; W239-D391 PolarHBondContact NE1-O 3.34Å; W239-D391 VanDerWaalsContact NE1-O 3.1Å; W239-V394 HydrophobicContact CD2-CG1 3.63Å; W239-V394 VanDerWaalsContact CE2-CG1 3.43Å; W239-V394 HydrophobicContact CE3-CG1 4.25Å; W239-V394 HydrophobicContact CG-CG1 3.89Å; W239-V394 HydrophobicContact CZ2-CG1 3.91Å; W239-H395 AromaticContact CE2-CD2 3.75Å; W239-H395 AromaticContact CE2-NE2 3.49Å; W239-H395 AromaticContact CZ2-CD2 3.45Å; W239-H395 VanDerWaalsContact CZ2-CD2 3.45Å; W239-H395 WeakPolarHBondContact CZ2-CD2 3.05Å; W239-H395 AromaticContact CZ2-NE2 3.36Å; W239-H395 WeakPolarHBondContact CZ2-NE2 3.48Å; W239-H395 AromaticContact NE1-CD2 3.59Å; W239-H395 AromaticContact NE1-NE2 3.08Å; W239-H395 PolarHBondContact NE1-NE2 3.3Å; W239-L398 HydrophobicContact CE3-CD1 3.87Å; W239-L398 HydrophobicContact CH2-CD1 3.28Å; W239-L398 HydrophobicContact CZ2-CD1 4.01Å; W239-L398 HydrophobicContact CZ3-CD1 3.19Å
240	N	98.9	Very high	98.7	Very high	14 Å²	14	47.6 Å²	47.6	8%	0.075	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-21	-171.5	-71	-34.8	0	0	0	113.5	D69 E72 S119 K236 G238 Q242 R390	D69-N240 WeakPolarHBondContact O-CB 3.3Å; D69-N240 WeakPolarHBondContact OD1-CB 3.48Å; D69-N240 PolarHBondContact OD1-ND2 3.24Å; E72-N240 VanDerWaalsContact CA-O 3.28Å; E72-N240 WeakPolarHBondContact CA-O 3.49Å; E72-N240 HydrophobicContact CG-CB 4.24Å; S119-N240 PolarHBondContact OG-N 2.97Å; K236-N240 PolarHBondContact O-OD1 2.96Å; G238-N240 PolarHBondContact O-N 3.49Å; N240-Q242 PolarHBondContact O-N 2.94Å; N240-R390 PolarHBondContact ND2-NH1 2.9Å
241	S	98.8	Very high	98.7	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.007	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-5.4	175.2	73.3	0	0	0	0	113.5	I73 F74 P75 S119 T120	I73-S241 CarbonylContact O-C 3.57Å; I73-S241 VanDerWaalsContact O-CA 3.26Å; I73-S241 WeakPolarHBondContact O-CA 3.45Å; I73-S241 WeakPolarHBondContact O-CB 3.25Å; I73-S241 VanDerWaalsContact O-O 3.06Å; F74-S241 VanDerWaalsContact CA-O 3.31Å; F74-S241 WeakPolarHBondContact CA-O 3.49Å; F74-S241 WeakPolarHBondContact CD2-O 3.49Å; P75-S241 WeakPolarHBondContact CD-O 3.5Å; S119-S241 VanDerWaalsContact CB-OG 3.27Å; S119-S241 WeakPolarHBondContact CB-OG 3.47Å; S119-S241 PolarHBondContact OG-N 2.68Å; S119-S241 VanDerWaalsContact OG-N 3.15Å; S119-S241 PolarHBondContact OG-OG 2.77Å; T120-S241 PolarHBondContact N-OG 3.36Å; T120-S241 WeakPolarHBondContact OG1-CB 3.32Å; T120-S241 PolarHBondContact OG1-OG 3.27Å
242	Q	98.3	Very high	98.7	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.237	C	C	.	.	S	Bend	trans	-117.8	125.5	175.7	51.4	178.5	-76.2	0	0	109.9	S119 Y123 S194 K236 W239 N240 T244	S119-Q242 PolarHBondContact O-NE2 3.27Å; Y123-Q242 HydrophobicContact CD2-CB 4.21Å; Y123-Q242 HydrophobicContact CG-CB 4.35Å; S194-Q242 PolarHBondContact OG-OE1 3.39Å; K236-Q242 PolarHBondContact NZ-O 2.99Å; W239-Q242 HydrophobicContact CB-CG 4.05Å; W239-Q242 HydrophobicContact CE3-CG 4.45Å; W239-Q242 WeakPolarHBondContact O-CG 3.43Å; N240-Q242 PolarHBondContact O-N 2.94Å; Q242-T244 PolarHBondContact O-N 3.29Å
243	P	98.3	Very high	98.7	Very high	8 Å²	8	46 Å²	46	5%	0.052	23%	0.227	C	C	.	.			trans	-64.8	140.4	175	24	-26.8	0	0	0	108.7	F74 S194 G195 D198 K233	F74-P243 HydrophobicContact CD2-CG 4.48Å; F74-P243 HydrophobicContact CG-CG 4.42Å; S194-P243 CarbonylContact C-O 3.53Å; G195-P243 PolarHBondContact N-O 3.21Å; D198-P243 HydrophobicContact CB-CG 3.63Å; D198-P243 WeakPolarHBondContact OD2-CB 3.39Å; D198-P243 VanDerWaalsContact OD2-CG 3.31Å; D198-P243 WeakPolarHBondContact OD2-CG 3.34Å; K233-P243 HydrophobicContact CD-CB 4.25Å; K233-P243 HydrophobicContact CG-CB 4.37Å
244	T	98.8	Very high	98.7	Very high	6 Å²	6	42.8 Å²	42.8	4%	0.037	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	122.5	176	-56.2	0	0	0	0	107.1	F192 I193 E234 K236 Q242	F192-T244 HydrophobicContact CB-CG2 4.24Å; I193-T244 WeakPolarHBondContact O-CA 3.5Å; E234-T244 WeakPolarHBondContact CB-O 3.41Å; E234-T244 WeakPolarHBondContact CG-O 3.3Å; E234-T244 PolarHBondContact N-O 3.15Å; K236-T244 HydrophobicContact CD-CG2 4.27Å; K236-T244 WeakPolarHBondContact CD-OG1 3.31Å; K236-T244 WeakPolarHBondContact CE-OG1 3.4Å; K236-T244 PolarHBondContact NZ-OG1 3.42Å; Q242-T244 PolarHBondContact O-N 3.29Å
245	R	98.8	Very high	98.7	Very high	61 Å²	61	42 Å²	42	23%	0.23	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	162.6	-177.2	-54.4	-168.5	-165.7	-150	8.1	110.5	I193 G196 D198 G231	I193-R245 PolarHBondContact N-O 3.08Å; I193-R245 PolarHBondContact O-N 3.11Å; G196-R245 WeakPolarHBondContact O-CD 3.49Å; G196-R245 VanDerWaalsContact O-CG 3.22Å; G196-R245 WeakPolarHBondContact O-CG 3.45Å; G196-R245 PolarHBondContact O-NE 3.4Å; G196-R245 VanDerWaalsContact O-NE 3.13Å; D198-R245 IonicContact OD1-NH2 3.54Å; D198-R245 IonicContact OD2-CZ 2.92Å; D198-R245 IonicContact OD2-NE 2.87Å; D198-R245 PolarHBondContact OD2-NE 3.02Å; D198-R245 IonicContact OD2-NH2 2.73Å; D198-R245 PolarHBondContact OD2-NH2 3.35Å; G231-R245 WeakPolarHBondContact O-CD 3.11Å
246	A	98.8	Very high	98.7	Very high	25 Å²	25	36.1 Å²	36.1	21%	0.207	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	143.8	157.5	0	0	0	0	0	109.7	K190 F230 G231 I248	K190-A246 CarbonylContact O-C 3.57Å; K190-A246 WeakPolarHBondContact O-CA 3.43Å; K190-A246 WeakPolarHBondContact O-CB 3.43Å; F230-A246 WeakPolarHBondContact CA-O 3.5Å; G231-A246 PolarHBondContact N-O 3Å; A246-I248 HydrophobicContact CB-CG1 4.42Å
247	V	98.9	Very high	98.7	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	121.3	167.5	176.2	0	0	0	0	106.9	S189 K190 I193 Y202 L228 F230	S189-V247 WeakPolarHBondContact CA-O 3.5Å; K190-V247 HydrophobicContact CB-CB 4.19Å; K190-V247 PolarHBondContact N-O 3.31Å; K190-V247 PolarHBondContact O-N 3.48Å; I193-V247 HydrophobicContact CB-CG2 3.78Å; I193-V247 HydrophobicContact CG1-CB 4.23Å; I193-V247 HydrophobicContact CG1-CG2 3.69Å; I193-V247 HydrophobicContact CG2-CG2 3.85Å; Y202-V247 HydrophobicContact CD1-CG2 4.17Å; Y202-V247 HydrophobicContact CE1-CG2 4.04Å; L228-V247 HydrophobicContact CD1-CG1 3.44Å; L228-V247 VanDerWaalsContact CD1-CG1 3.44Å; F230-V247 HydrophobicContact CD1-CG2 3.98Å; F230-V247 HydrophobicContact CE1-CG1 4.26Å; F230-V247 HydrophobicContact CE1-CG2 4Å
248	I	98.9	Very high	98.6	Very high	43 Å²	43	33.2 Å²	33.2	22%	0.221	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	131.7	-171.3	-59.4	163.1	0	0	0	107.7	S229 A246 E250	S229-I248 PolarHBondContact N-O 3.3Å; S229-I248 PolarHBondContact O-N 3.24Å; S229-I248 WeakPolarHBondContact OG-CB 3.27Å; A246-I248 HydrophobicContact CB-CG1 4.42Å; I248-E250 HydrophobicContact CG2-CG 3.99Å
249	L	98.9	Very high	98.6	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	112.4	-179	-64.4	151.1	0	0	0	106.7	T175 L186 N187 G188 V204 G227 L228 C252	T175-L249 HydrophobicContact CG2-CD1 3.87Å; L186-L249 HydrophobicContact CB-CB 4.18Å; L186-L249 HydrophobicContact CB-CD1 4.36Å; L186-L249 HydrophobicContact CB-CD2 4.2Å; L186-L249 HydrophobicContact CB-CG 4.48Å; L186-L249 HydrophobicContact CD2-CD1 4.18Å; L186-L249 HydrophobicContact CD2-CD2 4.25Å; N187-L249 CarbonylContact C-O 3.55Å; N187-L249 VanDerWaalsContact CA-O 3.29Å; N187-L249 WeakPolarHBondContact CA-O 3.39Å; G188-L249 PolarHBondContact N-O 3.32Å; G188-L249 PolarHBondContact O-N 2.87Å; V204-L249 HydrophobicContact CG1-CD1 4.06Å; G227-L249 WeakPolarHBondContact O-CA 3.41Å; L228-L249 HydrophobicContact CD1-CD2 3.89Å; L249-C252 HydrophobicContact CB-CB 4.18Å; L249-C252 HydrophobicContact CD2-CB 3.74Å
250	E	98.8	Very high	98.6	Very high	128 Å²	128	34.5 Å²	34.5	60%	0.598	18%	0.18	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-126.3	107.6	179.1	-72.9	177.9	-173.3	0	0	108.3	G227 I248 C252	G227-E250 WeakPolarHBondContact CA-O 3.38Å; G227-E250 PolarHBondContact O-N 2.91Å; I248-E250 HydrophobicContact CG2-CG 3.99Å; E250-C252 PolarHBondContact O-N 3.3Å; E250-C252 VanDerWaalsContact O-N 3.15Å
251	D	98.6	Very high	98.6	Very high	99 Å²	99	34.8 Å²	34.8	53%	0.529	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	45.5	45	-172.3	-62.2	-39.3	0	0	0	112.3	I185 L186 N187 H253	I185-D251 HydrophobicContact CG2-CB 4.22Å; L186-D251 PolarHBondContact O-N 3.39Å; N187-D251 PolarHBondContact ND2-OD1 2.83Å; N187-D251 PolarHBondContact OD1-N 3.31Å; D251-H253 PolarHBondContact O-CD2 3.22Å; D251-H253 PolarHBondContact O-N 3.44Å
252	C	98.8	Very high	98.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	110.5	-175.7	177.3	0	0	0	0	110.4	L186 P226 L249 E250 V254	L186-C252 HydrophobicContact CB-CB 4.06Å; L186-C252 PolarHBondContact N-O 3.37Å; L186-C252 PolarHBondContact O-N 3.28Å; P226-C252 WeakPolarHBondContact O-CA 3.19Å; L249-C252 HydrophobicContact CB-CB 4.18Å; L249-C252 HydrophobicContact CD2-CB 3.74Å; E250-C252 PolarHBondContact O-N 3.3Å; E250-C252 VanDerWaalsContact O-N 3.15Å; C252-V254 PolarHBondContact O-N 3.19Å
253	H	98.3	Very high	98.6	Very high	99 Å²	99	44.7 Å²	44.7	46%	0.458	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	113.6	-177.7	-71.8	-110.9	0	0	0	111.4	I185 T225 D251	I185-H253 HydrophobicContact CD1-CB 4.4Å; I185-H253 WeakPolarHBondContact CD1-CE1 3.24Å; I185-H253 WeakPolarHBondContact CD1-ND1 3.46Å; T225-H253 VanDerWaalsContact CG2-O 3.25Å; T225-H253 WeakPolarHBondContact CG2-O 3.3Å; D251-H253 PolarHBondContact O-CD2 3.22Å; D251-H253 PolarHBondContact O-N 3.44Å
254	V	98.6	Very high	98.6	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	126.9	-178.4	-174.3	0	0	0	0	110.1	H183 Y184 L186 V219 V220 V221 T225 C252 N258	H183-V254 CarbonylContact C-O 3.57Å; H183-V254 WeakPolarHBondContact CA-O 3.42Å; Y184-V254 PolarHBondContact N-O 3.22Å; Y184-V254 PolarHBondContact O-N 3.13Å; L186-V254 HydrophobicContact CD1-CB 4.06Å; L186-V254 HydrophobicContact CD1-CG2 3.85Å; L186-V254 HydrophobicContact CD2-CG2 4.34Å; V219-V254 HydrophobicContact CG1-CB 4.23Å; V219-V254 HydrophobicContact CG1-CG1 3.48Å; V219-V254 VanDerWaalsContact CG1-CG1 3.48Å; V220-V254 WeakPolarHBondContact O-CG1 3.36Å; V221-V254 HydrophobicContact CG1-CG2 4.14Å; V221-V254 HydrophobicContact CG2-CG1 4.48Å; V221-V254 HydrophobicContact CG2-CG2 3.92Å; T225-V254 HydrophobicContact CG2-CG2 4.42Å; C252-V254 PolarHBondContact O-N 3.19Å; V254-N258 HydrophobicContact CG1-CB 3.86Å
255	P	98.4	Very high	98.5	Very high	45 Å²	45	49 Å²	49	29%	0.292	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56	141.9	178.9	-27	35.3	0	0	0	112.6	T257 N258	P255-T257 WeakPolarHBondContact CB-OG1 3.38Å; P255-T257 PolarHBondContact O-N 3.5Å; P255-T257 VanDerWaalsContact O-N 3.16Å; P255-N258 WeakPolarHBondContact O-CB 3.42Å; P255-N258 PolarHBondContact O-N 3.46Å
256	V	98.4	Very high	98.5	Very high	37 Å²	37	46.1 Å²	46.1	22%	0.224	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-59.2	-28.3	174.7	171.7	0	0	0	0	111.4	L179 D182 Y184 N258 R259	L179-V256 HydrophobicContact CD1-CG2 3.33Å; D182-V256 WeakPolarHBondContact O-CG2 3.48Å; D182-V256 PolarHBondContact O-N 3.02Å; Y184-V256 HydrophobicContact CD2-CG2 4.02Å; Y184-V256 HydrophobicContact CE2-CB 4.25Å; Y184-V256 HydrophobicContact CE2-CG1 4.23Å; Y184-V256 HydrophobicContact CE2-CG2 3.85Å; V256-N258 PolarHBondContact O-N 3.49Å; V256-R259 VanDerWaalsContact O-CB 3.29Å; V256-R259 WeakPolarHBondContact O-CB 3.46Å; V256-R259 PolarHBondContact O-N 3.11Å
257	T	98.3	Very high	98.5	Very high	100 Å²	100	46.5 Å²	46.5	61%	0.613	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-64.5	-12	174.5	53.5	0	0	0	0	113.8	Q142 P255	Q142-T257 PolarHBondContact NE2-O 3.01Å; P255-T257 WeakPolarHBondContact CB-OG1 3.38Å; P255-T257 PolarHBondContact O-N 3.5Å; P255-T257 VanDerWaalsContact O-N 3.16Å
258	N	98.6	Very high	98.5	Very high	9 Å²	9	51.6 Å²	51.6	5%	0.048	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-89.6	-0.4	172.2	-76.8	21	0	0	0	113.3	V219 V220 V254 P255 V256 L260	V219-N258 HydrophobicContact CG1-CB 4.38Å; V220-N258 HydrophobicContact CB-CB 4.33Å; V220-N258 PolarHBondContact N-O 2.91Å; V220-N258 VanDerWaalsContact O-CB 3.25Å; V220-N258 WeakPolarHBondContact O-CB 3.49Å; V220-N258 PolarHBondContact O-ND2 2.92Å; V254-N258 HydrophobicContact CG1-CB 3.86Å; P255-N258 WeakPolarHBondContact O-CB 3.42Å; P255-N258 PolarHBondContact O-N 3.46Å; V256-N258 PolarHBondContact O-N 3.49Å; N258-L260 PolarHBondContact O-N 3.44Å
259	R	98.8	Very high	98.5	Very high	47 Å²	47	49.6 Å²	49.6	18%	0.177	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	124.7	175.6	-172.8	-175.4	68.9	-136.3	-0.1	110.8	Q142 Y184 C218 V219 V256 G261	Q142-R259 PolarHBondContact NE2-O 3.43Å; Y184-R259 HydrophobicContact CE2-CB 4.22Å; Y184-R259 PolarHBondContact OH-NH1 3.49Å; C218-R259 CarbonylContact O-C 3.53Å; C218-R259 WeakPolarHBondContact O-CA 3.33Å; C218-R259 WeakPolarHBondContact O-CG 3.43Å; V219-R259 HydrophobicContact CG2-CB 4.41Å; V219-R259 HydrophobicContact CG2-CG 4.37Å; V256-R259 VanDerWaalsContact O-CB 3.29Å; V256-R259 WeakPolarHBondContact O-CB 3.46Å; V256-R259 PolarHBondContact O-N 3.11Å; R259-G261 PolarHBondContact NE-O 3.19Å
260	L	98.6	Very high	98.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	122.6	173.4	-56.8	-174.8	0	0	0	109.7	M133 I134 F137 C218 V220 N258 I269	M133-L260 HydrophobicContact CB-CD1 4.49Å; I134-L260 HydrophobicContact CG1-CD1 4.04Å; I134-L260 HydrophobicContact CG2-CD2 4.46Å; F137-L260 HydrophobicContact CB-CB 4.49Å; C218-L260 HydrophobicContact CB-CB 4.18Å; C218-L260 PolarHBondContact O-N 2.86Å; V220-L260 HydrophobicContact CG2-CD1 3.97Å; V220-L260 HydrophobicContact CG2-CD2 3.76Å; V220-L260 HydrophobicContact CG2-CG 3.8Å; N258-L260 PolarHBondContact O-N 3.44Å; L260-I269 HydrophobicContact CB-CD1 4.41Å
261	G	98	Very high	98.3	Very high	21 Å²	21	46.1 Å²	46.1	22%	0.216	24%	0.244	C	C	.	.	S	Bend	trans	64.3	-158.8	-173.1	0	0	0	0	0	114	F137 R259	F137-G261 PolarHBondContact O-N 3.44Å; R259-G261 PolarHBondContact NE-O 3.19Å
262	Q	98.1	Very high	98.2	Very high	119 Å²	119	47.7 Å²	47.7	56%	0.556	24%	0.243	S	C	*	.	S	Bend	trans	-88.8	160.6	179.3	-58.1	-59.6	-20.1	0	0	111.6	G264 Q265	Q262-G264 PolarHBondContact O-N 3.26Å; Q262-Q265 HydrophobicContact CB-CG 4.13Å; Q262-Q265 WeakPolarHBondContact O-CB 3.38Å; Q262-Q265 PolarHBondContact O-N 2.84Å
263	E	98.4	Very high	98.1	Very high	90 Å²	90	47.8 Å²	47.8	42%	0.421	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	140.4	171.6	-67.4	-167.7	142	0	0	111.5	Y184 S217 Q265	Y184-E263 WeakPolarHBondContact CE1-OE1 3.47Å; Y184-E263 VanDerWaalsContact OH-CD 3.23Å; Y184-E263 VanDerWaalsContact OH-CG 3.24Å; Y184-E263 WeakPolarHBondContact OH-CG 3.27Å; Y184-E263 PolarHBondContact OH-OE1 2.79Å; S217-E263 VanDerWaalsContact OG-CA 3.3Å; S217-E263 WeakPolarHBondContact OG-CA 3.22Å; E263-Q265 VanDerWaalsContact C-N 3.26Å; E263-Q265 PolarHBondContact O-N 2.76Å
264	G	98.1	Very high	97.9	Very high	18 Å²	18	43.9 Å²	43.9	19%	0.186	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	-1.7	-179.5	0	0	0	0	0	115	K214 I216 S217 Q262	K214-G264 WeakPolarHBondContact O-CA 3.23Å; I216-G264 CarbonylContact O-C 3.55Å; I216-G264 WeakPolarHBondContact O-CA 3.35Å; S217-G264 PolarHBondContact OG-N 3.4Å; Q262-G264 PolarHBondContact O-N 3.26Å
265	Q	98.5	Very high	97.7	Very high	86 Å²	86	44.8 Å²	44.8	40%	0.402	23%	0.231	S	C	.	.			trans	-89.1	-8	176.2	-64.2	-170.3	-39	0	0	114.1	I216 Q262 E263 F267 N268 I269	I216-Q265 PolarHBondContact O-N 2.98Å; Q262-Q265 HydrophobicContact CB-CG 4.13Å; Q262-Q265 WeakPolarHBondContact O-CB 3.38Å; Q262-Q265 PolarHBondContact O-N 2.84Å; E263-Q265 VanDerWaalsContact C-N 3.26Å; E263-Q265 PolarHBondContact O-N 2.76Å; Q265-F267 PolarHBondContact O-N 3.15Å; Q265-N268 PolarHBondContact O-N 2.86Å; Q265-N268 VanDerWaalsContact O-N 3.11Å; Q265-I269 HydrophobicContact CB-CD1 4.43Å; Q265-I269 WeakPolarHBondContact O-CG1 3.39Å; Q265-I269 PolarHBondContact O-N 3.21Å; Q265-I269 VanDerWaalsContact O-N 3.07Å
266	G	98.6	Very high	97.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.5	-42.2	-172.5	0	0	0	0	0	113.6	I216 N268 I269 A270	I216-G266 WeakPolarHBondContact O-CA 3.49Å; I216-G266 PolarHBondContact O-N 3.46Å; G266-N268 VanDerWaalsContact C-N 3.33Å; G266-N268 PolarHBondContact O-N 3.04Å; G266-I269 WeakPolarHBondContact O-CB 3.43Å; G266-I269 PolarHBondContact O-N 2.99Å; G266-A270 WeakPolarHBondContact O-CB 3.41Å; G266-A270 PolarHBondContact O-N 2.94Å
267	F	98.2	Very high	97.6	Very high	33 Å²	33	41 Å²	41	15%	0.145	21%	0.208	C	C	.	.	H	α-helix	trans	-66.7	-34.9	178.9	-162.6	-101.3	0	0	0	112.8	A170 A171 P213 I216 Q265 A270 M271	A170-F267 HydrophobicContact CB-CE2 4.17Å; A171-F267 HydrophobicContact CB-CD2 4.29Å; A171-F267 HydrophobicContact CB-CE2 3.71Å; A171-F267 HydrophobicContact CB-CZ 3.88Å; P213-F267 HydrophobicContact CB-CB 4.04Å; P213-F267 HydrophobicContact CB-CD1 3.59Å; P213-F267 HydrophobicContact CB-CE1 4.18Å; P213-F267 HydrophobicContact CB-CG 3.84Å; P213-F267 HydrophobicContact CG-CD1 4.11Å; P213-F267 HydrophobicContact CG-CE1 4.18Å; P213-F267 WeakPolarHBondContact O-CB 3.45Å; I216-F267 HydrophobicContact CB-CB 4.23Å; I216-F267 HydrophobicContact CD1-CB 4.23Å; I216-F267 HydrophobicContact CD1-CD2 3.74Å; I216-F267 HydrophobicContact CD1-CG 4.34Å; Q265-F267 PolarHBondContact O-N 3.15Å; F267-A270 WeakPolarHBondContact O-CB 3.4Å; F267-A270 PolarHBondContact O-N 3.26Å; F267-M271 HydrophobicContact CD1-CE 4.48Å; F267-M271 HydrophobicContact CD1-CG 3.91Å; F267-M271 HydrophobicContact CD2-CE 4.36Å; F267-M271 HydrophobicContact CE1-CE 3.95Å; F267-M271 HydrophobicContact CE1-CG 3.7Å; F267-M271 HydrophobicContact CE1-SD 3.89Å; F267-M271 HydrophobicContact CE2-CE 3.79Å; F267-M271 HydrophobicContact CZ-CE 3.57Å; F267-M271 HydrophobicContact CZ-CG 4.3Å; F267-M271 HydrophobicContact CZ-SD 3.96Å; F267-M271 VanDerWaalsContact O-CG 3.32Å; F267-M271 WeakPolarHBondContact O-CG 3.34Å; F267-M271 PolarHBondContact O-N 2.76Å
268	N	97.9	Very high	97.6	Very high	107 Å²	107	36.8 Å²	36.8	57%	0.572	18%	0.181	S	C	*	.	H	α-helix	trans	-67.2	-40.9	174.9	-70.9	-29.3	0	0	0	111.2	Q265 G266 M271 R272	Q265-N268 PolarHBondContact O-N 2.86Å; Q265-N268 VanDerWaalsContact O-N 3.11Å; G266-N268 VanDerWaalsContact C-N 3.33Å; G266-N268 PolarHBondContact O-N 3.04Å; N268-M271 PolarHBondContact O-N 3.47Å; N268-R272 WeakPolarHBondContact O-CG 3.42Å; N268-R272 PolarHBondContact O-N 3.34Å
269	I	98.6	Very high	97.6	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-59	-48.5	173.5	-65.9	167.6	0	0	0	109.9	M133 F137 M205 C218 L260 Q265 G266 M271 R272 G273	M133-I269 HydrophobicContact CB-CG2 4.41Å; M133-I269 HydrophobicContact CG-CG2 4.07Å; M133-I269 HydrophobicContact SD-CG2 4.1Å; F137-I269 HydrophobicContact CB-CD1 4.07Å; F137-I269 HydrophobicContact CB-CG1 4.32Å; F137-I269 HydrophobicContact CD1-CD1 4.36Å; F137-I269 HydrophobicContact CD1-CG1 3.84Å; F137-I269 HydrophobicContact CD2-CB 4.37Å; F137-I269 HydrophobicContact CD2-CG1 4.01Å; F137-I269 HydrophobicContact CD2-CG2 3.71Å; F137-I269 HydrophobicContact CE1-CG1 4.07Å; F137-I269 HydrophobicContact CE2-CB 4.39Å; F137-I269 HydrophobicContact CE2-CG1 4.27Å; F137-I269 HydrophobicContact CE2-CG2 3.9Å; F137-I269 HydrophobicContact CG-CD1 4.1Å; F137-I269 HydrophobicContact CG-CG1 3.8Å; F137-I269 HydrophobicContact CG-CG2 4.3Å; F137-I269 HydrophobicContact CZ-CG1 4.29Å; M205-I269 HydrophobicContact CE-CB 4.36Å; M205-I269 HydrophobicContact CE-CG2 4.04Å; C218-I269 HydrophobicContact CB-CD1 3.97Å; L260-I269 HydrophobicContact CB-CD1 4.41Å; Q265-I269 HydrophobicContact CB-CD1 4.43Å; Q265-I269 WeakPolarHBondContact O-CG1 3.39Å; Q265-I269 PolarHBondContact O-N 3.21Å; Q265-I269 VanDerWaalsContact O-N 3.07Å; G266-I269 WeakPolarHBondContact O-CB 3.43Å; G266-I269 PolarHBondContact O-N 2.99Å; I269-M271 PolarHBondContact O-N 2.94Å; I269-R272 PolarHBondContact O-N 2.93Å; I269-G273 PolarHBondContact O-N 3.33Å
270	A	98.1	Very high	97.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-55.1	-51.1	175.6	0	0	0	0	0	111.8	Y159 M205 G266 F267 R272 G273 L274	Y159-A270 WeakPolarHBondContact OH-CB 3.31Å; M205-A270 HydrophobicContact CE-CB 3.83Å; M205-A270 HydrophobicContact CG-CB 4.49Å; M205-A270 HydrophobicContact SD-CB 4.2Å; G266-A270 WeakPolarHBondContact O-CB 3.41Å; G266-A270 PolarHBondContact O-N 2.94Å; F267-A270 WeakPolarHBondContact O-CB 3.4Å; F267-A270 PolarHBondContact O-N 3.26Å; A270-R272 VanDerWaalsContact C-N 3.34Å; A270-R272 PolarHBondContact O-N 3.2Å; A270-G273 PolarHBondContact O-N 3.34Å; A270-G273 VanDerWaalsContact O-N 3.17Å; A270-L274 WeakPolarHBondContact O-CG 3.47Å; A270-L274 PolarHBondContact O-N 3.17Å
271	M	95.9	Very high	97.6	Very high	55 Å²	55	34.5 Å²	34.5	27%	0.271	17%	0.172	S	C	.	.	H	α-helix	trans	-63.1	-37.9	-178.9	-68.4	-53.4	98.9	0	0	112.6	F267 N268 I269 L274 N275	F267-M271 HydrophobicContact CD1-CE 4.48Å; F267-M271 HydrophobicContact CD1-CG 3.91Å; F267-M271 HydrophobicContact CD2-CE 4.36Å; F267-M271 HydrophobicContact CE1-CE 3.95Å; F267-M271 HydrophobicContact CE1-CG 3.7Å; F267-M271 HydrophobicContact CE1-SD 3.89Å; F267-M271 HydrophobicContact CE2-CE 3.79Å; F267-M271 HydrophobicContact CZ-CE 3.57Å; F267-M271 HydrophobicContact CZ-CG 4.3Å; F267-M271 HydrophobicContact CZ-SD 3.96Å; F267-M271 VanDerWaalsContact O-CG 3.32Å; F267-M271 WeakPolarHBondContact O-CG 3.34Å; F267-M271 PolarHBondContact O-N 2.76Å; N268-M271 PolarHBondContact O-N 3.47Å; I269-M271 PolarHBondContact O-N 2.94Å; M271-L274 HydrophobicContact CE-CD1 3.38Å; M271-L274 HydrophobicContact CE-CG 4.46Å; M271-L274 PolarHBondContact O-N 3.07Å; M271-L274 HydrophobicContact SD-CD1 4.09Å; M271-N275 PolarHBondContact O-N 3.02Å; M271-N275 PolarHBondContact O-ND2 3.31Å
272	R	96.4	Very high	97.7	Very high	132 Å²	132	33.5 Å²	33.5	50%	0.498	16%	0.162	S	C	.	.	H	α-helix	trans	-66.8	-38.4	175	-70.1	-174.7	62.3	-167.9	-0.2	111.8	W132 F137 N268 I269 A270 N275	W132-R272 HydrophobicContact CH2-CB 3.87Å; F137-R272 HydrophobicContact CZ-CB 4.2Å; N268-R272 WeakPolarHBondContact O-CG 3.42Å; N268-R272 PolarHBondContact O-N 3.34Å; I269-R272 PolarHBondContact O-N 2.93Å; A270-R272 VanDerWaalsContact C-N 3.34Å; A270-R272 PolarHBondContact O-N 3.2Å; R272-N275 PolarHBondContact O-N 3.1Å
273	G	96.3	Very high	97.7	Very high	2 Å²	2	27.9 Å²	27.9	2%	0.021	14%	0.135	C	C	.	.	H	α-helix	trans	-61.6	-47.2	172.7	0	0	0	0	0	112.8	I269 A270 N275 G276 G277	I269-G273 PolarHBondContact O-N 3.33Å; A270-G273 PolarHBondContact O-N 3.34Å; A270-G273 VanDerWaalsContact O-N 3.17Å; G273-N275 PolarHBondContact O-N 3.24Å; G273-G276 PolarHBondContact O-N 2.91Å; G273-G276 VanDerWaalsContact O-N 3.1Å; G273-G277 PolarHBondContact O-N 3.36Å
274	L	94.8	Very high	97.7	Very high	17 Å²	17	23.6 Å²	23.6	9%	0.089	12%	0.115	C	C	.	.	H	α-helix	trans	-60.7	-29.1	179.8	-68.8	178.9	0	0	0	113.1	A270 M271 G277 R278 E399	A270-L274 WeakPolarHBondContact O-CG 3.47Å; A270-L274 PolarHBondContact O-N 3.17Å; M271-L274 HydrophobicContact CE-CD1 3.38Å; M271-L274 HydrophobicContact CE-CG 4.46Å; M271-L274 PolarHBondContact O-N 3.07Å; M271-L274 HydrophobicContact SD-CD1 4.09Å; L274-G277 PolarHBondContact O-N 2.93Å; L274-R278 VanDerWaalsContact O-CB 3.3Å; L274-R278 WeakPolarHBondContact O-CB 3.24Å; L274-R278 WeakPolarHBondContact O-CD 3.4Å; L274-R278 WeakPolarHBondContact O-CG 3.4Å; L274-R278 PolarHBondContact O-N 3.44Å; L274-E399 WeakPolarHBondContact CD2-OE2 3.41Å
275	N	94.6	Very high	97.8	Very high	20 Å²	20	22.7 Å²	22.7	11%	0.107	11%	0.107	C	C	.	.	H	α-helix	trans	-63.2	-44.4	175.1	-69.3	-27.9	0	0	0	111.7	M271 R272 G273 R278 L341	M271-N275 PolarHBondContact O-N 3.02Å; M271-N275 PolarHBondContact O-ND2 3.31Å; R272-N275 PolarHBondContact O-N 3.1Å; G273-N275 PolarHBondContact O-N 3.24Å; N275-R278 PolarHBondContact OD1-NH1 3.49Å; N275-L341 HydrophobicContact CB-CD1 4.16Å; N275-L341 HydrophobicContact CB-CD2 4.27Å
276	G	96.8	Very high	97.8	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.01	9%	0.087	C	C	.	.	H	α-helix	trans	-68.6	-43.1	172.5	0	0	0	0	0	112.2	G273 R278 I279 N280	G273-G276 PolarHBondContact O-N 2.91Å; G273-G276 VanDerWaalsContact O-N 3.1Å; G276-R278 VanDerWaalsContact C-N 3.3Å; G276-R278 PolarHBondContact O-N 3.43Å; G276-I279 PolarHBondContact O-N 3.41Å; G276-I279 VanDerWaalsContact O-N 3.15Å; G276-N280 PolarHBondContact O-N 3.46Å; G276-N280 PolarHBondContact O-OD1 3.06Å
277	G	97.9	Very high	97.8	Very high	3 Å²	3	18.6 Å²	18.6	3%	0.031	9%	0.087	C	C	.	.	H	α-helix	trans	-57.5	-40	177.8	0	0	0	0	0	113.3	G273 L274 I279 N280 I281 E399	G273-G277 PolarHBondContact O-N 3.36Å; L274-G277 PolarHBondContact O-N 2.93Å; G277-I279 PolarHBondContact O-N 3.25Å; G277-N280 PolarHBondContact O-N 2.89Å; G277-I281 WeakPolarHBondContact O-CB 3.04Å; G277-I281 WeakPolarHBondContact O-CG2 3.35Å; G277-I281 PolarHBondContact O-N 3.27Å; G277-E399 WeakPolarHBondContact CA-OE2 3.42Å
278	R	98.8	Very high	97.9	Very high	11 Å²	11	17 Å²	17	4%	0.042	8%	0.081	C	C	.	.	H	α-helix	trans	-59.8	-43.2	174.1	-78.7	165.1	-168.7	159.8	1.7	113.4	L274 N275 G276 A282 K356 E399 M405	L274-R278 VanDerWaalsContact O-CB 3.3Å; L274-R278 WeakPolarHBondContact O-CB 3.24Å; L274-R278 WeakPolarHBondContact O-CD 3.4Å; L274-R278 WeakPolarHBondContact O-CG 3.4Å; L274-R278 PolarHBondContact O-N 3.44Å; N275-R278 PolarHBondContact OD1-NH1 3.49Å; G276-R278 VanDerWaalsContact C-N 3.3Å; G276-R278 PolarHBondContact O-N 3.43Å; R278-A282 VanDerWaalsContact O-CB 3.27Å; R278-A282 WeakPolarHBondContact O-CB 3.42Å; R278-A282 PolarHBondContact O-N 2.93Å; R278-K356 HydrophobicContact CB-CB 3.88Å; R278-K356 HydrophobicContact CB-CG 4.07Å; R278-K356 HydrophobicContact CG-CB 4.12Å; R278-K356 HydrophobicContact CG-CG 4.06Å; R278-E399 HydrophobicContact CG-CB 4.12Å; R278-E399 PolarHBondContact NE-O 2.89Å; R278-M405 HydrophobicContact CG-SD 4.32Å
279	I	98.9	Very high	97.9	Very high	0 Å²	0	12 Å²	12	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-64.9	-52	174.1	-70.7	157.6	0	0	0	108.9	G276 G277 I281 A282 S283 L334 A337 A338 L341 C352	G276-I279 PolarHBondContact O-N 3.41Å; G276-I279 VanDerWaalsContact O-N 3.15Å; G277-I279 PolarHBondContact O-N 3.25Å; I279-I281 PolarHBondContact O-N 3.2Å; I279-A282 CarbonylContact O-C 3.55Å; I279-A282 WeakPolarHBondContact O-CA 3.26Å; I279-A282 WeakPolarHBondContact O-CB 3.34Å; I279-A282 PolarHBondContact O-N 3.47Å; I279-A282 VanDerWaalsContact O-N 3.1Å; I279-S283 PolarHBondContact O-N 3.47Å; I279-S283 PolarHBondContact O-OG 3.25Å; I279-L334 HydrophobicContact CB-CD1 4.33Å; I279-L334 HydrophobicContact CG2-CD1 3.93Å; I279-A337 HydrophobicContact CG1-CB 4.45Å; I279-A338 HydrophobicContact CD1-CB 4.39Å; I279-A338 HydrophobicContact CG2-CB 4.05Å; I279-L341 HydrophobicContact CD1-CB 3.96Å; I279-L341 HydrophobicContact CD1-CD2 3.49Å; I279-L341 VanDerWaalsContact CD1-CD2 3.49Å; I279-L341 HydrophobicContact CD1-CG 4.36Å; I279-C352 VanDerWaalsContact CD1-SG 3.55Å
280	N	98.8	Very high	97.9	Very high	0 Å²	0	12 Å²	12	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-62.6	-41.7	-173	-60.7	-11.2	0	0	0	113	Y91 F110 S125 G276 G277 A282 S283 C284	Y91-N280 PolarHBondContact OH-ND2 3.45Å; F110-N280 HydrophobicContact CD2-CB 3.74Å; F110-N280 HydrophobicContact CE2-CB 3.95Å; S125-N280 WeakPolarHBondContact OG-CB 3.45Å; S125-N280 PolarHBondContact OG-ND2 3.15Å; S125-N280 VanDerWaalsContact OG-ND2 3.15Å; G276-N280 PolarHBondContact O-N 3.46Å; G276-N280 PolarHBondContact O-OD1 3.06Å; G277-N280 PolarHBondContact O-N 2.89Å; N280-A282 VanDerWaalsContact C-N 3.32Å; N280-A282 PolarHBondContact O-N 3.5Å; N280-S283 WeakPolarHBondContact O-CB 3.18Å; N280-S283 PolarHBondContact O-N 3.2Å; N280-C284 PolarHBondContact O-N 3.39Å; N280-C284 PolarHBondContact O-SG 2.89Å
281	I	98.8	Very high	98	Very high	8 Å²	8	12.4 Å²	12.4	4%	0.041	6%	0.057	C	C	.	.	H	α-helix	trans	-69.4	-31.7	177.3	-159.2	169.6	0	0	0	111.9	W239 G277 I279 C284 S285 K356 H395 L398 E399	W239-I281 HydrophobicContact CH2-CD1 4.2Å; W239-I281 HydrophobicContact CZ2-CD1 4.14Å; G277-I281 WeakPolarHBondContact O-CB 3.04Å; G277-I281 WeakPolarHBondContact O-CG2 3.35Å; G277-I281 PolarHBondContact O-N 3.27Å; I279-I281 PolarHBondContact O-N 3.2Å; I281-C284 PolarHBondContact O-N 2.95Å; I281-S285 PolarHBondContact O-N 2.76Å; I281-S285 PolarHBondContact O-OG 2.95Å; I281-K356 HydrophobicContact CG2-CG 4.06Å; I281-H395 HydrophobicContact CD1-CB 4.05Å; I281-H395 HydrophobicContact CG1-CB 3.88Å; I281-H395 PolarHBondContact O-ND1 2.88Å; I281-L398 HydrophobicContact CD1-CB 3.81Å; I281-E399 HydrophobicContact CB-CG 4.26Å; I281-E399 HydrophobicContact CD1-CG 4.09Å; I281-E399 HydrophobicContact CG2-CB 4.08Å; I281-E399 HydrophobicContact CG2-CG 3.96Å
282	A	98.9	Very high	98.1	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-68	-39.3	170.5	0	0	0	0	0	111.1	R278 I279 N280 C284 S285 L286 L334 V359	R278-A282 VanDerWaalsContact O-CB 3.27Å; R278-A282 WeakPolarHBondContact O-CB 3.42Å; R278-A282 PolarHBondContact O-N 2.93Å; I279-A282 CarbonylContact O-C 3.55Å; I279-A282 WeakPolarHBondContact O-CA 3.26Å; I279-A282 WeakPolarHBondContact O-CB 3.34Å; I279-A282 PolarHBondContact O-N 3.47Å; I279-A282 VanDerWaalsContact O-N 3.1Å; N280-A282 VanDerWaalsContact C-N 3.32Å; N280-A282 PolarHBondContact O-N 3.5Å; A282-C284 VanDerWaalsContact C-N 3.28Å; A282-C284 PolarHBondContact O-N 2.76Å; A282-S285 WeakPolarHBondContact O-CB 3.33Å; A282-S285 PolarHBondContact O-N 3.13Å; A282-S285 VanDerWaalsContact O-N 3.15Å; A282-L286 WeakPolarHBondContact O-CB 3.3Å; A282-L286 PolarHBondContact O-N 3Å; A282-L334 HydrophobicContact CB-CD1 3.61Å; A282-L334 HydrophobicContact CB-CD2 4.24Å; A282-V359 HydrophobicContact CB-CB 3.98Å; A282-V359 HydrophobicContact CB-CG1 3.94Å; A282-V359 WeakPolarHBondContact O-CG1 3.27Å
283	S	98.9	Very high	98.2	Very high	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-59.5	-40.8	171.9	-46.1	0	0	0	0	111.2	S107 E111 I279 N280 S285 L286 G287	S107-S283 WeakPolarHBondContact CA-OG 3.05Å; S107-S283 WeakPolarHBondContact CB-OG 3.36Å; S107-S283 WeakPolarHBondContact O-CB 3.25Å; S107-S283 PolarHBondContact OG-OG 3.4Å; E111-S283 WeakPolarHBondContact CA-O 3.44Å; I279-S283 PolarHBondContact O-N 3.47Å; I279-S283 PolarHBondContact O-OG 3.25Å; N280-S283 WeakPolarHBondContact O-CB 3.18Å; N280-S283 PolarHBondContact O-N 3.2Å; S283-S285 VanDerWaalsContact C-N 3.33Å; S283-S285 PolarHBondContact O-N 3.25Å; S283-L286 WeakPolarHBondContact O-CB 3.48Å; S283-L286 PolarHBondContact O-N 2.9Å; S283-G287 PolarHBondContact O-N 3.37Å
284	C	98.9	Very high	98.3	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-63.2	-40.7	176.1	-61.6	0	0	0	0	112.4	S114 V118 N280 I281 A282 L286 G287 A288	S114-C284 WeakPolarHBondContact CB-O 3.49Å; S114-C284 WeakPolarHBondContact OG-CA 3.45Å; S114-C284 WeakPolarHBondContact OG-CB 3.36Å; S114-C284 PolarHBondContact OG-SG 2.75Å; V118-C284 HydrophobicContact CG1-CB 4.46Å; N280-C284 PolarHBondContact O-N 3.39Å; N280-C284 PolarHBondContact O-SG 2.89Å; I281-C284 PolarHBondContact O-N 2.95Å; A282-C284 VanDerWaalsContact C-N 3.28Å; A282-C284 PolarHBondContact O-N 2.76Å; C284-L286 VanDerWaalsContact C-N 3.32Å; C284-L286 PolarHBondContact O-N 3.15Å; C284-G287 PolarHBondContact O-N 3.46Å; C284-A288 PolarHBondContact O-N 2.86Å
285	S	98.9	Very high	98.5	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-62.5	-41.4	174.5	-49.9	0	0	0	0	111.7	I281 A282 S283 A288 A289 C363 H395	I281-S285 PolarHBondContact O-N 2.76Å; I281-S285 PolarHBondContact O-OG 2.95Å; A282-S285 WeakPolarHBondContact O-CB 3.33Å; A282-S285 PolarHBondContact O-N 3.13Å; A282-S285 VanDerWaalsContact O-N 3.15Å; S283-S285 VanDerWaalsContact C-N 3.33Å; S283-S285 PolarHBondContact O-N 3.25Å; S285-A288 PolarHBondContact O-N 3.48Å; S285-A289 WeakPolarHBondContact O-CB 3.38Å; S285-A289 PolarHBondContact O-N 2.87Å; S285-C363 WeakPolarHBondContact O-CB 3.46Å; S285-H395 PolarHBondContact OG-ND1 3.46Å
286	L	98.9	Very high	98.7	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-64.8	-41.4	-180	-173.3	68.4	0	0	0	112.1	E111 A282 S283 C284 A289 H290 L327 R331 L334 V359	E111-L286 VanDerWaalsContact CD-CD2 3.42Å; E111-L286 HydrophobicContact CG-CB 4.46Å; E111-L286 HydrophobicContact CG-CD2 4.08Å; E111-L286 HydrophobicContact CG-CG 4.18Å; E111-L286 VanDerWaalsContact OE1-CD2 3.3Å; E111-L286 WeakPolarHBondContact OE1-CD2 3.19Å; E111-L286 WeakPolarHBondContact OE1-CG 3.34Å; A282-L286 WeakPolarHBondContact O-CB 3.3Å; A282-L286 PolarHBondContact O-N 3Å; S283-L286 WeakPolarHBondContact O-CB 3.48Å; S283-L286 PolarHBondContact O-N 2.9Å; C284-L286 VanDerWaalsContact C-N 3.32Å; C284-L286 PolarHBondContact O-N 3.15Å; L286-A289 PolarHBondContact O-N 3.11Å; L286-H290 WeakPolarHBondContact O-CB 3.14Å; L286-H290 PolarHBondContact O-N 2.9Å; L286-L327 HydrophobicContact CD1-CD1 3.61Å; L286-L327 HydrophobicContact CD1-CG 4.49Å; L286-L327 HydrophobicContact CG-CD1 4.49Å; L286-R331 HydrophobicContact CD1-CB 4.08Å; L286-R331 HydrophobicContact CD2-CB 3.77Å; L286-R331 HydrophobicContact CD2-CG 3.9Å; L286-L334 HydrophobicContact CB-CD2 4.39Å; L286-L334 HydrophobicContact CD2-CD2 3.93Å; L286-V359 HydrophobicContact CB-CG1 4.34Å
287	G	98.9	Very high	98.8	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60.6	-48	174.2	0	0	0	0	0	112.4	E111 T115 S283 C284 A289 H290 A291	E111-G287 WeakPolarHBondContact O-CA 3.25Å; T115-G287 WeakPolarHBondContact CG2-O 3.39Å; S283-G287 PolarHBondContact O-N 3.37Å; C284-G287 PolarHBondContact O-N 3.46Å; G287-A289 VanDerWaalsContact C-N 3.34Å; G287-A289 PolarHBondContact O-N 3.2Å; G287-H290 WeakPolarHBondContact O-CB 3.4Å; G287-H290 PolarHBondContact O-N 2.9Å; G287-A291 PolarHBondContact O-N 3.5Å
288	A	98.9	Very high	98.8	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-57.6	-46.2	176	0	0	0	0	0	112.2	V118 C284 S285 A291 C292 F388 I392	V118-A288 HydrophobicContact CG2-CB 3.58Å; C284-A288 PolarHBondContact O-N 2.86Å; S285-A288 PolarHBondContact O-N 3.48Å; A288-A291 PolarHBondContact O-N 3.1Å; A288-C292 WeakPolarHBondContact O-CB 3.16Å; A288-C292 PolarHBondContact O-N 3.29Å; A288-C292 PolarHBondContact O-SG 2.73Å; A288-F388 HydrophobicContact CB-CB 4.17Å; A288-F388 HydrophobicContact CB-CD1 3.73Å; A288-F388 HydrophobicContact CB-CE1 4.48Å; A288-F388 HydrophobicContact CB-CG 4.19Å; A288-I392 HydrophobicContact CB-CD1 4.16Å; A288-I392 HydrophobicContact CB-CG2 3.47Å; A288-I392 VanDerWaalsContact CB-CG2 3.47Å
289	A	98.9	Very high	98.8	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-64.8	-40	177.8	0	0	0	0	0	112.1	S285 L286 G287 C292 V293 L327 C363 I366	S285-A289 WeakPolarHBondContact O-CB 3.38Å; S285-A289 PolarHBondContact O-N 2.87Å; L286-A289 PolarHBondContact O-N 3.11Å; G287-A289 VanDerWaalsContact C-N 3.34Å; G287-A289 PolarHBondContact O-N 3.2Å; A289-C292 PolarHBondContact O-N 2.95Å; A289-V293 WeakPolarHBondContact O-CG2 3.36Å; A289-V293 PolarHBondContact O-N 3.44Å; A289-L327 HydrophobicContact CB-CD1 3.8Å; A289-C363 HydrophobicContact CB-CB 3.67Å; A289-I366 HydrophobicContact CB-CB 4.13Å; A289-I366 HydrophobicContact CB-CD1 4.17Å; A289-I366 HydrophobicContact CB-CG2 3.88Å
290	H	98.9	Very high	98.8	Very high	3 Å²	3	17.3 Å²	17.3	1%	0.014	8%	0.083	C	C	.	.	H	α-helix	trans	-59.1	-51	175	-171.5	102.8	0	0	0	111.1	L286 G287 C292 V293 Q294 L327 R331	L286-H290 WeakPolarHBondContact O-CB 3.14Å; L286-H290 PolarHBondContact O-N 2.9Å; G287-H290 WeakPolarHBondContact O-CB 3.4Å; G287-H290 PolarHBondContact O-N 2.9Å; H290-C292 VanDerWaalsContact C-N 3.32Å; H290-C292 PolarHBondContact O-N 3.15Å; H290-V293 PolarHBondContact O-N 2.7Å; H290-Q294 PolarHBondContact NE2-NE2 2.82Å; H290-Q294 PolarHBondContact O-N 2.86Å; H290-Q294 VanDerWaalsContact O-N 3.14Å; H290-L327 HydrophobicContact CB-CD1 4.28Å; H290-L327 HydrophobicContact CB-CD2 4.33Å; H290-R331 PolarHBondContact ND1-NH2 3.21Å
291	A	98.9	Very high	98.8	Very high	8 Å²	8	22.2 Å²	22.2	7%	0.066	11%	0.108	C	C	.	.	H	α-helix	trans	-59.5	-43.8	177.3	0	0	0	0	0	111.3	T115 G287 A288 V293 Q294 L295 F388	T115-A291 HydrophobicContact CG2-CB 4.36Å; G287-A291 PolarHBondContact O-N 3.5Å; A288-A291 PolarHBondContact O-N 3.1Å; A291-V293 PolarHBondContact O-N 2.74Å; A291-Q294 PolarHBondContact O-N 3.36Å; A291-L295 WeakPolarHBondContact O-CB 3.45Å; A291-L295 VanDerWaalsContact O-CG 3.29Å; A291-L295 WeakPolarHBondContact O-CG 3.24Å; A291-L295 PolarHBondContact O-N 2.94Å; A291-F388 HydrophobicContact CB-CE2 3.84Å; A291-F388 HydrophobicContact CB-CZ 3.82Å
292	C	98.9	Very high	98.8	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.2	-38.4	178.2	-76.5	0	0	0	0	113.5	A288 A289 H290 A296 C367 A370 F388	A288-C292 WeakPolarHBondContact O-CB 3.16Å; A288-C292 PolarHBondContact O-N 3.29Å; A288-C292 PolarHBondContact O-SG 2.73Å; A289-C292 PolarHBondContact O-N 2.95Å; H290-C292 VanDerWaalsContact C-N 3.32Å; H290-C292 PolarHBondContact O-N 3.15Å; C292-A296 WeakPolarHBondContact O-CB 3.44Å; C292-A296 PolarHBondContact O-N 3Å; C292-C367 HydrophobicContact CB-CB 4.4Å; C292-C367 PolarHBondContact SG-SG 3.3Å; C292-A370 HydrophobicContact CB-CB 3.62Å; C292-A370 WeakPolarHBondContact O-CB 3.38Å; C292-F388 VanDerWaalsContact SG-CB 3.6Å; C292-F388 WeakPolarHBondContact SG-CD2 3.39Å
293	V	98.9	Very high	98.8	Very high	4 Å²	4	31.4 Å²	31.4	2%	0.024	16%	0.155	C	C	.	.	H	α-helix	trans	-63.8	-43.8	174.4	170.5	0	0	0	0	110.9	I36 A289 H290 A291 R297 L320 M323 L327 I366	I36-V293 HydrophobicContact CD1-CG1 3.78Å; A289-V293 WeakPolarHBondContact O-CG2 3.36Å; A289-V293 PolarHBondContact O-N 3.44Å; H290-V293 PolarHBondContact O-N 2.7Å; A291-V293 PolarHBondContact O-N 2.74Å; V293-R297 WeakPolarHBondContact O-CB 3.18Å; V293-R297 PolarHBondContact O-N 2.81Å; V293-L320 HydrophobicContact CG1-CD1 4.35Å; V293-M323 HydrophobicContact CG2-CB 4.05Å; V293-M323 HydrophobicContact CG2-CE 4.01Å; V293-L327 HydrophobicContact CB-CD2 4.38Å; V293-L327 HydrophobicContact CG2-CD2 4.14Å; V293-I366 HydrophobicContact CG2-CG2 3.58Å
294	Q	98.7	Very high	98.8	Very high	75 Å²	75	38 Å²	38	35%	0.35	18%	0.184	S	C	.	.	H	α-helix	trans	-64.7	-48.6	178.1	-68.6	-175.7	-26.7	0	0	111.7	H290 A291 A296 R297 D298	H290-Q294 PolarHBondContact NE2-NE2 2.82Å; H290-Q294 PolarHBondContact O-N 2.86Å; H290-Q294 VanDerWaalsContact O-N 3.14Å; A291-Q294 PolarHBondContact O-N 3.36Å; Q294-A296 VanDerWaalsContact C-N 3.34Å; Q294-A296 PolarHBondContact O-N 3.07Å; Q294-R297 WeakPolarHBondContact O-CB 3.42Å; Q294-R297 PolarHBondContact O-N 2.83Å; Q294-D298 WeakPolarHBondContact O-CB 3.31Å; Q294-D298 VanDerWaalsContact O-CG 3.25Å; Q294-D298 PolarHBondContact O-N 3.5Å
295	L	98.8	Very high	98.7	Very high	67 Å²	67	42.5 Å²	42.5	35%	0.351	21%	0.205	S	C	.	.	H	α-helix	trans	-59.3	-44.2	177.1	-70.8	171.1	0	0	0	111.7	A291 D298 H299 A384 F388	A291-L295 WeakPolarHBondContact O-CB 3.45Å; A291-L295 VanDerWaalsContact O-CG 3.29Å; A291-L295 WeakPolarHBondContact O-CG 3.24Å; A291-L295 PolarHBondContact O-N 2.94Å; L295-D298 PolarHBondContact O-N 3.4Å; L295-H299 VanDerWaalsContact O-CB 3.29Å; L295-H299 WeakPolarHBondContact O-CB 3.45Å; L295-H299 PolarHBondContact O-N 3.15Å; L295-A384 HydrophobicContact CD1-CB 4.23Å; L295-F388 HydrophobicContact CD1-CE2 4.15Å
296	A	98.8	Very high	98.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.7	-48.2	176.8	0	0	0	0	0	111.5	C292 Q294 D298 H299 L300 M323 A370 M373	C292-A296 WeakPolarHBondContact O-CB 3.44Å; C292-A296 PolarHBondContact O-N 3Å; Q294-A296 VanDerWaalsContact C-N 3.34Å; Q294-A296 PolarHBondContact O-N 3.07Å; A296-D298 VanDerWaalsContact C-N 3.32Å; A296-D298 PolarHBondContact O-N 3.01Å; A296-H299 PolarHBondContact O-N 3Å; A296-L300 WeakPolarHBondContact O-CG 3.46Å; A296-L300 PolarHBondContact O-N 3.31Å; A296-M323 HydrophobicContact CB-CE 4.14Å; A296-A370 HydrophobicContact CB-CB 4.07Å; A296-M373 HydrophobicContact CB-CB 4.41Å; A296-M373 HydrophobicContact CB-SD 3.84Å
297	R	98.7	Very high	98.6	Very high	92 Å²	92	55.6 Å²	55.6	35%	0.347	28%	0.282	S	S	.	.	H	α-helix	trans	-54.4	-49.9	175.7	179.4	-159.7	67	-157.6	-6.6	111.1	V293 Q294 L300 L301 L320	V293-R297 WeakPolarHBondContact O-CB 3.18Å; V293-R297 PolarHBondContact O-N 2.81Å; Q294-R297 WeakPolarHBondContact O-CB 3.42Å; Q294-R297 PolarHBondContact O-N 2.83Å; R297-L300 PolarHBondContact O-N 2.91Å; R297-L301 HydrophobicContact CG-CD1 4.16Å; R297-L301 WeakPolarHBondContact O-CG 3.13Å; R297-L301 PolarHBondContact O-N 3.45Å; R297-L301 VanDerWaalsContact O-N 3.12Å; R297-L320 HydrophobicContact CB-CD1 4.36Å; R297-L320 HydrophobicContact CB-CD2 4.19Å; R297-L320 HydrophobicContact CG-CD2 4.28Å
298	D	98.6	Very high	98.6	Very high	72 Å²	72	61.1 Å²	61.1	39%	0.385	31%	0.307	S	S	.	.	H	α-helix	trans	-68	-40.4	-175.4	-65.3	-12	0	0	0	111.3	Q294 L295 A296 L300 L301 V302	Q294-D298 WeakPolarHBondContact O-CB 3.31Å; Q294-D298 VanDerWaalsContact O-CG 3.25Å; Q294-D298 PolarHBondContact O-N 3.5Å; L295-D298 PolarHBondContact O-N 3.4Å; A296-D298 VanDerWaalsContact C-N 3.32Å; A296-D298 PolarHBondContact O-N 3.01Å; D298-L300 VanDerWaalsContact C-N 3.35Å; D298-L300 PolarHBondContact O-N 3.27Å; D298-L301 PolarHBondContact O-N 3.24Å; D298-V302 WeakPolarHBondContact O-CG2 3.47Å; D298-V302 PolarHBondContact O-N 2.74Å
299	H	98.7	Very high	98.5	Very high	31 Å²	31	61.9 Å²	61.9	14%	0.144	31%	0.313	C	S	.	.	H	α-helix	trans	-59.7	-43.7	172.7	179	-104.1	0	0	0	111.9	L295 A296 L301 V302 R303 M373 H374	L295-H299 VanDerWaalsContact O-CB 3.29Å; L295-H299 WeakPolarHBondContact O-CB 3.45Å; L295-H299 PolarHBondContact O-N 3.15Å; A296-H299 PolarHBondContact O-N 3Å; H299-L301 VanDerWaalsContact C-N 3.32Å; H299-L301 PolarHBondContact O-N 3.42Å; H299-V302 PolarHBondContact O-N 3.28Å; H299-R303 WeakPolarHBondContact O-CB 3.43Å; H299-R303 PolarHBondContact O-N 3.15Å; H299-M373 PolarHBondContact CE1-O 3.01Å; H299-M373 PolarHBondContact ND1-O 3.13Å; H299-H374 AromaticContact CD2-CD2 3.96Å; H299-H374 AromaticContact CG-CD2 3.81Å; H299-H374 AromaticContact CG-NE2 3.97Å
300	L	98.7	Very high	98.5	Very high	3 Å²	3	63.3 Å²	63.3	2%	0.016	32%	0.321	C	S	.	.	H	α-helix	trans	-64.8	-35	180	-68.3	173.1	0	0	0	113	A296 R297 D298 L310 S311 L316 L320 M373	A296-L300 WeakPolarHBondContact O-CG 3.46Å; A296-L300 PolarHBondContact O-N 3.31Å; R297-L300 PolarHBondContact O-N 2.91Å; D298-L300 VanDerWaalsContact C-N 3.35Å; D298-L300 PolarHBondContact O-N 3.27Å; L300-L310 HydrophobicContact CB-CB 4.37Å; L300-L310 HydrophobicContact CD2-CB 3.55Å; L300-L310 HydrophobicContact CD2-CD1 4.1Å; L300-L310 HydrophobicContact CD2-CG 4.5Å; L300-L310 PolarHBondContact O-N 2.83Å; L300-S311 PolarHBondContact O-N 2.86Å; L300-L316 HydrophobicContact CD2-CB 4.16Å; L300-L316 HydrophobicContact CD2-CD1 3.79Å; L300-L316 HydrophobicContact CD2-CD2 4.4Å; L300-L316 HydrophobicContact CD2-CG 4.34Å; L300-L320 HydrophobicContact CD1-CD2 4.25Å; L300-M373 HydrophobicContact CD1-CE 3.61Å; L300-M373 HydrophobicContact CD1-SD 3.99Å; L300-M373 HydrophobicContact CD2-CE 4.48Å
301	L	98.6	Very high	98.5	Very high	103 Å²	103	64.5 Å²	64.5	54%	0.539	33%	0.33	S	S	.	.	H	α-helix	trans	-71.3	-31.1	178.4	-70.9	170.2	0	0	0	112.6	R297 D298 H299	R297-L301 HydrophobicContact CG-CD1 4.16Å; R297-L301 WeakPolarHBondContact O-CG 3.13Å; R297-L301 PolarHBondContact O-N 3.45Å; R297-L301 VanDerWaalsContact O-N 3.12Å; D298-L301 PolarHBondContact O-N 3.24Å; H299-L301 VanDerWaalsContact C-N 3.32Å; H299-L301 PolarHBondContact O-N 3.42Å
302	V	98.4	Very high	98.5	Very high	117 Å²	117	68.6 Å²	68.6	71%	0.709	35%	0.351	S	S	*	.	H	α-helix	trans	-96	-43	-175	175.6	0	0	0	0	112.3	D298 H299	D298-V302 WeakPolarHBondContact O-CG2 3.47Å; D298-V302 PolarHBondContact O-N 2.74Å; H299-V302 PolarHBondContact O-N 3.28Å
303	R	98.4	Very high	98.5	Very high	84 Å²	84	72.3 Å²	72.3	32%	0.317	37%	0.371	S	S	.	.			trans	-72.7	133.3	-173.9	-176.1	64.6	-177.3	-146.9	1.1	110.6	H299 A309 L310 Y377	H299-R303 WeakPolarHBondContact O-CB 3.43Å; H299-R303 PolarHBondContact O-N 3.15Å; R303-A309 WeakPolarHBondContact O-CA 3.43Å; R303-L310 HydrophobicContact CB-CD1 3.84Å; R303-L310 HydrophobicContact CB-CG 4.12Å; R303-L310 HydrophobicContact CG-CD1 3.65Å; R303-L310 HydrophobicContact CG-CG 4.05Å; R303-L310 WeakPolarHBondContact O-CG 3.34Å; R303-L310 PolarHBondContact O-N 3.42Å; R303-Y377 VanDerWaalsContact NH1-CZ 3.34Å; R303-Y377 PolarHBondContact NH1-OH 2.95Å
304	K	98.6	Very high	98.5	Very high	138 Å²	138	78.2 Å²	78.2	60%	0.6	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113	139.6	176.3	-60.8	-174.1	178.9	-174.6	0	112.4	E308	K304-E308 CarbonylContact C-O 3.51Å; K304-E308 WeakPolarHBondContact CA-O 3.41Å; K304-E308 WeakPolarHBondContact CB-O 3.45Å
305	Q	98.3	Very high	98.5	Very high	96 Å²	96	80.8 Å²	80.8	45%	0.449	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	152.7	168.4	-76.8	-61.3	-79.2	0	0	109.2	G307 E308 L310	Q305-G307 PolarHBondContact O-N 3.19Å; Q305-G307 VanDerWaalsContact O-N 3.11Å; Q305-E308 PolarHBondContact N-O 3.04Å; Q305-E308 PolarHBondContact O-N 3.34Å; Q305-E308 VanDerWaalsContact O-N 3.11Å; Q305-L310 HydrophobicContact CB-CD2 3.9Å; Q305-L310 HydrophobicContact CG-CD2 4.17Å
306	F	97.8	Very high	98.5	Very high	208 Å²	208	79.1 Å²	79.1	91%	0.912	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	34.5	-177.4	-51.1	-77.9	0	0	0	113.2	E308	F306-E308 VanDerWaalsContact C-N 3.34Å; F306-E308 PolarHBondContact O-N 3.02Å
307	G	97.4	Very high	98.5	Very high	67 Å²	67	83.5 Å²	83.5	69%	0.691	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	-14.2	178.5	0	0	0	0	0	116.2	Q305	Q305-G307 PolarHBondContact O-N 3.19Å; Q305-G307 VanDerWaalsContact O-N 3.11Å
308	E	98.1	Very high	98.5	Very high	115 Å²	115	84.6 Å²	84.6	54%	0.537	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	162.8	-170	-69.9	-63.8	150.8	0	0	112.6	K304 Q305 F306 N312	K304-E308 CarbonylContact C-O 3.51Å; K304-E308 WeakPolarHBondContact CA-O 3.41Å; K304-E308 WeakPolarHBondContact CB-O 3.45Å; Q305-E308 PolarHBondContact N-O 3.04Å; Q305-E308 PolarHBondContact O-N 3.34Å; Q305-E308 VanDerWaalsContact O-N 3.11Å; F306-E308 VanDerWaalsContact C-N 3.34Å; F306-E308 PolarHBondContact O-N 3.02Å; E308-N312 HydrophobicContact CB-CB 4.42Å; E308-N312 PolarHBondContact OE2-ND2 3.46Å
309	A	98.6	Very high	98.5	Very high	16 Å²	16	83.1 Å²	83.1	13%	0.132	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	143.4	169.9	0	0	0	0	0	110.5	R303 S311 N312	R303-A309 WeakPolarHBondContact O-CA 3.43Å; A309-S311 PolarHBondContact O-N 3.06Å; A309-S311 VanDerWaalsContact O-N 3.17Å; A309-N312 WeakPolarHBondContact O-CB 3.35Å; A309-N312 PolarHBondContact O-N 3.34Å
310	L	98.7	Very high	98.5	Very high	30 Å²	30	83.6 Å²	83.6	16%	0.157	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-60	-28	177.8	-69.9	-173.1	0	0	0	112	L300 R303 Q305 N312 N313 L316	L300-L310 HydrophobicContact CB-CB 4.37Å; L300-L310 HydrophobicContact CD2-CB 3.55Å; L300-L310 HydrophobicContact CD2-CD1 4.1Å; L300-L310 HydrophobicContact CD2-CG 4.5Å; L300-L310 PolarHBondContact O-N 2.83Å; R303-L310 HydrophobicContact CB-CD1 3.84Å; R303-L310 HydrophobicContact CB-CG 4.12Å; R303-L310 HydrophobicContact CG-CD1 3.65Å; R303-L310 HydrophobicContact CG-CG 4.05Å; R303-L310 WeakPolarHBondContact O-CG 3.34Å; R303-L310 PolarHBondContact O-N 3.42Å; Q305-L310 HydrophobicContact CB-CD2 3.9Å; Q305-L310 HydrophobicContact CG-CD2 4.17Å; L310-N312 PolarHBondContact O-N 3.17Å; L310-N312 VanDerWaalsContact O-N 3.13Å; L310-N313 WeakPolarHBondContact O-CB 3.32Å; L310-N313 PolarHBondContact O-N 3.19Å; L310-L316 HydrophobicContact CB-CD1 3.89Å; L310-L316 HydrophobicContact CD2-CD1 4.21Å; L310-L316 HydrophobicContact CG-CD1 4.46Å; L310-L316 WeakPolarHBondContact O-CD1 3.43Å
311	S	98.4	Very high	98.5	Very high	28 Å²	28	86 Å²	86	20%	0.196	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-60.5	-15.6	172.8	61.8	0	0	0	0	114.3	L300 A309 Q317	L300-S311 PolarHBondContact O-N 2.86Å; A309-S311 PolarHBondContact O-N 3.06Å; A309-S311 VanDerWaalsContact O-N 3.17Å; S311-Q317 VanDerWaalsContact O-CG 3.3Å; S311-Q317 WeakPolarHBondContact O-CG 3.42Å; S311-Q317 PolarHBondContact O-NE2 3.18Å
312	N	98.3	Very high	98.5	Very high	95 Å²	95	85.3 Å²	85.3	51%	0.508	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-86.6	-8.4	176.1	-66.4	-12.8	0	0	0	112.7	E308 A309 L310	E308-N312 HydrophobicContact CB-CB 4.42Å; E308-N312 PolarHBondContact OE2-ND2 3.46Å; A309-N312 WeakPolarHBondContact O-CB 3.35Å; A309-N312 PolarHBondContact O-N 3.34Å; L310-N312 PolarHBondContact O-N 3.17Å; L310-N312 VanDerWaalsContact O-N 3.13Å
313	N	98.4	Very high	98.5	Very high	78 Å²	78	80 Å²	80	42%	0.417	40%	0.403	S	S	.	.			trans	-81.2	118.9	175.8	-177.7	-73.6	0	0	0	110.7	L310 F315 L316 Q317	L310-N313 WeakPolarHBondContact O-CB 3.32Å; L310-N313 PolarHBondContact O-N 3.19Å; N313-F315 VanDerWaalsContact C-N 3.31Å; N313-F315 PolarHBondContact O-N 2.89Å; N313-F315 WeakPolarHBondContact OD1-CB 3.44Å; N313-F315 PolarHBondContact OD1-N 3.43Å; N313-L316 HydrophobicContact CB-CB 4.23Å; N313-L316 HydrophobicContact CB-CD1 3.84Å; N313-L316 HydrophobicContact CB-CG 4.13Å; N313-L316 PolarHBondContact O-N 3.04Å; N313-L316 VanDerWaalsContact O-N 3.11Å; N313-L316 PolarHBondContact OD1-N 3.06Å; N313-Q317 PolarHBondContact O-N 3.05Å
314	Q	98.6	Very high	98.5	Very high	127 Å²	127	76.8 Å²	76.8	59%	0.593	39%	0.394	S	S	*	.	H	α-helix	trans	-58.2	-39.2	-176.1	-174.8	179	57.4	0	0	113.5	L316 Q317 F318	Q314-L316 VanDerWaalsContact C-N 3.31Å; Q314-L316 PolarHBondContact O-N 2.79Å; Q314-Q317 WeakPolarHBondContact O-CB 3.36Å; Q314-Q317 PolarHBondContact O-N 3.1Å; Q314-F318 HydrophobicContact CG-CD1 4.22Å; Q314-F318 HydrophobicContact CG-CE1 3.75Å; Q314-F318 HydrophobicContact CG-CE2 4.12Å; Q314-F318 HydrophobicContact CG-CZ 3.7Å; Q314-F318 WeakPolarHBondContact O-CG 3.4Å; Q314-F318 PolarHBondContact O-N 3.26Å
315	F	98.7	Very high	98.5	Very high	130 Å²	130	75 Å²	75	57%	0.57	40%	0.395	S	S	*	.	H	α-helix	trans	-63.5	-40.2	178.9	178.4	-102.2	0	0	0	111.4	N313 F318 K319	N313-F315 VanDerWaalsContact C-N 3.31Å; N313-F315 PolarHBondContact O-N 2.89Å; N313-F315 WeakPolarHBondContact OD1-CB 3.44Å; N313-F315 PolarHBondContact OD1-N 3.43Å; F315-F318 PolarHBondContact O-N 3.2Å; F315-K319 HydrophobicContact CD1-CG 4.43Å; F315-K319 HydrophobicContact CE1-CG 4.04Å; F315-K319 HydrophobicContact CE2-CG 4.48Å; F315-K319 HydrophobicContact CZ-CD 4.34Å; F315-K319 HydrophobicContact CZ-CG 4.08Å; F315-K319 WeakPolarHBondContact O-CG 3.49Å; F315-K319 PolarHBondContact O-N 2.9Å
316	L	98.8	Very high	98.6	Very high	31 Å²	31	73.9 Å²	73.9	16%	0.162	39%	0.389	C	S	.	.	H	α-helix	trans	-68.3	-36.8	175.9	-65.4	173.5	0	0	0	112.1	L300 L310 N313 Q314 K319 L320 M373	L300-L316 HydrophobicContact CD2-CB 4.16Å; L300-L316 HydrophobicContact CD2-CD1 3.79Å; L300-L316 HydrophobicContact CD2-CD2 4.4Å; L300-L316 HydrophobicContact CD2-CG 4.34Å; L310-L316 HydrophobicContact CB-CD1 3.89Å; L310-L316 HydrophobicContact CD2-CD1 4.21Å; L310-L316 HydrophobicContact CG-CD1 4.46Å; L310-L316 WeakPolarHBondContact O-CD1 3.43Å; N313-L316 HydrophobicContact CB-CB 4.23Å; N313-L316 HydrophobicContact CB-CD1 3.84Å; N313-L316 HydrophobicContact CB-CG 4.13Å; N313-L316 PolarHBondContact O-N 3.04Å; N313-L316 VanDerWaalsContact O-N 3.11Å; N313-L316 PolarHBondContact OD1-N 3.06Å; Q314-L316 VanDerWaalsContact C-N 3.31Å; Q314-L316 PolarHBondContact O-N 2.79Å; L316-K319 PolarHBondContact O-N 2.96Å; L316-L320 WeakPolarHBondContact O-CB 3.32Å; L316-L320 PolarHBondContact O-N 3.43Å; L316-M373 HydrophobicContact CB-CE 4.13Å; L316-M373 HydrophobicContact CD2-CE 3.94Å; L316-M373 HydrophobicContact CD2-CG 4.28Å; L316-M373 WeakPolarHBondContact O-CE 3.41Å
317	Q	98.8	Very high	98.6	Very high	92 Å²	92	64 Å²	64	43%	0.43	35%	0.345	S	S	.	.	H	α-helix	trans	-61.6	-44.7	172.3	-66.4	174.8	-3.9	0	0	111.8	S311 N313 Q314 K319 L320 A321	S311-Q317 VanDerWaalsContact O-CG 3.3Å; S311-Q317 WeakPolarHBondContact O-CG 3.42Å; S311-Q317 PolarHBondContact O-NE2 3.18Å; N313-Q317 PolarHBondContact O-N 3.05Å; Q314-Q317 WeakPolarHBondContact O-CB 3.36Å; Q314-Q317 PolarHBondContact O-N 3.1Å; Q317-K319 PolarHBondContact O-N 3.2Å; Q317-L320 PolarHBondContact O-N 3.3Å; Q317-A321 WeakPolarHBondContact O-CB 3.31Å; Q317-A321 PolarHBondContact O-N 3Å
318	F	98.8	Very high	98.7	Very high	116 Å²	116	62.9 Å²	62.9	51%	0.509	33%	0.325	S	S	.	.	H	α-helix	trans	-62.3	-43.4	177.6	-73.1	2.9	0	0	0	111.5	Q314 F315 L320 A321 E322	Q314-F318 HydrophobicContact CG-CD1 4.22Å; Q314-F318 HydrophobicContact CG-CE1 3.75Å; Q314-F318 HydrophobicContact CG-CE2 4.12Å; Q314-F318 HydrophobicContact CG-CZ 3.7Å; Q314-F318 WeakPolarHBondContact O-CG 3.4Å; Q314-F318 PolarHBondContact O-N 3.26Å; F315-F318 PolarHBondContact O-N 3.2Å; F318-L320 PolarHBondContact O-N 3.35Å; F318-A321 WeakPolarHBondContact O-CB 3.29Å; F318-A321 PolarHBondContact O-N 3.11Å; F318-E322 WeakPolarHBondContact O-CG 3.46Å; F318-E322 PolarHBondContact O-N 3.25Å
319	K	98.8	Very high	98.7	Very high	40 Å²	40	59.4 Å²	59.4	17%	0.174	32%	0.316	C	S	.	.	H	α-helix	trans	-61.8	-42.6	175.5	-72.1	-70.9	155.4	-146.3	0	112.4	F315 L316 Q317 A321 E322 M323 M373	F315-K319 HydrophobicContact CD1-CG 4.43Å; F315-K319 HydrophobicContact CE1-CG 4.04Å; F315-K319 HydrophobicContact CE2-CG 4.48Å; F315-K319 HydrophobicContact CZ-CD 4.34Å; F315-K319 HydrophobicContact CZ-CG 4.08Å; F315-K319 WeakPolarHBondContact O-CG 3.49Å; F315-K319 PolarHBondContact O-N 2.9Å; L316-K319 PolarHBondContact O-N 2.96Å; Q317-K319 PolarHBondContact O-N 3.2Å; K319-A321 VanDerWaalsContact C-N 3.33Å; K319-A321 PolarHBondContact O-N 3.07Å; K319-E322 IonicContact NZ-OE1 3.2Å; K319-E322 PolarHBondContact NZ-OE1 2.82Å; K319-E322 IonicContact NZ-OE2 3.35Å; K319-E322 PolarHBondContact NZ-OE2 2.92Å; K319-E322 PolarHBondContact O-N 3.45Å; K319-M323 VanDerWaalsContact O-CG 3.24Å; K319-M323 WeakPolarHBondContact O-CG 3.5Å; K319-M323 PolarHBondContact O-N 3.41Å; K319-M373 HydrophobicContact CB-CE 3.71Å
320	L	98.7	Very high	98.7	Very high	41 Å²	41	58.6 Å²	58.6	22%	0.215	31%	0.309	C	S	.	.	H	α-helix	trans	-64.4	-38.8	176.4	-170.8	64.7	0	0	0	111.8	V293 R297 L300 L316 Q317 F318 M323 A324 M373	V293-L320 HydrophobicContact CG1-CD1 4.35Å; R297-L320 HydrophobicContact CB-CD1 4.36Å; R297-L320 HydrophobicContact CB-CD2 4.19Å; R297-L320 HydrophobicContact CG-CD2 4.28Å; L300-L320 HydrophobicContact CD1-CD2 4.25Å; L316-L320 WeakPolarHBondContact O-CB 3.32Å; L316-L320 PolarHBondContact O-N 3.43Å; Q317-L320 PolarHBondContact O-N 3.3Å; F318-L320 PolarHBondContact O-N 3.35Å; L320-M323 PolarHBondContact O-N 3.25Å; L320-A324 WeakPolarHBondContact O-CB 3.37Å; L320-A324 PolarHBondContact O-N 3.1Å; L320-M373 HydrophobicContact CB-CE 4.25Å
321	A	98.8	Very high	98.8	Very high	55 Å²	55	57.7 Å²	57.7	46%	0.455	30%	0.304	S	S	.	.	H	α-helix	trans	-63	-47.2	175.1	0	0	0	0	0	111.8	Q317 F318 K319 M323 A324 T325	Q317-A321 WeakPolarHBondContact O-CB 3.31Å; Q317-A321 PolarHBondContact O-N 3Å; F318-A321 WeakPolarHBondContact O-CB 3.29Å; F318-A321 PolarHBondContact O-N 3.11Å; K319-A321 VanDerWaalsContact C-N 3.33Å; K319-A321 PolarHBondContact O-N 3.07Å; A321-M323 VanDerWaalsContact C-N 3.33Å; A321-M323 PolarHBondContact O-N 2.91Å; A321-A324 PolarHBondContact O-N 3.24Å; A321-T325 PolarHBondContact O-N 3.34Å; A321-T325 PolarHBondContact O-OG1 3.06Å
322	E	98.9	Very high	98.8	Very high	88 Å²	88	61.6 Å²	61.6	41%	0.411	32%	0.322	S	S	.	.	H	α-helix	trans	-57.3	-45	174.9	-71.7	169.8	-166.9	0	0	111.8	F318 K319 T325 K326	F318-E322 WeakPolarHBondContact O-CG 3.46Å; F318-E322 PolarHBondContact O-N 3.25Å; K319-E322 IonicContact NZ-OE1 3.2Å; K319-E322 PolarHBondContact NZ-OE1 2.82Å; K319-E322 IonicContact NZ-OE2 3.35Å; K319-E322 PolarHBondContact NZ-OE2 2.92Å; K319-E322 PolarHBondContact O-N 3.45Å; E322-T325 PolarHBondContact O-N 3.29Å; E322-K326 WeakPolarHBondContact O-CB 3.32Å; E322-K326 VanDerWaalsContact O-CG 3.31Å; E322-K326 WeakPolarHBondContact O-CG 3.33Å; E322-K326 PolarHBondContact O-N 2.91Å
323	M	98.9	Very high	98.8	Very high	5 Å²	5	59.3 Å²	59.3	3%	0.025	31%	0.31	C	S	.	.	H	α-helix	trans	-61.5	-45.7	177.9	-70.6	164.4	63	0	0	111.6	V293 A296 K319 L320 A321 K326 L327 I366 Q369 A370 M373	V293-M323 HydrophobicContact CG2-CB 4.05Å; V293-M323 HydrophobicContact CG2-CE 4.01Å; A296-M323 HydrophobicContact CB-CE 4.14Å; K319-M323 VanDerWaalsContact O-CG 3.24Å; K319-M323 WeakPolarHBondContact O-CG 3.5Å; K319-M323 PolarHBondContact O-N 3.41Å; L320-M323 PolarHBondContact O-N 3.25Å; A321-M323 VanDerWaalsContact C-N 3.33Å; A321-M323 PolarHBondContact O-N 2.91Å; M323-K326 PolarHBondContact O-N 3.43Å; M323-L327 WeakPolarHBondContact O-CB 3.2Å; M323-L327 PolarHBondContact O-N 2.89Å; M323-I366 HydrophobicContact CB-CG1 4.27Å; M323-I366 HydrophobicContact CB-CG2 4.31Å; M323-I366 HydrophobicContact CE-CG2 3.93Å; M323-I366 HydrophobicContact CG-CG1 4.35Å; M323-I366 HydrophobicContact CG-CG2 4.37Å; M323-Q369 HydrophobicContact CG-CB 4.3Å; M323-Q369 HydrophobicContact SD-CB 3.84Å; M323-A370 HydrophobicContact CE-CB 3.9Å; M323-M373 HydrophobicContact CE-SD 4.5Å; M323-M373 HydrophobicContact SD-SD 3.92Å
324	A	98.8	Very high	98.8	Very high	17 Å²	17	55.6 Å²	55.6	14%	0.14	29%	0.29	C	S	.	.	H	α-helix	trans	-63	-44.6	178.4	0	0	0	0	0	112.1	I36 L320 A321 L327 V328	I36-A324 HydrophobicContact CG2-CB 3.72Å; L320-A324 WeakPolarHBondContact O-CB 3.37Å; L320-A324 PolarHBondContact O-N 3.1Å; A321-A324 PolarHBondContact O-N 3.24Å; A324-L327 PolarHBondContact O-N 2.98Å; A324-V328 WeakPolarHBondContact O-CG2 3.16Å; A324-V328 PolarHBondContact O-N 3.21Å
325	T	98.9	Very high	98.8	Very high	99 Å²	99	50.7 Å²	50.7	61%	0.607	27%	0.266	S	S	*	.	H	α-helix	trans	-60.4	-47.5	177.3	-62.2	0	0	0	0	111.6	A321 E322 L327 V328 A329	A321-T325 PolarHBondContact O-N 3.34Å; A321-T325 PolarHBondContact O-OG1 3.06Å; E322-T325 PolarHBondContact O-N 3.29Å; T325-L327 VanDerWaalsContact C-N 3.33Å; T325-L327 PolarHBondContact O-N 2.86Å; T325-V328 PolarHBondContact O-N 3.39Å; T325-A329 WeakPolarHBondContact O-CB 3.22Å; T325-A329 PolarHBondContact O-N 2.99Å
326	K	98.9	Very high	98.8	Very high	73 Å²	73	48.3 Å²	48.3	32%	0.317	26%	0.256	S	S	.	.	H	α-helix	trans	-65.2	-36.6	179	-73.2	169.7	167.5	-139.6	0	112.4	E322 M323 S330 E362 I366	E322-K326 WeakPolarHBondContact O-CB 3.32Å; E322-K326 VanDerWaalsContact O-CG 3.31Å; E322-K326 WeakPolarHBondContact O-CG 3.33Å; E322-K326 PolarHBondContact O-N 2.91Å; M323-K326 PolarHBondContact O-N 3.43Å; K326-S330 VanDerWaalsContact O-CB 3.26Å; K326-S330 WeakPolarHBondContact O-CB 3.35Å; K326-S330 PolarHBondContact O-N 3.41Å; K326-S330 PolarHBondContact O-OG 2.96Å; K326-E362 HydrophobicContact CB-CB 4.48Å; K326-E362 WeakPolarHBondContact CD-OE2 3.13Å; K326-E362 VanDerWaalsContact CE-OE2 3.25Å; K326-E362 WeakPolarHBondContact CE-OE2 3.41Å; K326-E362 IonicContact NZ-OE1 3.33Å; K326-E362 IonicContact NZ-OE2 2.68Å; K326-E362 PolarHBondContact NZ-OE2 3.38Å; K326-I366 HydrophobicContact CB-CD1 3.92Å; K326-I366 HydrophobicContact CB-CG1 4.37Å
327	L	98.9	Very high	98.8	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.9	-47.7	174.9	-179.3	69.5	0	0	0	111.3	I36 L286 A289 H290 V293 M323 A324 T325 S330 R331 I366	I36-L327 HydrophobicContact CB-CD2 4.21Å; I36-L327 HydrophobicContact CD1-CD2 4.49Å; I36-L327 HydrophobicContact CG2-CD2 4.28Å; L286-L327 HydrophobicContact CD1-CD1 3.61Å; L286-L327 HydrophobicContact CD1-CG 4.49Å; L286-L327 HydrophobicContact CG-CD1 4.49Å; A289-L327 HydrophobicContact CB-CD1 3.8Å; H290-L327 HydrophobicContact CB-CD1 4.28Å; H290-L327 HydrophobicContact CB-CD2 4.33Å; V293-L327 HydrophobicContact CB-CD2 4.38Å; V293-L327 HydrophobicContact CG2-CD2 4.14Å; M323-L327 WeakPolarHBondContact O-CB 3.2Å; M323-L327 PolarHBondContact O-N 2.89Å; A324-L327 PolarHBondContact O-N 2.98Å; T325-L327 VanDerWaalsContact C-N 3.33Å; T325-L327 PolarHBondContact O-N 2.86Å; L327-S330 WeakPolarHBondContact O-CB 3.46Å; L327-S330 PolarHBondContact O-N 3.39Å; L327-R331 PolarHBondContact O-N 3.19Å; L327-I366 HydrophobicContact CB-CD1 4.04Å
328	V	98.8	Very high	98.8	Very high	45 Å²	45	42.4 Å²	42.4	27%	0.273	23%	0.228	S	C	.	.	H	α-helix	trans	-65.5	-45.8	179.5	173.7	0	0	0	0	110.9	C35 I36 A324 T325 S330 R331 L332	C35-V328 WeakPolarHBondContact O-CG2 3.47Å; I36-V328 HydrophobicContact CG2-CG2 4.16Å; A324-V328 WeakPolarHBondContact O-CG2 3.16Å; A324-V328 PolarHBondContact O-N 3.21Å; T325-V328 PolarHBondContact O-N 3.39Å; V328-S330 VanDerWaalsContact C-N 3.29Å; V328-S330 PolarHBondContact O-N 2.98Å; V328-R331 PolarHBondContact O-N 2.96Å; V328-L332 HydrophobicContact CG1-CD1 4.11Å; V328-L332 HydrophobicContact CG1-CG 4.45Å; V328-L332 WeakPolarHBondContact O-CG 3.48Å; V328-L332 PolarHBondContact O-N 3.34Å
329	A	98.9	Very high	98.8	Very high	41 Å²	41	38.4 Å²	38.4	34%	0.339	21%	0.213	S	C	.	.	H	α-helix	trans	-57.9	-42.8	175.6	0	0	0	0	0	111.9	T325 L332 L333 F358	T325-A329 WeakPolarHBondContact O-CB 3.22Å; T325-A329 PolarHBondContact O-N 2.99Å; A329-L332 PolarHBondContact O-N 3.28Å; A329-L333 PolarHBondContact O-N 3.4Å; A329-L333 VanDerWaalsContact O-N 3.1Å; A329-F358 HydrophobicContact CB-CE1 4.11Å; A329-F358 HydrophobicContact CB-CZ 4.17Å
330	S	98.9	Very high	98.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.1	-44.8	176.7	-64.8	0	0	0	0	111.9	K326 L327 V328 L334 V359	K326-S330 VanDerWaalsContact O-CB 3.26Å; K326-S330 WeakPolarHBondContact O-CB 3.35Å; K326-S330 PolarHBondContact O-N 3.41Å; K326-S330 PolarHBondContact O-OG 2.96Å; L327-S330 WeakPolarHBondContact O-CB 3.46Å; L327-S330 PolarHBondContact O-N 3.39Å; V328-S330 VanDerWaalsContact C-N 3.29Å; V328-S330 PolarHBondContact O-N 2.98Å; S330-L334 VanDerWaalsContact O-CB 3.28Å; S330-L334 WeakPolarHBondContact O-CB 3.27Å; S330-L334 PolarHBondContact O-N 3.46Å; S330-V359 WeakPolarHBondContact O-CG2 3.42Å
331	R	98.8	Very high	98.8	Very high	10 Å²	10	36 Å²	36	4%	0.038	20%	0.202	C	C	.	.	H	α-helix	trans	-62.5	-44.5	178.4	-175.9	172.9	-66.7	114.5	12.6	112.2	I36 E111 L286 H290 L327 V328 L334 R335	I36-R331 PolarHBondContact O-NH1 3.4Å; E111-R331 IonicContact OE1-CZ 2.89Å; E111-R331 IonicContact OE1-NE 2.76Å; E111-R331 PolarHBondContact OE1-NE 3.32Å; E111-R331 IonicContact OE1-NH2 3.68Å; E111-R331 PolarHBondContact OE1-NH2 2.86Å; E111-R331 IonicContact OE2-NE 3.72Å; L286-R331 HydrophobicContact CD1-CB 4.08Å; L286-R331 HydrophobicContact CD2-CB 3.77Å; L286-R331 HydrophobicContact CD2-CG 3.9Å; H290-R331 PolarHBondContact ND1-NH2 3.21Å; L327-R331 PolarHBondContact O-N 3.19Å; V328-R331 PolarHBondContact O-N 2.96Å; R331-L334 PolarHBondContact O-N 3.17Å; R331-R335 WeakPolarHBondContact O-CB 3.34Å; R331-R335 VanDerWaalsContact O-CG 3.32Å; R331-R335 WeakPolarHBondContact O-CG 3.49Å; R331-R335 PolarHBondContact O-N 3.29Å
332	L	98.8	Very high	98.7	Very high	111 Å²	111	37.2 Å²	37.2	58%	0.581	20%	0.198	S	C	*	.	H	α-helix	trans	-62.8	-50.7	-179.8	-68.2	172.9	0	0	0	111.4	V328 A329 L334 R335 E336	V328-L332 HydrophobicContact CG1-CD1 4.11Å; V328-L332 HydrophobicContact CG1-CG 4.45Å; V328-L332 WeakPolarHBondContact O-CG 3.48Å; V328-L332 PolarHBondContact O-N 3.34Å; A329-L332 PolarHBondContact O-N 3.28Å; L332-L334 VanDerWaalsContact C-N 3.31Å; L332-L334 PolarHBondContact O-N 3.43Å; L332-R335 PolarHBondContact O-N 3.47Å; L332-E336 WeakPolarHBondContact O-CB 3.38Å; L332-E336 PolarHBondContact O-N 2.88Å
333	L	98.8	Very high	98.7	Very high	47 Å²	47	38.5 Å²	38.5	25%	0.246	20%	0.204	C	C	.	.	H	α-helix	trans	-61.6	-40.4	179.4	178.4	60.4	0	0	0	112.1	A329 A337 A355 F358	A329-L333 PolarHBondContact O-N 3.4Å; A329-L333 VanDerWaalsContact O-N 3.1Å; L333-A337 PolarHBondContact O-N 3.04Å; L333-A355 HydrophobicContact CG-CB 4.1Å; L333-F358 HydrophobicContact CD2-CB 3.62Å; L333-F358 HydrophobicContact CD2-CD1 3.81Å; L333-F358 HydrophobicContact CD2-CG 3.81Å
334	L	98.8	Very high	98.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-64.5	-45.8	178.6	-177.6	56.9	0	0	0	112.5	I279 A282 L286 S330 R331 L332 E336 A337 A338 A355 V359	I279-L334 HydrophobicContact CB-CD1 4.33Å; I279-L334 HydrophobicContact CG2-CD1 3.93Å; A282-L334 HydrophobicContact CB-CD1 3.61Å; A282-L334 HydrophobicContact CB-CD2 4.24Å; L286-L334 HydrophobicContact CB-CD2 4.39Å; L286-L334 HydrophobicContact CD2-CD2 3.93Å; S330-L334 VanDerWaalsContact O-CB 3.28Å; S330-L334 WeakPolarHBondContact O-CB 3.27Å; S330-L334 PolarHBondContact O-N 3.46Å; R331-L334 PolarHBondContact O-N 3.17Å; L332-L334 VanDerWaalsContact C-N 3.31Å; L332-L334 PolarHBondContact O-N 3.43Å; L334-E336 VanDerWaalsContact C-N 3.33Å; L334-A337 PolarHBondContact O-N 3.11Å; L334-A338 PolarHBondContact O-N 2.99Å; L334-A355 HydrophobicContact CD1-CB 4.26Å; L334-V359 HydrophobicContact CB-CG2 4.19Å
335	R	98.8	Very high	98.6	Very high	24 Å²	24	46.1 Å²	46.1	9%	0.091	25%	0.245	C	C	.	.	H	α-helix	trans	-66.4	-37.7	179.9	-71.2	-176.8	-178.9	-179.9	0.5	111.4	P38 H40 L42 L104 E111 R331 L332 A338 V339	P38-R335 PolarHBondContact O-NH1 2.81Å; P38-R335 VanDerWaalsContact O-NH1 3.14Å; P38-R335 PolarHBondContact O-NH2 2.79Å; H40-R335 PolarHBondContact O-NH1 2.97Å; L42-R335 VanDerWaalsContact CD2-NH1 3.31Å; L104-R335 HydrophobicContact CD1-CB 3.83Å; L104-R335 HydrophobicContact CD1-CG 3.63Å; E111-R335 IonicContact OE2-NH2 2.73Å; E111-R335 PolarHBondContact OE2-NH2 3.01Å; R331-R335 WeakPolarHBondContact O-CB 3.34Å; R331-R335 VanDerWaalsContact O-CG 3.32Å; R331-R335 WeakPolarHBondContact O-CG 3.49Å; R331-R335 PolarHBondContact O-N 3.29Å; L332-R335 PolarHBondContact O-N 3.47Å; R335-A338 PolarHBondContact O-N 3.39Å; R335-V339 WeakPolarHBondContact O-CG2 3.44Å; R335-V339 PolarHBondContact O-N 3.5Å
336	E	98.7	Very high	98.4	Very high	79 Å²	79	47.5 Å²	47.5	37%	0.369	26%	0.259	S	S	.	.	H	α-helix	trans	-59.9	-45.2	172.5	178.7	59	-161.2	0	0	111.7	L332 L334 A338 V339 A340 R345 L351	L332-E336 WeakPolarHBondContact O-CB 3.38Å; L332-E336 PolarHBondContact O-N 2.88Å; L334-E336 VanDerWaalsContact C-N 3.33Å; E336-A338 VanDerWaalsContact C-N 3.32Å; E336-A338 PolarHBondContact O-N 3.47Å; E336-V339 PolarHBondContact O-N 3.37Å; E336-A340 WeakPolarHBondContact O-CB 3.35Å; E336-A340 PolarHBondContact O-N 3.44Å; E336-R345 IonicContact OE1-CZ 2.64Å; E336-R345 IonicContact OE1-NH1 3.15Å; E336-R345 PolarHBondContact OE1-NH1 3.41Å; E336-R345 IonicContact OE1-NH2 2.77Å; E336-R345 PolarHBondContact OE1-NH2 3.45Å; E336-R345 VanDerWaalsContact OE1-NH2 3.1Å; E336-L351 HydrophobicContact CG-CD1 4.36Å
337	A	98.8	Very high	98.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-37.9	176	0	0	0	0	0	112.7	I279 L333 L334 A340 L341 L351 A355	I279-A337 HydrophobicContact CG1-CB 4.45Å; L333-A337 PolarHBondContact O-N 3.04Å; L334-A337 PolarHBondContact O-N 3.11Å; A337-A340 PolarHBondContact O-N 3.15Å; A337-L341 WeakPolarHBondContact O-CB 3.3Å; A337-L341 PolarHBondContact O-N 2.73Å; A337-L351 HydrophobicContact CB-CB 4.02Å; A337-A355 HydrophobicContact CB-CB 3.66Å
338	A	98.8	Very high	98.2	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.3	-46	175.8	0	0	0	0	0	112.1	R103 L104 I279 L334 R335 E336 L341 Q342	R103-A338 HydrophobicContact CB-CB 4.31Å; R103-A338 WeakPolarHBondContact CB-O 3.46Å; L104-A338 HydrophobicContact CB-CB 4.47Å; I279-A338 HydrophobicContact CD1-CB 4.39Å; I279-A338 HydrophobicContact CG2-CB 4.05Å; L334-A338 PolarHBondContact O-N 2.99Å; R335-A338 PolarHBondContact O-N 3.39Å; E336-A338 VanDerWaalsContact C-N 3.32Å; E336-A338 PolarHBondContact O-N 3.47Å; A338-L341 PolarHBondContact O-N 3.01Å; A338-Q342 PolarHBondContact O-N 3.46Å; A338-Q342 VanDerWaalsContact O-N 3.1Å
339	V	98.8	Very high	98.1	Very high	31 Å²	31	48 Å²	48	19%	0.188	27%	0.266	C	S	.	.	H	α-helix	trans	-60.9	-47.8	174.8	172.1	0	0	0	0	110.6	L104 R335 E336 L341 Q342 E343	L104-V339 HydrophobicContact CB-CG2 4.46Å; L104-V339 HydrophobicContact CD2-CG2 3.89Å; R335-V339 WeakPolarHBondContact O-CG2 3.44Å; R335-V339 PolarHBondContact O-N 3.5Å; E336-V339 PolarHBondContact O-N 3.37Å; V339-L341 VanDerWaalsContact C-N 3.26Å; V339-L341 PolarHBondContact O-N 2.99Å; V339-Q342 WeakPolarHBondContact O-CG 3.47Å; V339-Q342 PolarHBondContact O-N 3.03Å; V339-E343 HydrophobicContact CG1-CG 4.32Å; V339-E343 WeakPolarHBondContact O-CB 3.14Å; V339-E343 WeakPolarHBondContact O-CG 3.24Å; V339-E343 PolarHBondContact O-N 3.38Å
340	A	98.8	Very high	98	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.6	-39.3	178.4	0	0	0	0	0	112.6	E336 A337 S344 R345 A348 L351	E336-A340 WeakPolarHBondContact O-CB 3.35Å; E336-A340 PolarHBondContact O-N 3.44Å; A337-A340 PolarHBondContact O-N 3.15Å; A340-S344 PolarHBondContact O-N 2.93Å; A340-R345 HydrophobicContact CB-CB 4.31Å; A340-R345 PolarHBondContact O-N 3.47Å; A340-A348 HydrophobicContact CB-CB 4.07Å; A340-A348 WeakPolarHBondContact O-CB 3.39Å; A340-L351 HydrophobicContact CB-CD1 3.56Å
341	L	98.4	Very high	98	Very high	31 Å²	31	48 Å²	48	16%	0.162	26%	0.262	C	S	.	.	H	α-helix	trans	-68.8	-43.1	178.5	-174.7	62.9	0	0	0	113	R103 N275 I279 A337 A338 V339 E343 S344 A348	R103-L341 HydrophobicContact CG-CB 4.44Å; R103-L341 HydrophobicContact CG-CD2 4.14Å; R103-L341 HydrophobicContact CG-CG 4.26Å; N275-L341 HydrophobicContact CB-CD1 4.16Å; N275-L341 HydrophobicContact CB-CD2 4.27Å; I279-L341 HydrophobicContact CD1-CB 3.96Å; I279-L341 HydrophobicContact CD1-CD2 3.49Å; I279-L341 VanDerWaalsContact CD1-CD2 3.49Å; I279-L341 HydrophobicContact CD1-CG 4.36Å; A337-L341 WeakPolarHBondContact O-CB 3.3Å; A337-L341 PolarHBondContact O-N 2.73Å; A338-L341 PolarHBondContact O-N 3.01Å; V339-L341 VanDerWaalsContact C-N 3.26Å; V339-L341 PolarHBondContact O-N 2.99Å; L341-E343 VanDerWaalsContact C-N 3.34Å; L341-S344 PolarHBondContact O-N 3.24Å; L341-A348 HydrophobicContact CB-CB 4.49Å; L341-A348 HydrophobicContact CD1-CB 4.42Å
342	Q	97.8	Very high	98	Very high	80 Å²	80	47.5 Å²	47.5	37%	0.374	26%	0.26	S	S	.	.	H	α-helix	trans	-69.9	-31.9	178.4	63	-176.9	57.1	0	0	112.6	S102 R103 A338 V339 S344	S102-Q342 PolarHBondContact OG-OE1 3.3Å; R103-Q342 HydrophobicContact CB-CB 4.09Å; R103-Q342 HydrophobicContact CG-CB 4.07Å; A338-Q342 PolarHBondContact O-N 3.46Å; A338-Q342 VanDerWaalsContact O-N 3.1Å; V339-Q342 WeakPolarHBondContact O-CG 3.47Å; V339-Q342 PolarHBondContact O-N 3.03Å; Q342-S344 PolarHBondContact O-N 3.41Å
343	E	98.3	Very high	98	Very high	115 Å²	115	42.2 Å²	42.2	54%	0.537	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-0.9	175.1	-68	179.5	168.5	0	0	112.9	V339 L341 R345	V339-E343 HydrophobicContact CG1-CG 4.32Å; V339-E343 WeakPolarHBondContact O-CB 3.14Å; V339-E343 WeakPolarHBondContact O-CG 3.24Å; V339-E343 PolarHBondContact O-N 3.38Å; L341-E343 VanDerWaalsContact C-N 3.34Å; E343-R345 HydrophobicContact CB-CG 3.99Å; E343-R345 PolarHBondContact O-N 2.94Å; E343-R345 WeakPolarHBondContact OE2-CD 3.46Å
344	S	97.3	Very high	98	Very high	105 Å²	105	43.6 Å²	43.6	73%	0.734	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	36.2	-177.3	-56.7	0	0	0	0	113.1	A340 L341 Q342	A340-S344 PolarHBondContact O-N 2.93Å; L341-S344 PolarHBondContact O-N 3.24Å; Q342-S344 PolarHBondContact O-N 3.41Å
345	R	98	Very high	98	Very high	77 Å²	77	43.6 Å²	43.6	29%	0.291	24%	0.238	S	C	.	.			trans	-64.4	148.8	178.4	-71.4	173.9	30.5	-172.3	2.7	111.1	E336 A340 E343 D347 A348	E336-R345 IonicContact OE1-CZ 2.64Å; E336-R345 IonicContact OE1-NH1 3.15Å; E336-R345 PolarHBondContact OE1-NH1 3.41Å; E336-R345 IonicContact OE1-NH2 2.77Å; E336-R345 PolarHBondContact OE1-NH2 3.45Å; E336-R345 VanDerWaalsContact OE1-NH2 3.1Å; A340-R345 HydrophobicContact CB-CB 4.31Å; A340-R345 PolarHBondContact O-N 3.47Å; E343-R345 HydrophobicContact CB-CG 3.99Å; E343-R345 PolarHBondContact O-N 2.94Å; E343-R345 WeakPolarHBondContact OE2-CD 3.46Å; R345-D347 WeakPolarHBondContact CB-OD1 3.37Å; R345-D347 IonicContact CZ-OD1 2.75Å; R345-D347 IonicContact CZ-OD2 3.13Å; R345-D347 IonicContact NE-OD1 3.68Å; R345-D347 PolarHBondContact NE-OD1 3.47Å; R345-D347 IonicContact NE-OD2 2.7Å; R345-D347 IonicContact NH2-OD1 3.04Å; R345-D347 PolarHBondContact NH2-OD1 2.92Å; R345-D347 IonicContact NH2-OD2 3.57Å; R345-D347 PolarHBondContact NH2-OD2 3.02Å; R345-D347 PolarHBondContact O-N 3.34Å; R345-A348 WeakPolarHBondContact O-CB 3.47Å; R345-A348 PolarHBondContact O-N 3.41Å; R345-A348 VanDerWaalsContact O-N 3.15Å
346	S	95.4	Very high	98	Very high	129 Å²	129	42.5 Å²	42.5	90%	0.902	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-27.2	-179.2	50.8	0	0	0	0	113.4
347	D	96.4	Very high	98	Very high	59 Å²	59	40 Å²	40	32%	0.316	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-3.5	178.7	64.4	-17.8	0	0	0	113.8	R345 V349 S350 L351	R345-D347 WeakPolarHBondContact CB-OD1 3.37Å; R345-D347 IonicContact CZ-OD1 2.75Å; R345-D347 IonicContact CZ-OD2 3.13Å; R345-D347 IonicContact NE-OD1 3.68Å; R345-D347 PolarHBondContact NE-OD1 3.47Å; R345-D347 IonicContact NE-OD2 2.7Å; R345-D347 IonicContact NH2-OD1 3.04Å; R345-D347 PolarHBondContact NH2-OD1 2.92Å; R345-D347 IonicContact NH2-OD2 3.57Å; R345-D347 PolarHBondContact NH2-OD2 3.02Å; R345-D347 PolarHBondContact O-N 3.34Å; D347-V349 VanDerWaalsContact C-N 3.32Å; D347-V349 PolarHBondContact O-N 3.19Å; D347-S350 PolarHBondContact O-N 3.03Å; D347-S350 VanDerWaalsContact O-N 3.09Å; D347-L351 HydrophobicContact CB-CD1 4.5Å; D347-L351 PolarHBondContact O-N 3.03Å; D347-L351 WeakPolarHBondContact OD2-CD1 3.4Å
348	A	97.4	Very high	98	Very high	3 Å²	3	43.5 Å²	43.5	3%	0.025	24%	0.239	C	C	.	.	H	α-helix	trans	-57.3	-40.5	-172.9	0	0	0	0	0	113.5	A340 L341 R345 S350 L351 C352	A340-A348 HydrophobicContact CB-CB 4.07Å; A340-A348 WeakPolarHBondContact O-CB 3.39Å; L341-A348 HydrophobicContact CB-CB 4.49Å; L341-A348 HydrophobicContact CD1-CB 4.42Å; R345-A348 WeakPolarHBondContact O-CB 3.47Å; R345-A348 PolarHBondContact O-N 3.41Å; R345-A348 VanDerWaalsContact O-N 3.15Å; A348-S350 VanDerWaalsContact C-N 3.33Å; A348-S350 PolarHBondContact O-N 2.99Å; A348-L351 PolarHBondContact O-N 3.34Å; A348-C352 WeakPolarHBondContact O-CB 3.36Å; A348-C352 PolarHBondContact O-N 3.48Å; A348-C352 PolarHBondContact O-SG 3.39Å
349	V	95.5	Very high	98	Very high	66 Å²	66	43.5 Å²	43.5	40%	0.4	24%	0.239	S	C	.	.	H	α-helix	trans	-63.4	-41.3	179.9	179	0	0	0	0	111.2	D347 S353	D347-V349 VanDerWaalsContact C-N 3.32Å; D347-V349 PolarHBondContact O-N 3.19Å; V349-S353 PolarHBondContact O-N 2.98Å; V349-S353 PolarHBondContact O-OG 3.27Å
350	S	97	Very high	98	Very high	17 Å²	17	42 Å²	42	12%	0.119	23%	0.23	C	C	.	.	H	α-helix	trans	-69.1	-44.6	177.9	-63.6	0	0	0	0	110.5	D347 A348 C352 S353 M354 S412	D347-S350 PolarHBondContact O-N 3.03Å; D347-S350 VanDerWaalsContact O-N 3.09Å; A348-S350 VanDerWaalsContact C-N 3.33Å; A348-S350 PolarHBondContact O-N 2.99Å; S350-C352 PolarHBondContact O-N 3.36Å; S350-S353 PolarHBondContact O-N 3.42Å; S350-S353 VanDerWaalsContact O-N 3.16Å; S350-M354 WeakPolarHBondContact O-CG 3.24Å; S350-M354 PolarHBondContact O-N 3.1Å; S350-S412 VanDerWaalsContact OG-CB 3.31Å; S350-S412 WeakPolarHBondContact OG-CB 3.41Å; S350-S412 PolarHBondContact OG-OG 3.37Å
351	L	98.5	Very high	98	Very high	24 Å²	24	43.5 Å²	43.5	13%	0.126	24%	0.238	C	C	.	.	H	α-helix	trans	-61.7	-41.9	175.2	-72.5	174.1	0	0	0	112.8	E336 A337 A340 D347 A348 S353 M354 A355	E336-L351 HydrophobicContact CG-CD1 4.36Å; A337-L351 HydrophobicContact CB-CB 4.02Å; A340-L351 HydrophobicContact CB-CD1 3.56Å; D347-L351 HydrophobicContact CB-CD1 4.5Å; D347-L351 PolarHBondContact O-N 3.03Å; D347-L351 WeakPolarHBondContact OD2-CD1 3.4Å; A348-L351 PolarHBondContact O-N 3.34Å; L351-S353 VanDerWaalsContact C-N 3.27Å; L351-S353 PolarHBondContact O-N 3.24Å; L351-M354 HydrophobicContact CD2-SD 4.5Å; L351-M354 PolarHBondContact O-N 3.26Å; L351-A355 VanDerWaalsContact O-CB 3.24Å; L351-A355 WeakPolarHBondContact O-CB 3.49Å; L351-A355 PolarHBondContact O-N 3.33Å
352	C	98.6	Very high	98	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-58.7	-40.9	174.3	-69.2	0	0	0	0	111.6	I279 A348 S350 K356	I279-C352 VanDerWaalsContact CD1-SG 3.55Å; A348-C352 WeakPolarHBondContact O-CB 3.36Å; A348-C352 PolarHBondContact O-N 3.48Å; A348-C352 PolarHBondContact O-SG 3.39Å; S350-C352 PolarHBondContact O-N 3.36Å; C352-K356 WeakPolarHBondContact O-CB 3.39Å; C352-K356 PolarHBondContact O-N 3.1Å
353	S	98.5	Very high	98.1	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-71	-42.4	179.2	-54.6	0	0	0	0	111.8	V349 S350 L351 L357 I408	V349-S353 PolarHBondContact O-N 2.98Å; V349-S353 PolarHBondContact O-OG 3.27Å; S350-S353 PolarHBondContact O-N 3.42Å; S350-S353 VanDerWaalsContact O-N 3.16Å; L351-S353 VanDerWaalsContact C-N 3.27Å; L351-S353 PolarHBondContact O-N 3.24Å; S353-L357 VanDerWaalsContact O-CB 3.3Å; S353-L357 WeakPolarHBondContact O-CB 3.31Å; S353-L357 PolarHBondContact O-N 3.35Å; S353-I408 WeakPolarHBondContact OG-CG2 3.29Å
354	M	98.8	Very high	98.1	Very high	76 Å²	76	36.1 Å²	36.1	37%	0.374	20%	0.202	S	C	.	.	H	α-helix	trans	-62.8	-46.9	175.2	-71.1	176.9	-177.6	0	0	111.5	S350 L351 L357 F358 I409	S350-M354 WeakPolarHBondContact O-CG 3.24Å; S350-M354 PolarHBondContact O-N 3.1Å; L351-M354 HydrophobicContact CD2-SD 4.5Å; L351-M354 PolarHBondContact O-N 3.26Å; M354-L357 PolarHBondContact O-N 2.92Å; M354-F358 VanDerWaalsContact O-CB 3.3Å; M354-F358 WeakPolarHBondContact O-CB 3.39Å; M354-F358 PolarHBondContact O-N 3.01Å; M354-I409 HydrophobicContact CB-CD1 4.32Å; M354-I409 HydrophobicContact CE-CG2 3.73Å; M354-I409 HydrophobicContact CG-CD1 3.73Å; M354-I409 HydrophobicContact CG-CG1 3.81Å; M354-I409 HydrophobicContact CG-CG2 4.28Å
355	A	98.8	Very high	98.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.3	-50.7	176.7	0	0	0	0	0	110.9	L333 L334 A337 L351 L357 F358 V359	L333-A355 HydrophobicContact CG-CB 4.1Å; L334-A355 HydrophobicContact CD1-CB 4.26Å; A337-A355 HydrophobicContact CB-CB 3.66Å; L351-A355 VanDerWaalsContact O-CB 3.24Å; L351-A355 WeakPolarHBondContact O-CB 3.49Å; L351-A355 PolarHBondContact O-N 3.33Å; A355-L357 VanDerWaalsContact C-N 3.34Å; A355-L357 PolarHBondContact O-N 2.86Å; A355-F358 PolarHBondContact O-N 2.97Å; A355-V359 WeakPolarHBondContact O-CB 3.33Å; A355-V359 WeakPolarHBondContact O-CG2 3.26Å; A355-V359 PolarHBondContact O-N 3.25Å
356	K	98.9	Very high	98.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.3	-45.8	179.2	-169.8	-90.7	174.9	-176.8	0	112	R278 I281 C352 T360 H395 L398 G400 N402 M405	R278-K356 HydrophobicContact CB-CB 3.88Å; R278-K356 HydrophobicContact CB-CG 4.07Å; R278-K356 HydrophobicContact CG-CB 4.12Å; R278-K356 HydrophobicContact CG-CG 4.06Å; I281-K356 HydrophobicContact CG2-CG 4.06Å; C352-K356 WeakPolarHBondContact O-CB 3.39Å; C352-K356 PolarHBondContact O-N 3.1Å; K356-T360 HydrophobicContact CD-CG2 4.4Å; K356-T360 HydrophobicContact CG-CG2 4.32Å; K356-T360 VanDerWaalsContact O-CB 3.31Å; K356-T360 WeakPolarHBondContact O-CB 3.28Å; K356-T360 WeakPolarHBondContact O-CG2 3.48Å; K356-T360 PolarHBondContact O-N 3Å; K356-T360 VanDerWaalsContact O-N 3.15Å; K356-T360 PolarHBondContact O-OG1 3.22Å; K356-H395 WeakPolarHBondContact CE-O 3.23Å; K356-H395 PolarHBondContact NZ-O 2.64Å; K356-L398 WeakPolarHBondContact CE-O 3.47Å; K356-L398 PolarHBondContact NZ-O 3.45Å; K356-G400 PolarHBondContact NZ-O 3.06Å; K356-N402 PolarHBondContact NZ-OD1 3.01Å; K356-M405 HydrophobicContact CB-SD 4.35Å; K356-M405 HydrophobicContact CD-CG 3.7Å; K356-M405 HydrophobicContact CD-SD 4.01Å
357	L	98.9	Very high	98.4	Very high	28 Å²	28	24.7 Å²	24.7	15%	0.147	13%	0.128	C	C	.	.	H	α-helix	trans	-57.1	-59.9	176.4	171	59.9	0	0	0	111.6	S353 M354 A355 T360 D361 N402 M405 R406 I409	S353-L357 VanDerWaalsContact O-CB 3.3Å; S353-L357 WeakPolarHBondContact O-CB 3.31Å; S353-L357 PolarHBondContact O-N 3.35Å; M354-L357 PolarHBondContact O-N 2.92Å; A355-L357 VanDerWaalsContact C-N 3.34Å; A355-L357 PolarHBondContact O-N 2.86Å; L357-T360 PolarHBondContact O-OG1 3.1Å; L357-D361 PolarHBondContact O-N 2.7Å; L357-N402 HydrophobicContact CD1-CB 3.6Å; L357-M405 HydrophobicContact CB-CB 3.9Å; L357-M405 HydrophobicContact CB-CG 4.38Å; L357-R406 HydrophobicContact CD1-CG 4.29Å; L357-R406 HydrophobicContact CD2-CG 3.78Å; L357-I409 HydrophobicContact CB-CD1 4.46Å; L357-I409 HydrophobicContact CD2-CD1 3.73Å
358	F	98.9	Very high	98.5	Very high	73 Å²	73	25.2 Å²	25.2	32%	0.32	13%	0.131	S	C	.	.	H	α-helix	trans	-64.8	-48.5	-172.5	-178.7	-93.5	0	0	0	111.6	A329 L333 M354 A355 D361 E362	A329-F358 HydrophobicContact CB-CE1 4.11Å; A329-F358 HydrophobicContact CB-CZ 4.17Å; L333-F358 HydrophobicContact CD2-CB 3.62Å; L333-F358 HydrophobicContact CD2-CD1 3.81Å; L333-F358 HydrophobicContact CD2-CG 3.81Å; M354-F358 VanDerWaalsContact O-CB 3.3Å; M354-F358 WeakPolarHBondContact O-CB 3.39Å; M354-F358 PolarHBondContact O-N 3.01Å; A355-F358 PolarHBondContact O-N 2.97Å; F358-D361 PolarHBondContact O-N 2.68Å; F358-E362 HydrophobicContact CD1-CG 4.36Å; F358-E362 HydrophobicContact CD2-CG 4.26Å; F358-E362 HydrophobicContact CE1-CG 4.06Å; F358-E362 HydrophobicContact CE2-CG 3.96Å; F358-E362 HydrophobicContact CG-CG 4.46Å; F358-E362 HydrophobicContact CZ-CG 3.86Å; F358-E362 WeakPolarHBondContact O-CB 3.32Å; F358-E362 WeakPolarHBondContact O-CG 3.47Å; F358-E362 PolarHBondContact O-N 3.32Å
359	V	98.9	Very high	98.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-67.2	-43.1	-174.7	177.3	0	0	0	0	111	A282 L286 S330 L334 A355 C363	A282-V359 HydrophobicContact CB-CB 3.98Å; A282-V359 HydrophobicContact CB-CG1 3.94Å; A282-V359 WeakPolarHBondContact O-CG1 3.27Å; L286-V359 HydrophobicContact CB-CG1 4.34Å; S330-V359 WeakPolarHBondContact O-CG2 3.42Å; L334-V359 HydrophobicContact CB-CG2 4.19Å; A355-V359 WeakPolarHBondContact O-CB 3.33Å; A355-V359 WeakPolarHBondContact O-CG2 3.26Å; A355-V359 PolarHBondContact O-N 3.25Å; V359-C363 WeakPolarHBondContact O-CB 3.49Å; V359-C363 PolarHBondContact O-N 2.89Å; V359-C363 PolarHBondContact O-SG 3.34Å
360	T	98.9	Very high	98.8	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-68.3	-37.1	-179.8	60.1	0	0	0	0	112.5	K356 L357 F364 H395 N402	K356-T360 HydrophobicContact CD-CG2 4.4Å; K356-T360 HydrophobicContact CG-CG2 4.32Å; K356-T360 VanDerWaalsContact O-CB 3.31Å; K356-T360 WeakPolarHBondContact O-CB 3.28Å; K356-T360 WeakPolarHBondContact O-CG2 3.48Å; K356-T360 PolarHBondContact O-N 3Å; K356-T360 VanDerWaalsContact O-N 3.15Å; K356-T360 PolarHBondContact O-OG1 3.22Å; L357-T360 PolarHBondContact O-OG1 3.1Å; T360-F364 VanDerWaalsContact O-CB 3.3Å; T360-F364 WeakPolarHBondContact O-CB 3.36Å; T360-F364 PolarHBondContact O-N 3.34Å; T360-H395 HydrophobicContact CG2-CB 3.8Å; T360-N402 PolarHBondContact OG1-ND2 3.34Å; T360-N402 PolarHBondContact OG1-OD1 2.9Å
361	D	98.9	Very high	98.9	Very high	31 Å²	31	25.8 Å²	25.8	17%	0.166	13%	0.127	C	C	.	.	H	α-helix	trans	-67.2	-50.8	175	-81.5	-10	0	0	0	111.4	L357 F358 F364 N365 Q396 N402 R406	L357-D361 PolarHBondContact O-N 2.7Å; F358-D361 PolarHBondContact O-N 2.68Å; D361-F364 PolarHBondContact O-N 3.27Å; D361-N365 PolarHBondContact O-N 3.47Å; D361-N365 VanDerWaalsContact O-N 3.1Å; D361-N365 PolarHBondContact O-ND2 3.34Å; D361-Q396 PolarHBondContact OD1-NE2 3.46Å; D361-N402 VanDerWaalsContact CG-ND2 3.33Å; D361-N402 PolarHBondContact OD1-ND2 2.83Å; D361-R406 IonicContact OD2-NH2 3Å; D361-R406 PolarHBondContact OD2-NH2 3.1Å; D361-R406 VanDerWaalsContact OD2-NH2 3.15Å
362	E	98.9	Very high	98.9	Very high	36 Å²	36	30.9 Å²	30.9	17%	0.168	15%	0.151	C	C	.	.	H	α-helix	trans	-71.4	-38.2	-175.8	-66.3	-56	158.1	0	0	112.7	K326 F358 N365 I366	K326-E362 HydrophobicContact CB-CB 4.48Å; K326-E362 WeakPolarHBondContact CD-OE2 3.13Å; K326-E362 VanDerWaalsContact CE-OE2 3.25Å; K326-E362 WeakPolarHBondContact CE-OE2 3.41Å; K326-E362 IonicContact NZ-OE1 3.33Å; K326-E362 IonicContact NZ-OE2 2.68Å; K326-E362 PolarHBondContact NZ-OE2 3.38Å; F358-E362 HydrophobicContact CD1-CG 4.36Å; F358-E362 HydrophobicContact CD2-CG 4.26Å; F358-E362 HydrophobicContact CE1-CG 4.06Å; F358-E362 HydrophobicContact CE2-CG 3.96Å; F358-E362 HydrophobicContact CG-CG 4.46Å; F358-E362 HydrophobicContact CZ-CG 3.86Å; F358-E362 WeakPolarHBondContact O-CB 3.32Å; F358-E362 WeakPolarHBondContact O-CG 3.47Å; F358-E362 PolarHBondContact O-N 3.32Å; E362-N365 WeakPolarHBondContact O-CB 3.35Å; E362-N365 PolarHBondContact O-N 2.95Å; E362-I366 VanDerWaalsContact O-CG1 3.25Å; E362-I366 WeakPolarHBondContact O-CG1 3.39Å; E362-I366 PolarHBondContact O-N 3.11Å
363	C	98.9	Very high	98.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-67.7	-36.6	176.8	-68.3	0	0	0	0	112.3	S285 A289 V359 I366 C367 I392	S285-C363 WeakPolarHBondContact O-CB 3.46Å; A289-C363 HydrophobicContact CB-CB 3.67Å; V359-C363 WeakPolarHBondContact O-CB 3.49Å; V359-C363 PolarHBondContact O-N 2.89Å; V359-C363 PolarHBondContact O-SG 3.34Å; C363-I366 PolarHBondContact O-N 2.95Å; C363-C367 PolarHBondContact O-N 2.88Å; C363-C367 PolarHBondContact O-SG 3.41Å; C363-I392 HydrophobicContact CB-CD1 4.47Å; C363-I392 WeakPolarHBondContact O-CD1 3.39Å
364	F	98.9	Very high	98.9	Very high	35 Å²	35	32 Å²	32	15%	0.154	16%	0.156	C	C	.	.	H	α-helix	trans	-60.9	-47.1	171.2	176.1	-100.8	0	0	0	111.3	T360 D361 I366 C367 N368 V389 I392 R393	T360-F364 VanDerWaalsContact O-CB 3.3Å; T360-F364 WeakPolarHBondContact O-CB 3.36Å; T360-F364 PolarHBondContact O-N 3.34Å; D361-F364 PolarHBondContact O-N 3.27Å; F364-I366 VanDerWaalsContact C-N 3.32Å; F364-I366 PolarHBondContact O-N 2.88Å; F364-C367 PolarHBondContact O-N 3.48Å; F364-N368 WeakPolarHBondContact O-CB 3.36Å; F364-N368 PolarHBondContact O-N 2.9Å; F364-V389 HydrophobicContact CE2-CG1 3.98Å; F364-I392 HydrophobicContact CB-CD1 4.47Å; F364-I392 HydrophobicContact CB-CG1 4.35Å; F364-I392 HydrophobicContact CD2-CG1 4.15Å; F364-R393 HydrophobicContact CD2-CB 4.12Å; F364-R393 HydrophobicContact CE2-CB 3.83Å; F364-R393 HydrophobicContact CE2-CG 4.21Å
365	N	98.9	Very high	98.9	Very high	68 Å²	68	30.2 Å²	30.2	36%	0.364	16%	0.157	S	C	.	.	H	α-helix	trans	-58.8	-43.2	176.5	-72.6	-32.8	0	0	0	111.9	D361 E362 N368 Q369	D361-N365 PolarHBondContact O-N 3.47Å; D361-N365 VanDerWaalsContact O-N 3.1Å; D361-N365 PolarHBondContact O-ND2 3.34Å; E362-N365 WeakPolarHBondContact O-CB 3.35Å; E362-N365 PolarHBondContact O-N 2.95Å; N365-N368 PolarHBondContact O-N 3.36Å; N365-Q369 VanDerWaalsContact O-CG 3.27Å; N365-Q369 WeakPolarHBondContact O-CG 3.36Å; N365-Q369 PolarHBondContact O-N 3.33Å
366	I	98.9	Very high	98.9	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-58.9	-50.1	175.9	-70.9	163.7	0	0	0	111.1	A289 V293 M323 K326 L327 E362 C363 F364 N368 Q369 A370	A289-I366 HydrophobicContact CB-CB 4.13Å; A289-I366 HydrophobicContact CB-CD1 4.17Å; A289-I366 HydrophobicContact CB-CG2 3.88Å; V293-I366 HydrophobicContact CG2-CG2 3.58Å; M323-I366 HydrophobicContact CB-CG1 4.27Å; M323-I366 HydrophobicContact CB-CG2 4.31Å; M323-I366 HydrophobicContact CE-CG2 3.93Å; M323-I366 HydrophobicContact CG-CG1 4.35Å; M323-I366 HydrophobicContact CG-CG2 4.37Å; K326-I366 HydrophobicContact CB-CD1 3.92Å; K326-I366 HydrophobicContact CB-CG1 4.37Å; L327-I366 HydrophobicContact CB-CD1 4.04Å; E362-I366 VanDerWaalsContact O-CG1 3.25Å; E362-I366 WeakPolarHBondContact O-CG1 3.39Å; E362-I366 PolarHBondContact O-N 3.11Å; C363-I366 PolarHBondContact O-N 2.95Å; F364-I366 VanDerWaalsContact C-N 3.32Å; F364-I366 PolarHBondContact O-N 2.88Å; I366-N368 VanDerWaalsContact C-N 3.33Å; I366-N368 PolarHBondContact O-N 3.2Å; I366-Q369 PolarHBondContact O-N 3.45Å; I366-A370 PolarHBondContact O-N 3.42Å
367	C	98.9	Very high	98.9	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.9	-39.1	-178.5	-63.3	0	0	0	0	111.8	C292 C363 F364 Q369 A370 L371 V389 I392	C292-C367 HydrophobicContact CB-CB 4.4Å; C292-C367 PolarHBondContact SG-SG 3.3Å; C363-C367 PolarHBondContact O-N 2.88Å; C363-C367 PolarHBondContact O-SG 3.41Å; F364-C367 PolarHBondContact O-N 3.48Å; C367-Q369 VanDerWaalsContact C-N 3.35Å; C367-Q369 PolarHBondContact O-N 2.83Å; C367-A370 WeakPolarHBondContact O-CB 3.44Å; C367-A370 PolarHBondContact O-N 2.68Å; C367-L371 PolarHBondContact O-N 2.91Å; C367-V389 VanDerWaalsContact C-CG2 3.44Å; C367-V389 HydrophobicContact CB-CG2 3.79Å; C367-V389 WeakPolarHBondContact O-CG2 3.36Å; C367-I392 HydrophobicContact CB-CD1 3.74Å; C367-I392 WeakPolarHBondContact SG-CD1 3.38Å
368	N	98.9	Very high	98.9	Very high	70 Å²	70	36 Å²	36	37%	0.374	20%	0.196	S	C	.	.	H	α-helix	trans	-66.4	-36.6	176.8	-168.9	50.2	0	0	0	112.1	F364 N365 I366 L371 Q372	F364-N368 WeakPolarHBondContact O-CB 3.36Å; F364-N368 PolarHBondContact O-N 2.9Å; N365-N368 PolarHBondContact O-N 3.36Å; I366-N368 VanDerWaalsContact C-N 3.33Å; I366-N368 PolarHBondContact O-N 3.2Å; N368-L371 WeakPolarHBondContact O-CB 3.47Å; N368-L371 PolarHBondContact O-N 2.98Å; N368-Q372 PolarHBondContact O-N 3.44Å; N368-Q372 VanDerWaalsContact O-N 3.07Å
369	Q	98.9	Very high	98.9	Very high	70 Å²	70	41.5 Å²	41.5	33%	0.327	22%	0.217	S	C	.	.	H	α-helix	trans	-69.4	-37.7	172.8	-68.2	-63.8	-0.8	0	0	112.2	M323 N365 I366 C367 L371 Q372 M373	M323-Q369 HydrophobicContact CG-CB 4.3Å; M323-Q369 HydrophobicContact SD-CB 3.84Å; N365-Q369 VanDerWaalsContact O-CG 3.27Å; N365-Q369 WeakPolarHBondContact O-CG 3.36Å; N365-Q369 PolarHBondContact O-N 3.33Å; I366-Q369 PolarHBondContact O-N 3.45Å; C367-Q369 VanDerWaalsContact C-N 3.35Å; C367-Q369 PolarHBondContact O-N 2.83Å; Q369-L371 VanDerWaalsContact C-N 3.27Å; Q369-L371 PolarHBondContact O-N 3.42Å; Q369-Q372 WeakPolarHBondContact O-CB 3.42Å; Q369-Q372 PolarHBondContact O-N 3.11Å; Q369-Q372 VanDerWaalsContact O-N 3.17Å; Q369-M373 WeakPolarHBondContact O-CG 3.37Å; Q369-M373 PolarHBondContact O-N 2.94Å
370	A	98.9	Very high	98.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.5	-39.8	172.5	0	0	0	0	0	111.3	C292 A296 M323 I366 C367 M373 H374 V385	C292-A370 HydrophobicContact CB-CB 3.62Å; C292-A370 WeakPolarHBondContact O-CB 3.38Å; A296-A370 HydrophobicContact CB-CB 4.07Å; M323-A370 HydrophobicContact CE-CB 3.9Å; I366-A370 PolarHBondContact O-N 3.42Å; C367-A370 WeakPolarHBondContact O-CB 3.44Å; C367-A370 PolarHBondContact O-N 2.68Å; A370-M373 PolarHBondContact O-N 3.17Å; A370-H374 PolarHBondContact O-N 3.3Å; A370-H374 PolarHBondContact O-ND1 2.94Å; A370-V385 HydrophobicContact CB-CG2 3.63Å
371	L	98.9	Very high	98.8	Very high	28 Å²	28	50.5 Å²	50.5	15%	0.147	26%	0.259	C	S	.	.	H	α-helix	trans	-58.3	-49	173.2	-176.3	155.1	0	0	0	110.4	C367 N368 Q369 M373 H374 G375 G378 V385 Q386 V389	C367-L371 PolarHBondContact O-N 2.91Å; N368-L371 WeakPolarHBondContact O-CB 3.47Å; N368-L371 PolarHBondContact O-N 2.98Å; Q369-L371 VanDerWaalsContact C-N 3.27Å; Q369-L371 PolarHBondContact O-N 3.42Å; L371-M373 VanDerWaalsContact C-N 3.3Å; L371-M373 PolarHBondContact O-N 2.91Å; L371-H374 PolarHBondContact O-N 3.37Å; L371-H374 VanDerWaalsContact O-N 3.1Å; L371-G375 PolarHBondContact O-N 3.39Å; L371-G378 WeakPolarHBondContact CG-O 3.34Å; L371-V385 HydrophobicContact CB-CG1 4.46Å; L371-V385 HydrophobicContact CB-CG2 4.1Å; L371-V385 VanDerWaalsContact N-CG2 3.32Å; L371-Q386 HydrophobicContact CD1-CB 4.25Å; L371-V389 HydrophobicContact CB-CG2 4.15Å; L371-V389 HydrophobicContact CD1-CB 4.39Å; L371-V389 HydrophobicContact CD1-CG2 4.02Å
372	Q	98.9	Very high	98.7	Very high	132 Å²	132	56 Å²	56	62%	0.617	29%	0.288	S	S	*	.	H	α-helix	trans	-58.4	-39.7	177	-173.6	63.4	32.5	0	0	112.5	N368 Q369 H374 G375	N368-Q372 PolarHBondContact O-N 3.44Å; N368-Q372 VanDerWaalsContact O-N 3.07Å; Q369-Q372 WeakPolarHBondContact O-CB 3.42Å; Q369-Q372 PolarHBondContact O-N 3.11Å; Q369-Q372 VanDerWaalsContact O-N 3.17Å; Q372-H374 PolarHBondContact O-N 3.28Å; Q372-G375 PolarHBondContact O-N 2.93Å
373	M	98.8	Very high	98.7	Very high	12 Å²	12	58.3 Å²	58.3	6%	0.059	30%	0.296	C	S	.	.	H	α-helix	trans	-67.3	-20.7	178.7	-72.2	-176.7	136.5	0	0	114	A296 H299 L300 L316 K319 L320 M323 Q369 A370 L371	A296-M373 HydrophobicContact CB-CB 4.41Å; A296-M373 HydrophobicContact CB-SD 3.84Å; H299-M373 PolarHBondContact CE1-O 3.01Å; H299-M373 PolarHBondContact ND1-O 3.13Å; L300-M373 HydrophobicContact CD1-CE 3.61Å; L300-M373 HydrophobicContact CD1-SD 3.99Å; L300-M373 HydrophobicContact CD2-CE 4.48Å; L316-M373 HydrophobicContact CB-CE 4.13Å; L316-M373 HydrophobicContact CD2-CE 3.94Å; L316-M373 HydrophobicContact CD2-CG 4.28Å; L316-M373 WeakPolarHBondContact O-CE 3.41Å; K319-M373 HydrophobicContact CB-CE 3.71Å; L320-M373 HydrophobicContact CB-CE 4.25Å; M323-M373 HydrophobicContact CE-SD 4.5Å; M323-M373 HydrophobicContact SD-SD 3.92Å; Q369-M373 WeakPolarHBondContact O-CG 3.37Å; Q369-M373 PolarHBondContact O-N 2.94Å; A370-M373 PolarHBondContact O-N 3.17Å; L371-M373 VanDerWaalsContact C-N 3.3Å; L371-M373 PolarHBondContact O-N 2.91Å
374	H	98.8	Very high	98.7	Very high	11 Å²	11	59.9 Å²	59.9	5%	0.051	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-6.7	172.1	-71.6	74.6	0	0	0	112.8	H299 A370 L371 Q372 G376 Y377 G378 Y383	H299-H374 AromaticContact CD2-CD2 3.96Å; H299-H374 AromaticContact CG-CD2 3.81Å; H299-H374 AromaticContact CG-NE2 3.97Å; A370-H374 PolarHBondContact O-N 3.3Å; A370-H374 PolarHBondContact O-ND1 2.94Å; L371-H374 PolarHBondContact O-N 3.37Å; L371-H374 VanDerWaalsContact O-N 3.1Å; Q372-H374 PolarHBondContact O-N 3.28Å; H374-G376 PolarHBondContact O-N 3.27Å; H374-Y377 WeakPolarHBondContact O-CB 3.12Å; H374-Y377 PolarHBondContact O-N 3.14Å; H374-G378 VanDerWaalsContact CB-CA 3.49Å; H374-G378 PolarHBondContact O-N 3.27Å; H374-Y383 AromaticContact CD2-CD1 3.85Å
375	G	98.7	Very high	98.7	Very high	39 Å²	39	58.3 Å²	58.3	40%	0.402	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	56.6	-137.2	-178.4	0	0	0	0	0	112	L371 Q372 Y377 G378	L371-G375 PolarHBondContact O-N 3.39Å; Q372-G375 PolarHBondContact O-N 2.93Å; G375-Y377 PolarHBondContact O-N 2.98Å; G375-G378 PolarHBondContact O-N 3.12Å
376	G	98.6	Very high	98.7	Very high	60 Å²	60	55.8 Å²	55.8	62%	0.619	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-57.4	-33.1	179.5	0	0	0	0	0	114	H374 G378 Y379	H374-G376 PolarHBondContact O-N 3.27Å; G376-G378 VanDerWaalsContact C-N 3.28Å; G376-G378 PolarHBondContact O-N 2.94Å; G376-Y379 PolarHBondContact O-N 3.42Å; G376-Y379 VanDerWaalsContact O-N 3.15Å
377	Y	98.7	Very high	98.7	Very high	89 Å²	89	56 Å²	56	35%	0.349	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-65.5	-33.6	176.8	-62.1	-80.8	0	0	0	112.3	R303 H374 G375 Y379 L380 Y383	R303-Y377 VanDerWaalsContact NH1-CZ 3.34Å; R303-Y377 PolarHBondContact NH1-OH 2.95Å; H374-Y377 WeakPolarHBondContact O-CB 3.12Å; H374-Y377 PolarHBondContact O-N 3.14Å; G375-Y377 PolarHBondContact O-N 2.98Å; Y377-Y379 PolarHBondContact O-N 3.12Å; Y377-Y379 VanDerWaalsContact O-N 3.08Å; Y377-L380 HydrophobicContact CD1-CD1 4.19Å; Y377-L380 PolarHBondContact O-N 3.21Å; Y377-Y383 AromaticContact CD1-CE2 3.64Å; Y377-Y383 HydrophobicContact CD1-CE2 3.64Å; Y377-Y383 AromaticContact CD1-CZ 3.72Å; Y377-Y383 WeakPolarHBondContact CD1-OH 3.48Å; Y377-Y383 HydrophobicContact CG-CE2 4.06Å; Y377-Y383 AromaticContact CG-CZ 3.94Å; Y377-Y383 WeakPolarHBondContact O-CB 3.19Å; Y377-Y383 VanDerWaalsContact O-CD2 3.32Å; Y377-Y383 WeakPolarHBondContact O-CD2 3.44Å
378	G	98.7	Very high	98.7	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-62.4	-15.3	176.3	0	0	0	0	0	113.3	L371 H374 G375 G376 Q386	L371-G378 WeakPolarHBondContact CG-O 3.34Å; H374-G378 VanDerWaalsContact CB-CA 3.49Å; H374-G378 PolarHBondContact O-N 3.27Å; G375-G378 PolarHBondContact O-N 3.12Å; G376-G378 VanDerWaalsContact C-N 3.28Å; G376-G378 PolarHBondContact O-N 2.94Å; G378-Q386 WeakPolarHBondContact O-CB 3.45Å
379	Y	98.7	Very high	98.7	Very high	189 Å²	189	53.6 Å²	53.6	74%	0.741	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-96.9	-9.7	176.6	-156	-114.2	0	0	0	113.4	G376 Y377	G376-Y379 PolarHBondContact O-N 3.42Å; G376-Y379 VanDerWaalsContact O-N 3.15Å; Y377-Y379 PolarHBondContact O-N 3.12Å; Y377-Y379 VanDerWaalsContact O-N 3.08Å
380	L	98.6	Very high	98.7	Very high	78 Å²	78	52 Å²	52	41%	0.408	27%	0.268	S	S	.	.	S	Bend	trans	-83.6	140.9	178.6	-56	-179.3	0	0	0	110.7	Y377 D382 Y383	Y377-L380 HydrophobicContact CD1-CD1 4.19Å; Y377-L380 PolarHBondContact O-N 3.21Å; L380-D382 PolarHBondContact O-N 3.13Å; L380-Y383 HydrophobicContact CB-CD2 4.34Å; L380-Y383 PolarHBondContact O-N 3.28Å; L380-Y383 VanDerWaalsContact O-N 3.11Å
381	K	98.3	Very high	98.7	Very high	111 Å²	111	52 Å²	52	48%	0.483	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-19.7	179.6	-76.3	-81.9	-179.2	121.8	0	113.8	D69 Y383	D69-K381 IonicContact OD2-NZ 3.08Å; D69-K381 PolarHBondContact OD2-NZ 3.05Å; K381-Y383 PolarHBondContact O-N 3.04Å
382	D	97.7	Very high	98.7	Very high	146 Å²	146	50.6 Å²	50.6	78%	0.781	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-15.2	174.6	-57	-42.4	0	0	0	113.3	L380	L380-D382 PolarHBondContact O-N 3.13Å
383	Y	98.3	Very high	98.7	Very high	84 Å²	84	49.5 Å²	49.5	33%	0.329	25%	0.251	S	S	.	.	S	Bend	trans	-107.4	119	179	-73.6	-102.6	0	0	0	110.8	H374 Y377 L380 K381 V385 Q386	H374-Y383 AromaticContact CD2-CD1 3.85Å; Y377-Y383 AromaticContact CD1-CE2 3.64Å; Y377-Y383 HydrophobicContact CD1-CE2 3.64Å; Y377-Y383 AromaticContact CD1-CZ 3.72Å; Y377-Y383 WeakPolarHBondContact CD1-OH 3.48Å; Y377-Y383 HydrophobicContact CG-CE2 4.06Å; Y377-Y383 AromaticContact CG-CZ 3.94Å; Y377-Y383 WeakPolarHBondContact O-CB 3.19Å; Y377-Y383 VanDerWaalsContact O-CD2 3.32Å; Y377-Y383 WeakPolarHBondContact O-CD2 3.44Å; L380-Y383 HydrophobicContact CB-CD2 4.34Å; L380-Y383 PolarHBondContact O-N 3.28Å; L380-Y383 VanDerWaalsContact O-N 3.11Å; K381-Y383 PolarHBondContact O-N 3.04Å; Y383-V385 PolarHBondContact O-N 3.25Å; Y383-Q386 WeakPolarHBondContact O-CG 3.38Å; Y383-Q386 PolarHBondContact O-N 3.42Å
384	A	98.4	Very high	98.7	Very high	34 Å²	34	50.8 Å²	50.8	28%	0.281	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-31.5	-177.1	0	0	0	0	0	115	M65 L295 Q386 Q387 F388	M65-A384 HydrophobicContact CE-CB 3.6Å; L295-A384 HydrophobicContact CD1-CB 4.23Å; A384-Q386 PolarHBondContact O-N 3.27Å; A384-Q386 VanDerWaalsContact O-N 3.11Å; A384-Q387 WeakPolarHBondContact O-CB 3.3Å; A384-Q387 PolarHBondContact O-N 2.73Å; A384-F388 HydrophobicContact CB-CD2 4.39Å; A384-F388 HydrophobicContact CB-CE2 3.9Å; A384-F388 WeakPolarHBondContact O-CD2 3.29Å; A384-F388 PolarHBondContact O-N 3.05Å
385	V	98.6	Very high	98.7	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.012	26%	0.257	C	S	.	.	H	α-helix	trans	-52.2	-38.5	-174.8	70.3	0	0	0	0	113.4	A370 L371 Y383 Q387 F388 V389	A370-V385 HydrophobicContact CB-CG2 3.63Å; L371-V385 HydrophobicContact CB-CG1 4.46Å; L371-V385 HydrophobicContact CB-CG2 4.1Å; L371-V385 VanDerWaalsContact N-CG2 3.32Å; Y383-V385 PolarHBondContact O-N 3.25Å; V385-Q387 VanDerWaalsContact C-N 3.31Å; V385-Q387 PolarHBondContact O-N 3.17Å; V385-F388 PolarHBondContact O-N 2.7Å; V385-V389 WeakPolarHBondContact O-CG2 3.44Å; V385-V389 PolarHBondContact O-N 2.6Å; V385-V389 VanDerWaalsContact O-N 3.13Å
386	Q	98.8	Very high	98.7	Very high	15 Å²	15	49.7 Å²	49.7	7%	0.07	24%	0.244	C	C	.	.	H	α-helix	trans	-69.5	-30.9	-179.5	69.1	96.3	-94.5	0	0	112.8	L371 G378 Y383 A384 V389 R390	L371-Q386 HydrophobicContact CD1-CB 4.25Å; G378-Q386 WeakPolarHBondContact O-CB 3.45Å; Y383-Q386 WeakPolarHBondContact O-CG 3.38Å; Y383-Q386 PolarHBondContact O-N 3.42Å; A384-Q386 PolarHBondContact O-N 3.27Å; A384-Q386 VanDerWaalsContact O-N 3.11Å; Q386-V389 PolarHBondContact O-N 2.75Å; Q386-R390 WeakPolarHBondContact O-CG 3.29Å; Q386-R390 PolarHBondContact O-N 3.04Å; Q386-R390 VanDerWaalsContact O-N 3.09Å
387	Q	98.9	Very high	98.7	Very high	5 Å²	5	50.9 Å²	50.9	2%	0.023	24%	0.235	C	C	.	.	H	α-helix	trans	-75.4	-41	179	-178.6	167	-11.4	0	0	109.7	M65 A384 V385 V389 R390 D391	M65-Q387 HydrophobicContact CE-CB 4.28Å; M65-Q387 VanDerWaalsContact CG-CD 3.47Å; M65-Q387 PolarHBondContact O-NE2 2.81Å; M65-Q387 PolarHBondContact O-OE1 3.39Å; M65-Q387 HydrophobicContact SD-CG 4.3Å; A384-Q387 WeakPolarHBondContact O-CB 3.3Å; A384-Q387 PolarHBondContact O-N 2.73Å; V385-Q387 VanDerWaalsContact C-N 3.31Å; V385-Q387 PolarHBondContact O-N 3.17Å; Q387-V389 VanDerWaalsContact C-N 3.28Å; Q387-V389 PolarHBondContact O-N 2.94Å; Q387-R390 PolarHBondContact O-N 3.34Å; Q387-R390 VanDerWaalsContact O-N 3.16Å; Q387-D391 WeakPolarHBondContact CG-OD2 3.38Å; Q387-D391 VanDerWaalsContact O-CB 3.31Å; Q387-D391 WeakPolarHBondContact O-CB 3.48Å; Q387-D391 PolarHBondContact O-N 2.95Å
388	F	98.9	Very high	98.6	Very high	4 Å²	4	49.4 Å²	49.4	2%	0.018	23%	0.233	C	C	.	.	H	α-helix	trans	-55.1	-44.6	171.1	-67.5	-51.9	0	0	0	111.8	M65 S114 V118 A288 A291 C292 L295 A384 V385 D391 I392	M65-F388 HydrophobicContact SD-CE1 4.26Å; M65-F388 HydrophobicContact SD-CZ 4.37Å; S114-F388 WeakPolarHBondContact O-CE1 3.18Å; V118-F388 HydrophobicContact CG2-CD1 3.64Å; V118-F388 HydrophobicContact CG2-CE1 3.98Å; A288-F388 HydrophobicContact CB-CB 4.17Å; A288-F388 HydrophobicContact CB-CD1 3.73Å; A288-F388 HydrophobicContact CB-CE1 4.48Å; A288-F388 HydrophobicContact CB-CG 4.19Å; A291-F388 HydrophobicContact CB-CE2 3.84Å; A291-F388 HydrophobicContact CB-CZ 3.82Å; C292-F388 VanDerWaalsContact SG-CB 3.6Å; C292-F388 WeakPolarHBondContact SG-CD2 3.39Å; L295-F388 HydrophobicContact CD1-CE2 4.15Å; A384-F388 HydrophobicContact CB-CD2 4.39Å; A384-F388 HydrophobicContact CB-CE2 3.9Å; A384-F388 WeakPolarHBondContact O-CD2 3.29Å; A384-F388 PolarHBondContact O-N 3.05Å; V385-F388 PolarHBondContact O-N 2.7Å; F388-D391 PolarHBondContact O-N 2.93Å; F388-I392 VanDerWaalsContact O-CG1 3.27Å; F388-I392 WeakPolarHBondContact O-CG1 3.37Å; F388-I392 PolarHBondContact O-N 2.99Å
389	V	98.9	Very high	98.4	Very high	17 Å²	17	50.9 Å²	50.9	10%	0.103	24%	0.24	C	C	.	.	H	α-helix	trans	-58.9	-49.3	175.2	171.6	0	0	0	0	111.9	F364 C367 L371 V385 Q386 Q387 R393	F364-V389 HydrophobicContact CE2-CG1 3.98Å; C367-V389 VanDerWaalsContact C-CG2 3.44Å; C367-V389 HydrophobicContact CB-CG2 3.79Å; C367-V389 WeakPolarHBondContact O-CG2 3.36Å; L371-V389 HydrophobicContact CB-CG2 4.15Å; L371-V389 HydrophobicContact CD1-CB 4.39Å; L371-V389 HydrophobicContact CD1-CG2 4.02Å; V385-V389 WeakPolarHBondContact O-CG2 3.44Å; V385-V389 PolarHBondContact O-N 2.6Å; V385-V389 VanDerWaalsContact O-N 3.13Å; Q386-V389 PolarHBondContact O-N 2.75Å; Q387-V389 VanDerWaalsContact C-N 3.28Å; Q387-V389 PolarHBondContact O-N 2.94Å; V389-R393 WeakPolarHBondContact O-CB 3.37Å; V389-R393 PolarHBondContact O-N 2.97Å
390	R	98.9	Very high	98.3	Very high	35 Å²	35	42.9 Å²	42.9	13%	0.132	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-43.1	-179.2	-71	-179.7	-56.2	106.8	-3.8	112.1	D69 V237 N240 Q386 Q387	D69-R390 IonicContact OD1-CZ 3.58Å; D69-R390 IonicContact OD1-NH1 2.89Å; D69-R390 PolarHBondContact OD1-NH1 2.82Å; D69-R390 IonicContact OD1-NH2 2.68Å; D69-R390 PolarHBondContact OD1-NH2 3.29Å; D69-R390 IonicContact OD2-CZ 2.8Å; D69-R390 IonicContact OD2-NH1 2.68Å; D69-R390 PolarHBondContact OD2-NH1 3.21Å; D69-R390 IonicContact OD2-NH2 2.7Å; D69-R390 PolarHBondContact OD2-NH2 3.47Å; V237-R390 HydrophobicContact CG1-CB 4.2Å; V237-R390 HydrophobicContact CG1-CG 3.99Å; V237-R390 WeakPolarHBondContact O-CD 3.49Å; V237-R390 PolarHBondContact O-NH1 3.36Å; N240-R390 PolarHBondContact ND2-NH1 2.9Å; Q386-R390 WeakPolarHBondContact O-CG 3.29Å; Q386-R390 PolarHBondContact O-N 3.04Å; Q386-R390 VanDerWaalsContact O-N 3.09Å; Q387-R390 PolarHBondContact O-N 3.34Å; Q387-R390 VanDerWaalsContact O-N 3.16Å
391	D	98.9	Very high	98.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-73	-40.8	-174.1	-75.1	-8	0	0	0	112	V118 S119 G238 W239 Q387 F388 V394 H395	V118-D391 HydrophobicContact CB-CB 3.82Å; V118-D391 HydrophobicContact CG1-CB 3.79Å; S119-D391 WeakPolarHBondContact CB-OD2 3.47Å; S119-D391 PolarHBondContact N-OD2 2.98Å; G238-D391 WeakPolarHBondContact CA-OD1 3.42Å; W239-D391 VanDerWaalsContact CD1-O 3.3Å; W239-D391 PolarHBondContact N-OD1 3.44Å; W239-D391 PolarHBondContact NE1-O 3.34Å; W239-D391 VanDerWaalsContact NE1-O 3.1Å; Q387-D391 WeakPolarHBondContact CG-OD2 3.38Å; Q387-D391 VanDerWaalsContact O-CB 3.31Å; Q387-D391 WeakPolarHBondContact O-CB 3.48Å; Q387-D391 PolarHBondContact O-N 2.95Å; F388-D391 PolarHBondContact O-N 2.93Å; D391-V394 WeakPolarHBondContact O-CG1 3.47Å; D391-H395 PolarHBondContact O-NE2 3.4Å
392	I	98.8	Very high	98.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-84.9	-12.2	-179.4	76.5	-171.5	0	0	0	113.5	V118 A288 C363 F364 C367 F388 V394 H395	V118-I392 HydrophobicContact CG1-CG2 3.84Å; V118-I392 HydrophobicContact CG2-CG2 4.13Å; A288-I392 HydrophobicContact CB-CD1 4.16Å; A288-I392 HydrophobicContact CB-CG2 3.47Å; A288-I392 VanDerWaalsContact CB-CG2 3.47Å; C363-I392 HydrophobicContact CB-CD1 4.47Å; C363-I392 WeakPolarHBondContact O-CD1 3.39Å; F364-I392 HydrophobicContact CB-CD1 4.47Å; F364-I392 HydrophobicContact CB-CG1 4.35Å; F364-I392 HydrophobicContact CD2-CG1 4.15Å; C367-I392 HydrophobicContact CB-CD1 3.74Å; C367-I392 WeakPolarHBondContact SG-CD1 3.38Å; F388-I392 VanDerWaalsContact O-CG1 3.27Å; F388-I392 WeakPolarHBondContact O-CG1 3.37Å; F388-I392 PolarHBondContact O-N 2.99Å; I392-V394 PolarHBondContact O-N 3.26Å; I392-H395 VanDerWaalsContact O-CB 3.26Å; I392-H395 WeakPolarHBondContact O-CB 3.5Å; I392-H395 PolarHBondContact O-N 3.01Å
393	R	98.9	Very high	98.4	Very high	108 Å²	108	33.6 Å²	33.6	41%	0.408	17%	0.168	S	C	.	.	H	α-helix	trans	-56.5	-38	174.8	177.3	58	-170.5	89.4	-4.8	111.4	F364 V389 H395 Q396	F364-R393 HydrophobicContact CD2-CB 4.12Å; F364-R393 HydrophobicContact CE2-CB 3.83Å; F364-R393 HydrophobicContact CE2-CG 4.21Å; V389-R393 WeakPolarHBondContact O-CB 3.37Å; V389-R393 PolarHBondContact O-N 2.97Å; R393-H395 PolarHBondContact O-N 2.73Å; R393-Q396 VanDerWaalsContact NH1-OE1 3.1Å
394	V	98.8	Very high	98.4	Very high	39 Å²	39	30.5 Å²	30.5	24%	0.236	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-72.2	-18	-179.8	82.6	0	0	0	0	112.5	W239 D391 I392 Q396 I397 L398	W239-V394 HydrophobicContact CD2-CG1 3.63Å; W239-V394 VanDerWaalsContact CE2-CG1 3.43Å; W239-V394 HydrophobicContact CE3-CG1 4.25Å; W239-V394 HydrophobicContact CG-CG1 3.89Å; W239-V394 HydrophobicContact CZ2-CG1 3.91Å; D391-V394 WeakPolarHBondContact O-CG1 3.47Å; I392-V394 PolarHBondContact O-N 3.26Å; V394-Q396 PolarHBondContact O-N 3.15Å; V394-I397 HydrophobicContact CG2-CD1 4.46Å; V394-I397 WeakPolarHBondContact O-CA 3.49Å; V394-I397 WeakPolarHBondContact O-CB 3.38Å; V394-I397 PolarHBondContact O-N 3.05Å; V394-L398 HydrophobicContact CG1-CD1 4.01Å; V394-L398 HydrophobicContact CG2-CD1 3.85Å; V394-L398 HydrophobicContact CG2-CG 4Å; V394-L398 PolarHBondContact O-N 3.34Å
395	H	98.9	Very high	98.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-67	-25.3	178.8	-59.4	-179.1	0	0	0	112.5	V118 W239 I281 S285 K356 T360 D391 I392 R393 I397	V118-H395 WeakPolarHBondContact CG1-CE1 3.4Å; W239-H395 AromaticContact CE2-CD2 3.75Å; W239-H395 AromaticContact CE2-NE2 3.49Å; W239-H395 AromaticContact CZ2-CD2 3.45Å; W239-H395 VanDerWaalsContact CZ2-CD2 3.45Å; W239-H395 WeakPolarHBondContact CZ2-CD2 3.05Å; W239-H395 AromaticContact CZ2-NE2 3.36Å; W239-H395 WeakPolarHBondContact CZ2-NE2 3.48Å; W239-H395 AromaticContact NE1-CD2 3.59Å; W239-H395 AromaticContact NE1-NE2 3.08Å; W239-H395 PolarHBondContact NE1-NE2 3.3Å; I281-H395 HydrophobicContact CD1-CB 4.05Å; I281-H395 HydrophobicContact CG1-CB 3.88Å; I281-H395 PolarHBondContact O-ND1 2.88Å; S285-H395 PolarHBondContact OG-ND1 3.46Å; K356-H395 WeakPolarHBondContact CE-O 3.23Å; K356-H395 PolarHBondContact NZ-O 2.64Å; T360-H395 HydrophobicContact CG2-CB 3.8Å; D391-H395 PolarHBondContact O-NE2 3.4Å; I392-H395 VanDerWaalsContact O-CB 3.26Å; I392-H395 WeakPolarHBondContact O-CB 3.5Å; I392-H395 PolarHBondContact O-N 3.01Å; R393-H395 PolarHBondContact O-N 2.73Å; H395-I397 PolarHBondContact O-N 3.26Å
396	Q	98.9	Very high	98.4	Very high	27 Å²	27	34 Å²	34	13%	0.126	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-70.1	-12.7	171.6	-61.3	173.3	-63.3	0	0	112.7	D361 R393 V394 T401 N402	D361-Q396 PolarHBondContact OD1-NE2 3.46Å; R393-Q396 VanDerWaalsContact NH1-OE1 3.1Å; V394-Q396 PolarHBondContact O-N 3.15Å; Q396-T401 WeakPolarHBondContact O-CA 3.46Å; Q396-N402 PolarHBondContact O-N 2.9Å; Q396-N402 PolarHBondContact O-OD1 2.95Å
397	I	98.8	Very high	98.3	Very high	85 Å²	85	37.8 Å²	37.8	44%	0.436	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-44.7	-175.3	-54	172.9	0	0	0	111.1	V394 H395 G400 T401	V394-I397 HydrophobicContact CG2-CD1 4.46Å; V394-I397 WeakPolarHBondContact O-CA 3.49Å; V394-I397 WeakPolarHBondContact O-CB 3.38Å; V394-I397 PolarHBondContact O-N 3.05Å; H395-I397 PolarHBondContact O-N 3.26Å; I397-G400 CarbonylContact O-C 3.52Å; I397-T401 HydrophobicContact CG2-CG2 4.4Å; I397-T401 WeakPolarHBondContact O-CA 3.49Å; I397-T401 WeakPolarHBondContact O-CG2 3.41Å; I397-T401 PolarHBondContact O-N 2.87Å
398	L	97.4	Very high	98.1	Very high	58 Å²	58	39.5 Å²	39.5	30%	0.304	19%	0.192	S	C	.	.	S	Bend	trans	-81.6	167.5	-174.5	-61.2	175.7	0	0	0	113.1	W239 I281 K356 V394 G400	W239-L398 HydrophobicContact CE3-CD1 3.87Å; W239-L398 HydrophobicContact CH2-CD1 3.28Å; W239-L398 HydrophobicContact CZ2-CD1 4.01Å; W239-L398 HydrophobicContact CZ3-CD1 3.19Å; I281-L398 HydrophobicContact CD1-CB 3.81Å; K356-L398 WeakPolarHBondContact CE-O 3.47Å; K356-L398 PolarHBondContact NZ-O 3.45Å; V394-L398 HydrophobicContact CG1-CD1 4.01Å; V394-L398 HydrophobicContact CG2-CD1 3.85Å; V394-L398 HydrophobicContact CG2-CG 4Å; V394-L398 PolarHBondContact O-N 3.34Å; L398-G400 PolarHBondContact O-N 2.99Å; L398-G400 VanDerWaalsContact O-O 3.1Å
399	E	94.7	Very high	98.1	Very high	31 Å²	31	40.6 Å²	40.6	15%	0.145	20%	0.198	C	C	.	.	S	Bend	trans	57	28.5	-174.7	-61.4	-61.9	134.2	0	0	113.2	L274 G277 R278 I281	L274-E399 WeakPolarHBondContact CD2-OE2 3.41Å; G277-E399 WeakPolarHBondContact CA-OE2 3.42Å; R278-E399 HydrophobicContact CG-CB 4.12Å; R278-E399 PolarHBondContact NE-O 2.89Å; I281-E399 HydrophobicContact CB-CG 4.26Å; I281-E399 HydrophobicContact CD1-CG 4.09Å; I281-E399 HydrophobicContact CG2-CB 4.08Å; I281-E399 HydrophobicContact CG2-CG 3.96Å
400	G	96.3	Very high	98	Very high	21 Å²	21	42 Å²	42	22%	0.216	21%	0.211	C	C	.	.	S	Bend	trans	88.5	126.8	-167.7	0	0	0	0	0	111.3	K356 I397 L398	K356-G400 PolarHBondContact NZ-O 3.06Å; I397-G400 CarbonylContact O-C 3.52Å; L398-G400 PolarHBondContact O-N 2.99Å; L398-G400 VanDerWaalsContact O-O 3.1Å
401	T	98.5	Very high	97.8	Very high	26 Å²	26	48.9 Å²	48.9	16%	0.16	24%	0.237	C	C	.	.			trans	-59.8	159.8	-179.2	82.2	0	0	0	0	111.1	Q396 I397 E403 V404 M405	Q396-T401 WeakPolarHBondContact O-CA 3.46Å; I397-T401 HydrophobicContact CG2-CG2 4.4Å; I397-T401 WeakPolarHBondContact O-CA 3.49Å; I397-T401 WeakPolarHBondContact O-CG2 3.41Å; I397-T401 PolarHBondContact O-N 2.87Å; T401-E403 WeakPolarHBondContact CB-OE2 3.27Å; T401-E403 PolarHBondContact O-N 3.32Å; T401-E403 PolarHBondContact OG1-N 3.02Å; T401-E403 PolarHBondContact OG1-OE2 3.02Å; T401-V404 CarbonylContact O-C 3.04Å; T401-V404 WeakPolarHBondContact O-CA 3.38Å; T401-V404 WeakPolarHBondContact O-CB 3.42Å; T401-V404 PolarHBondContact O-N 3.47Å; T401-V404 PolarHBondContact OG1-N 3.35Å; T401-M405 PolarHBondContact O-N 3.07Å
402	N	98.7	Very high	97.6	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.011	25%	0.248	C	C	.	.	H	α-helix	trans	-61.4	-25.6	177.5	-76.2	4.7	0	0	0	112.4	K356 L357 T360 D361 Q396 M405 R406	K356-N402 PolarHBondContact NZ-OD1 3.01Å; L357-N402 HydrophobicContact CD1-CB 3.6Å; T360-N402 PolarHBondContact OG1-ND2 3.34Å; T360-N402 PolarHBondContact OG1-OD1 2.9Å; D361-N402 VanDerWaalsContact CG-ND2 3.33Å; D361-N402 PolarHBondContact OD1-ND2 2.83Å; Q396-N402 PolarHBondContact O-N 2.9Å; Q396-N402 PolarHBondContact O-OD1 2.95Å; N402-M405 PolarHBondContact O-N 2.74Å; N402-R406 VanDerWaalsContact C-NH1 3.35Å; N402-R406 WeakPolarHBondContact O-CG 3.49Å; N402-R406 PolarHBondContact O-N 3.09Å; N402-R406 PolarHBondContact O-NH1 3.11Å
403	E	98.7	Very high	97.4	Very high	112 Å²	112	55.9 Å²	55.9	52%	0.523	28%	0.276	S	S	.	.	H	α-helix	trans	-67.6	-41.5	169.4	-61.5	62.6	-126	0	0	111.4	T401 M405 R406 M407	T401-E403 WeakPolarHBondContact CB-OE2 3.27Å; T401-E403 PolarHBondContact O-N 3.32Å; T401-E403 PolarHBondContact OG1-N 3.02Å; T401-E403 PolarHBondContact OG1-OE2 3.02Å; E403-M405 VanDerWaalsContact C-N 3.33Å; E403-R406 WeakPolarHBondContact O-CB 3.5Å; E403-R406 PolarHBondContact O-N 3.14Å; E403-R406 IonicContact OE1-NH1 2.74Å; E403-R406 PolarHBondContact OE1-NH1 3.17Å; E403-R406 VanDerWaalsContact OE1-NH1 3.08Å; E403-M407 WeakPolarHBondContact O-CG 3.32Å; E403-M407 PolarHBondContact O-N 3.48Å
404	V	98.1	Very high	97.3	Very high	20 Å²	20	58.1 Å²	58.1	12%	0.121	30%	0.295	C	S	.	.	H	α-helix	trans	-63.1	-40.2	172.6	178.6	0	0	0	0	111.1	T401 R406 M407 I408	T401-V404 CarbonylContact O-C 3.04Å; T401-V404 WeakPolarHBondContact O-CA 3.38Å; T401-V404 WeakPolarHBondContact O-CB 3.42Å; T401-V404 PolarHBondContact O-N 3.47Å; T401-V404 PolarHBondContact OG1-N 3.35Å; V404-R406 VanDerWaalsContact C-N 3.35Å; V404-R406 PolarHBondContact O-N 3.32Å; V404-M407 HydrophobicContact CB-CE 4.17Å; V404-M407 HydrophobicContact CG1-CE 4.43Å; V404-M407 HydrophobicContact CG2-CE 3.81Å; V404-M407 WeakPolarHBondContact O-CB 3.3Å; V404-M407 PolarHBondContact O-N 3.4Å; V404-I408 HydrophobicContact CG1-CD1 4.1Å; V404-I408 HydrophobicContact CG1-CG1 4.49Å; V404-I408 WeakPolarHBondContact O-CG1 3.26Å; V404-I408 PolarHBondContact O-N 3.11Å
405	M	98.4	Very high	96.9	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-60.5	-45.7	175.1	-62.8	-55.3	96.3	0	0	111.1	R278 K356 L357 T401 N402 E403 M407 I408 I409	R278-M405 HydrophobicContact CG-SD 4.32Å; K356-M405 HydrophobicContact CB-SD 4.35Å; K356-M405 HydrophobicContact CD-CG 3.7Å; K356-M405 HydrophobicContact CD-SD 4.01Å; L357-M405 HydrophobicContact CB-CB 3.9Å; L357-M405 HydrophobicContact CB-CG 4.38Å; T401-M405 PolarHBondContact O-N 3.07Å; N402-M405 PolarHBondContact O-N 2.74Å; E403-M405 VanDerWaalsContact C-N 3.33Å; M405-M407 VanDerWaalsContact C-N 3.3Å; M405-M407 PolarHBondContact O-N 3.38Å; M405-I408 HydrophobicContact CE-CD1 3.88Å; M405-I408 PolarHBondContact O-N 3.19Å; M405-I408 VanDerWaalsContact O-N 3.17Å; M405-I409 WeakPolarHBondContact O-CD1 3.4Å; M405-I409 WeakPolarHBondContact O-CG1 3.25Å; M405-I409 PolarHBondContact O-N 3.49Å
406	R	98.5	Very high	96	Very high	108 Å²	108	66.3 Å²	66.3	41%	0.408	34%	0.34	S	S	.	.	H	α-helix	trans	-57.5	-42.5	174.6	-70.5	175.3	-170.8	99.5	3.3	111.7	L357 D361 N402 E403 V404 I409 A410	L357-R406 HydrophobicContact CD1-CG 4.29Å; L357-R406 HydrophobicContact CD2-CG 3.78Å; D361-R406 IonicContact OD2-NH2 3Å; D361-R406 PolarHBondContact OD2-NH2 3.1Å; D361-R406 VanDerWaalsContact OD2-NH2 3.15Å; N402-R406 VanDerWaalsContact C-NH1 3.35Å; N402-R406 WeakPolarHBondContact O-CG 3.49Å; N402-R406 PolarHBondContact O-N 3.09Å; N402-R406 PolarHBondContact O-NH1 3.11Å; E403-R406 WeakPolarHBondContact O-CB 3.5Å; E403-R406 PolarHBondContact O-N 3.14Å; E403-R406 IonicContact OE1-NH1 2.74Å; E403-R406 PolarHBondContact OE1-NH1 3.17Å; E403-R406 VanDerWaalsContact OE1-NH1 3.08Å; V404-R406 VanDerWaalsContact C-N 3.35Å; V404-R406 PolarHBondContact O-N 3.32Å; R406-I409 PolarHBondContact O-N 3.02Å; R406-A410 WeakPolarHBondContact O-CB 3.42Å; R406-A410 PolarHBondContact O-N 3.07Å
407	M	97.4	Very high	94.2	Very high	95 Å²	95	70.7 Å²	70.7	47%	0.468	37%	0.374	S	S	.	.	H	α-helix	trans	-61.8	-43.8	175.6	-71.2	-168.1	-69	0	0	112.6	E403 V404 M405 R411	E403-M407 WeakPolarHBondContact O-CG 3.32Å; E403-M407 PolarHBondContact O-N 3.48Å; V404-M407 HydrophobicContact CB-CE 4.17Å; V404-M407 HydrophobicContact CG1-CE 4.43Å; V404-M407 HydrophobicContact CG2-CE 3.81Å; V404-M407 WeakPolarHBondContact O-CB 3.3Å; V404-M407 PolarHBondContact O-N 3.4Å; M405-M407 VanDerWaalsContact C-N 3.3Å; M405-M407 PolarHBondContact O-N 3.38Å; M407-R411 WeakPolarHBondContact O-CB 3.32Å; M407-R411 VanDerWaalsContact O-CG 3.26Å; M407-R411 WeakPolarHBondContact O-CG 3.43Å; M407-R411 PolarHBondContact O-N 3.04Å
408	I	95.2	Very high	92	Very high	42 Å²	42	74 Å²	74	22%	0.215	43%	0.429	C	S	.	.	H	α-helix	trans	-63.9	-47.9	178.8	-66.5	169.2	0	0	0	110.3	S353 V404 M405 R411 S412	S353-I408 WeakPolarHBondContact OG-CG2 3.29Å; V404-I408 HydrophobicContact CG1-CD1 4.1Å; V404-I408 HydrophobicContact CG1-CG1 4.49Å; V404-I408 WeakPolarHBondContact O-CG1 3.26Å; V404-I408 PolarHBondContact O-N 3.11Å; M405-I408 HydrophobicContact CE-CD1 3.88Å; M405-I408 PolarHBondContact O-N 3.19Å; M405-I408 VanDerWaalsContact O-N 3.17Å; I408-R411 PolarHBondContact O-N 2.75Å; I408-S412 PolarHBondContact O-N 3.36Å
409	I	97.6	Very high	91.7	Very high	27 Å²	27	74.9 Å²	74.9	14%	0.138	44%	0.436	C	S	.	.	H	α-helix	trans	-61.1	-48.9	179.7	-65	160.1	0	0	0	110.5	M354 L357 M405 R406 R411 S412 L413	M354-I409 HydrophobicContact CB-CD1 4.32Å; M354-I409 HydrophobicContact CE-CG2 3.73Å; M354-I409 HydrophobicContact CG-CD1 3.73Å; M354-I409 HydrophobicContact CG-CG1 3.81Å; M354-I409 HydrophobicContact CG-CG2 4.28Å; L357-I409 HydrophobicContact CB-CD1 4.46Å; L357-I409 HydrophobicContact CD2-CD1 3.73Å; M405-I409 WeakPolarHBondContact O-CD1 3.4Å; M405-I409 WeakPolarHBondContact O-CG1 3.25Å; M405-I409 PolarHBondContact O-N 3.49Å; R406-I409 PolarHBondContact O-N 3.02Å; I409-R411 VanDerWaalsContact C-N 3.34Å; I409-R411 PolarHBondContact O-N 2.84Å; I409-S412 WeakPolarHBondContact O-CB 3.33Å; I409-S412 PolarHBondContact O-N 3.42Å; I409-L413 PolarHBondContact O-N 2.8Å
410	A	97.6	Very high	91.5	Very high	46 Å²	46	77.2 Å²	77.2	38%	0.38	45%	0.451	S	S	.	.	H	α-helix	trans	-61.4	-41.7	179.6	0	0	0	0	0	111.9	R406 L413 L414	R406-A410 WeakPolarHBondContact O-CB 3.42Å; R406-A410 PolarHBondContact O-N 3.07Å; A410-L413 PolarHBondContact O-N 3.06Å; A410-L414 WeakPolarHBondContact O-CB 3.2Å; A410-L414 VanDerWaalsContact O-CG 3.25Å; A410-L414 WeakPolarHBondContact O-CG 3.32Å; A410-L414 PolarHBondContact O-N 2.81Å
411	R	94.9	Very high	91.3	Very high	180 Å²	180	80.3 Å²	80.3	68%	0.679	46%	0.464	S	S	*	.	H	α-helix	trans	-63.4	-43.2	176.1	-76.8	176.1	-175.1	173.7	3.3	112.2	M407 I408 I409 S415	M407-R411 WeakPolarHBondContact O-CB 3.32Å; M407-R411 VanDerWaalsContact O-CG 3.26Å; M407-R411 WeakPolarHBondContact O-CG 3.43Å; M407-R411 PolarHBondContact O-N 3.04Å; I408-R411 PolarHBondContact O-N 2.75Å; I409-R411 VanDerWaalsContact C-N 3.34Å; I409-R411 PolarHBondContact O-N 2.84Å; R411-S415 VanDerWaalsContact O-CB 3.31Å; R411-S415 WeakPolarHBondContact O-CB 3.42Å; R411-S415 PolarHBondContact O-N 2.99Å; R411-S415 VanDerWaalsContact O-N 3.09Å; R411-S415 PolarHBondContact O-OG 2.99Å; R411-S415 VanDerWaalsContact O-OG 3.13Å
412	S	94.6	Very high	90.8	Very high	34 Å²	34	83.5 Å²	83.5	24%	0.238	48%	0.482	C	S	.	.	H	α-helix	trans	-57.1	-54.9	175.6	-175.4	0	0	0	0	110.3	S350 I408 I409 L414 S415 E416	S350-S412 VanDerWaalsContact OG-CB 3.31Å; S350-S412 WeakPolarHBondContact OG-CB 3.41Å; S350-S412 PolarHBondContact OG-OG 3.37Å; I408-S412 PolarHBondContact O-N 3.36Å; I409-S412 WeakPolarHBondContact O-CB 3.33Å; I409-S412 PolarHBondContact O-N 3.42Å; S412-L414 VanDerWaalsContact C-N 3.32Å; S412-L414 PolarHBondContact O-N 3.1Å; S412-S415 PolarHBondContact O-N 3.05Å; S412-S415 PolarHBondContact O-OG 3.23Å; S412-E416 PolarHBondContact O-N 3.07Å
413	L	95.2	Very high	90.4	Very high	112 Å²	112	88.6 Å²	88.6	59%	0.586	51%	0.511	S	S	*	.	H	α-helix	trans	-61.4	-37.9	-175.9	-171.9	65.1	0	0	0	112.7	I409 A410 S415	I409-L413 PolarHBondContact O-N 2.8Å; A410-L413 PolarHBondContact O-N 3.06Å; L413-S415 VanDerWaalsContact C-N 3.31Å
414	L	95.3	Very high	89.8	Confident	155 Å²	155	87 Å²	87	81%	0.812	51%	0.511	S	S	*	.	H	α-helix	trans	-77.5	-15.5	177.9	-68.7	172	0	0	0	113.8	A410 S412	A410-L414 WeakPolarHBondContact O-CB 3.2Å; A410-L414 VanDerWaalsContact O-CG 3.25Å; A410-L414 WeakPolarHBondContact O-CG 3.32Å; A410-L414 PolarHBondContact O-N 2.81Å; S412-L414 VanDerWaalsContact C-N 3.32Å; S412-L414 PolarHBondContact O-N 3.1Å
415	S	90.3	Very high	89.2	Confident	82 Å²	82	91.8 Å²	91.8	57%	0.573	54%	0.538	S	S	*	.	H	α-helix	trans	-92.9	-10	177.7	68.8	0	0	0	0	113.5	R411 S412 L413 S417	R411-S415 VanDerWaalsContact O-CB 3.31Å; R411-S415 WeakPolarHBondContact O-CB 3.42Å; R411-S415 PolarHBondContact O-N 2.99Å; R411-S415 VanDerWaalsContact O-N 3.09Å; R411-S415 PolarHBondContact O-OG 2.99Å; R411-S415 VanDerWaalsContact O-OG 3.13Å; S412-S415 PolarHBondContact O-N 3.05Å; S412-S415 PolarHBondContact O-OG 3.23Å; L413-S415 VanDerWaalsContact C-N 3.31Å; S415-S417 PolarHBondContact O-N 3.24Å; S415-S417 VanDerWaalsContact O-N 3.11Å
416	E	81.9	Confident	88.5	Confident	129 Å²	129	98.8 Å²	98.8	60%	0.603	58%	0.58	S	S	*	*			trans	-62.4	112.4	172.5	-71.7	170.1	-160.3	0	0	108.6	S412	S412-E416 PolarHBondContact O-N 3.07Å
417	S	60.5	Low	87.7	Confident	120 Å²	120	98.1 Å²	98.1	84%	0.839	59%	0.594	S	S	*	*			trans	-78.5	121.6	170.7	-58.7	0	0	0	0	107.2	S415	S415-S417 PolarHBondContact O-N 3.24Å; S415-S417 VanDerWaalsContact O-N 3.11Å
418	G	51.4	Low	86.8	Confident	155 Å²	155	98.4 Å²	98.4	100%	1.598	61%	0.606	S	S	*	*			trans	-64	0	178.7	0	0	0	0	0	114.2

Retrieved 418 of 418 residues in 129.4 ms (Link to these results)

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