A0A060WP52_ONCMY Loading...

Glycosyl transferase CAP10 domain-containing protein

AlphaFold DB , UniProt , Accession A0A060WP52, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene poglut1, Length 391 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	35.5	Very low	237 Å²	237	166.7 Å²	166.7	100%	1.167	84%	0.843	S	S	*	*				0	113.3	0	-96.3	159.3	58.5	0	0	109
2	K	37.3	Very low	35.3	Very low	206 Å²	206	164.5 Å²	164.5	90%	0.896	83%	0.832	S	S	*	*			trans	49.5	99.2	155.1	-58.6	-172.1	179	-177.6	0	119.5
3	L	34.5	Very low	35.1	Very low	162 Å²	162	162.8 Å²	162.8	85%	0.848	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-71.1	135.1	151.5	-134.1	79.7	0	0	0	108.7
4	P	45.6	Very low	34.7	Very low	115 Å²	115	162.9 Å²	162.9	75%	0.747	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-83.5	129.9	175.9	27.7	-22.1	0	0	0	110.9	L6	P4-L6 PolarHBondContact O-N 2.88Å
5	W	33	Very low	34.6	Very low	235 Å²	235	165.2 Å²	165.2	89%	0.89	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-63.5	116.9	170	-77.7	22.3	0	0	0	110.5
6	L	35.2	Very low	34.4	Very low	164 Å²	164	161.6 Å²	161.6	86%	0.859	82%	0.818	S	S	*	*			trans	-92.7	105.5	159.6	-90.7	153.8	0	0	0	107.7	P4 I8	P4-L6 PolarHBondContact O-N 2.88Å; L6-I8 PolarHBondContact O-N 3.13Å
7	L	35	Very low	34.2	Very low	155 Å²	155	155.9 Å²	155.9	81%	0.812	81%	0.809	S	S	*	*			trans	-61.8	107.6	165.9	-82.3	148.6	0	0	0	108.6
8	I	36.4	Very low	34.1	Very low	147 Å²	147	153.3 Å²	153.3	75%	0.754	80%	0.801	S	S	*	*			trans	-84.4	118.3	164.7	-60.6	174.2	0	0	0	106.3	L6 L10	L6-I8 PolarHBondContact O-N 3.13Å; I8-L10 PolarHBondContact O-N 3.02Å
9	P	35.1	Very low	33.9	Very low	107 Å²	107	152.8 Å²	152.8	70%	0.695	80%	0.8	S	S	*	*			trans	-70.9	116.6	171	11.6	-0.9	0	0	0	108.2	L11	P9-L11 VanDerWaalsContact C-N 3.34Å; P9-L11 PolarHBondContact O-N 3.41Å
10	L	31.4	Very low	34	Very low	157 Å²	157	154.4 Å²	154.4	82%	0.822	80%	0.8	S	S	*	*			trans	-61.3	98.4	163	-112.5	99.5	0	0	0	107.4	I8 I12	I8-L10 PolarHBondContact O-N 3.02Å; L10-I12 VanDerWaalsContact C-N 3.35Å; L10-I12 PolarHBondContact O-N 3.49Å
11	L	30.6	Very low	34	Very low	149 Å²	149	151.7 Å²	151.7	78%	0.78	80%	0.795	S	S	*	*			trans	-70.3	98	164.6	-126.6	103.2	0	0	0	106.7	P9 L13	P9-L11 VanDerWaalsContact C-N 3.34Å; P9-L11 PolarHBondContact O-N 3.41Å; L11-L13 VanDerWaalsContact C-N 3.33Å; L11-L13 PolarHBondContact O-N 3.16Å
12	I	33.5	Very low	34.3	Very low	140 Å²	140	147 Å²	147	72%	0.718	78%	0.779	S	S	*	*			trans	-65.6	100.7	164.7	-62.7	174.3	0	0	0	105.6	L10 Q14	L10-I12 VanDerWaalsContact C-N 3.35Å; L10-I12 PolarHBondContact O-N 3.49Å; I12-Q14 PolarHBondContact O-N 2.96Å
13	L	32.3	Very low	34.5	Very low	142 Å²	142	142.1 Å²	142.1	74%	0.743	78%	0.777	S	S	*	*			trans	-63.4	88.7	164.4	-93.7	145.1	0	0	0	107.2	L11 F15	L11-L13 VanDerWaalsContact C-N 3.33Å; L11-L13 PolarHBondContact O-N 3.16Å; L13-F15 PolarHBondContact O-N 3.25Å
14	Q	29.9	Very low	34.7	Very low	165 Å²	165	137.3 Å²	137.3	77%	0.771	77%	0.767	S	S	*	*			trans	-59.4	106.5	156.8	-88.5	179.4	-39.5	0	0	106.4	I12 C16	I12-Q14 PolarHBondContact O-N 2.96Å; Q14-C16 PolarHBondContact O-N 3.26Å
15	F	32.7	Very low	34.8	Very low	197 Å²	197	138.1 Å²	138.1	86%	0.864	78%	0.775	S	S	*	*			trans	-59.8	92.8	157.8	-85.6	-91.4	0	0	0	106.7	L13 G17	L13-F15 PolarHBondContact O-N 3.25Å; F15-G17 PolarHBondContact O-N 3.48Å
16	C	32.8	Very low	35.4	Very low	107 Å²	107	130.2 Å²	130.2	72%	0.723	77%	0.766	S	S	*	*			trans	-60.2	98	154.2	-79.3	0	0	0	0	105.5	Q14 V18	Q14-C16 PolarHBondContact O-N 3.26Å; C16-V18 VanDerWaalsContact C-N 3.33Å; C16-V18 PolarHBondContact O-N 2.81Å
17	G	30.6	Very low	36	Very low	65 Å²	65	128.1 Å²	128.1	67%	0.67	76%	0.756	S	S	*	*			trans	-53.3	106.9	158.4	0	0	0	0	0	106.2	F15 D19	F15-G17 PolarHBondContact O-N 3.48Å; G17-D19 PolarHBondContact O-N 3.44Å
18	V	31.7	Very low	37	Very low	109 Å²	109	124.7 Å²	124.7	66%	0.661	76%	0.758	S	S	*	*			trans	-71.7	90.7	166.4	-178.7	0	0	0	0	104.4	C16 F20	C16-V18 VanDerWaalsContact C-N 3.33Å; C16-V18 PolarHBondContact O-N 2.81Å; V18-F20 VanDerWaalsContact C-N 3.29Å; V18-F20 HydrophobicContact CG1-CD2 3.97Å; V18-F20 HydrophobicContact CG1-CE2 3.86Å; V18-F20 HydrophobicContact CG1-CZ 4.39Å; V18-F20 PolarHBondContact O-N 2.82Å
19	D	30.3	Very low	38.8	Very low	145 Å²	145	120.7 Å²	120.7	78%	0.775	75%	0.754	S	S	*	*			trans	-58.2	100.7	160	-87	-33.1	0	0	0	106.5	G17 S21	G17-D19 PolarHBondContact O-N 3.44Å; D19-S21 PolarHBondContact O-N 2.74Å
20	F	35.7	Very low	41.5	Very low	184 Å²	184	122.2 Å²	122.2	81%	0.807	75%	0.745	S	S	*	*			trans	-68.3	72.3	159.1	-83.8	-85.3	0	0	0	107.8	V18 V22	V18-F20 VanDerWaalsContact C-N 3.29Å; V18-F20 HydrophobicContact CG1-CD2 3.97Å; V18-F20 HydrophobicContact CG1-CE2 3.86Å; V18-F20 HydrophobicContact CG1-CZ 4.39Å; V18-F20 PolarHBondContact O-N 2.82Å; F20-V22 PolarHBondContact O-N 3.05Å
21	S	33.8	Very low	44.7	Very low	98 Å²	98	115.1 Å²	115.1	69%	0.685	71%	0.708	S	S	*	*			trans	-69.9	109.2	156.7	44.9	0	0	0	0	106.1	D19 A23	D19-S21 PolarHBondContact O-N 2.74Å; S21-A23 PolarHBondContact O-N 3.02Å
22	V	43.4	Very low	47.8	Very low	138 Å²	138	112 Å²	112	84%	0.836	69%	0.689	S	S	*	*			trans	-64.4	87.4	171	177	0	0	0	0	107.2	F20 G24	F20-V22 PolarHBondContact O-N 3.05Å; V22-G24 PolarHBondContact O-N 3.01Å; V22-G24 VanDerWaalsContact O-N 3.09Å
23	A	41.5	Very low	50.8	Low	104 Å²	104	109.7 Å²	109.7	86%	0.86	68%	0.677	S	S	*	*			trans	-80.6	79.3	166.8	0	0	0	0	0	108.1	S21	S21-A23 PolarHBondContact O-N 3.02Å
24	G	38.4	Very low	54	Low	61 Å²	61	103.5 Å²	103.5	63%	0.629	64%	0.644	S	S	*	*			trans	-124.5	84.1	167.6	0	0	0	0	0	109.2	V22 G26	V22-G24 PolarHBondContact O-N 3.01Å; V22-G24 VanDerWaalsContact O-N 3.09Å; G24-G26 PolarHBondContact O-N 3.13Å
25	S	47.8	Very low	57.2	Low	131 Å²	131	97.7 Å²	97.7	92%	0.916	62%	0.618	S	S	*	*			trans	-70	108.6	167.3	55.5	0	0	0	0	109.2
26	G	44.8	Very low	60.3	Low	69 Å²	69	93.5 Å²	93.5	71%	0.711	60%	0.601	S	S	*	*	S	Bend	trans	153.5	36.6	164.4	0	0	0	0	0	119.7	G24	G24-G26 PolarHBondContact O-N 3.13Å
27	N	47.8	Very low	63.4	Low	120 Å²	120	92.6 Å²	92.6	64%	0.642	59%	0.585	S	S	*	*			trans	-178	57.5	150	-121.2	-9	0	0	0	113.7	G29	N27-G29 PolarHBondContact O-N 3.29Å
28	G	55.7	Low	66.7	Low	83 Å²	83	90 Å²	90	86%	0.856	56%	0.556	S	S	*	*	S	Bend	trans	-70.6	42	177.4	0	0	0	0	0	115.5
29	G	74.6	Confident	69.8	Low	64 Å²	64	88.1 Å²	88.1	66%	0.66	54%	0.544	S	S	*	.	S	Bend	trans	-135.9	-52.2	-169.7	0	0	0	0	0	116.7	N27	N27-G29 PolarHBondContact O-N 3.29Å
30	R	93.3	Very high	73.1	Confident	139 Å²	139	87.9 Å²	87.9	53%	0.525	54%	0.537	S	S	.	.	S	Bend	trans	-97.4	-45.1	-165.5	-170.1	178.8	-178.7	-173.8	1.3	114.6	E329	R30-E329 IonicContact NH1-OE1 3.13Å; R30-E329 PolarHBondContact NH1-OE1 2.93Å; R30-E329 VanDerWaalsContact NH1-OE1 3.13Å; R30-E329 IonicContact NH1-OE2 3.83Å
31	W	97.1	Very high	76.1	Confident	8 Å²	8	80.1 Å²	80.1	3%	0.03	51%	0.506	C	S	.	.	S	Bend	trans	-101.7	2.6	-170.1	-56.3	128.8	0	0	0	114.6	I33 Y34 L35 E322 Q325 F326 E329	W31-I33 PolarHBondContact O-N 3.12Å; W31-I33 VanDerWaalsContact O-N 3.12Å; W31-Y34 AromaticContact CE3-CD2 3.95Å; W31-Y34 HydrophobicContact CE3-CD2 3.95Å; W31-Y34 HydrophobicContact CE3-CE2 4.15Å; W31-Y34 HydrophobicContact CZ3-CE2 4.28Å; W31-Y34 PolarHBondContact O-N 3.29Å; W31-L35 WeakPolarHBondContact O-CG 3.43Å; W31-L35 PolarHBondContact O-N 3.14Å; W31-L35 VanDerWaalsContact O-N 3.07Å; W31-E322 HydrophobicContact CH2-CG 4.37Å; W31-E322 HydrophobicContact CZ3-CG 3.77Å; W31-Q325 HydrophobicContact CH2-CB 3.92Å; W31-Q325 HydrophobicContact CH2-CG 3.85Å; W31-Q325 HydrophobicContact CZ2-CB 4.23Å; W31-Q325 HydrophobicContact CZ2-CG 3.75Å; W31-F326 HydrophobicContact CB-CD2 3.73Å; W31-F326 HydrophobicContact CB-CE2 3.96Å; W31-F326 HydrophobicContact CD2-CB 4.17Å; W31-F326 AromaticContact CD2-CD2 3.86Å; W31-F326 HydrophobicContact CD2-CD2 3.86Å; W31-F326 HydrophobicContact CE3-CB 3.85Å; W31-F326 HydrophobicContact CE3-CD2 4.04Å; W31-F326 HydrophobicContact CE3-CG 4.39Å; W31-F326 AromaticContact CG-CD2 3.76Å; W31-F326 HydrophobicContact CG-CD2 3.76Å; W31-F326 HydrophobicContact CG-CE2 4.4Å; W31-F326 HydrophobicContact CH2-CB 4.33Å; W31-F326 HydrophobicContact CZ3-CB 3.94Å; W31-E329 WeakPolarHBondContact CZ2-OE2 3.28Å; W31-E329 PolarHBondContact NE1-OE2 3.03Å
32	Q	96.6	Very high	79.1	Confident	82 Å²	82	77.9 Å²	77.9	38%	0.383	49%	0.489	S	S	.	.	H	α-helix	trans	-52	-40.5	-174.4	-173.1	61.5	23.6	0	0	112.6	Y34 L35 E36	Q32-Y34 VanDerWaalsContact C-N 3.32Å; Q32-Y34 PolarHBondContact O-N 3.45Å; Q32-L35 PolarHBondContact O-N 3.4Å; Q32-E36 HydrophobicContact CG-CG 4.38Å; Q32-E36 VanDerWaalsContact CG-OE1 3.3Å; Q32-E36 WeakPolarHBondContact CG-OE1 3.42Å; Q32-E36 PolarHBondContact NE2-OE1 3.44Å; Q32-E36 WeakPolarHBondContact O-CB 3.4Å; Q32-E36 WeakPolarHBondContact O-CG 3.4Å; Q32-E36 PolarHBondContact O-N 3.16Å
33	I	96.9	Very high	81.6	Confident	92 Å²	92	78.5 Å²	78.5	47%	0.472	48%	0.482	S	S	.	.	H	α-helix	trans	-59.6	-38.2	178	-169.1	169.6	0	0	0	113.3	W31 K37	W31-I33 PolarHBondContact O-N 3.12Å; W31-I33 VanDerWaalsContact O-N 3.12Å; I33-K37 VanDerWaalsContact O-CG 3.28Å; I33-K37 WeakPolarHBondContact O-CG 3.43Å; I33-K37 PolarHBondContact O-N 2.99Å
34	Y	98.2	Very high	84.2	Confident	12 Å²	12	79.6 Å²	79.6	5%	0.047	47%	0.473	C	S	.	.	H	α-helix	trans	-78.4	-39.4	178.6	-65.1	-62	0	0	0	111.1	W31 Q32 E36 K37 I38 W307 E322 L323 F326	W31-Y34 AromaticContact CE3-CD2 3.95Å; W31-Y34 HydrophobicContact CE3-CD2 3.95Å; W31-Y34 HydrophobicContact CE3-CE2 4.15Å; W31-Y34 HydrophobicContact CZ3-CE2 4.28Å; W31-Y34 PolarHBondContact O-N 3.29Å; Q32-Y34 VanDerWaalsContact C-N 3.32Å; Q32-Y34 PolarHBondContact O-N 3.45Å; Y34-E36 VanDerWaalsContact C-N 3.32Å; Y34-E36 PolarHBondContact O-N 2.7Å; Y34-K37 HydrophobicContact CD1-CD 4.39Å; Y34-K37 PolarHBondContact O-N 3.32Å; Y34-I38 WeakPolarHBondContact O-CD1 3.3Å; Y34-I38 VanDerWaalsContact O-CG1 3.26Å; Y34-I38 WeakPolarHBondContact O-CG1 3.36Å; Y34-I38 PolarHBondContact O-N 3.34Å; Y34-W307 AromaticContact CD1-CH2 3.48Å; Y34-W307 HydrophobicContact CD1-CH2 3.48Å; Y34-W307 VanDerWaalsContact CD1-CH2 3.48Å; Y34-W307 HydrophobicContact CD1-CZ2 4.08Å; Y34-W307 HydrophobicContact CD1-CZ3 4.03Å; Y34-W307 AromaticContact CE1-CH2 3.84Å; Y34-W307 HydrophobicContact CE1-CH2 3.84Å; Y34-W307 HydrophobicContact CE1-CZ2 4.34Å; Y34-E322 HydrophobicContact CE2-CG 3.98Å; Y34-E322 PolarHBondContact OH-OE2 3.34Å; Y34-L323 HydrophobicContact CD1-CD2 4.04Å; Y34-L323 HydrophobicContact CE1-CD2 3.4Å; Y34-F326 HydrophobicContact CD2-CB 4.15Å; Y34-F326 HydrophobicContact CD2-CD1 4.4Å; Y34-F326 HydrophobicContact CD2-CD2 4.03Å; Y34-F326 AromaticContact CD2-CG 3.91Å; Y34-F326 HydrophobicContact CD2-CG 3.91Å; Y34-F326 HydrophobicContact CE2-CB 4.49Å; Y34-F326 HydrophobicContact CG-CD1 4.22Å; Y34-F326 HydrophobicContact CG-CD2 4.29Å; Y34-F326 HydrophobicContact CG-CE1 4.44Å; Y34-F326 HydrophobicContact CG-CG 4.15Å
35	L	98.1	Very high	86.9	Confident	43 Å²	43	79.1 Å²	79.1	23%	0.225	45%	0.452	C	S	.	.	H	α-helix	trans	-60.7	-40.9	175.5	-61.7	177.5	0	0	0	111.9	W31 Q32 I38 T39 F326 I333	W31-L35 WeakPolarHBondContact O-CG 3.43Å; W31-L35 PolarHBondContact O-N 3.14Å; W31-L35 VanDerWaalsContact O-N 3.07Å; Q32-L35 PolarHBondContact O-N 3.4Å; L35-I38 PolarHBondContact O-N 3.13Å; L35-T39 WeakPolarHBondContact O-CB 3.25Å; L35-T39 PolarHBondContact O-N 3Å; L35-T39 PolarHBondContact O-OG1 2.9Å; L35-F326 HydrophobicContact CD2-CE2 4.09Å; L35-F326 HydrophobicContact CD2-CZ 4.34Å; L35-F326 HydrophobicContact CG-CE2 4.49Å; L35-I333 HydrophobicContact CD2-CD1 3.21Å
36	E	97.9	Very high	89.1	Confident	110 Å²	110	81.3 Å²	81.3	51%	0.514	45%	0.446	S	S	.	.	H	α-helix	trans	-66.7	-42.5	175.2	-75.2	173.4	-173	0	0	112.2	Q32 Y34 I38 T39 K40	Q32-E36 HydrophobicContact CG-CG 4.38Å; Q32-E36 VanDerWaalsContact CG-OE1 3.3Å; Q32-E36 WeakPolarHBondContact CG-OE1 3.42Å; Q32-E36 PolarHBondContact NE2-OE1 3.44Å; Q32-E36 WeakPolarHBondContact O-CB 3.4Å; Q32-E36 WeakPolarHBondContact O-CG 3.4Å; Q32-E36 PolarHBondContact O-N 3.16Å; Y34-E36 VanDerWaalsContact C-N 3.32Å; Y34-E36 PolarHBondContact O-N 2.7Å; E36-I38 VanDerWaalsContact C-N 3.34Å; E36-I38 PolarHBondContact O-N 3.13Å; E36-T39 PolarHBondContact O-N 3.37Å; E36-K40 VanDerWaalsContact O-CB 3.25Å; E36-K40 WeakPolarHBondContact O-CB 3.41Å; E36-K40 PolarHBondContact O-N 3.38Å
37	K	98.2	Very high	91.2	Very high	87 Å²	87	82.8 Å²	82.8	38%	0.378	44%	0.443	S	S	.	.	H	α-helix	trans	-58.4	-46.3	174.1	-77.5	172.9	-179.3	178.3	0	111.4	I33 Y34 A41 W307	I33-K37 VanDerWaalsContact O-CG 3.28Å; I33-K37 WeakPolarHBondContact O-CG 3.43Å; I33-K37 PolarHBondContact O-N 2.99Å; Y34-K37 HydrophobicContact CD1-CD 4.39Å; Y34-K37 PolarHBondContact O-N 3.32Å; K37-A41 VanDerWaalsContact O-CB 3.23Å; K37-A41 WeakPolarHBondContact O-CB 3.44Å; K37-A41 PolarHBondContact O-N 3.23Å; K37-W307 HydrophobicContact CB-CD2 4.33Å; K37-W307 HydrophobicContact CB-CG 4.28Å; K37-W307 HydrophobicContact CD-CZ2 4Å
38	I	98.6	Very high	93.2	Very high	12 Å²	12	78.2 Å²	78.2	6%	0.062	42%	0.42	C	S	.	.	H	α-helix	trans	-63.1	-52.2	178.3	-66.9	160.6	0	0	0	110.1	Y34 L35 E36 K40 A41 T42 W307 F326 I333 I337	Y34-I38 WeakPolarHBondContact O-CD1 3.3Å; Y34-I38 VanDerWaalsContact O-CG1 3.26Å; Y34-I38 WeakPolarHBondContact O-CG1 3.36Å; Y34-I38 PolarHBondContact O-N 3.34Å; L35-I38 PolarHBondContact O-N 3.13Å; E36-I38 VanDerWaalsContact C-N 3.34Å; E36-I38 PolarHBondContact O-N 3.13Å; I38-K40 VanDerWaalsContact C-N 3.34Å; I38-K40 PolarHBondContact O-N 3.43Å; I38-A41 PolarHBondContact O-N 3.25Å; I38-A41 VanDerWaalsContact O-N 3.16Å; I38-T42 HydrophobicContact CG2-CG2 4.32Å; I38-T42 WeakPolarHBondContact O-CG2 3.42Å; I38-T42 PolarHBondContact O-N 2.63Å; I38-T42 PolarHBondContact O-OG1 3.49Å; I38-W307 HydrophobicContact CD1-CE3 4.28Å; I38-W307 HydrophobicContact CG1-CB 3.95Å; I38-W307 HydrophobicContact CG1-CD2 4.32Å; I38-W307 HydrophobicContact CG1-CE3 3.83Å; I38-W307 HydrophobicContact CG1-CG 4.42Å; I38-F326 HydrophobicContact CD1-CE1 3.91Å; I38-F326 HydrophobicContact CD1-CZ 3.59Å; I38-I333 HydrophobicContact CD1-CG2 3.68Å; I38-I337 HydrophobicContact CD1-CD1 3.98Å; I38-I337 HydrophobicContact CG1-CD1 4.24Å
39	T	98.2	Very high	94.6	Very high	68 Å²	68	76.4 Å²	76.4	42%	0.417	39%	0.394	S	S	.	.	H	α-helix	trans	-54.7	-51.1	179.9	-59.2	0	0	0	0	110.9	L35 E36 A41 T42 Q43	L35-T39 WeakPolarHBondContact O-CB 3.25Å; L35-T39 PolarHBondContact O-N 3Å; L35-T39 PolarHBondContact O-OG1 2.9Å; E36-T39 PolarHBondContact O-N 3.37Å; T39-A41 PolarHBondContact O-N 2.91Å; T39-T42 PolarHBondContact O-N 3.33Å; T39-T42 PolarHBondContact O-OG1 2.93Å; T39-Q43 WeakPolarHBondContact O-CB 3.29Å; T39-Q43 WeakPolarHBondContact O-CG 3.33Å; T39-Q43 PolarHBondContact O-N 3.29Å
40	K	98.3	Very high	94.9	Very high	141 Å²	141	75.1 Å²	75.1	61%	0.613	37%	0.374	S	S	*	.	H	α-helix	trans	-59.8	-46.8	178	-176.6	179	-179.8	-180	0	111.8	E36 I38 T42 Q43 L44	E36-K40 VanDerWaalsContact O-CB 3.25Å; E36-K40 WeakPolarHBondContact O-CB 3.41Å; E36-K40 PolarHBondContact O-N 3.38Å; I38-K40 VanDerWaalsContact C-N 3.34Å; I38-K40 PolarHBondContact O-N 3.43Å; K40-T42 PolarHBondContact O-N 3.46Å; K40-Q43 PolarHBondContact O-N 3.39Å; K40-L44 HydrophobicContact CG-CD1 3.99Å; K40-L44 WeakPolarHBondContact O-CG 3.32Å; K40-L44 PolarHBondContact O-N 2.81Å; K40-L44 VanDerWaalsContact O-N 3.11Å
41	A	98.1	Very high	94	Very high	20 Å²	20	78.6 Å²	78.6	17%	0.165	39%	0.388	C	S	.	.	H	α-helix	trans	-62.8	-43.1	180	0	0	0	0	0	111.7	K37 I38 T39 L44 Y45 W307 V308	K37-A41 VanDerWaalsContact O-CB 3.23Å; K37-A41 WeakPolarHBondContact O-CB 3.44Å; K37-A41 PolarHBondContact O-N 3.23Å; I38-A41 PolarHBondContact O-N 3.25Å; I38-A41 VanDerWaalsContact O-N 3.16Å; T39-A41 PolarHBondContact O-N 2.91Å; A41-L44 PolarHBondContact O-N 3.12Å; A41-Y45 WeakPolarHBondContact O-CB 3.46Å; A41-Y45 PolarHBondContact O-N 3.37Å; A41-W307 HydrophobicContact CB-CB 3.89Å; A41-V308 HydrophobicContact CB-CG2 3.86Å
42	T	97.3	Very high	92.9	Very high	52 Å²	52	82.1 Å²	82.1	32%	0.319	41%	0.408	S	S	.	.	H	α-helix	trans	-70.1	-33.1	178.9	54.4	0	0	0	0	113.5	I38 T39 K40 Y45	I38-T42 HydrophobicContact CG2-CG2 4.32Å; I38-T42 WeakPolarHBondContact O-CG2 3.42Å; I38-T42 PolarHBondContact O-N 2.63Å; I38-T42 PolarHBondContact O-OG1 3.49Å; T39-T42 PolarHBondContact O-N 3.33Å; T39-T42 PolarHBondContact O-OG1 2.93Å; K40-T42 PolarHBondContact O-N 3.46Å; T42-Y45 PolarHBondContact O-N 2.99Å
43	Q	97.1	Very high	92	Very high	151 Å²	151	78.5 Å²	78.5	71%	0.706	39%	0.392	S	S	*	.	H	α-helix	trans	-70.2	-34.5	175.3	-76.3	175.3	-9.5	0	0	112.5	T39 K40	T39-Q43 WeakPolarHBondContact O-CB 3.29Å; T39-Q43 WeakPolarHBondContact O-CG 3.33Å; T39-Q43 PolarHBondContact O-N 3.29Å; K40-Q43 PolarHBondContact O-N 3.39Å
44	L	95.8	Very high	91.7	Very high	126 Å²	126	76.3 Å²	76.3	66%	0.66	38%	0.384	S	S	*	.	H	α-helix	trans	-81.6	-18.5	177.5	-67.5	173.9	0	0	0	112.9	K40 A41 K46	K40-L44 HydrophobicContact CG-CD1 3.99Å; K40-L44 WeakPolarHBondContact O-CG 3.32Å; K40-L44 PolarHBondContact O-N 2.81Å; K40-L44 VanDerWaalsContact O-N 3.11Å; A41-L44 PolarHBondContact O-N 3.12Å; L44-K46 PolarHBondContact O-N 3.21Å
45	Y	95.1	Very high	91.5	Very high	51 Å²	51	76.1 Å²	76.1	20%	0.2	39%	0.385	C	S	.	.			trans	-65.5	126	-178	176	-123.8	0	0	0	111.5	A41 T42 P47 L305 V308 H309	A41-Y45 WeakPolarHBondContact O-CB 3.46Å; A41-Y45 PolarHBondContact O-N 3.37Å; T42-Y45 PolarHBondContact O-N 2.99Å; Y45-P47 HydrophobicContact CD1-CG 4.33Å; Y45-P47 HydrophobicContact CE1-CB 4.3Å; Y45-P47 HydrophobicContact CE1-CG 3.86Å; Y45-L305 HydrophobicContact CD2-CD1 3.63Å; Y45-L305 HydrophobicContact CE2-CD1 4.34Å; Y45-V308 HydrophobicContact CD1-CG1 3.8Å; Y45-V308 HydrophobicContact CD2-CG1 4.11Å; Y45-V308 HydrophobicContact CE1-CG1 4.14Å; Y45-V308 HydrophobicContact CE2-CG1 4.42Å; Y45-V308 HydrophobicContact CG-CG1 3.77Å; Y45-V308 HydrophobicContact CG-CG2 4.38Å; Y45-H309 AromaticContact CE2-CE1 3.73Å; Y45-H309 AromaticContact CE2-NE2 3.95Å; Y45-H309 AromaticContact CZ-CE1 3.91Å; Y45-H309 AromaticContact CZ-NE2 3.65Å; Y45-H309 PolarHBondContact OH-NE2 2.73Å
46	K	92.8	Very high	91.4	Very high	178 Å²	178	74.2 Å²	74.2	77%	0.774	38%	0.375	S	S	*	.			trans	-110.7	113.4	171.3	-67.5	179.7	-178.5	178.2	0	108.2	L44	L44-K46 PolarHBondContact O-N 3.21Å
47	P	89.9	Confident	91.1	Very high	100 Å²	100	70.4 Å²	70.4	65%	0.649	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-58.2	143.4	175.6	-23	32.7	0	0	0	111.4	Y45	Y45-P47 HydrophobicContact CD1-CG 4.33Å; Y45-P47 HydrophobicContact CE1-CB 4.3Å; Y45-P47 HydrophobicContact CE1-CG 3.86Å
48	C	88.9	Confident	90.9	Very high	23 Å²	23	68.8 Å²	68.8	16%	0.155	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-89.4	157.7	174.4	66.7	0	0	0	0	111.6	C55 H348	C48-C55 HydrophobicContact CB-CB 3.56Å; C48-C55 WeakPolarHBondContact CB-SG 3.31Å; C48-C55 WeakPolarHBondContact SG-CB 3.49Å; C48-C55 CovalentContact SG-SG 2.04Å; C48-C55 PolarHBondContact SG-SG 3.39Å; C48-H348 PolarHBondContact O-CE1 2.02Å; C48-H348 VanDerWaalsContact SG-CD2 3.53Å; C48-H348 PolarHBondContact SG-CE1 3.29Å; C48-H348 PolarHBondContact SG-ND1 2.91Å; C48-H348 VanDerWaalsContact SG-ND1 3.41Å
49	S	86.9	Confident	90.8	Very high	46 Å²	46	68.6 Å²	68.6	32%	0.322	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-74.2	132.7	177.3	179.7	0	0	0	0	110.8	Y51	S49-Y51 VanDerWaalsContact C-N 3.31Å; S49-Y51 PolarHBondContact OG-N 3.43Å
50	P	78.9	Confident	90.8	Very high	36 Å²	36	65.3 Å²	65.3	23%	0.234	34%	0.337	C	S	.	.	S	Bend	trans	-83.1	-1.1	176	33.4	-34.4	0	0	0	113.5	R350	P50-R350 PolarHBondContact O-NH1 2.91Å; P50-R350 PolarHBondContact O-NH2 3.33Å
51	Y	75.6	Confident	90.7	Very high	212 Å²	212	62.1 Å²	62.1	83%	0.831	33%	0.327	S	S	*	.	S	Bend	trans	-101.4	-11.8	-166	-61.1	-70	0	0	0	115.8	S49	S49-Y51 VanDerWaalsContact C-N 3.31Å; S49-Y51 PolarHBondContact OG-N 3.43Å
52	N	73.5	Confident	90.7	Very high	82 Å²	82	65 Å²	65	44%	0.439	34%	0.339	S	S	.	.	S	Bend	trans	-139.5	17.6	-167.9	65.2	-5.2	0	0	0	114.3	S54	N52-S54 PolarHBondContact O-N 2.74Å; N52-S54 WeakPolarHBondContact OD1-CB 3.41Å; N52-S54 PolarHBondContact OD1-N 3.21Å; N52-S54 VanDerWaalsContact OD1-N 3.13Å; N52-S54 PolarHBondContact OD1-OG 3.12Å
53	C	78.7	Confident	90.7	Very high	6 Å²	6	63 Å²	63	4%	0.041	33%	0.326	C	S	.	.	S	Bend	trans	49	17.3	-174.1	81.9	0	0	0	0	115.3	C55 C356	C53-C55 PolarHBondContact O-N 2.95Å; C53-C356 HydrophobicContact CB-CB 3.38Å; C53-C356 WeakPolarHBondContact CB-SG 3.48Å; C53-C356 WeakPolarHBondContact SG-CB 3.49Å; C53-C356 CovalentContact SG-SG 2.02Å; C53-C356 PolarHBondContact SG-SG 2.83Å
54	S	89.9	Confident	90.8	Very high	46 Å²	46	56.3 Å²	56.3	32%	0.322	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-73.4	-12.5	-173.8	77.7	0	0	0	0	113.3	N52 H56 L57	N52-S54 PolarHBondContact O-N 2.74Å; N52-S54 WeakPolarHBondContact OD1-CB 3.41Å; N52-S54 PolarHBondContact OD1-N 3.21Å; N52-S54 VanDerWaalsContact OD1-N 3.13Å; N52-S54 PolarHBondContact OD1-OG 3.12Å; S54-H56 PolarHBondContact O-N 2.94Å; S54-H56 VanDerWaalsContact O-N 3.16Å; S54-L57 PolarHBondContact O-N 2.85Å
55	C	93.5	Very high	90.9	Very high	9 Å²	9	56.4 Å²	56.4	6%	0.061	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-51.2	-40.7	-176.9	-164.4	0	0	0	0	111.7	C48 C53 Q303	C48-C55 HydrophobicContact CB-CB 3.56Å; C48-C55 WeakPolarHBondContact CB-SG 3.31Å; C48-C55 WeakPolarHBondContact SG-CB 3.49Å; C48-C55 CovalentContact SG-SG 2.04Å; C48-C55 PolarHBondContact SG-SG 3.39Å; C53-C55 PolarHBondContact O-N 2.95Å; C55-Q303 WeakPolarHBondContact O-CG 3.33Å; C55-Q303 PolarHBondContact O-NE2 3.05Å; C55-Q303 VanDerWaalsContact O-NE2 3.15Å
56	H	95.5	Very high	91	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.009	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-102.8	0.2	-172.8	-50	-60.7	0	0	0	113.7	S54 S58 V59 F299 Q303 F344 H348 Y357	S54-H56 PolarHBondContact O-N 2.94Å; S54-H56 VanDerWaalsContact O-N 3.16Å; H56-S58 PolarHBondContact O-N 2.97Å; H56-V59 VanDerWaalsContact O-CB 3.32Å; H56-V59 WeakPolarHBondContact O-CB 3.21Å; H56-V59 PolarHBondContact O-N 3.17Å; H56-F299 HydrophobicContact CB-CD2 4.07Å; H56-F299 HydrophobicContact CB-CE2 4.22Å; H56-F299 AromaticContact CD2-CE2 3.82Å; H56-F299 AromaticContact CG-CE2 3.99Å; H56-Q303 WeakPolarHBondContact ND1-CG 3.22Å; H56-F344 AromaticContact CE1-CZ 3.96Å; H56-H348 PolarHBondContact NE2-O 3.47Å; H56-Y357 HydrophobicContact CB-CD2 3.81Å; H56-Y357 HydrophobicContact CB-CE2 3.81Å
57	L	92.3	Very high	91.3	Very high	31 Å²	31	48.3 Å²	48.3	16%	0.162	26%	0.258	C	S	.	.	H	α-helix	trans	-67.6	-21.5	-173.7	-67.7	179.7	0	0	0	113.9	S54 V59 L60 N61 R360	S54-L57 PolarHBondContact O-N 2.85Å; L57-V59 PolarHBondContact O-N 3.28Å; L57-L60 HydrophobicContact CD2-CD2 4.09Å; L57-L60 PolarHBondContact O-N 2.92Å; L57-N61 WeakPolarHBondContact O-CB 3.3Å; L57-N61 VanDerWaalsContact O-CG 3.3Å; L57-N61 PolarHBondContact O-N 2.74Å; L57-N61 PolarHBondContact O-ND2 2.76Å; L57-R360 HydrophobicContact CD2-CB 3.95Å; L57-R360 HydrophobicContact CD2-CG 3.98Å
58	S	94.9	Very high	91.6	Very high	53 Å²	53	51 Å²	51	37%	0.371	26%	0.255	S	S	.	.	H	α-helix	trans	-60	-36.5	171.8	62	0	0	0	0	111.4	H56 N61 D62 Q303	H56-S58 PolarHBondContact O-N 2.97Å; S58-N61 PolarHBondContact O-N 3.48Å; S58-D62 WeakPolarHBondContact O-CB 3.35Å; S58-D62 PolarHBondContact O-N 3.35Å; S58-Q303 PolarHBondContact OG-NE2 3.36Å
59	V	96.6	Very high	92	Very high	7 Å²	7	57.6 Å²	57.6	4%	0.042	28%	0.284	C	S	.	.	H	α-helix	trans	-66.5	-46.6	178.4	-175.3	0	0	0	0	110.3	H56 L57 N61 D62 D63 M159 F299 P302	H56-V59 VanDerWaalsContact O-CB 3.32Å; H56-V59 WeakPolarHBondContact O-CB 3.21Å; H56-V59 PolarHBondContact O-N 3.17Å; L57-V59 PolarHBondContact O-N 3.28Å; V59-N61 PolarHBondContact O-N 3.2Å; V59-D62 PolarHBondContact O-N 3.3Å; V59-D63 WeakPolarHBondContact O-CB 3.25Å; V59-D63 PolarHBondContact O-N 2.96Å; V59-M159 HydrophobicContact CG1-CE 3.41Å; V59-M159 VanDerWaalsContact CG1-CE 3.41Å; V59-F299 WeakPolarHBondContact CG2-O 3.41Å; V59-P302 HydrophobicContact CG2-CB 3.82Å; V59-P302 HydrophobicContact CG2-CG 3.62Å
60	L	96.4	Very high	92.5	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-58.9	-47.5	176.1	178.9	60.6	0	0	0	111.8	L57 D62 D63 L64 Y357 R360 L361 E364	L57-L60 HydrophobicContact CD2-CD2 4.09Å; L57-L60 PolarHBondContact O-N 2.92Å; L60-D62 PolarHBondContact O-N 3.45Å; L60-D63 PolarHBondContact O-N 2.83Å; L60-L64 HydrophobicContact CD1-CD1 3.71Å; L60-L64 HydrophobicContact CD1-CG 3.85Å; L60-L64 HydrophobicContact CG-CD1 4.07Å; L60-L64 HydrophobicContact CG-CG 4.43Å; L60-L64 WeakPolarHBondContact O-CB 3.49Å; L60-L64 WeakPolarHBondContact O-CG 3.12Å; L60-L64 PolarHBondContact O-N 2.9Å; L60-Y357 HydrophobicContact CB-CE2 4.21Å; L60-R360 HydrophobicContact CD2-CB 3.91Å; L60-L361 HydrophobicContact CD1-CB 3.96Å; L60-L361 HydrophobicContact CD1-CD1 3.42Å; L60-L361 VanDerWaalsContact CD1-CD1 3.42Å; L60-L361 HydrophobicContact CD1-CG 4.26Å; L60-L361 HydrophobicContact CD2-CB 4.48Å; L60-E364 WeakPolarHBondContact CD2-OE2 3.34Å
61	N	97	Very high	93.4	Very high	74 Å²	74	54.5 Å²	54.5	40%	0.396	27%	0.266	S	S	.	.	H	α-helix	trans	-60.1	-35.1	178.9	-78	-48.3	0	0	0	113	L57 S58 V59 R65	L57-N61 WeakPolarHBondContact O-CB 3.3Å; L57-N61 VanDerWaalsContact O-CG 3.3Å; L57-N61 PolarHBondContact O-N 2.74Å; L57-N61 PolarHBondContact O-ND2 2.76Å; S58-N61 PolarHBondContact O-N 3.48Å; V59-N61 PolarHBondContact O-N 3.2Å; N61-R65 PolarHBondContact O-N 2.78Å
62	D	98.1	Very high	94.5	Very high	79 Å²	79	46.9 Å²	46.9	42%	0.422	24%	0.243	S	C	.	.	H	α-helix	trans	-74.8	-42.6	178.7	-71.7	-4.2	0	0	0	111	S58 V59 L60 L64 R65	S58-D62 WeakPolarHBondContact O-CB 3.35Å; S58-D62 PolarHBondContact O-N 3.35Å; V59-D62 PolarHBondContact O-N 3.3Å; L60-D62 PolarHBondContact O-N 3.45Å; D62-L64 PolarHBondContact O-N 3.2Å; D62-R65 VanDerWaalsContact CG-NH2 3.28Å; D62-R65 WeakPolarHBondContact O-CB 3.03Å; D62-R65 PolarHBondContact O-N 2.79Å; D62-R65 IonicContact OD1-CZ 2.66Å; D62-R65 IonicContact OD1-NH2 2.75Å; D62-R65 PolarHBondContact OD1-NH2 2.9Å; D62-R65 IonicContact OD2-NH2 3.38Å
63	D	98.5	Very high	95.7	Very high	11 Å²	11	49 Å²	49	6%	0.059	25%	0.251	C	S	.	.	H	α-helix	trans	-67.8	-34	178.8	-75.6	0.9	0	0	0	113	V59 L60 P66 K151 I158 M159	V59-D63 WeakPolarHBondContact O-CB 3.25Å; V59-D63 PolarHBondContact O-N 2.96Å; L60-D63 PolarHBondContact O-N 2.83Å; D63-P66 VanDerWaalsContact O-CD 3.32Å; D63-P66 WeakPolarHBondContact O-CD 3.49Å; D63-K151 VanDerWaalsContact CG-NZ 3.29Å; D63-K151 WeakPolarHBondContact OD1-CE 3.06Å; D63-K151 IonicContact OD1-NZ 3.6Å; D63-K151 PolarHBondContact OD1-NZ 3.19Å; D63-K151 IonicContact OD2-NZ 3.92Å; D63-I158 HydrophobicContact CB-CB 4.45Å; D63-I158 HydrophobicContact CB-CG1 4.47Å; D63-I158 HydrophobicContact CB-CG2 4.09Å; D63-M159 WeakPolarHBondContact OD2-CB 3.46Å; D63-M159 PolarHBondContact OD2-N 3.36Å
64	L	98.4	Very high	96.6	Very high	10 Å²	10	55.6 Å²	55.6	5%	0.052	28%	0.281	C	S	.	.	S	Bend	trans	-84.7	-11.7	176.7	-65.2	-173.2	0	0	0	113.5	L60 D62 F67 I158 E364 F365 L368	L60-L64 HydrophobicContact CD1-CD1 3.71Å; L60-L64 HydrophobicContact CD1-CG 3.85Å; L60-L64 HydrophobicContact CG-CD1 4.07Å; L60-L64 HydrophobicContact CG-CG 4.43Å; L60-L64 WeakPolarHBondContact O-CB 3.49Å; L60-L64 WeakPolarHBondContact O-CG 3.12Å; L60-L64 PolarHBondContact O-N 2.9Å; D62-L64 PolarHBondContact O-N 3.2Å; L64-F67 PolarHBondContact O-N 3.29Å; L64-I158 HydrophobicContact CD2-CD1 3.76Å; L64-I158 HydrophobicContact CD2-CG1 4.16Å; L64-I158 HydrophobicContact CD2-CG2 4.13Å; L64-E364 HydrophobicContact CD1-CB 3.66Å; L64-F365 HydrophobicContact CD2-CB 4.34Å; L64-F365 HydrophobicContact CD2-CD2 3.91Å; L64-L368 HydrophobicContact CB-CD1 4.32Å; L64-L368 HydrophobicContact CD1-CD1 4.45Å; L64-L368 HydrophobicContact CD2-CD1 4.32Å
65	R	98	Very high	97	Very high	129 Å²	129	54.6 Å²	54.6	49%	0.487	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-52.6	-42.5	-178.7	-170.3	-172.4	-56.8	166.7	-1.8	114	N61 D62 F67 R68	N61-R65 PolarHBondContact O-N 2.78Å; D62-R65 VanDerWaalsContact CG-NH2 3.28Å; D62-R65 WeakPolarHBondContact O-CB 3.03Å; D62-R65 PolarHBondContact O-N 2.79Å; D62-R65 IonicContact OD1-CZ 2.66Å; D62-R65 IonicContact OD1-NH2 2.75Å; D62-R65 PolarHBondContact OD1-NH2 2.9Å; D62-R65 IonicContact OD2-NH2 3.38Å; R65-F67 PolarHBondContact O-N 3Å; R65-R68 WeakPolarHBondContact O-CG 3.32Å; R65-R68 PolarHBondContact O-N 3.39Å
66	P	97.8	Very high	97.2	Very high	51 Å²	51	54.2 Å²	54.2	33%	0.331	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-63.5	-19.5	179.3	-22.5	35.6	0	0	0	114.2	D63 I143	D63-P66 VanDerWaalsContact O-CD 3.32Å; D63-P66 WeakPolarHBondContact O-CD 3.49Å; P66-I143 HydrophobicContact CB-CD1 3.76Å; P66-I143 HydrophobicContact CB-CG2 4.36Å
67	F	97.9	Very high	97.3	Very high	7 Å²	7	55.9 Å²	55.9	3%	0.031	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-106	12.7	-174	-51.9	-76.3	0	0	0	113.2	L64 R65 E69 G70 V71 I143 P145 I158 L368	L64-F67 PolarHBondContact O-N 3.29Å; R65-F67 PolarHBondContact O-N 3Å; F67-E69 PolarHBondContact O-N 3.25Å; F67-G70 VanDerWaalsContact O-CA 3.3Å; F67-G70 WeakPolarHBondContact O-CA 3.33Å; F67-G70 PolarHBondContact O-N 3.36Å; F67-V71 HydrophobicContact CB-CG2 4.14Å; F67-V71 HydrophobicContact CD1-CG2 4.08Å; F67-V71 HydrophobicContact CG-CG2 4.39Å; F67-I143 HydrophobicContact CE1-CB 4.35Å; F67-I143 HydrophobicContact CE1-CG2 3.86Å; F67-I143 WeakPolarHBondContact CE1-O 3.36Å; F67-I143 HydrophobicContact CZ-CG2 3.61Å; F67-P145 HydrophobicContact CD1-CB 4.28Å; F67-P145 HydrophobicContact CE1-CB 3.81Å; F67-P145 HydrophobicContact CE1-CG 4.38Å; F67-P145 HydrophobicContact CZ-CB 4.02Å; F67-I158 HydrophobicContact CD2-CD1 4.07Å; F67-I158 HydrophobicContact CD2-CG1 4.5Å; F67-I158 HydrophobicContact CE2-CD1 3.68Å; F67-I158 HydrophobicContact CE2-CG1 3.89Å; F67-I158 HydrophobicContact CZ-CD1 4.39Å; F67-L368 HydrophobicContact CB-CD1 3.94Å
68	R	96.4	Very high	97.6	Very high	158 Å²	158	56.5 Å²	56.5	60%	0.596	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-29.5	-178.2	-76.4	176.5	-180	-172.2	3.6	114	R65 G70	R65-R68 WeakPolarHBondContact O-CG 3.32Å; R65-R68 PolarHBondContact O-N 3.39Å; R68-G70 PolarHBondContact O-N 3.04Å
69	E	96.5	Very high	97.7	Very high	160 Å²	160	54 Å²	54	75%	0.748	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	6.7	172.3	-60.8	-53.3	137.3	0	0	112.8	F67 K370	F67-E69 PolarHBondContact O-N 3.25Å; E69-K370 WeakPolarHBondContact O-CE 3.45Å; E69-K370 PolarHBondContact O-NZ 2.99Å
70	G	97.6	Very high	97.8	Very high	18 Å²	18	55.7 Å²	55.7	19%	0.186	28%	0.278	C	S	.	.			trans	83	164.5	177.8	0	0	0	0	0	114.7	F67 R68 L368	F67-G70 VanDerWaalsContact O-CA 3.3Å; F67-G70 WeakPolarHBondContact O-CA 3.33Å; F67-G70 PolarHBondContact O-N 3.36Å; R68-G70 PolarHBondContact O-N 3.04Å; G70-L368 CarbonylContact C-O 3.54Å; G70-L368 WeakPolarHBondContact CA-O 3.25Å
71	V	98.6	Very high	97.8	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-108.8	116	179	176	0	0	0	0	108.1	F67 L75 M76 P145 F365 L368 L369 K370	F67-V71 HydrophobicContact CB-CG2 4.14Å; F67-V71 HydrophobicContact CD1-CG2 4.08Å; F67-V71 HydrophobicContact CG-CG2 4.39Å; V71-L75 HydrophobicContact CG1-CD2 4.27Å; V71-M76 HydrophobicContact CG1-CE 4.19Å; V71-P145 HydrophobicContact CG1-CG 3.99Å; V71-P145 HydrophobicContact CG2-CB 4.5Å; V71-P145 HydrophobicContact CG2-CG 4.38Å; V71-F365 HydrophobicContact CG2-CE2 4.26Å; V71-L368 PolarHBondContact N-O 3.27Å; V71-L369 HydrophobicContact CB-CD2 3.9Å; V71-L369 HydrophobicContact CG1-CD2 3.95Å; V71-K370 PolarHBondContact O-N 2.93Å
72	S	98.4	Very high	97.7	Very high	51 Å²	51	64.8 Å²	64.8	36%	0.357	31%	0.307	S	S	.	.			trans	-78.6	161.8	175.9	66.5	0	0	0	0	111.7	E74 L75 M76	S72-E74 PolarHBondContact O-N 3.28Å; S72-L75 PolarHBondContact O-N 2.98Å; S72-L75 WeakPolarHBondContact OG-CB 3.27Å; S72-L75 PolarHBondContact OG-N 3.25Å; S72-L75 VanDerWaalsContact OG-N 3.1Å; S72-M76 PolarHBondContact O-N 2.98Å
73	E	98.1	Very high	97.5	Very high	126 Å²	126	63.6 Å²	63.6	59%	0.589	31%	0.313	S	S	*	.	H	α-helix	trans	-60.1	-38.2	173.4	-172.2	175	-170.2	0	0	111.3	M76 A77 Y371	E73-M76 PolarHBondContact O-N 3.1Å; E73-A77 WeakPolarHBondContact O-CB 3.45Å; E73-A77 PolarHBondContact O-N 2.8Å; E73-Y371 HydrophobicContact CB-CD1 3.93Å; E73-Y371 HydrophobicContact CB-CD2 3.89Å; E73-Y371 HydrophobicContact CB-CE1 4.3Å; E73-Y371 HydrophobicContact CB-CE2 4.25Å; E73-Y371 HydrophobicContact CB-CG 3.72Å; E73-Y371 HydrophobicContact CG-CD2 4.02Å; E73-Y371 HydrophobicContact CG-CE2 4.2Å; E73-Y371 HydrophobicContact CG-CG 4.37Å; E73-Y371 VanDerWaalsContact N-CD1 3.29Å
74	E	98.1	Very high	97.3	Very high	146 Å²	146	63.8 Å²	63.8	68%	0.682	32%	0.315	S	S	*	.	H	α-helix	trans	-62.5	-46.4	175.4	-174.9	176.7	-164.8	0	0	111.7	S72 M76 A77 D78	S72-E74 PolarHBondContact O-N 3.28Å; E74-M76 VanDerWaalsContact C-N 3.31Å; E74-M76 PolarHBondContact O-N 3.08Å; E74-A77 WeakPolarHBondContact O-CB 3.46Å; E74-A77 PolarHBondContact O-N 2.86Å; E74-A77 VanDerWaalsContact O-N 3.13Å; E74-D78 VanDerWaalsContact O-CG 3.3Å; E74-D78 PolarHBondContact O-N 3.34Å
75	L	98.3	Very high	97.2	Very high	24 Å²	24	64.2 Å²	64.2	13%	0.126	32%	0.321	C	S	.	.	H	α-helix	trans	-62.5	-39.5	178	-176.4	63	0	0	0	112	V71 S72 D78 T79 P142 L144	V71-L75 HydrophobicContact CG1-CD2 4.27Å; S72-L75 PolarHBondContact O-N 2.98Å; S72-L75 WeakPolarHBondContact OG-CB 3.27Å; S72-L75 PolarHBondContact OG-N 3.25Å; S72-L75 VanDerWaalsContact OG-N 3.1Å; L75-D78 PolarHBondContact O-N 3.21Å; L75-T79 PolarHBondContact O-N 2.93Å; L75-T79 PolarHBondContact O-OG1 3.38Å; L75-P142 HydrophobicContact CD1-CB 3.93Å; L75-P142 HydrophobicContact CD1-CG 3.7Å; L75-L144 HydrophobicContact CD1-CD2 3.75Å
76	M	98.4	Very high	97.2	Very high	2 Å²	2	58.5 Å²	58.5	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-65.1	-44.3	173.8	-173.8	57.7	70.4	0	0	110.9	V71 S72 E73 E74 D78 T79 L80 E125 V127 P145 F365 L369 Y371	V71-M76 HydrophobicContact CG1-CE 4.19Å; S72-M76 PolarHBondContact O-N 2.98Å; E73-M76 PolarHBondContact O-N 3.1Å; E74-M76 VanDerWaalsContact C-N 3.31Å; E74-M76 PolarHBondContact O-N 3.08Å; M76-D78 VanDerWaalsContact C-N 3.29Å; M76-D78 PolarHBondContact O-N 3.18Å; M76-T79 WeakPolarHBondContact O-CB 3.27Å; M76-T79 PolarHBondContact O-N 3.4Å; M76-T79 VanDerWaalsContact O-N 3.14Å; M76-L80 HydrophobicContact CG-CD1 4.39Å; M76-L80 VanDerWaalsContact O-CG 3.32Å; M76-L80 WeakPolarHBondContact O-CG 3.4Å; M76-L80 PolarHBondContact O-N 2.96Å; M76-E125 HydrophobicContact CE-CG 4.16Å; M76-E125 WeakPolarHBondContact CE-O 3.25Å; M76-E125 HydrophobicContact CG-CG 4.07Å; M76-E125 HydrophobicContact SD-CG 4.47Å; M76-V127 HydrophobicContact SD-CG2 4.03Å; M76-P145 HydrophobicContact CE-CG 4.17Å; M76-F365 HydrophobicContact CE-CE1 4.45Å; M76-F365 HydrophobicContact CE-CZ 4.21Å; M76-L369 HydrophobicContact CE-CD2 4.35Å; M76-Y371 WeakPolarHBondContact CB-OH 3.33Å; M76-Y371 WeakPolarHBondContact CG-OH 3.38Å
77	A	97.7	Very high	97.3	Very high	37 Å²	37	56 Å²	56	31%	0.306	29%	0.285	S	S	.	.	H	α-helix	trans	-59.1	-40	176	0	0	0	0	0	112.2	E73 E74 L80 R81	E73-A77 WeakPolarHBondContact O-CB 3.45Å; E73-A77 PolarHBondContact O-N 2.8Å; E74-A77 WeakPolarHBondContact O-CB 3.46Å; E74-A77 PolarHBondContact O-N 2.86Å; E74-A77 VanDerWaalsContact O-N 3.13Å; A77-L80 PolarHBondContact O-N 3.08Å; A77-R81 WeakPolarHBondContact O-CG 3.29Å; A77-R81 PolarHBondContact O-N 3.43Å; A77-R81 PolarHBondContact O-NH1 3.37Å
78	D	97.6	Very high	97.3	Very high	43 Å²	43	55.7 Å²	55.7	23%	0.23	28%	0.283	C	S	.	.	H	α-helix	trans	-63.3	-42.2	175.5	-72.1	15.9	0	0	0	111.6	E74 L75 M76 R81 R82 L144	E74-D78 VanDerWaalsContact O-CG 3.3Å; E74-D78 PolarHBondContact O-N 3.34Å; L75-D78 PolarHBondContact O-N 3.21Å; M76-D78 VanDerWaalsContact C-N 3.29Å; M76-D78 PolarHBondContact O-N 3.18Å; D78-R81 VanDerWaalsContact CG-NH2 3.26Å; D78-R81 PolarHBondContact O-N 2.93Å; D78-R81 IonicContact OD1-CZ 2.76Å; D78-R81 IonicContact OD1-NH1 3.91Å; D78-R81 PolarHBondContact OD1-NH1 3.14Å; D78-R81 IonicContact OD1-NH2 3.3Å; D78-R81 PolarHBondContact OD1-NH2 3.35Å; D78-R81 IonicContact OD2-NH2 3.59Å; D78-R82 PolarHBondContact O-N 2.87Å; D78-L144 HydrophobicContact CB-CD2 4.32Å
79	T	98	Very high	97.4	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61	-45.3	175.6	-54.3	0	0	0	0	111.3	L75 M76 R82 V127 L144 P145 V146	L75-T79 PolarHBondContact O-N 2.93Å; L75-T79 PolarHBondContact O-OG1 3.38Å; M76-T79 WeakPolarHBondContact O-CB 3.27Å; M76-T79 PolarHBondContact O-N 3.4Å; M76-T79 VanDerWaalsContact O-N 3.14Å; T79-R82 WeakPolarHBondContact O-CB 3.3Å; T79-R82 PolarHBondContact O-N 3.13Å; T79-V127 HydrophobicContact CG2-CB 4.03Å; T79-V127 HydrophobicContact CG2-CG1 4.35Å; T79-V127 HydrophobicContact CG2-CG2 3.8Å; T79-L144 HydrophobicContact CG2-CB 4.21Å; T79-P145 VanDerWaalsContact OG1-CD 3.32Å; T79-P145 WeakPolarHBondContact OG1-CD 3.22Å; T79-V146 HydrophobicContact CG2-CG2 3.66Å
80	L	97.1	Very high	97.5	Very high	43 Å²	43	40.6 Å²	40.6	23%	0.225	22%	0.22	C	C	.	.	H	α-helix	trans	-63.3	-42	177	-66	174	0	0	0	112.3	M76 A77 R82 G83 H87 V127	M76-L80 HydrophobicContact CG-CD1 4.39Å; M76-L80 VanDerWaalsContact O-CG 3.32Å; M76-L80 WeakPolarHBondContact O-CG 3.4Å; M76-L80 PolarHBondContact O-N 2.96Å; A77-L80 PolarHBondContact O-N 3.08Å; L80-R82 PolarHBondContact O-N 3.29Å; L80-G83 PolarHBondContact O-N 3.39Å; L80-H87 HydrophobicContact CD2-CB 3.53Å; L80-V127 HydrophobicContact CD2-CG2 3.53Å; L80-V127 HydrophobicContact CG-CG2 4.32Å
81	R	96.6	Very high	97.6	Very high	176 Å²	176	40.5 Å²	40.5	66%	0.664	22%	0.215	S	C	*	.	H	α-helix	trans	-61.5	-25.6	177.9	-73.6	-165.9	-49.4	-86.9	13.4	112.9	A77 D78 G83	A77-R81 WeakPolarHBondContact O-CG 3.29Å; A77-R81 PolarHBondContact O-N 3.43Å; A77-R81 PolarHBondContact O-NH1 3.37Å; D78-R81 VanDerWaalsContact CG-NH2 3.26Å; D78-R81 PolarHBondContact O-N 2.93Å; D78-R81 IonicContact OD1-CZ 2.76Å; D78-R81 IonicContact OD1-NH1 3.91Å; D78-R81 PolarHBondContact OD1-NH1 3.14Å; D78-R81 IonicContact OD1-NH2 3.3Å; D78-R81 PolarHBondContact OD1-NH2 3.35Å; D78-R81 IonicContact OD2-NH2 3.59Å; R81-G83 VanDerWaalsContact C-N 3.27Å; R81-G83 PolarHBondContact O-N 3.25Å
82	R	94.9	Very high	97.5	Very high	90 Å²	90	46.9 Å²	46.9	34%	0.34	25%	0.248	S	C	.	.	H	α-helix	trans	-69.6	-24.5	176.9	-149.7	176	-176.9	-172.6	1.7	112.9	D78 T79 L80 V84 Q135 L144	D78-R82 PolarHBondContact O-N 2.87Å; T79-R82 WeakPolarHBondContact O-CB 3.3Å; T79-R82 PolarHBondContact O-N 3.13Å; L80-R82 PolarHBondContact O-N 3.29Å; R82-V84 VanDerWaalsContact C-N 3.28Å; R82-V84 HydrophobicContact CB-CG1 4.17Å; R82-V84 HydrophobicContact CB-CG2 4.23Å; R82-V84 HydrophobicContact CG-CG1 3.74Å; R82-V84 HydrophobicContact CG-CG2 4.46Å; R82-V84 PolarHBondContact O-N 3.44Å; R82-Q135 PolarHBondContact NH1-O 2.92Å; R82-Q135 VanDerWaalsContact NH1-O 3.16Å; R82-L144 VanDerWaalsContact CD-CD1 3.45Å
83	G	94.4	Very high	97.4	Very high	54 Å²	54	45.9 Å²	45.9	56%	0.557	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.7	28.1	175.1	0	0	0	0	0	114.5	L80 R81	L80-G83 PolarHBondContact O-N 3.39Å; R81-G83 VanDerWaalsContact C-N 3.27Å; R81-G83 PolarHBondContact O-N 3.25Å
84	V	93.9	Very high	97.4	Very high	15 Å²	15	44.5 Å²	44.5	9%	0.091	24%	0.238	C	C	.	.			trans	-94.1	-3	-171.9	-67.2	0	0	0	0	114.4	R82 N129 Q135 V146	R82-V84 VanDerWaalsContact C-N 3.28Å; R82-V84 HydrophobicContact CB-CG1 4.17Å; R82-V84 HydrophobicContact CB-CG2 4.23Å; R82-V84 HydrophobicContact CG-CG1 3.74Å; R82-V84 HydrophobicContact CG-CG2 4.46Å; R82-V84 PolarHBondContact O-N 3.44Å; V84-N129 PolarHBondContact O-OD1 2.9Å; V84-Q135 HydrophobicContact CB-CB 3.82Å; V84-Q135 HydrophobicContact CB-CG 3.79Å; V84-Q135 HydrophobicContact CG1-CB 4.32Å; V84-Q135 HydrophobicContact CG1-CG 4.49Å; V84-Q135 HydrophobicContact CG2-CB 3.96Å; V84-Q135 HydrophobicContact CG2-CG 4.34Å; V84-V146 HydrophobicContact CG2-CG1 4.36Å; V84-V146 HydrophobicContact CG2-CG2 3.79Å
85	G	97.2	Very high	97.5	Very high	19 Å²	19	37.6 Å²	37.6	20%	0.196	21%	0.206	C	C	.	.	S	Bend	trans	-155.5	179.7	177.2	0	0	0	0	0	111.9
86	T	98.5	Very high	97.5	Very high	8 Å²	8	37.3 Å²	37.3	5%	0.049	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	127.3	176.4	-62.9	0	0	0	0	110	Y88 R97 E98 V128	T86-Y88 HydrophobicContact CG2-CD2 4.3Å; T86-Y88 HydrophobicContact CG2-CE2 3.62Å; T86-Y88 WeakPolarHBondContact O-CD2 3.41Å; T86-R97 HydrophobicContact CG2-CG 3.63Å; T86-E98 VanDerWaalsContact CA-OE1 3.22Å; T86-E98 WeakPolarHBondContact CA-OE1 3.24Å; T86-E98 HydrophobicContact CG2-CG 4.09Å; T86-V128 PolarHBondContact N-O 2.78Å; T86-V128 PolarHBondContact O-N 3.19Å
87	H	98.6	Very high	97.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	130.3	-178.8	-174.1	-149.5	0	0	0	112.8	L80 R97 E98 E125 M126 Y379	L80-H87 HydrophobicContact CD2-CB 3.53Å; H87-R97 WeakPolarHBondContact O-CA 3.48Å; H87-R97 WeakPolarHBondContact O-CG 3.39Å; H87-E98 PolarHBondContact N-OE1 3.32Å; H87-E98 PolarHBondContact O-N 2.88Å; H87-E98 VanDerWaalsContact O-N 3.12Å; H87-E125 IonicContact CE1-OE2 3.7Å; H87-E125 PolarHBondContact CE1-OE2 3.06Å; H87-E125 IonicContact NE2-OE2 3.58Å; H87-E125 PolarHBondContact NE2-OE2 2.81Å; H87-E125 VanDerWaalsContact NE2-OE2 3.08Å; H87-M126 PolarHBondContact CD2-O 2.98Å; H87-Y379 HydrophobicContact CB-CE2 4.18Å; H87-Y379 WeakPolarHBondContact CB-OH 3.22Å; H87-Y379 AromaticContact CE1-CE2 3.94Å; H87-Y379 AromaticContact CG-CE2 3.84Å; H87-Y379 AromaticContact ND1-CE2 3.27Å; H87-Y379 VanDerWaalsContact ND1-CE2 3.27Å; H87-Y379 WeakPolarHBondContact ND1-CE2 3.33Å; H87-Y379 AromaticContact ND1-CZ 3.38Å; H87-Y379 PolarHBondContact ND1-OH 3.07Å
88	Y	98.8	Very high	97.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	148	175.1	-67.8	-92.7	0	0	0	111.3	T86 L95 Y96 R97 C107 E111 E125 M126 V128	T86-Y88 HydrophobicContact CG2-CD2 4.3Å; T86-Y88 HydrophobicContact CG2-CE2 3.62Å; T86-Y88 WeakPolarHBondContact O-CD2 3.41Å; Y88-L95 HydrophobicContact CD1-CD1 3.79Å; Y88-L95 HydrophobicContact CD1-CD2 4.36Å; Y88-L95 HydrophobicContact CD1-CG 4.21Å; Y88-L95 HydrophobicContact CG-CD1 4.41Å; Y88-Y96 CarbonylContact C-O 3.55Å; Y88-Y96 VanDerWaalsContact CA-O 3.27Å; Y88-Y96 WeakPolarHBondContact CA-O 3.46Å; Y88-R97 HydrophobicContact CD1-CB 3.72Å; Y88-R97 HydrophobicContact CD1-CG 3.6Å; Y88-R97 HydrophobicContact CD2-CG 4.4Å; Y88-R97 HydrophobicContact CE1-CB 3.72Å; Y88-R97 HydrophobicContact CE1-CG 3.32Å; Y88-R97 HydrophobicContact CE2-CG 4.16Å; Y88-R97 HydrophobicContact CG-CG 4.15Å; Y88-R97 VanDerWaalsContact OH-CD 3.32Å; Y88-R97 WeakPolarHBondContact OH-CD 3.38Å; Y88-C107 WeakPolarHBondContact OH-CB 3.43Å; Y88-C107 PolarHBondContact OH-SG 3.37Å; Y88-C107 VanDerWaalsContact OH-SG 3.39Å; Y88-E111 HydrophobicContact CE1-CG 3.72Å; Y88-E111 PolarHBondContact OH-OE1 3.25Å; Y88-E125 CarbonylContact O-C 3.31Å; Y88-E125 VanDerWaalsContact O-CA 3.24Å; Y88-E125 WeakPolarHBondContact O-CA 3.49Å; Y88-E125 WeakPolarHBondContact O-CB 3.5Å; Y88-M126 HydrophobicContact CG-CE 4.3Å; Y88-M126 PolarHBondContact N-O 3.33Å; Y88-M126 PolarHBondContact O-N 3.44Å; Y88-V128 HydrophobicContact CD2-CB 4.17Å; Y88-V128 HydrophobicContact CD2-CG2 3.86Å; Y88-V128 HydrophobicContact CE2-CB 4.06Å; Y88-V128 HydrophobicContact CE2-CG2 4.17Å
89	Q	98.8	Very high	97.3	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	133.7	170.2	-56.5	-174.5	-65	0	0	109.4	I91 L95 Y96 V124 E125 Q374 Y379	Q89-I91 HydrophobicContact CB-CD1 4.28Å; Q89-I91 HydrophobicContact CB-CG1 4.45Å; Q89-L95 CarbonylContact O-C 3.23Å; Q89-Y96 PolarHBondContact N-O 3.04Å; Q89-Y96 PolarHBondContact O-N 2.96Å; Q89-V124 CarbonylContact C-O 3.57Å; Q89-V124 WeakPolarHBondContact CA-O 3.15Å; Q89-E125 HydrophobicContact CB-CB 4.4Å; Q89-E125 HydrophobicContact CG-CB 3.88Å; Q89-Q374 PolarHBondContact NE2-O 2.98Å; Q89-Y379 HydrophobicContact CG-CD2 4.32Å; Q89-Y379 HydrophobicContact CG-CE2 4.31Å
90	I	98.8	Very high	97.1	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	117.1	168	-57.3	179.1	0	0	0	106.3	K94 L95 I114 I118 L121 D123 V124 M126 L362	I90-K94 WeakPolarHBondContact CA-O 3.22Å; I90-L95 HydrophobicContact CD1-CD1 4.4Å; I90-L95 HydrophobicContact CG1-CD1 3.74Å; I90-I114 HydrophobicContact CD1-CG2 3.58Å; I90-I114 HydrophobicContact CG1-CG2 4.4Å; I90-I118 HydrophobicContact CG2-CD1 4.23Å; I90-I118 HydrophobicContact CG2-CG1 3.92Å; I90-L121 HydrophobicContact CD1-CB 4.48Å; I90-L121 HydrophobicContact CD1-CD1 3.45Å; I90-L121 VanDerWaalsContact CD1-CD1 3.45Å; I90-D123 CarbonylContact O-C 3.57Å; I90-D123 WeakPolarHBondContact O-CA 3.27Å; I90-V124 HydrophobicContact CB-CG1 3.89Å; I90-V124 HydrophobicContact CD1-CG1 3.8Å; I90-V124 HydrophobicContact CG1-CG1 4.08Å; I90-V124 PolarHBondContact N-O 3.19Å; I90-V124 PolarHBondContact O-N 3.43Å; I90-M126 HydrophobicContact CD1-CE 4.31Å; I90-L362 HydrophobicContact CD1-CD1 4.36Å
91	I	98.3	Very high	97	Very high	16 Å²	16	48.9 Å²	48.9	8%	0.082	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	122.1	-179.2	-62	171.8	0	0	0	108.6	Q89 G93 K94 Y96 D123 L373 R375	Q89-I91 HydrophobicContact CB-CD1 4.28Å; Q89-I91 HydrophobicContact CB-CG1 4.45Å; I91-G93 PolarHBondContact O-N 2.64Å; I91-K94 PolarHBondContact N-O 3.36Å; I91-K94 PolarHBondContact O-N 3.34Å; I91-Y96 HydrophobicContact CB-CE2 4.23Å; I91-D123 WeakPolarHBondContact CA-OD1 3.46Å; I91-L373 HydrophobicContact CD1-CB 4.2Å; I91-L373 HydrophobicContact CG1-CB 4.32Å; I91-L373 HydrophobicContact CG1-CD2 4.42Å; I91-R375 VanDerWaalsContact CD1-CA 3.5Å; I91-R375 HydrophobicContact CD1-CB 3.7Å
92	N	96.8	Very high	96.9	Very high	133 Å²	133	45.7 Å²	45.7	71%	0.711	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	49.6	-176.1	-60.9	-56.3	0	0	0	112.5	K94 D123	N92-K94 PolarHBondContact O-N 3.15Å; N92-D123 PolarHBondContact N-OD1 2.82Å
93	G	97.1	Very high	97	Very high	30 Å²	30	45 Å²	45	31%	0.309	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	67	18.9	178.1	0	0	0	0	0	114.7	I91 I118	I91-G93 PolarHBondContact O-N 2.64Å; G93-I118 WeakPolarHBondContact O-CD1 3.44Å
94	K	98.3	Very high	97.1	Very high	98 Å²	98	46.8 Å²	46.8	43%	0.426	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	131.8	179.7	-65.3	178.4	-177	-178.2	0	111	I90 I91 N92 Y96	I90-K94 WeakPolarHBondContact CA-O 3.22Å; I91-K94 PolarHBondContact N-O 3.36Å; I91-K94 PolarHBondContact O-N 3.34Å; N92-K94 PolarHBondContact O-N 3.15Å; K94-Y96 HydrophobicContact CB-CE2 3.64Å; K94-Y96 WeakPolarHBondContact CD-OH 3.24Å; K94-Y96 VanDerWaalsContact O-CD2 3.29Å; K94-Y96 WeakPolarHBondContact O-CD2 3.45Å; K94-Y96 VanDerWaalsContact O-CE2 3.25Å; K94-Y96 WeakPolarHBondContact O-CE2 3.09Å
95	L	98.7	Very high	97.3	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	131.3	177.6	-175.6	61.1	0	0	0	110.2	Y88 Q89 I90 E111 I114 L115 I118 Q381 V382	Y88-L95 HydrophobicContact CD1-CD1 3.79Å; Y88-L95 HydrophobicContact CD1-CD2 4.36Å; Y88-L95 HydrophobicContact CD1-CG 4.21Å; Y88-L95 HydrophobicContact CG-CD1 4.41Å; Q89-L95 CarbonylContact O-C 3.23Å; I90-L95 HydrophobicContact CD1-CD1 4.4Å; I90-L95 HydrophobicContact CG1-CD1 3.74Å; L95-E111 HydrophobicContact CD2-CB 4.38Å; L95-E111 HydrophobicContact CD2-CG 4.16Å; L95-I114 HydrophobicContact CD1-CG2 3.97Å; L95-I114 HydrophobicContact CD2-CB 4.21Å; L95-I114 HydrophobicContact CD2-CG2 3.94Å; L95-I114 HydrophobicContact CG-CG2 4.48Å; L95-L115 HydrophobicContact CB-CD2 3.99Å; L95-L115 HydrophobicContact CD2-CD2 4.16Å; L95-L115 HydrophobicContact CD2-CG 4.12Å; L95-I118 HydrophobicContact CB-CD1 3.74Å; L95-I118 VanDerWaalsContact N-CD1 3.35Å; L95-Q381 CarbonylContact O-C 3.57Å; L95-Q381 WeakPolarHBondContact O-CA 3.42Å; L95-Q381 WeakPolarHBondContact O-CG 3.42Å; L95-V382 HydrophobicContact CB-CB 4.29Å; L95-V382 HydrophobicContact CD2-CB 3.96Å; L95-V382 HydrophobicContact CD2-CG1 4.15Å; L95-V382 HydrophobicContact CD2-CG2 4.4Å; L95-V382 HydrophobicContact CG-CB 4.02Å; L95-V382 HydrophobicContact CG-CG2 4.29Å; L95-V382 PolarHBondContact O-N 3.13Å
96	Y	98.7	Very high	97.3	Very high	18 Å²	18	48.9 Å²	48.9	7%	0.071	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	147.2	173.6	-54.6	-87.5	0	0	0	109	Y88 Q89 I91 K94 R375 N380 Q381	Y88-Y96 CarbonylContact C-O 3.55Å; Y88-Y96 VanDerWaalsContact CA-O 3.27Å; Y88-Y96 WeakPolarHBondContact CA-O 3.46Å; Q89-Y96 PolarHBondContact N-O 3.04Å; Q89-Y96 PolarHBondContact O-N 2.96Å; I91-Y96 HydrophobicContact CB-CE2 4.23Å; K94-Y96 HydrophobicContact CB-CE2 3.64Å; K94-Y96 WeakPolarHBondContact CD-OH 3.24Å; K94-Y96 VanDerWaalsContact O-CD2 3.29Å; K94-Y96 WeakPolarHBondContact O-CD2 3.45Å; K94-Y96 VanDerWaalsContact O-CE2 3.25Å; K94-Y96 WeakPolarHBondContact O-CE2 3.09Å; Y96-R375 HydrophobicContact CD1-CG 4.46Å; Y96-R375 HydrophobicContact CD2-CG 4.48Å; Y96-R375 HydrophobicContact CG-CG 4.39Å; Y96-N380 VanDerWaalsContact CA-O 3.3Å; Y96-N380 WeakPolarHBondContact CA-O 3.29Å; Y96-Q381 HydrophobicContact CD1-CB 3.9Å; Y96-Q381 HydrophobicContact CD1-CG 4.31Å; Y96-Q381 HydrophobicContact CE1-CB 3.8Å; Y96-Q381 HydrophobicContact CE1-CG 4.02Å
97	R	98.4	Very high	97.3	Very high	48 Å²	48	48.5 Å²	48.5	18%	0.181	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	150.5	178.7	-166.5	-165.4	78.9	-169.9	4	110.2	T86 H87 Y88 Q99 E111 Y379 N380 V382	T86-R97 HydrophobicContact CG2-CG 3.63Å; H87-R97 WeakPolarHBondContact O-CA 3.48Å; H87-R97 WeakPolarHBondContact O-CG 3.39Å; Y88-R97 HydrophobicContact CD1-CB 3.72Å; Y88-R97 HydrophobicContact CD1-CG 3.6Å; Y88-R97 HydrophobicContact CD2-CG 4.4Å; Y88-R97 HydrophobicContact CE1-CB 3.72Å; Y88-R97 HydrophobicContact CE1-CG 3.32Å; Y88-R97 HydrophobicContact CE2-CG 4.16Å; Y88-R97 HydrophobicContact CG-CG 4.15Å; Y88-R97 VanDerWaalsContact OH-CD 3.32Å; Y88-R97 WeakPolarHBondContact OH-CD 3.38Å; R97-Q99 PolarHBondContact NH2-O 3.06Å; R97-E111 WeakPolarHBondContact CD-OE1 3.28Å; R97-E111 IonicContact CZ-OE1 3.56Å; R97-E111 IonicContact NE-OE1 2.84Å; R97-E111 IonicContact NH1-OE1 3.35Å; R97-E111 PolarHBondContact NH1-OE1 3.43Å; R97-Y379 WeakPolarHBondContact O-CA 3.24Å; R97-Y379 WeakPolarHBondContact O-CB 3.35Å; R97-N380 PolarHBondContact N-O 3.23Å; R97-N380 PolarHBondContact O-N 3.32Å; R97-N380 VanDerWaalsContact O-N 3.13Å; R97-V382 HydrophobicContact CB-CG2 3.74Å
98	E	97	Very high	97.3	Very high	51 Å²	51	50.4 Å²	50.4	24%	0.238	27%	0.269	C	S	.	.			trans	-59	159.1	163.5	73.5	-175.3	157.6	0	0	112	T86 H87 N100 Y379	T86-E98 VanDerWaalsContact CA-OE1 3.22Å; T86-E98 WeakPolarHBondContact CA-OE1 3.24Å; T86-E98 HydrophobicContact CG2-CG 4.09Å; H87-E98 PolarHBondContact N-OE1 3.32Å; H87-E98 PolarHBondContact O-N 2.88Å; H87-E98 VanDerWaalsContact O-N 3.12Å; E98-N100 PolarHBondContact O-N 3.5Å; E98-Y379 HydrophobicContact CB-CD1 4.15Å; E98-Y379 HydrophobicContact CB-CE1 3.55Å; E98-Y379 HydrophobicContact CB-CE2 4.13Å
99	Q	94	Very high	97.3	Very high	122 Å²	122	50.4 Å²	50.4	57%	0.57	27%	0.269	S	S	*	.	S	Bend	trans	-64.6	-42.8	-174.2	-64	-177.8	-5	0	0	111.8	R97	R97-Q99 PolarHBondContact NH2-O 3.06Å
100	N	93.4	Very high	97.3	Very high	128 Å²	128	50.3 Å²	50.3	68%	0.684	27%	0.268	S	S	*	.			trans	-81.6	124	-172	-68.6	-22.1	0	0	0	111.8	E98	E98-N100 PolarHBondContact O-N 3.5Å
101	C	95.4	Very high	97.3	Very high	19 Å²	19	51.4 Å²	51.4	13%	0.128	27%	0.273	C	S	.	.			trans	-131.7	118.2	161.9	171.4	0	0	0	0	108.3	F103 C107	C101-F103 PolarHBondContact O-N 3.05Å; C101-F103 PolarHBondContact SG-O 2.92Å; C101-C107 HydrophobicContact CB-CB 3.95Å; C101-C107 WeakPolarHBondContact CB-SG 3.39Å; C101-C107 WeakPolarHBondContact SG-CB 3.36Å; C101-C107 CovalentContact SG-SG 2.02Å; C101-C107 PolarHBondContact SG-SG 3.29Å
102	M	94.4	Very high	97.3	Very high	109 Å²	109	51.7 Å²	51.7	54%	0.537	27%	0.274	S	S	.	.	S	Bend	trans	-62.1	-30.9	-177.7	178.8	169.3	-72.5	0	0	112.7	R131	M102-R131 PolarHBondContact SD-NH1 2.97Å
103	F	97.1	Very high	97.4	Very high	76 Å²	76	45.4 Å²	45.4	33%	0.333	24%	0.241	S	C	.	.	S	Bend	trans	-125.7	83.8	179.1	-63.9	-73.9	0	0	0	110.3	C101 A105 R106 C107 V130 R131	C101-F103 PolarHBondContact O-N 3.05Å; C101-F103 PolarHBondContact SG-O 2.92Å; F103-A105 VanDerWaalsContact C-N 3.33Å; F103-A105 PolarHBondContact O-N 3.18Å; F103-R106 HydrophobicContact CB-CB 3.84Å; F103-R106 VanDerWaalsContact CB-CD 3.47Å; F103-R106 HydrophobicContact CB-CG 3.65Å; F103-R106 HydrophobicContact CG-CG 4.41Å; F103-R106 WeakPolarHBondContact O-CA 3.42Å; F103-R106 WeakPolarHBondContact O-CB 3.49Å; F103-R106 PolarHBondContact O-N 2.95Å; F103-C107 PolarHBondContact O-N 3.09Å; F103-C107 VanDerWaalsContact O-N 3.08Å; F103-V130 HydrophobicContact CB-CG2 4.33Å; F103-V130 HydrophobicContact CD2-CG2 4.29Å; F103-R131 HydrophobicContact CE2-CG 4.17Å
104	P	97.2	Very high	97.4	Very high	91 Å²	91	44 Å²	44	59%	0.591	23%	0.226	S	C	*	.	H	α-helix	trans	-54.6	-41.7	-170.7	-29.7	36.3	0	0	0	114.8	R106 C107 S108	P104-R106 VanDerWaalsContact C-N 3.31Å; P104-R106 PolarHBondContact O-N 3.29Å; P104-C107 PolarHBondContact O-N 2.95Å; P104-S108 PolarHBondContact O-N 2.94Å
105	A	97.3	Very high	97.5	Very high	45 Å²	45	40.3 Å²	40.3	37%	0.372	21%	0.211	S	C	.	.	H	α-helix	trans	-65.5	-33.3	177.3	0	0	0	0	0	112.5	F103 S108 G109	F103-A105 VanDerWaalsContact C-N 3.33Å; F103-A105 PolarHBondContact O-N 3.18Å; A105-S108 WeakPolarHBondContact O-CB 3.36Å; A105-S108 PolarHBondContact O-N 3.16Å; A105-G109 PolarHBondContact O-N 2.72Å
106	R	98.5	Very high	97.4	Very high	33 Å²	33	44.5 Å²	44.5	13%	0.125	23%	0.23	C	C	.	.	H	α-helix	trans	-69.9	-42.5	175.8	-58.6	-175	180	-166.8	-2.4	111.3	F103 P104 S108 G109 V110 V130 D132 W163 G168	F103-R106 HydrophobicContact CB-CB 3.84Å; F103-R106 VanDerWaalsContact CB-CD 3.47Å; F103-R106 HydrophobicContact CB-CG 3.65Å; F103-R106 HydrophobicContact CG-CG 4.41Å; F103-R106 WeakPolarHBondContact O-CA 3.42Å; F103-R106 WeakPolarHBondContact O-CB 3.49Å; F103-R106 PolarHBondContact O-N 2.95Å; P104-R106 VanDerWaalsContact C-N 3.31Å; P104-R106 PolarHBondContact O-N 3.29Å; R106-S108 VanDerWaalsContact C-N 3.33Å; R106-S108 PolarHBondContact O-N 3.47Å; R106-G109 PolarHBondContact O-N 3.33Å; R106-V110 PolarHBondContact O-N 2.96Å; R106-V130 HydrophobicContact CB-CB 3.96Å; R106-V130 HydrophobicContact CB-CG1 4.33Å; R106-V130 WeakPolarHBondContact CD-O 3.46Å; R106-V130 PolarHBondContact NH1-O 3.41Å; R106-D132 IonicContact CZ-OD1 2.67Å; R106-D132 IonicContact NH1-OD1 2.73Å; R106-D132 PolarHBondContact NH1-OD1 3.27Å; R106-D132 IonicContact NH2-OD1 3.28Å; R106-D132 PolarHBondContact NH2-OD1 3.41Å; R106-W163 HydrophobicContact CB-CB 4.14Å; R106-W163 HydrophobicContact CB-CD2 3.69Å; R106-W163 HydrophobicContact CB-CE3 4.11Å; R106-W163 HydrophobicContact CB-CG 3.67Å; R106-W163 VanDerWaalsContact CD-CZ2 3.49Å; R106-W163 HydrophobicContact CG-CD2 3.78Å; R106-W163 HydrophobicContact CG-CG 3.81Å; R106-W163 HydrophobicContact CG-CZ2 4.3Å; R106-W163 VanDerWaalsContact CZ-CZ2 3.48Å; R106-W163 WeakPolarHBondContact O-CB 3.44Å; R106-G168 WeakPolarHBondContact CG-O 3.41Å
107	C	98.5	Very high	97.3	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.8	-44.1	171.7	-72.2	0	0	0	0	111.3	Y88 C101 F103 P104 G109 V110 E111	Y88-C107 WeakPolarHBondContact OH-CB 3.43Å; Y88-C107 PolarHBondContact OH-SG 3.37Å; Y88-C107 VanDerWaalsContact OH-SG 3.39Å; C101-C107 HydrophobicContact CB-CB 3.95Å; C101-C107 WeakPolarHBondContact CB-SG 3.39Å; C101-C107 WeakPolarHBondContact SG-CB 3.36Å; C101-C107 CovalentContact SG-SG 2.02Å; C101-C107 PolarHBondContact SG-SG 3.29Å; F103-C107 PolarHBondContact O-N 3.09Å; F103-C107 VanDerWaalsContact O-N 3.08Å; P104-C107 PolarHBondContact O-N 2.95Å; C107-G109 VanDerWaalsContact C-N 3.32Å; C107-G109 PolarHBondContact O-N 3.41Å; C107-V110 PolarHBondContact O-N 2.94Å; C107-V110 VanDerWaalsContact O-N 3.12Å; C107-E111 WeakPolarHBondContact O-CB 3.32Å; C107-E111 WeakPolarHBondContact O-CG 3.37Å; C107-E111 PolarHBondContact O-N 2.98Å
108	S	98.2	Very high	97.3	Very high	39 Å²	39	42.3 Å²	42.3	27%	0.273	22%	0.224	S	C	.	.	H	α-helix	trans	-57.3	-43.4	175.3	-168.1	0	0	0	0	112.4	P104 A105 R106 V110 E111 H112 E167	P104-S108 PolarHBondContact O-N 2.94Å; A105-S108 WeakPolarHBondContact O-CB 3.36Å; A105-S108 PolarHBondContact O-N 3.16Å; R106-S108 VanDerWaalsContact C-N 3.33Å; R106-S108 PolarHBondContact O-N 3.47Å; S108-V110 PolarHBondContact O-N 3.38Å; S108-E111 PolarHBondContact O-N 3Å; S108-H112 PolarHBondContact O-N 3.02Å; S108-E167 VanDerWaalsContact CB-OE1 3.25Å; S108-E167 WeakPolarHBondContact CB-OE1 3.19Å; S108-E167 PolarHBondContact OG-OE1 2.88Å
109	G	98.4	Very high	97.3	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.6	-36.6	175.2	0	0	0	0	0	114.1	A105 R106 C107 F113	A105-G109 PolarHBondContact O-N 2.72Å; R106-G109 PolarHBondContact O-N 3.33Å; C107-G109 VanDerWaalsContact C-N 3.32Å; C107-G109 PolarHBondContact O-N 3.41Å; G109-F113 WeakPolarHBondContact O-CD2 3.05Å
110	V	98.8	Very high	97.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-68.2	-49.1	172.1	168.7	0	0	0	0	110.8	R106 C107 S108 H112 F113 I114 V128 V130 Y160 W163 W358	R106-V110 PolarHBondContact O-N 2.96Å; C107-V110 PolarHBondContact O-N 2.94Å; C107-V110 VanDerWaalsContact O-N 3.12Å; S108-V110 PolarHBondContact O-N 3.38Å; V110-H112 PolarHBondContact O-N 3.44Å; V110-F113 PolarHBondContact O-N 2.88Å; V110-I114 HydrophobicContact CG1-CD1 3.6Å; V110-I114 HydrophobicContact CG1-CG1 4.3Å; V110-I114 WeakPolarHBondContact O-CG1 3.45Å; V110-I114 PolarHBondContact O-N 3.35Å; V110-V128 HydrophobicContact CG1-CG1 4.27Å; V110-V128 HydrophobicContact CG2-CG1 4.32Å; V110-V130 HydrophobicContact CG2-CG1 4.28Å; V110-Y160 HydrophobicContact CG2-CE2 3.8Å; V110-W163 HydrophobicContact CG2-CB 4.29Å; V110-W358 HydrophobicContact CG1-CH2 3.87Å; V110-W358 HydrophobicContact CG1-CZ2 4.07Å; V110-W358 HydrophobicContact CG2-CZ2 4.33Å
111	E	98.7	Very high	97.7	Very high	22 Å²	22	42.3 Å²	42.3	10%	0.103	22%	0.223	C	C	.	.	H	α-helix	trans	-58.4	-36.4	-178.8	-70.9	161.2	-171.1	0	0	111.7	Y88 L95 R97 C107 S108 F113 I114 L115 V382	Y88-E111 HydrophobicContact CE1-CG 3.72Å; Y88-E111 PolarHBondContact OH-OE1 3.25Å; L95-E111 HydrophobicContact CD2-CB 4.38Å; L95-E111 HydrophobicContact CD2-CG 4.16Å; R97-E111 WeakPolarHBondContact CD-OE1 3.28Å; R97-E111 IonicContact CZ-OE1 3.56Å; R97-E111 IonicContact NE-OE1 2.84Å; R97-E111 IonicContact NH1-OE1 3.35Å; R97-E111 PolarHBondContact NH1-OE1 3.43Å; C107-E111 WeakPolarHBondContact O-CB 3.32Å; C107-E111 WeakPolarHBondContact O-CG 3.37Å; C107-E111 PolarHBondContact O-N 2.98Å; S108-E111 PolarHBondContact O-N 3Å; E111-F113 PolarHBondContact O-N 3.04Å; E111-I114 PolarHBondContact O-N 3.1Å; E111-L115 VanDerWaalsContact O-CB 3.3Å; E111-L115 WeakPolarHBondContact O-CB 3.29Å; E111-L115 VanDerWaalsContact O-CG 3.22Å; E111-L115 WeakPolarHBondContact O-CG 3.34Å; E111-L115 PolarHBondContact O-N 3.49Å; E111-V382 HydrophobicContact CB-CG1 4.09Å; E111-V382 HydrophobicContact CG-CG1 3.86Å; E111-V382 WeakPolarHBondContact OE2-CG1 3.47Å
112	H	98.4	Very high	97.8	Very high	23 Å²	23	43.7 Å²	43.7	11%	0.106	23%	0.232	C	C	.	.	H	α-helix	trans	-51.8	-52.8	174.6	174.9	88.1	0	0	0	112.3	S108 V110 Q116 W166	S108-H112 PolarHBondContact O-N 3.02Å; V110-H112 PolarHBondContact O-N 3.44Å; H112-Q116 PolarHBondContact CE1-NE2 2.85Å; H112-Q116 VanDerWaalsContact CE1-NE2 3.32Å; H112-Q116 PolarHBondContact NE2-NE2 3Å; H112-Q116 WeakPolarHBondContact O-CG 3.3Å; H112-Q116 PolarHBondContact O-N 2.89Å; H112-Q116 VanDerWaalsContact O-N 3.14Å; H112-W166 HydrophobicContact CB-CB 4.31Å; H112-W166 HydrophobicContact CB-CG 3.89Å; H112-W166 AromaticContact CD2-CD2 3.69Å; H112-W166 AromaticContact CD2-CE3 3.99Å; H112-W166 AromaticContact CD2-CG 3.63Å; H112-W166 AromaticContact CE1-CD2 3.3Å; H112-W166 AromaticContact CE1-CE2 3.3Å; H112-W166 AromaticContact CE1-CE3 3.44Å; H112-W166 VanDerWaalsContact CE1-CE3 3.44Å; H112-W166 AromaticContact CE1-CG 3.98Å; H112-W166 AromaticContact CE1-CH2 3.59Å; H112-W166 AromaticContact CE1-CZ2 3.46Å; H112-W166 VanDerWaalsContact CE1-CZ2 3.46Å; H112-W166 WeakPolarHBondContact CE1-CZ2 3.08Å; H112-W166 AromaticContact CE1-CZ3 3.58Å; H112-W166 AromaticContact CE1-NE1 3.92Å; H112-W166 AromaticContact CG-CD1 3.53Å; H112-W166 AromaticContact CG-CD2 3.69Å; H112-W166 AromaticContact CG-CE2 3.87Å; H112-W166 AromaticContact CG-CG 3.5Å; H112-W166 VanDerWaalsContact CG-CG 3.5Å; H112-W166 AromaticContact CG-NE1 3.76Å; H112-W166 AromaticContact ND1-CD1 3.65Å; H112-W166 AromaticContact ND1-CD2 3.47Å; H112-W166 AromaticContact ND1-CE2 3.24Å; H112-W166 AromaticContact ND1-CG 3.74Å; H112-W166 AromaticContact ND1-CZ2 3.7Å; H112-W166 AromaticContact ND1-NE1 3.37Å; H112-W166 PolarHBondContact ND1-NE1 2.8Å; H112-W166 AromaticContact NE2-CD2 3.44Å; H112-W166 AromaticContact NE2-CE2 3.95Å; H112-W166 AromaticContact NE2-CE3 3.34Å; H112-W166 VanDerWaalsContact NE2-CE3 3.34Å; H112-W166 AromaticContact NE2-CG 3.92Å; H112-W166 AromaticContact NE2-CZ3 3.77Å
113	F	98.4	Very high	98	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-72.2	-38.2	-177.2	-66.2	-68.5	0	0	0	112.3	G109 V110 E111 Q116 V117 F165 W166 M351 V354 W358	G109-F113 WeakPolarHBondContact O-CD2 3.05Å; V110-F113 PolarHBondContact O-N 2.88Å; E111-F113 PolarHBondContact O-N 3.04Å; F113-Q116 PolarHBondContact O-N 3.12Å; F113-V117 PolarHBondContact O-N 3.27Å; F113-F165 HydrophobicContact CE2-CB 3.81Å; F113-F165 HydrophobicContact CZ-CB 3.51Å; F113-W166 HydrophobicContact CE2-CB 3.83Å; F113-W166 HydrophobicContact CZ-CB 3.94Å; F113-M351 HydrophobicContact CE1-CE 3.56Å; F113-M351 HydrophobicContact CZ-CE 3.71Å; F113-V354 HydrophobicContact CD1-CG1 3.87Å; F113-V354 HydrophobicContact CD2-CG1 4.47Å; F113-V354 HydrophobicContact CE1-CB 4.32Å; F113-V354 HydrophobicContact CE1-CG1 3.47Å; F113-V354 VanDerWaalsContact CE1-CG1 3.47Å; F113-V354 HydrophobicContact CE2-CG1 4.15Å; F113-V354 HydrophobicContact CG-CG1 4.36Å; F113-V354 HydrophobicContact CZ-CG1 3.64Å; F113-W358 HydrophobicContact CB-CB 4.43Å; F113-W358 HydrophobicContact CB-CD2 4.47Å; F113-W358 HydrophobicContact CB-CG 3.89Å; F113-W358 AromaticContact CD2-NE1 3.75Å; F113-W358 AromaticContact CG-CD1 3.68Å; F113-W358 AromaticContact CG-NE1 3.82Å
114	I	98.6	Very high	98.1	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61	-49.5	176.8	-61.9	172.6	0	0	0	110	I90 L95 V110 E111 Q116 V117 I118 L121 M126 L362	I90-I114 HydrophobicContact CD1-CG2 3.58Å; I90-I114 HydrophobicContact CG1-CG2 4.4Å; L95-I114 HydrophobicContact CD1-CG2 3.97Å; L95-I114 HydrophobicContact CD2-CB 4.21Å; L95-I114 HydrophobicContact CD2-CG2 3.94Å; L95-I114 HydrophobicContact CG-CG2 4.48Å; V110-I114 HydrophobicContact CG1-CD1 3.6Å; V110-I114 HydrophobicContact CG1-CG1 4.3Å; V110-I114 WeakPolarHBondContact O-CG1 3.45Å; V110-I114 PolarHBondContact O-N 3.35Å; E111-I114 PolarHBondContact O-N 3.1Å; I114-Q116 VanDerWaalsContact C-N 3.27Å; I114-Q116 PolarHBondContact O-N 3.21Å; I114-V117 PolarHBondContact O-N 3.34Å; I114-I118 WeakPolarHBondContact O-CA 3.03Å; I114-I118 WeakPolarHBondContact O-CB 3.46Å; I114-I118 PolarHBondContact O-N 3.22Å; I114-L121 HydrophobicContact CG2-CD1 4.41Å; I114-M126 HydrophobicContact CD1-CE 3.53Å; I114-M126 HydrophobicContact CG1-CE 4.45Å; I114-L362 HydrophobicContact CG1-CD1 3.97Å; I114-L362 HydrophobicContact CG2-CD1 4.26Å
115	L	98.4	Very high	98.1	Very high	21 Å²	21	34.1 Å²	34.1	11%	0.11	18%	0.181	C	C	.	.	H	α-helix	trans	-64.2	-30.7	-179	-70.4	170.3	0	0	0	112.7	L95 E111 V117 I118 V382 H384	L95-L115 HydrophobicContact CB-CD2 3.99Å; L95-L115 HydrophobicContact CD2-CD2 4.16Å; L95-L115 HydrophobicContact CD2-CG 4.12Å; E111-L115 VanDerWaalsContact O-CB 3.3Å; E111-L115 WeakPolarHBondContact O-CB 3.29Å; E111-L115 VanDerWaalsContact O-CG 3.22Å; E111-L115 WeakPolarHBondContact O-CG 3.34Å; E111-L115 PolarHBondContact O-N 3.49Å; L115-V117 VanDerWaalsContact C-N 3.29Å; L115-V117 PolarHBondContact O-N 2.92Å; L115-I118 HydrophobicContact CD2-CD1 4.16Å; L115-I118 VanDerWaalsContact O-CG2 3.31Å; L115-I118 WeakPolarHBondContact O-CG2 3.36Å; L115-V382 HydrophobicContact CD1-CG1 4.25Å; L115-H384 WeakPolarHBondContact CB-NE2 3.3Å
116	Q	97.1	Very high	98.2	Very high	89 Å²	89	32 Å²	32	42%	0.416	16%	0.163	S	C	.	.	H	α-helix	trans	-64	-30.8	175.7	-82.5	176.8	-25.8	0	0	114	H112 F113 I114 S355	H112-Q116 PolarHBondContact CE1-NE2 2.85Å; H112-Q116 VanDerWaalsContact CE1-NE2 3.32Å; H112-Q116 PolarHBondContact NE2-NE2 3Å; H112-Q116 WeakPolarHBondContact O-CG 3.3Å; H112-Q116 PolarHBondContact O-N 2.89Å; H112-Q116 VanDerWaalsContact O-N 3.14Å; F113-Q116 PolarHBondContact O-N 3.12Å; I114-Q116 VanDerWaalsContact C-N 3.27Å; I114-Q116 PolarHBondContact O-N 3.21Å; Q116-S355 PolarHBondContact OE1-OG 2.94Å
117	V	97.4	Very high	98.2	Very high	8 Å²	8	30.5 Å²	30.5	5%	0.048	16%	0.158	C	C	.	.	H	α-helix	trans	-112.6	1.9	-175.5	-56.8	0	0	0	0	112.9	F113 I114 L115 D119 K120 L121 E359	F113-V117 PolarHBondContact O-N 3.27Å; I114-V117 PolarHBondContact O-N 3.34Å; L115-V117 VanDerWaalsContact C-N 3.29Å; L115-V117 PolarHBondContact O-N 2.92Å; V117-D119 VanDerWaalsContact C-N 3.25Å; V117-D119 PolarHBondContact O-N 2.89Å; V117-D119 VanDerWaalsContact O-N 3.13Å; V117-K120 PolarHBondContact O-N 2.99Å; V117-L121 HydrophobicContact CG2-CD1 4.02Å; V117-L121 HydrophobicContact CG2-CD2 4.32Å; V117-L121 HydrophobicContact CG2-CG 4.22Å; V117-E359 HydrophobicContact CB-CB 4.08Å; V117-E359 HydrophobicContact CB-CG 4.27Å; V117-E359 HydrophobicContact CG1-CB 4.09Å; V117-E359 HydrophobicContact CG2-CB 4.17Å
118	I	98.1	Very high	98.2	Very high	13 Å²	13	30.5 Å²	30.5	7%	0.067	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-57.6	-33.5	-167.8	-162.5	166.4	0	0	0	114.2	I90 G93 L95 I114 L115 K120 L121	I90-I118 HydrophobicContact CG2-CD1 4.23Å; I90-I118 HydrophobicContact CG2-CG1 3.92Å; G93-I118 WeakPolarHBondContact O-CD1 3.44Å; L95-I118 HydrophobicContact CB-CD1 3.74Å; L95-I118 VanDerWaalsContact N-CD1 3.35Å; I114-I118 WeakPolarHBondContact O-CA 3.03Å; I114-I118 WeakPolarHBondContact O-CB 3.46Å; I114-I118 PolarHBondContact O-N 3.22Å; L115-I118 HydrophobicContact CD2-CD1 4.16Å; L115-I118 VanDerWaalsContact O-CG2 3.31Å; L115-I118 WeakPolarHBondContact O-CG2 3.36Å; I118-K120 PolarHBondContact O-N 3Å; I118-K120 VanDerWaalsContact O-N 3.16Å; I118-L121 PolarHBondContact O-N 3.06Å; I118-L121 VanDerWaalsContact O-N 3.13Å
119	D	97.1	Very high	98.2	Very high	150 Å²	150	28.7 Å²	28.7	80%	0.802	15%	0.145	S	C	*	.	G	3₁₀ helix	trans	-67.1	-15.5	-179.2	-64.6	-32.3	0	0	0	113.2	V117	V117-D119 VanDerWaalsContact C-N 3.25Å; V117-D119 PolarHBondContact O-N 2.89Å; V117-D119 VanDerWaalsContact O-N 3.13Å
120	K	97	Very high	98.2	Very high	133 Å²	133	28.9 Å²	28.9	58%	0.578	15%	0.146	S	C	*	.	G	3₁₀ helix	trans	-102.6	-8.9	178.4	-54.4	177.1	-170.7	173.9	0	112.9	V117 I118 E359	V117-K120 PolarHBondContact O-N 2.99Å; I118-K120 PolarHBondContact O-N 3Å; I118-K120 VanDerWaalsContact O-N 3.16Å; K120-E359 VanDerWaalsContact CD-CD 3.4Å; K120-E359 HydrophobicContact CD-CG 4.37Å; K120-E359 VanDerWaalsContact CD-OE1 3.3Å; K120-E359 WeakPolarHBondContact CD-OE1 3.48Å; K120-E359 VanDerWaalsContact CD-OE2 3.29Å; K120-E359 WeakPolarHBondContact CD-OE2 3.32Å; K120-E359 IonicContact NZ-OE1 2.74Å; K120-E359 IonicContact NZ-OE2 3.72Å; K120-E359 PolarHBondContact NZ-OE2 2.93Å
121	L	98.1	Very high	98.2	Very high	17 Å²	17	33.6 Å²	33.6	9%	0.089	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-85.1	145	-173.7	-64.2	-177	0	0	0	111.3	I90 I114 V117 I118 L362	I90-L121 HydrophobicContact CD1-CB 4.48Å; I90-L121 HydrophobicContact CD1-CD1 3.45Å; I90-L121 VanDerWaalsContact CD1-CD1 3.45Å; I114-L121 HydrophobicContact CG2-CD1 4.41Å; V117-L121 HydrophobicContact CG2-CD1 4.02Å; V117-L121 HydrophobicContact CG2-CD2 4.32Å; V117-L121 HydrophobicContact CG2-CG 4.22Å; I118-L121 PolarHBondContact O-N 3.06Å; I118-L121 VanDerWaalsContact O-N 3.13Å; L121-L362 HydrophobicContact CD1-CB 3.98Å; L121-L362 HydrophobicContact CD1-CD1 3.61Å; L121-L362 HydrophobicContact CD1-CG 4.46Å; L121-L362 HydrophobicContact CD2-CB 3.75Å; L121-L362 HydrophobicContact CG-CB 4.49Å
122	P	97.8	Very high	98.2	Very high	48 Å²	48	35.1 Å²	35.1	31%	0.312	17%	0.173	S	C	.	.	P	Polyproline II helix	trans	-69.6	173	167.5	33.5	-35.9	0	0	0	110.5	V124	P122-V124 PolarHBondContact O-N 3.16Å
123	D	98.5	Very high	98.2	Very high	66 Å²	66	38.5 Å²	38.5	35%	0.353	19%	0.185	S	C	.	.	S	Bend	trans	-61.9	125.1	163	-75.1	3	0	0	0	109	I90 I91 N92	I90-D123 CarbonylContact O-C 3.57Å; I90-D123 WeakPolarHBondContact O-CA 3.27Å; I91-D123 WeakPolarHBondContact CA-OD1 3.46Å; N92-D123 PolarHBondContact N-OD1 2.82Å
124	V	98.6	Very high	98.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	146.5	-175.5	60	0	0	0	0	111.1	Q89 I90 P122 M126 F365 L369	Q89-V124 CarbonylContact C-O 3.57Å; Q89-V124 WeakPolarHBondContact CA-O 3.15Å; I90-V124 HydrophobicContact CB-CG1 3.89Å; I90-V124 HydrophobicContact CD1-CG1 3.8Å; I90-V124 HydrophobicContact CG1-CG1 4.08Å; I90-V124 PolarHBondContact N-O 3.19Å; I90-V124 PolarHBondContact O-N 3.43Å; P122-V124 PolarHBondContact O-N 3.16Å; V124-M126 HydrophobicContact CG1-SD 4.44Å; V124-F365 HydrophobicContact CG2-CD1 3.88Å; V124-F365 HydrophobicContact CG2-CE1 4.41Å; V124-L369 HydrophobicContact CB-CD1 4.45Å; V124-L369 HydrophobicContact CG2-CD1 4.08Å
125	E	98.8	Very high	98.2	Very high	10 Å²	10	40.6 Å²	40.6	5%	0.047	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	139	170.9	73	-178	89.8	0	0	109.9	M76 H87 Y88 Q89 F365 L369 Y371 L373	M76-E125 HydrophobicContact CE-CG 4.16Å; M76-E125 WeakPolarHBondContact CE-O 3.25Å; M76-E125 HydrophobicContact CG-CG 4.07Å; M76-E125 HydrophobicContact SD-CG 4.47Å; H87-E125 IonicContact CE1-OE2 3.7Å; H87-E125 PolarHBondContact CE1-OE2 3.06Å; H87-E125 IonicContact NE2-OE2 3.58Å; H87-E125 PolarHBondContact NE2-OE2 2.81Å; H87-E125 VanDerWaalsContact NE2-OE2 3.08Å; Y88-E125 CarbonylContact O-C 3.31Å; Y88-E125 VanDerWaalsContact O-CA 3.24Å; Y88-E125 WeakPolarHBondContact O-CA 3.49Å; Y88-E125 WeakPolarHBondContact O-CB 3.5Å; Q89-E125 HydrophobicContact CB-CB 4.4Å; Q89-E125 HydrophobicContact CG-CB 3.88Å; E125-F365 WeakPolarHBondContact O-CE1 3.32Å; E125-L369 HydrophobicContact CG-CD1 4.46Å; E125-Y371 VanDerWaalsContact CG-OH 3.24Å; E125-Y371 WeakPolarHBondContact CG-OH 3.38Å; E125-Y371 WeakPolarHBondContact OE1-CE2 3.28Å; E125-Y371 PolarHBondContact OE1-OH 2.8Å; E125-L373 HydrophobicContact CB-CD2 3.72Å; E125-L373 HydrophobicContact CG-CD2 4.08Å; E125-L373 HydrophobicContact CG-CG 4.46Å
126	M	98.6	Very high	98.2	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	148.4	-173.5	64.9	-84.4	-172.3	0	0	112.8	H87 Y88 I90 I114 V124 V128 L362 F365	H87-M126 PolarHBondContact CD2-O 2.98Å; Y88-M126 HydrophobicContact CG-CE 4.3Å; Y88-M126 PolarHBondContact N-O 3.33Å; Y88-M126 PolarHBondContact O-N 3.44Å; I90-M126 HydrophobicContact CD1-CE 4.31Å; I114-M126 HydrophobicContact CD1-CE 3.53Å; I114-M126 HydrophobicContact CG1-CE 4.45Å; V124-M126 HydrophobicContact CG1-SD 4.44Å; M126-V128 HydrophobicContact CG-CG2 3.83Å; M126-L362 HydrophobicContact CE-CD1 4.23Å; M126-L362 HydrophobicContact CE-CD2 3.96Å; M126-L362 HydrophobicContact CG-CD2 4.28Å; M126-L362 HydrophobicContact SD-CD2 3.96Å; M126-F365 HydrophobicContact CB-CD1 4.38Å; M126-F365 HydrophobicContact CB-CE1 3.96Å
127	V	98.8	Very high	98.3	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.012	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	110.2	173.3	-179.3	0	0	0	0	109.2	M76 T79 L80 L147	M76-V127 HydrophobicContact SD-CG2 4.03Å; T79-V127 HydrophobicContact CG2-CB 4.03Å; T79-V127 HydrophobicContact CG2-CG1 4.35Å; T79-V127 HydrophobicContact CG2-CG2 3.8Å; L80-V127 HydrophobicContact CD2-CG2 3.53Å; L80-V127 HydrophobicContact CG-CG2 4.32Å; V127-L147 PolarHBondContact O-N 2.85Å
128	V	98.8	Very high	98.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	108.3	-178.4	-173.7	0	0	0	0	110.1	T86 Y88 V110 M126 V130 L147 Y160	T86-V128 PolarHBondContact N-O 2.78Å; T86-V128 PolarHBondContact O-N 3.19Å; Y88-V128 HydrophobicContact CD2-CB 4.17Å; Y88-V128 HydrophobicContact CD2-CG2 3.86Å; Y88-V128 HydrophobicContact CE2-CB 4.06Å; Y88-V128 HydrophobicContact CE2-CG2 4.17Å; V110-V128 HydrophobicContact CG1-CG1 4.27Å; V110-V128 HydrophobicContact CG2-CG1 4.32Å; M126-V128 HydrophobicContact CG-CG2 3.83Å; V128-V130 HydrophobicContact CG1-CG1 4.25Å; V128-V130 PolarHBondContact O-N 2.76Å; V128-L147 HydrophobicContact CG2-CB 4.41Å; V128-L147 HydrophobicContact CG2-CD2 4.36Å; V128-Y160 HydrophobicContact CG1-CD1 4.4Å; V128-Y160 HydrophobicContact CG1-CE1 3.7Å; V128-Y160 HydrophobicContact CG1-CE2 4.44Å
129	N	98.8	Very high	98.1	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	116.6	170.1	172	35.1	0	0	0	110.2	V84 R131 Y133 Q135 V146 L147 S148 Y160	V84-N129 PolarHBondContact O-OD1 2.9Å; N129-R131 WeakPolarHBondContact OD1-CB 3.29Å; N129-R131 WeakPolarHBondContact OD1-CG 3.37Å; N129-R131 PolarHBondContact OD1-N 3.06Å; N129-Y133 PolarHBondContact ND2-O 2.83Å; N129-Q135 HydrophobicContact CB-CG 4.14Å; N129-Q135 WeakPolarHBondContact ND2-CG 3.36Å; N129-V146 HydrophobicContact CB-CG1 3.85Å; N129-L147 WeakPolarHBondContact CA-O 3.13Å; N129-L147 WeakPolarHBondContact CB-O 3.37Å; N129-L147 PolarHBondContact N-O 3.09Å; N129-S148 WeakPolarHBondContact CB-OG 3.3Å; N129-S148 PolarHBondContact ND2-OG 3.2Å; N129-Y160 WeakPolarHBondContact O-CE1 3.32Å; N129-Y160 PolarHBondContact O-OH 3.44Å
130	V	98.5	Very high	98	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.024	19%	0.189	C	C	.	.			trans	-101.7	10.4	175.2	-63.8	0	0	0	0	113.2	F103 R106 V110 V128 W163	F103-V130 HydrophobicContact CB-CG2 4.33Å; F103-V130 HydrophobicContact CD2-CG2 4.29Å; R106-V130 HydrophobicContact CB-CB 3.96Å; R106-V130 HydrophobicContact CB-CG1 4.33Å; R106-V130 WeakPolarHBondContact CD-O 3.46Å; R106-V130 PolarHBondContact NH1-O 3.41Å; V110-V130 HydrophobicContact CG2-CG1 4.28Å; V128-V130 HydrophobicContact CG1-CG1 4.25Å; V128-V130 PolarHBondContact O-N 2.76Å; V130-W163 HydrophobicContact CB-CE3 4.27Å; V130-W163 HydrophobicContact CB-CZ3 4.15Å; V130-W163 HydrophobicContact CG1-CE3 4.31Å; V130-W163 WeakPolarHBondContact O-CH2 3.28Å
131	R	98.5	Very high	97.8	Very high	99 Å²	99	40.1 Å²	40.1	37%	0.374	19%	0.192	S	C	.	.	S	Bend	trans	-80.7	169.7	170.4	-54.9	172.1	177.1	-98.2	6	110	M102 F103 N129	M102-R131 PolarHBondContact SD-NH1 2.97Å; F103-R131 HydrophobicContact CE2-CG 4.17Å; N129-R131 WeakPolarHBondContact OD1-CB 3.29Å; N129-R131 WeakPolarHBondContact OD1-CG 3.37Å; N129-R131 PolarHBondContact OD1-N 3.06Å
132	D	98.2	Very high	97.6	Very high	54 Å²	54	42.6 Å²	42.6	29%	0.289	21%	0.21	S	C	.	.	S	Bend	trans	-73	-32.4	-178.6	-72.2	13.8	0	0	0	113.2	R106 F149 V273 A274	R106-D132 IonicContact CZ-OD1 2.67Å; R106-D132 IonicContact NH1-OD1 2.73Å; R106-D132 PolarHBondContact NH1-OD1 3.27Å; R106-D132 IonicContact NH2-OD1 3.28Å; R106-D132 PolarHBondContact NH2-OD1 3.41Å; D132-F149 VanDerWaalsContact O-CE1 3.27Å; D132-F149 WeakPolarHBondContact O-CE1 3.38Å; D132-V273 HydrophobicContact CB-CB 3.98Å; D132-V273 HydrophobicContact CB-CG1 3.66Å; D132-A274 WeakPolarHBondContact O-CB 3.45Å
133	Y	98.6	Very high	97.6	Very high	93 Å²	93	42 Å²	42	37%	0.365	20%	0.203	S	C	.	.	S	Bend	trans	-104.5	142.6	-169.6	-149.1	-100.6	0	0	0	111.8	N129 Q135 Y155 V273 W296	N129-Y133 PolarHBondContact ND2-O 2.83Å; Y133-Q135 PolarHBondContact O-NE2 2.69Å; Y133-Y155 HydrophobicContact CE1-CE1 4.37Å; Y133-Y155 AromaticContact CE1-CZ 3.87Å; Y133-Y155 VanDerWaalsContact CE1-OH 3.25Å; Y133-Y155 WeakPolarHBondContact CE1-OH 3.22Å; Y133-V273 HydrophobicContact CD2-CG1 4.01Å; Y133-W296 AromaticContact CD2-CH2 3.73Å; Y133-W296 HydrophobicContact CD2-CH2 3.73Å; Y133-W296 HydrophobicContact CD2-CZ2 4.37Å; Y133-W296 HydrophobicContact CE1-CH2 4.45Å; Y133-W296 AromaticContact CE2-CH2 3.24Å; Y133-W296 HydrophobicContact CE2-CH2 3.24Å; Y133-W296 AromaticContact CE2-CZ2 3.53Å; Y133-W296 HydrophobicContact CE2-CZ2 3.53Å; Y133-W296 HydrophobicContact CE2-CZ3 4.39Å; Y133-W296 AromaticContact CZ-CH2 3.65Å; Y133-W296 AromaticContact CZ-CZ2 3.93Å
134	P	98.7	Very high	97.6	Very high	4 Å²	4	39.4 Å²	39.4	3%	0.026	19%	0.189	C	C	.	.			trans	-65.5	162.9	176.1	28.7	-37.6	0	0	0	112.6	K151 Y155 D157 W296	P134-K151 HydrophobicContact CB-CB 4.27Å; P134-Y155 HydrophobicContact CB-CD1 3.5Å; P134-Y155 HydrophobicContact CB-CE1 4.03Å; P134-Y155 HydrophobicContact CB-CG 3.79Å; P134-Y155 HydrophobicContact CG-CD1 3.47Å; P134-Y155 VanDerWaalsContact CG-CD1 3.47Å; P134-Y155 HydrophobicContact CG-CD2 3.83Å; P134-Y155 HydrophobicContact CG-CE1 3.61Å; P134-Y155 HydrophobicContact CG-CE2 3.99Å; P134-Y155 HydrophobicContact CG-CG 3.6Å; P134-D157 HydrophobicContact CB-CB 4.33Å; P134-D157 WeakPolarHBondContact CB-OD2 3.36Å; P134-W296 HydrophobicContact CG-CH2 4.16Å; P134-W296 HydrophobicContact CG-CZ3 4.07Å
135	Q	98.5	Very high	97.6	Very high	40 Å²	40	39.4 Å²	39.4	19%	0.187	19%	0.189	C	C	.	.	S	Bend	trans	-124.2	-11.2	-164.4	-59.8	-63.2	-48.8	0	0	114.4	R82 V84 N129 Y133 P137 V146 D157	R82-Q135 PolarHBondContact NH1-O 2.92Å; R82-Q135 VanDerWaalsContact NH1-O 3.16Å; V84-Q135 HydrophobicContact CB-CB 3.82Å; V84-Q135 HydrophobicContact CB-CG 3.79Å; V84-Q135 HydrophobicContact CG1-CB 4.32Å; V84-Q135 HydrophobicContact CG1-CG 4.49Å; V84-Q135 HydrophobicContact CG2-CB 3.96Å; V84-Q135 HydrophobicContact CG2-CG 4.34Å; N129-Q135 HydrophobicContact CB-CG 4.14Å; N129-Q135 WeakPolarHBondContact ND2-CG 3.36Å; Y133-Q135 PolarHBondContact O-NE2 2.69Å; Q135-P137 VanDerWaalsContact C-CD 3.43Å; Q135-P137 VanDerWaalsContact O-CD 3.25Å; Q135-P137 WeakPolarHBondContact O-CD 3.1Å; Q135-V146 HydrophobicContact CB-CG1 4.2Å; Q135-V146 HydrophobicContact CG-CG1 4.47Å; Q135-D157 PolarHBondContact N-OD1 3.32Å; Q135-D157 PolarHBondContact N-OD2 2.79Å; Q135-D157 VanDerWaalsContact N-OD2 3.1Å
136	V	98.4	Very high	97.6	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.187	C	C	.	.			trans	-121.1	77.1	-175.4	-164.7	0	0	0	0	110.2	V140 I143 L144 V146 Y155 Q156 D157	V136-V140 HydrophobicContact CG1-CB 4.34Å; V136-V140 HydrophobicContact CG1-CG1 4.45Å; V136-I143 HydrophobicContact CG1-CG2 4.31Å; V136-L144 HydrophobicContact CG1-CB 4.46Å; V136-L144 HydrophobicContact CG2-CB 4.36Å; V136-L144 WeakPolarHBondContact CG2-O 3.42Å; V136-V146 HydrophobicContact CG2-CB 3.72Å; V136-V146 HydrophobicContact CG2-CG2 3.65Å; V136-Y155 CarbonylContact O-C 3.6Å; V136-Y155 WeakPolarHBondContact O-CA 3.35Å; V136-Q156 HydrophobicContact CB-CB 4.34Å; V136-Q156 HydrophobicContact CG1-CB 3.97Å; V136-Q156 PolarHBondContact O-N 3.41Å; V136-D157 WeakPolarHBondContact CA-OD2 3.33Å; V136-D157 PolarHBondContact N-OD2 3.45Å
137	P	98	Very high	97.6	Very high	20 Å²	20	39 Å²	39	13%	0.13	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-54.2	149	170.7	-24.2	31.6	0	0	0	112.2	Q135 W139 V140 D154 Y155	Q135-P137 VanDerWaalsContact C-CD 3.43Å; Q135-P137 VanDerWaalsContact O-CD 3.25Å; Q135-P137 WeakPolarHBondContact O-CD 3.1Å; P137-W139 HydrophobicContact CB-CD2 4.24Å; P137-W139 HydrophobicContact CB-CG 4.26Å; P137-W139 HydrophobicContact CB-CZ2 4.12Å; P137-W139 HydrophobicContact CG-CZ2 4.01Å; P137-W139 PolarHBondContact O-N 2.79Å; P137-V140 HydrophobicContact CB-CG2 4.39Å; P137-V140 HydrophobicContact CG-CG2 4.46Å; P137-V140 WeakPolarHBondContact O-CB 3.3Å; P137-V140 WeakPolarHBondContact O-CG2 3.14Å; P137-V140 PolarHBondContact O-N 3.38Å; P137-D154 CarbonylContact C-O 3.57Å; P137-Y155 HydrophobicContact CB-CE1 4.28Å; P137-Y155 HydrophobicContact CG-CD1 4.29Å; P137-Y155 HydrophobicContact CG-CE1 3.79Å
138	G	96.6	Very high	97.6	Very high	33 Å²	33	38.9 Å²	38.9	34%	0.34	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-15.3	-174.4	0	0	0	0	0	115.9	D154	G138-D154 PolarHBondContact N-O 3.29Å
139	W	95.4	Very high	97.6	Very high	198 Å²	198	39.1 Å²	39.1	75%	0.75	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-10	175.3	55.6	-100.8	0	0	0	113.9	P137 Q141	P137-W139 HydrophobicContact CB-CD2 4.24Å; P137-W139 HydrophobicContact CB-CG 4.26Å; P137-W139 HydrophobicContact CB-CZ2 4.12Å; P137-W139 HydrophobicContact CG-CZ2 4.01Å; P137-W139 PolarHBondContact O-N 2.79Å; W139-Q141 PolarHBondContact O-N 3.43Å
140	V	94.7	Very high	97.6	Very high	14 Å²	14	39.1 Å²	39.1	9%	0.085	19%	0.188	C	C	.	.			trans	-71.9	127.8	178.4	174.7	0	0	0	0	110.1	V136 P137 L144	V136-V140 HydrophobicContact CG1-CB 4.34Å; V136-V140 HydrophobicContact CG1-CG1 4.45Å; P137-V140 HydrophobicContact CB-CG2 4.39Å; P137-V140 HydrophobicContact CG-CG2 4.46Å; P137-V140 WeakPolarHBondContact O-CB 3.3Å; P137-V140 WeakPolarHBondContact O-CG2 3.14Å; P137-V140 PolarHBondContact O-N 3.38Å; V140-L144 HydrophobicContact CG1-CG 4.36Å
141	Q	93	Very high	97.6	Very high	140 Å²	140	39.8 Å²	39.8	65%	0.654	19%	0.191	S	C	*	.	S	Bend	trans	-134.2	136.6	175.7	-66.1	-62.8	-24.3	0	0	110.7	W139	W139-Q141 PolarHBondContact O-N 3.43Å
142	P	94.9	Very high	97.7	Very high	69 Å²	69	35.4 Å²	35.4	45%	0.448	18%	0.175	S	C	.	.	S	Bend	cis	-63	157.4	-10	30.4	-36	0	0	0	111.5	L75 L144	L75-P142 HydrophobicContact CD1-CB 3.93Å; L75-P142 HydrophobicContact CD1-CG 3.7Å; P142-L144 HydrophobicContact CG-CD2 4.48Å; P142-L144 PolarHBondContact O-N 3.02Å
143	I	97.6	Very high	97.6	Very high	35 Å²	35	37.3 Å²	37.3	18%	0.179	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-66.3	126.1	177.4	-58.6	173.3	0	0	0	108.6	P66 F67 V136 Q156	P66-I143 HydrophobicContact CB-CD1 3.76Å; P66-I143 HydrophobicContact CB-CG2 4.36Å; F67-I143 HydrophobicContact CE1-CB 4.35Å; F67-I143 HydrophobicContact CE1-CG2 3.86Å; F67-I143 WeakPolarHBondContact CE1-O 3.36Å; F67-I143 HydrophobicContact CZ-CG2 3.61Å; V136-I143 HydrophobicContact CG1-CG2 4.31Å; I143-Q156 HydrophobicContact CD1-CG 4.33Å; I143-Q156 HydrophobicContact CG1-CG 4.48Å; I143-Q156 HydrophobicContact CG2-CB 3.57Å; I143-Q156 HydrophobicContact CG2-CG 4.05Å
144	L	98	Very high	97.6	Very high	12 Å²	12	38.2 Å²	38.2	6%	0.063	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-95.4	131.9	-176.2	-56	-177.3	0	0	0	111	L75 D78 T79 R82 V136 V140 P142 V146	L75-L144 HydrophobicContact CD1-CD2 3.75Å; D78-L144 HydrophobicContact CB-CD2 4.32Å; T79-L144 HydrophobicContact CG2-CB 4.21Å; R82-L144 VanDerWaalsContact CD-CD1 3.45Å; V136-L144 HydrophobicContact CG1-CB 4.46Å; V136-L144 HydrophobicContact CG2-CB 4.36Å; V136-L144 WeakPolarHBondContact CG2-O 3.42Å; V140-L144 HydrophobicContact CG1-CG 4.36Å; P142-L144 HydrophobicContact CG-CD2 4.48Å; P142-L144 PolarHBondContact O-N 3.02Å; L144-V146 HydrophobicContact CB-CG2 4.47Å; L144-V146 PolarHBondContact O-N 3.1Å
145	P	98.3	Very high	97.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.215	C	C	.	.			trans	-75.6	87.9	178.7	30.3	-38.4	0	0	0	112.3	F67 V71 M76 T79 F365	F67-P145 HydrophobicContact CD1-CB 4.28Å; F67-P145 HydrophobicContact CE1-CB 3.81Å; F67-P145 HydrophobicContact CE1-CG 4.38Å; F67-P145 HydrophobicContact CZ-CB 4.02Å; V71-P145 HydrophobicContact CG1-CG 3.99Å; V71-P145 HydrophobicContact CG2-CB 4.5Å; V71-P145 HydrophobicContact CG2-CG 4.38Å; M76-P145 HydrophobicContact CE-CG 4.17Å; T79-P145 VanDerWaalsContact OG1-CD 3.32Å; T79-P145 WeakPolarHBondContact OG1-CD 3.22Å; P145-F365 HydrophobicContact CB-CE2 3.69Å; P145-F365 HydrophobicContact CB-CZ 3.68Å; P145-F365 HydrophobicContact CG-CZ 4.36Å
146	V	98.8	Very high	97.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	129.6	174.2	-177.1	0	0	0	0	109.8	T79 V84 N129 Q135 V136 L144 D157 I158	T79-V146 HydrophobicContact CG2-CG2 3.66Å; V84-V146 HydrophobicContact CG2-CG1 4.36Å; V84-V146 HydrophobicContact CG2-CG2 3.79Å; N129-V146 HydrophobicContact CB-CG1 3.85Å; Q135-V146 HydrophobicContact CB-CG1 4.2Å; Q135-V146 HydrophobicContact CG-CG1 4.47Å; V136-V146 HydrophobicContact CG2-CB 3.72Å; V136-V146 HydrophobicContact CG2-CG2 3.65Å; L144-V146 HydrophobicContact CB-CG2 4.47Å; L144-V146 PolarHBondContact O-N 3.1Å; V146-D157 CarbonylContact O-C 3.55Å; V146-D157 WeakPolarHBondContact O-CA 3.24Å; V146-I158 PolarHBondContact O-N 3.35Å
147	L	98.9	Very high	97.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	123.9	174.4	-84.9	66.3	0	0	0	109.4	V127 V128 N129 I158 Y160 W358 L361	V127-L147 PolarHBondContact O-N 2.85Å; V128-L147 HydrophobicContact CG2-CB 4.41Å; V128-L147 HydrophobicContact CG2-CD2 4.36Å; N129-L147 WeakPolarHBondContact CA-O 3.13Å; N129-L147 WeakPolarHBondContact CB-O 3.37Å; N129-L147 PolarHBondContact N-O 3.09Å; L147-I158 CarbonylContact C-O 3.58Å; L147-I158 VanDerWaalsContact CA-O 3.24Å; L147-I158 WeakPolarHBondContact CA-O 3.38Å; L147-I158 HydrophobicContact CD1-CB 4.11Å; L147-I158 HydrophobicContact CD1-CD1 4.01Å; L147-I158 HydrophobicContact CD1-CG2 4.46Å; L147-I158 HydrophobicContact CG-CB 4.16Å; L147-I158 HydrophobicContact CG-CG2 4.31Å; L147-Y160 HydrophobicContact CB-CD1 3.78Å; L147-Y160 HydrophobicContact CB-CE1 4.27Å; L147-Y160 WeakPolarHBondContact O-CE1 3.41Å; L147-W358 HydrophobicContact CD2-CZ3 4.2Å; L147-L361 HydrophobicContact CD2-CD2 3.88Å; L147-L361 HydrophobicContact CD2-CG 4.42Å
148	S	98.9	Very high	97.7	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.007	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	143.6	176	-70.7	0	0	0	0	110.2	N129 S150 D157 I158 M159 Y160	N129-S148 WeakPolarHBondContact CB-OG 3.3Å; N129-S148 PolarHBondContact ND2-OG 3.2Å; S148-S150 PolarHBondContact O-N 3.11Å; S148-D157 WeakPolarHBondContact CB-OD1 3.09Å; S148-D157 PolarHBondContact OG-OD1 2.92Å; S148-I158 PolarHBondContact N-O 3.26Å; S148-M159 VanDerWaalsContact O-CA 3.28Å; S148-M159 WeakPolarHBondContact O-CA 3.16Å; S148-Y160 VanDerWaalsContact C-CD1 3.42Å; S148-Y160 VanDerWaalsContact C-CE1 3.4Å; S148-Y160 PolarHBondContact O-N 3.09Å
149	F	98.9	Very high	97.8	Very high	5 Å²	5	38 Å²	38	2%	0.022	20%	0.196	C	C	.	.	S	Bend	trans	-68.2	-25.6	-175.1	91	-82.5	0	0	0	113.5	D132 Y160 A162 W163 A274 F277 E298	D132-F149 VanDerWaalsContact O-CE1 3.27Å; D132-F149 WeakPolarHBondContact O-CE1 3.38Å; F149-Y160 HydrophobicContact CB-CE1 4.34Å; F149-Y160 HydrophobicContact CB-CE2 4.23Å; F149-Y160 VanDerWaalsContact N-CE1 3.33Å; F149-A162 HydrophobicContact CB-CB 3.83Å; F149-A162 HydrophobicContact CD2-CB 3.88Å; F149-A162 HydrophobicContact CG-CB 4.1Å; F149-W163 HydrophobicContact CB-CZ3 4.21Å; F149-W163 AromaticContact CD1-CH2 3.57Å; F149-W163 HydrophobicContact CD1-CH2 3.57Å; F149-W163 HydrophobicContact CD1-CZ2 4.33Å; F149-W163 HydrophobicContact CD1-CZ3 4.04Å; F149-W163 HydrophobicContact CE1-CH2 4.08Å; F149-W163 HydrophobicContact CG-CH2 4.19Å; F149-W163 HydrophobicContact CG-CZ3 4.37Å; F149-A274 HydrophobicContact CE1-CB 4.37Å; F149-A274 HydrophobicContact CZ-CB 4.1Å; F149-F277 AromaticContact CD2-CE1 3.62Å; F149-F277 HydrophobicContact CD2-CE1 3.62Å; F149-F277 HydrophobicContact CD2-CZ 4.33Å; F149-F277 HydrophobicContact CE2-CD1 4.13Å; F149-F277 AromaticContact CE2-CE1 3.35Å; F149-F277 HydrophobicContact CE2-CE1 3.35Å; F149-F277 HydrophobicContact CE2-CZ 4.03Å; F149-F277 HydrophobicContact CG-CE1 4.44Å; F149-F277 HydrophobicContact CZ-CE1 4.01Å; F149-F277 HydrophobicContact CZ-CZ 4.26Å; F149-E298 HydrophobicContact CD2-CG 4.16Å; F149-E298 HydrophobicContact CE2-CG 4.2Å
150	S	98.9	Very high	98	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	146.4	-174.6	-178.1	0	0	0	0	111.8	S148 A275 L297	S148-S150 PolarHBondContact O-N 3.11Å; S150-A275 WeakPolarHBondContact OG-CB 3.5Å; S150-A275 PolarHBondContact OG-N 3.47Å; S150-A275 VanDerWaalsContact OG-N 3.08Å; S150-L297 WeakPolarHBondContact CA-O 3.18Å; S150-L297 WeakPolarHBondContact CB-O 3.34Å; S150-L297 PolarHBondContact OG-O 2.9Å
151	K	98.8	Very high	98.2	Very high	19 Å²	19	28 Å²	28	8%	0.083	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	173.3	176.9	71.9	178.4	-178.1	172.4	0	112.3	D63 P134 D157 M159 L297	D63-K151 VanDerWaalsContact CG-NZ 3.29Å; D63-K151 WeakPolarHBondContact OD1-CE 3.06Å; D63-K151 IonicContact OD1-NZ 3.6Å; D63-K151 PolarHBondContact OD1-NZ 3.19Å; D63-K151 IonicContact OD2-NZ 3.92Å; P134-K151 HydrophobicContact CB-CB 4.27Å; K151-D157 HydrophobicContact CD-CB 4.46Å; K151-D157 WeakPolarHBondContact CD-O 3.47Å; K151-D157 WeakPolarHBondContact CE-O 3.49Å; K151-D157 PolarHBondContact NZ-O 2.68Å; K151-M159 HydrophobicContact CD-CG 4.05Å; K151-M159 HydrophobicContact CG-CE 4.38Å; K151-M159 HydrophobicContact CG-CG 3.87Å; K151-M159 HydrophobicContact CG-SD 3.96Å; K151-L297 PolarHBondContact N-O 2.94Å; K151-L297 PolarHBondContact O-N 3.31Å
152	T	98.8	Very high	98.4	Very high	7 Å²	7	21.3 Å²	21.3	4%	0.043	13%	0.125	C	C	.	.			trans	-110	178.3	162.4	74.6	0	0	0	0	109.7	D154 Y155 E295 W296	T152-D154 PolarHBondContact O-N 2.9Å; T152-D154 PolarHBondContact OG1-N 3.25Å; T152-Y155 PolarHBondContact O-N 3.32Å; T152-Y155 WeakPolarHBondContact OG1-CD2 3.48Å; T152-E295 WeakPolarHBondContact CA-O 3.26Å; T152-E295 WeakPolarHBondContact CB-O 3.24Å; T152-E295 HydrophobicContact CG2-CB 4.06Å; T152-W296 HydrophobicContact CG2-CD2 3.68Å; T152-W296 HydrophobicContact CG2-CE3 3.97Å; T152-W296 HydrophobicContact CG2-CG 4.09Å; T152-W296 HydrophobicContact CG2-CH2 4.21Å; T152-W296 HydrophobicContact CG2-CZ2 3.91Å; T152-W296 HydrophobicContact CG2-CZ3 4.23Å
153	A	97.9	Very high	98.6	Very high	94 Å²	94	18 Å²	18	78%	0.777	10%	0.104	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-18.4	173.3	0	0	0	0	0	113.7	Y155	A153-Y155 PolarHBondContact O-N 2.58Å
154	D	98.3	Very high	98.7	Very high	112 Å²	112	16.4 Å²	16.4	60%	0.599	10%	0.096	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	1.4	179.7	-56.9	-44.6	0	0	0	113.5	P137 G138 T152	P137-D154 CarbonylContact C-O 3.57Å; G138-D154 PolarHBondContact N-O 3.29Å; T152-D154 PolarHBondContact O-N 2.9Å; T152-D154 PolarHBondContact OG1-N 3.25Å
155	Y	98.7	Very high	98.7	Very high	37 Å²	37	15.9 Å²	15.9	15%	0.145	9%	0.093	C	C	.	.	B	Isolated β-bridge	trans	-124.5	144.3	-177.3	-69.4	-97.1	0	0	0	111.8	Y133 P134 V136 P137 T152 A153	Y133-Y155 HydrophobicContact CE1-CE1 4.37Å; Y133-Y155 AromaticContact CE1-CZ 3.87Å; Y133-Y155 VanDerWaalsContact CE1-OH 3.25Å; Y133-Y155 WeakPolarHBondContact CE1-OH 3.22Å; P134-Y155 HydrophobicContact CB-CD1 3.5Å; P134-Y155 HydrophobicContact CB-CE1 4.03Å; P134-Y155 HydrophobicContact CB-CG 3.79Å; P134-Y155 HydrophobicContact CG-CD1 3.47Å; P134-Y155 VanDerWaalsContact CG-CD1 3.47Å; P134-Y155 HydrophobicContact CG-CD2 3.83Å; P134-Y155 HydrophobicContact CG-CE1 3.61Å; P134-Y155 HydrophobicContact CG-CE2 3.99Å; P134-Y155 HydrophobicContact CG-CG 3.6Å; V136-Y155 CarbonylContact O-C 3.6Å; V136-Y155 WeakPolarHBondContact O-CA 3.35Å; P137-Y155 HydrophobicContact CB-CE1 4.28Å; P137-Y155 HydrophobicContact CG-CD1 4.29Å; P137-Y155 HydrophobicContact CG-CE1 3.79Å; T152-Y155 PolarHBondContact O-N 3.32Å; T152-Y155 WeakPolarHBondContact OG1-CD2 3.48Å; A153-Y155 PolarHBondContact O-N 2.58Å
156	Q	98.4	Very high	98.7	Very high	52 Å²	52	18.1 Å²	18.1	24%	0.243	10%	0.101	C	C	.	.			trans	-100	4.8	-179.2	-57.1	-64.3	-20.6	0	0	112.7	V136 I143	V136-Q156 HydrophobicContact CB-CB 4.34Å; V136-Q156 HydrophobicContact CG1-CB 3.97Å; V136-Q156 PolarHBondContact O-N 3.41Å; I143-Q156 HydrophobicContact CD1-CG 4.33Å; I143-Q156 HydrophobicContact CG1-CG 4.48Å; I143-Q156 HydrophobicContact CG2-CB 3.57Å; I143-Q156 HydrophobicContact CG2-CG 4.05Å
157	D	98.8	Very high	98.7	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.111	C	C	.	.	P	Polyproline II helix	trans	-54.9	147.6	173.6	-64.4	-119.2	0	0	0	111.2	P134 Q135 V136 V146 S148 K151	P134-D157 HydrophobicContact CB-CB 4.33Å; P134-D157 WeakPolarHBondContact CB-OD2 3.36Å; Q135-D157 PolarHBondContact N-OD1 3.32Å; Q135-D157 PolarHBondContact N-OD2 2.79Å; Q135-D157 VanDerWaalsContact N-OD2 3.1Å; V136-D157 WeakPolarHBondContact CA-OD2 3.33Å; V136-D157 PolarHBondContact N-OD2 3.45Å; V146-D157 CarbonylContact O-C 3.55Å; V146-D157 WeakPolarHBondContact O-CA 3.24Å; S148-D157 WeakPolarHBondContact CB-OD1 3.09Å; S148-D157 PolarHBondContact OG-OD1 2.92Å; K151-D157 HydrophobicContact CD-CB 4.46Å; K151-D157 WeakPolarHBondContact CD-O 3.47Å; K151-D157 WeakPolarHBondContact CE-O 3.49Å; K151-D157 PolarHBondContact NZ-O 2.68Å
158	I	98.9	Very high	98.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	121.1	176.1	-60.5	158.5	0	0	0	108.2	D63 L64 F67 V146 L147 S148 L361 F365	D63-I158 HydrophobicContact CB-CB 4.45Å; D63-I158 HydrophobicContact CB-CG1 4.47Å; D63-I158 HydrophobicContact CB-CG2 4.09Å; L64-I158 HydrophobicContact CD2-CD1 3.76Å; L64-I158 HydrophobicContact CD2-CG1 4.16Å; L64-I158 HydrophobicContact CD2-CG2 4.13Å; F67-I158 HydrophobicContact CD2-CD1 4.07Å; F67-I158 HydrophobicContact CD2-CG1 4.5Å; F67-I158 HydrophobicContact CE2-CD1 3.68Å; F67-I158 HydrophobicContact CE2-CG1 3.89Å; F67-I158 HydrophobicContact CZ-CD1 4.39Å; V146-I158 PolarHBondContact O-N 3.35Å; L147-I158 CarbonylContact C-O 3.58Å; L147-I158 VanDerWaalsContact CA-O 3.24Å; L147-I158 WeakPolarHBondContact CA-O 3.38Å; L147-I158 HydrophobicContact CD1-CB 4.11Å; L147-I158 HydrophobicContact CD1-CD1 4.01Å; L147-I158 HydrophobicContact CD1-CG2 4.46Å; L147-I158 HydrophobicContact CG-CB 4.16Å; L147-I158 HydrophobicContact CG-CG2 4.31Å; S148-I158 PolarHBondContact N-O 3.26Å; I158-L361 HydrophobicContact CG2-CD1 3.51Å; I158-F365 HydrophobicContact CD1-CD2 4.07Å; I158-F365 HydrophobicContact CD1-CE2 3.99Å
159	M	98.9	Very high	98.6	Very high	3 Å²	3	21 Å²	21	2%	0.015	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	136.4	-179.6	-73.8	-171.3	-74.4	0	0	112.1	V59 D63 S148 K151 L297 F299	V59-M159 HydrophobicContact CG1-CE 3.41Å; V59-M159 VanDerWaalsContact CG1-CE 3.41Å; D63-M159 WeakPolarHBondContact OD2-CB 3.46Å; D63-M159 PolarHBondContact OD2-N 3.36Å; S148-M159 VanDerWaalsContact O-CA 3.28Å; S148-M159 WeakPolarHBondContact O-CA 3.16Å; K151-M159 HydrophobicContact CD-CG 4.05Å; K151-M159 HydrophobicContact CG-CE 4.38Å; K151-M159 HydrophobicContact CG-CG 3.87Å; K151-M159 HydrophobicContact CG-SD 3.96Å; M159-L297 HydrophobicContact CE-CB 4.31Å; M159-L297 HydrophobicContact SD-CB 3.94Å; M159-F299 HydrophobicContact CB-CB 4.13Å
160	Y	98.9	Very high	98.5	Very high	1 Å²	1	23.8 Å²	23.8	0%	0.004	14%	0.138	C	C	.	.			trans	-127.2	155.4	172.1	72.1	-96.1	0	0	0	111.7	V110 V128 N129 L147 S148 F149 A162 W163 W358	V110-Y160 HydrophobicContact CG2-CE2 3.8Å; V128-Y160 HydrophobicContact CG1-CD1 4.4Å; V128-Y160 HydrophobicContact CG1-CE1 3.7Å; V128-Y160 HydrophobicContact CG1-CE2 4.44Å; N129-Y160 WeakPolarHBondContact O-CE1 3.32Å; N129-Y160 PolarHBondContact O-OH 3.44Å; L147-Y160 HydrophobicContact CB-CD1 3.78Å; L147-Y160 HydrophobicContact CB-CE1 4.27Å; L147-Y160 WeakPolarHBondContact O-CE1 3.41Å; S148-Y160 VanDerWaalsContact C-CD1 3.42Å; S148-Y160 VanDerWaalsContact C-CE1 3.4Å; S148-Y160 PolarHBondContact O-N 3.09Å; F149-Y160 HydrophobicContact CB-CE1 4.34Å; F149-Y160 HydrophobicContact CB-CE2 4.23Å; F149-Y160 VanDerWaalsContact N-CE1 3.33Å; Y160-A162 PolarHBondContact O-N 2.96Å; Y160-A162 VanDerWaalsContact O-N 3.16Å; Y160-W163 HydrophobicContact CE2-CE3 4.2Å; Y160-W163 WeakPolarHBondContact OH-CZ3 3.37Å; Y160-W358 HydrophobicContact CD1-CH2 4.47Å; Y160-W358 AromaticContact CD2-CH2 3.41Å; Y160-W358 HydrophobicContact CD2-CH2 3.41Å; Y160-W358 VanDerWaalsContact CD2-CH2 3.41Å; Y160-W358 AromaticContact CD2-CZ2 3.15Å; Y160-W358 HydrophobicContact CD2-CZ2 3.15Å; Y160-W358 HydrophobicContact CE2-CH2 4.12Å; Y160-W358 AromaticContact CE2-CZ2 3.86Å; Y160-W358 HydrophobicContact CE2-CZ2 3.86Å; Y160-W358 AromaticContact CG-CH2 3.59Å; Y160-W358 HydrophobicContact CG-CH2 3.59Å; Y160-W358 AromaticContact CG-CZ2 3.77Å; Y160-W358 HydrophobicContact CG-CZ2 3.77Å; Y160-W358 HydrophobicContact CG-CZ3 4.45Å
161	P	98.8	Very high	98.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.153	C	C	.	.			trans	-63.9	114.9	174.1	-20.4	32	0	0	0	111.6	F165 F299 V354 Y357 W358	P161-F165 HydrophobicContact CB-CD2 4.05Å; P161-F165 HydrophobicContact CB-CE2 4.15Å; P161-F299 HydrophobicContact CB-CD1 4.02Å; P161-F299 HydrophobicContact CB-CE1 3.63Å; P161-F299 HydrophobicContact CB-CZ 4.14Å; P161-F299 HydrophobicContact CG-CD1 4.01Å; P161-F299 HydrophobicContact CG-CE1 3.81Å; P161-F299 HydrophobicContact CG-CE2 4.34Å; P161-F299 HydrophobicContact CG-CG 4.36Å; P161-F299 HydrophobicContact CG-CZ 3.99Å; P161-V354 HydrophobicContact CB-CG1 3.71Å; P161-V354 HydrophobicContact CG-CG1 4.35Å; P161-Y357 HydrophobicContact CG-CD1 3.61Å; P161-Y357 HydrophobicContact CG-CE1 4.43Å; P161-Y357 HydrophobicContact CG-CG 4.09Å; P161-W358 HydrophobicContact CG-CG 4.35Å; P161-W358 PolarHBondContact O-NE1 3Å
162	A	98.8	Very high	98.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.162	C	C	.	.			trans	-52.3	148.4	-172.5	0	0	0	0	0	114.1	F149 Y160 T164 F165 F277	F149-A162 HydrophobicContact CB-CB 3.83Å; F149-A162 HydrophobicContact CD2-CB 3.88Å; F149-A162 HydrophobicContact CG-CB 4.1Å; Y160-A162 PolarHBondContact O-N 2.96Å; Y160-A162 VanDerWaalsContact O-N 3.16Å; A162-T164 HydrophobicContact CB-CG2 4.1Å; A162-T164 PolarHBondContact O-N 2.79Å; A162-F165 VanDerWaalsContact O-CD2 3.29Å; A162-F165 WeakPolarHBondContact O-CD2 3.38Å; A162-F165 PolarHBondContact O-N 3.35Å; A162-F165 VanDerWaalsContact O-N 3.1Å; A162-F277 HydrophobicContact CB-CD1 4.47Å; A162-F277 HydrophobicContact CB-CE1 3.64Å; A162-F277 HydrophobicContact CB-CZ 4.19Å
163	W	98.8	Very high	97.8	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-46.7	-36.2	175.5	50	82.3	0	0	0	114.2	R106 V110 V130 F149 Y160 F165 W166 E167 G168 F277	R106-W163 HydrophobicContact CB-CB 4.14Å; R106-W163 HydrophobicContact CB-CD2 3.69Å; R106-W163 HydrophobicContact CB-CE3 4.11Å; R106-W163 HydrophobicContact CB-CG 3.67Å; R106-W163 VanDerWaalsContact CD-CZ2 3.49Å; R106-W163 HydrophobicContact CG-CD2 3.78Å; R106-W163 HydrophobicContact CG-CG 3.81Å; R106-W163 HydrophobicContact CG-CZ2 4.3Å; R106-W163 VanDerWaalsContact CZ-CZ2 3.48Å; R106-W163 WeakPolarHBondContact O-CB 3.44Å; V110-W163 HydrophobicContact CG2-CB 4.29Å; V130-W163 HydrophobicContact CB-CE3 4.27Å; V130-W163 HydrophobicContact CB-CZ3 4.15Å; V130-W163 HydrophobicContact CG1-CE3 4.31Å; V130-W163 WeakPolarHBondContact O-CH2 3.28Å; F149-W163 HydrophobicContact CB-CZ3 4.21Å; F149-W163 AromaticContact CD1-CH2 3.57Å; F149-W163 HydrophobicContact CD1-CH2 3.57Å; F149-W163 HydrophobicContact CD1-CZ2 4.33Å; F149-W163 HydrophobicContact CD1-CZ3 4.04Å; F149-W163 HydrophobicContact CE1-CH2 4.08Å; F149-W163 HydrophobicContact CG-CH2 4.19Å; F149-W163 HydrophobicContact CG-CZ3 4.37Å; Y160-W163 HydrophobicContact CE2-CE3 4.2Å; Y160-W163 WeakPolarHBondContact OH-CZ3 3.37Å; W163-F165 PolarHBondContact O-N 2.84Å; W163-W166 PolarHBondContact O-N 3.34Å; W163-E167 CarbonylContact C-O 3.56Å; W163-E167 PolarHBondContact O-N 3.5Å; W163-G168 VanDerWaalsContact CD1-C 3.49Å; W163-G168 VanDerWaalsContact CD1-O 3.3Å; W163-G168 PolarHBondContact NE1-O 2.65Å; W163-F277 AromaticContact CE2-CZ 3.91Å; W163-F277 HydrophobicContact CZ2-CE2 4.47Å; W163-F277 AromaticContact CZ2-CZ 3.83Å; W163-F277 HydrophobicContact CZ2-CZ 3.83Å; W163-F277 AromaticContact NE1-CE2 3.97Å; W163-F277 AromaticContact NE1-CZ 3.86Å
164	T	98.7	Very high	97.7	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.012	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-64	-11.1	-175.9	-163.8	0	0	0	0	114.3	A162 W166 E167 L180 G181 F277	A162-T164 HydrophobicContact CB-CG2 4.1Å; A162-T164 PolarHBondContact O-N 2.79Å; T164-W166 PolarHBondContact O-N 2.81Å; T164-E167 WeakPolarHBondContact CA-O 3.41Å; T164-E167 PolarHBondContact N-O 3.33Å; T164-L180 PolarHBondContact OG1-O 2.77Å; T164-G181 WeakPolarHBondContact O-CA 3.46Å; T164-F277 HydrophobicContact CG2-CB 4.26Å; T164-F277 HydrophobicContact CG2-CD1 3.64Å; T164-F277 HydrophobicContact CG2-CD2 3.84Å; T164-F277 HydrophobicContact CG2-CE1 3.8Å; T164-F277 HydrophobicContact CG2-CE2 4.01Å; T164-F277 HydrophobicContact CG2-CG 3.66Å; T164-F277 HydrophobicContact CG2-CZ 4Å
165	F	98.9	Very high	97.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-61.2	-28.6	167.5	-78.1	-73.7	0	0	0	111.4	F113 P161 A162 W163 W183 K280 F299 F300 L349 V354	F113-F165 HydrophobicContact CE2-CB 3.81Å; F113-F165 HydrophobicContact CZ-CB 3.51Å; P161-F165 HydrophobicContact CB-CD2 4.05Å; P161-F165 HydrophobicContact CB-CE2 4.15Å; A162-F165 VanDerWaalsContact O-CD2 3.29Å; A162-F165 WeakPolarHBondContact O-CD2 3.38Å; A162-F165 PolarHBondContact O-N 3.35Å; A162-F165 VanDerWaalsContact O-N 3.1Å; W163-F165 PolarHBondContact O-N 2.84Å; F165-W183 HydrophobicContact CB-CB 4.43Å; F165-W183 HydrophobicContact CD1-CB 3.77Å; F165-W183 AromaticContact CD1-CD1 3.38Å; F165-W183 HydrophobicContact CD1-CD2 4.37Å; F165-W183 AromaticContact CD1-CG 3.57Å; F165-W183 HydrophobicContact CD1-CG 3.57Å; F165-W183 AromaticContact CD1-NE1 3.98Å; F165-W183 AromaticContact CE1-CD1 3.65Å; F165-W183 HydrophobicContact CE1-CD2 4.39Å; F165-W183 AromaticContact CE1-CG 4Å; F165-W183 HydrophobicContact CE1-CG 4Å; F165-W183 AromaticContact CE1-NE1 3.74Å; F165-W183 VanDerWaalsContact O-CB 3.3Å; F165-W183 WeakPolarHBondContact O-CB 3.37Å; F165-W183 PolarHBondContact O-N 2.88Å; F165-K280 HydrophobicContact CD1-CD 4.48Å; F165-K280 HydrophobicContact CE1-CD 3.65Å; F165-K280 HydrophobicContact CZ-CD 3.89Å; F165-F299 AromaticContact CE2-CE1 3.83Å; F165-F299 HydrophobicContact CE2-CE1 3.83Å; F165-F299 HydrophobicContact CZ-CE1 4.07Å; F165-F300 HydrophobicContact CZ-CE1 4.33Å; F165-L349 HydrophobicContact CE1-CD1 4.33Å; F165-L349 HydrophobicContact CE1-CD2 4.25Å; F165-L349 HydrophobicContact CE1-CG 4.13Å; F165-L349 HydrophobicContact CZ-CD1 4.06Å; F165-L349 HydrophobicContact CZ-CD2 4.23Å; F165-L349 HydrophobicContact CZ-CG 4.27Å; F165-V354 HydrophobicContact CB-CG1 4.08Å; F165-V354 HydrophobicContact CD1-CG2 3.63Å; F165-V354 HydrophobicContact CD2-CG1 4.19Å; F165-V354 HydrophobicContact CD2-CG2 4.17Å; F165-V354 HydrophobicContact CE1-CG2 3.76Å; F165-V354 HydrophobicContact CE2-CG2 4.3Å; F165-V354 HydrophobicContact CG-CG1 4.07Å; F165-V354 HydrophobicContact CG-CG2 3.85Å; F165-V354 HydrophobicContact CZ-CG2 4.1Å
166	W	98.6	Very high	97.4	Very high	47 Å²	47	31.2 Å²	31.2	18%	0.178	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-58.3	172.8	-173.3	-113.6	0	0	0	113	H112 F113 W163 T164 G181 R182 M351	H112-W166 HydrophobicContact CB-CB 4.31Å; H112-W166 HydrophobicContact CB-CG 3.89Å; H112-W166 AromaticContact CD2-CD2 3.69Å; H112-W166 AromaticContact CD2-CE3 3.99Å; H112-W166 AromaticContact CD2-CG 3.63Å; H112-W166 AromaticContact CE1-CD2 3.3Å; H112-W166 AromaticContact CE1-CE2 3.3Å; H112-W166 AromaticContact CE1-CE3 3.44Å; H112-W166 VanDerWaalsContact CE1-CE3 3.44Å; H112-W166 AromaticContact CE1-CG 3.98Å; H112-W166 AromaticContact CE1-CH2 3.59Å; H112-W166 AromaticContact CE1-CZ2 3.46Å; H112-W166 VanDerWaalsContact CE1-CZ2 3.46Å; H112-W166 WeakPolarHBondContact CE1-CZ2 3.08Å; H112-W166 AromaticContact CE1-CZ3 3.58Å; H112-W166 AromaticContact CE1-NE1 3.92Å; H112-W166 AromaticContact CG-CD1 3.53Å; H112-W166 AromaticContact CG-CD2 3.69Å; H112-W166 AromaticContact CG-CE2 3.87Å; H112-W166 AromaticContact CG-CG 3.5Å; H112-W166 VanDerWaalsContact CG-CG 3.5Å; H112-W166 AromaticContact CG-NE1 3.76Å; H112-W166 AromaticContact ND1-CD1 3.65Å; H112-W166 AromaticContact ND1-CD2 3.47Å; H112-W166 AromaticContact ND1-CE2 3.24Å; H112-W166 AromaticContact ND1-CG 3.74Å; H112-W166 AromaticContact ND1-CZ2 3.7Å; H112-W166 AromaticContact ND1-NE1 3.37Å; H112-W166 PolarHBondContact ND1-NE1 2.8Å; H112-W166 AromaticContact NE2-CD2 3.44Å; H112-W166 AromaticContact NE2-CE2 3.95Å; H112-W166 AromaticContact NE2-CE3 3.34Å; H112-W166 VanDerWaalsContact NE2-CE3 3.34Å; H112-W166 AromaticContact NE2-CG 3.92Å; H112-W166 AromaticContact NE2-CZ3 3.77Å; F113-W166 HydrophobicContact CE2-CB 3.83Å; F113-W166 HydrophobicContact CZ-CB 3.94Å; W163-W166 PolarHBondContact O-N 3.34Å; T164-W166 PolarHBondContact O-N 2.81Å; W166-G181 CarbonylContact O-C 3.42Å; W166-G181 WeakPolarHBondContact O-CA 3.46Å; W166-R182 VanDerWaalsContact CZ3-NE 3.31Å; W166-R182 PolarHBondContact O-N 2.88Å; W166-M351 HydrophobicContact CE3-CE 4.18Å
167	E	98.1	Very high	97.3	Very high	44 Å²	44	31.8 Å²	31.8	21%	0.206	17%	0.171	C	C	.	.	S	Bend	trans	-160.9	176.9	-176.6	69.5	-177.3	128.6	0	0	112.8	S108 W163 T164 G169	S108-E167 VanDerWaalsContact CB-OE1 3.25Å; S108-E167 WeakPolarHBondContact CB-OE1 3.19Å; S108-E167 PolarHBondContact OG-OE1 2.88Å; W163-E167 CarbonylContact C-O 3.56Å; W163-E167 PolarHBondContact O-N 3.5Å; T164-E167 WeakPolarHBondContact CA-O 3.41Å; T164-E167 PolarHBondContact N-O 3.33Å; E167-G169 VanDerWaalsContact C-N 3.33Å; E167-G169 PolarHBondContact O-N 2.02Å
168	G	96.8	Very high	97	Very high	10 Å²	10	36.5 Å²	36.5	10%	0.103	20%	0.199	C	C	.	.			trans	78.3	11.5	172.7	0	0	0	0	0	115.5	R106 W163	R106-G168 WeakPolarHBondContact CG-O 3.41Å; W163-G168 VanDerWaalsContact CD1-C 3.49Å; W163-G168 VanDerWaalsContact CD1-O 3.3Å; W163-G168 PolarHBondContact NE1-O 2.65Å
169	G	98	Very high	96.9	Very high	8 Å²	8	37 Å²	37	8%	0.082	20%	0.204	C	C	.	.	S	Bend	trans	-68.9	-178.8	165.7	0	0	0	0	0	112.3	E167 A171 G179 L180	E167-G169 VanDerWaalsContact C-N 3.33Å; E167-G169 PolarHBondContact O-N 2.02Å; G169-A171 PolarHBondContact O-N 3.03Å; G169-G179 WeakPolarHBondContact O-CA 3.47Å; G169-L180 WeakPolarHBondContact CA-O 3.43Å; G169-L180 PolarHBondContact N-O 3.48Å
170	P	96.9	Very high	96.9	Very high	63 Å²	63	37.5 Å²	37.5	41%	0.409	21%	0.207	S	C	.	.			trans	-57.1	125.8	-178	-26.4	35.6	0	0	0	112.5	V172 L180 F277	P170-V172 HydrophobicContact CB-CG2 3.94Å; P170-V172 PolarHBondContact O-N 2.77Å; P170-L180 PolarHBondContact O-N 3.14Å; P170-F277 HydrophobicContact CG-CD2 4.37Å
171	A	95.6	Very high	96.9	Very high	39 Å²	39	38.1 Å²	38.1	32%	0.322	21%	0.214	S	C	.	.			trans	-83.5	86.3	172.1	0	0	0	0	0	109.7	G169 Y176 Q239	G169-A171 PolarHBondContact O-N 3.03Å; A171-Y176 CarbonylContact C-O 3.55Å; A171-Y176 VanDerWaalsContact CA-O 3.29Å; A171-Y176 WeakPolarHBondContact CA-O 3.28Å; A171-Q239 PolarHBondContact O-NE2 2.94Å
172	V	95	Very high	96.9	Very high	43 Å²	43	40.7 Å²	40.7	26%	0.261	22%	0.224	S	C	.	.			trans	-92.2	102.9	-177.4	-177.4	0	0	0	0	108.2	P170 I175 Y176 E255	P170-V172 HydrophobicContact CB-CG2 3.94Å; P170-V172 PolarHBondContact O-N 2.77Å; V172-I175 HydrophobicContact CB-CD1 4.42Å; V172-I175 HydrophobicContact CB-CG1 4.05Å; V172-I175 HydrophobicContact CG1-CD1 3.95Å; V172-I175 HydrophobicContact CG1-CG1 3.82Å; V172-I175 WeakPolarHBondContact O-CG1 3.34Å; V172-I175 PolarHBondContact O-N 2.83Å; V172-Y176 HydrophobicContact CB-CD2 4.14Å; V172-Y176 PolarHBondContact N-O 3.04Å; V172-Y176 PolarHBondContact O-N 3.35Å; V172-E255 HydrophobicContact CG1-CB 4.08Å; V172-E255 HydrophobicContact CG1-CG 3.53Å
173	W	92.9	Very high	96.9	Very high	190 Å²	190	40.8 Å²	40.8	72%	0.72	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	140.2	178.7	-177	-93.3	0	0	0	111.4	P177	W173-P177 HydrophobicContact CE3-CB 3.93Å; W173-P177 HydrophobicContact CZ3-CB 3.78Å
174	P	94.6	Very high	96.8	Very high	78 Å²	78	42.9 Å²	42.9	51%	0.506	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	cis	-89.2	-1.5	-3.3	35.7	-35.3	0	0	0	114.1
175	I	95.9	Very high	96.8	Very high	42 Å²	42	45.1 Å²	45.1	22%	0.215	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-26.6	-164.5	60.4	169.8	0	0	0	115.1	V172 E255 P257	V172-I175 HydrophobicContact CB-CD1 4.42Å; V172-I175 HydrophobicContact CB-CG1 4.05Å; V172-I175 HydrophobicContact CG1-CD1 3.95Å; V172-I175 HydrophobicContact CG1-CG1 3.82Å; V172-I175 WeakPolarHBondContact O-CG1 3.34Å; V172-I175 PolarHBondContact O-N 2.83Å; I175-E255 HydrophobicContact CD1-CB 3.97Å; I175-E255 HydrophobicContact CG1-CB 4.26Å; I175-E255 HydrophobicContact CG2-CB 4.45Å; I175-P257 HydrophobicContact CB-CG 4.31Å; I175-P257 HydrophobicContact CG2-CG 3.72Å
176	Y	96.1	Very high	96.8	Very high	33 Å²	33	46.1 Å²	46.1	13%	0.129	25%	0.252	C	S	.	.			trans	-137.4	70.8	175.8	-52.6	-57.7	0	0	0	109.8	A171 V172 T178 G179 L180 M186 L258	A171-Y176 CarbonylContact C-O 3.55Å; A171-Y176 VanDerWaalsContact CA-O 3.29Å; A171-Y176 WeakPolarHBondContact CA-O 3.28Å; V172-Y176 HydrophobicContact CB-CD2 4.14Å; V172-Y176 PolarHBondContact N-O 3.04Å; V172-Y176 PolarHBondContact O-N 3.35Å; Y176-T178 PolarHBondContact O-N 3.45Å; Y176-G179 PolarHBondContact O-N 3.24Å; Y176-G179 VanDerWaalsContact O-N 3.1Å; Y176-L180 HydrophobicContact CD1-CD1 4.23Å; Y176-L180 HydrophobicContact CD2-CB 4.38Å; Y176-L180 HydrophobicContact CD2-CD1 4.23Å; Y176-L180 HydrophobicContact CE1-CD1 4.05Å; Y176-L180 HydrophobicContact CE2-CD1 4.04Å; Y176-L180 HydrophobicContact CG-CB 4.46Å; Y176-L180 HydrophobicContact CG-CD1 4.35Å; Y176-M186 HydrophobicContact CE1-CE 3.7Å; Y176-L258 HydrophobicContact CE2-CD1 4.49Å; Y176-L258 WeakPolarHBondContact OH-CB 3.17Å; Y176-L258 WeakPolarHBondContact OH-CD1 3.36Å; Y176-L258 VanDerWaalsContact OH-CG 3.3Å; Y176-L258 WeakPolarHBondContact OH-CG 3.01Å; Y176-L258 PolarHBondContact OH-N 3.37Å
177	P	94.4	Very high	96.8	Very high	65 Å²	65	45 Å²	45	42%	0.422	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-29.4	-171.6	27	-35	0	0	0	113	W173	W173-P177 HydrophobicContact CE3-CB 3.93Å; W173-P177 HydrophobicContact CZ3-CB 3.78Å
178	T	94.5	Very high	96.8	Very high	98 Å²	98	46.9 Å²	46.9	60%	0.601	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	5.4	179.5	51.5	0	0	0	0	113.2	Y176 L391	Y176-T178 PolarHBondContact O-N 3.45Å; T178-L391 PolarHBondContact OG1-OXT 2.87Å
179	G	96.6	Very high	96.9	Very high	10 Å²	10	49.5 Å²	49.5	10%	0.103	27%	0.271	C	S	.	.			trans	93.4	140.4	-176.3	0	0	0	0	0	112.9	G169 Y176 G181	G169-G179 WeakPolarHBondContact O-CA 3.47Å; Y176-G179 PolarHBondContact O-N 3.24Å; Y176-G179 VanDerWaalsContact O-N 3.1Å; G179-G181 PolarHBondContact O-N 3.11Å
180	L	98.1	Very high	97	Very high	14 Å²	14	49.1 Å²	49.1	7%	0.073	27%	0.267	C	S	.	.	S	Bend	trans	-56.7	126.1	173.8	-178.3	67.6	0	0	0	110.2	T164 G169 P170 Y176 M186 L258 F277	T164-L180 PolarHBondContact OG1-O 2.77Å; G169-L180 WeakPolarHBondContact CA-O 3.43Å; G169-L180 PolarHBondContact N-O 3.48Å; P170-L180 PolarHBondContact O-N 3.14Å; Y176-L180 HydrophobicContact CD1-CD1 4.23Å; Y176-L180 HydrophobicContact CD2-CB 4.38Å; Y176-L180 HydrophobicContact CD2-CD1 4.23Å; Y176-L180 HydrophobicContact CE1-CD1 4.05Å; Y176-L180 HydrophobicContact CE2-CD1 4.04Å; Y176-L180 HydrophobicContact CG-CB 4.46Å; Y176-L180 HydrophobicContact CG-CD1 4.35Å; L180-M186 HydrophobicContact CD1-CE 4.23Å; L180-L258 HydrophobicContact CD1-CD1 4.18Å; L180-F277 HydrophobicContact CD2-CB 4.26Å
181	G	98.1	Very high	97	Very high	14 Å²	14	50.7 Å²	50.7	14%	0.144	27%	0.267	C	S	.	.			trans	-163.7	-161.7	-173.3	0	0	0	0	0	111.9	T164 W166 G179 W183	T164-G181 WeakPolarHBondContact O-CA 3.46Å; W166-G181 CarbonylContact O-C 3.42Å; W166-G181 WeakPolarHBondContact O-CA 3.46Å; G179-G181 PolarHBondContact O-N 3.11Å; G181-W183 PolarHBondContact O-N 3.47Å
182	R	98.6	Very high	97.2	Very high	55 Å²	55	54.6 Å²	54.6	21%	0.208	28%	0.277	C	S	.	.			trans	45.8	60.4	170.4	-65.2	-60	-55.7	-81.4	2.7	112.3	W166 D184 L185 M186	W166-R182 VanDerWaalsContact CZ3-NE 3.31Å; W166-R182 PolarHBondContact O-N 2.88Å; R182-D184 WeakPolarHBondContact CA-OD1 3.27Å; R182-D184 IonicContact CZ-OD1 3.79Å; R182-D184 IonicContact CZ-OD2 3.43Å; R182-D184 IonicContact NE-OD1 3.76Å; R182-D184 PolarHBondContact NE-OD1 3.34Å; R182-D184 IonicContact NE-OD2 2.8Å; R182-D184 PolarHBondContact NE-OD2 3.46Å; R182-D184 IonicContact NH2-OD1 3.78Å; R182-D184 IonicContact NH2-OD2 2.7Å; R182-D184 PolarHBondContact NH2-OD2 3.29Å; R182-D184 PolarHBondContact O-N 3.42Å; R182-L185 HydrophobicContact CB-CB 4.22Å; R182-L185 HydrophobicContact CB-CD1 4.11Å; R182-L185 HydrophobicContact CB-CG 4.18Å; R182-L185 HydrophobicContact CG-CD1 4.4Å; R182-L185 VanDerWaalsContact CZ-CD1 3.47Å; R182-L185 PolarHBondContact O-N 2.79Å; R182-M186 PolarHBondContact O-N 2.81Å
183	W	98.8	Very high	97.4	Very high	1 Å²	1	53.1 Å²	53.1	0%	0.004	27%	0.268	C	S	.	.	H	α-helix	trans	-56.8	-31.8	-179.4	175.5	-124.5	0	0	0	112.2	F165 G181 M186 R187 L190 K280 H281 L284 I345 L349 M351	F165-W183 HydrophobicContact CB-CB 4.43Å; F165-W183 HydrophobicContact CD1-CB 3.77Å; F165-W183 AromaticContact CD1-CD1 3.38Å; F165-W183 HydrophobicContact CD1-CD2 4.37Å; F165-W183 AromaticContact CD1-CG 3.57Å; F165-W183 HydrophobicContact CD1-CG 3.57Å; F165-W183 AromaticContact CD1-NE1 3.98Å; F165-W183 AromaticContact CE1-CD1 3.65Å; F165-W183 HydrophobicContact CE1-CD2 4.39Å; F165-W183 AromaticContact CE1-CG 4Å; F165-W183 HydrophobicContact CE1-CG 4Å; F165-W183 AromaticContact CE1-NE1 3.74Å; F165-W183 VanDerWaalsContact O-CB 3.3Å; F165-W183 WeakPolarHBondContact O-CB 3.37Å; F165-W183 PolarHBondContact O-N 2.88Å; G181-W183 PolarHBondContact O-N 3.47Å; W183-M186 HydrophobicContact CE3-CB 4.36Å; W183-M186 HydrophobicContact CE3-CG 4.35Å; W183-M186 HydrophobicContact CZ3-CG 4.44Å; W183-R187 HydrophobicContact CD2-CG 3.69Å; W183-R187 VanDerWaalsContact CE2-CG 3.48Å; W183-R187 HydrophobicContact CE3-CG 3.97Å; W183-R187 HydrophobicContact CG-CG 4.29Å; W183-R187 HydrophobicContact CH2-CG 3.92Å; W183-R187 HydrophobicContact CZ2-CG 3.62Å; W183-R187 HydrophobicContact CZ3-CG 4.06Å; W183-R187 WeakPolarHBondContact O-CB 3.3Å; W183-R187 VanDerWaalsContact O-CD 3.3Å; W183-R187 WeakPolarHBondContact O-CD 3.46Å; W183-R187 WeakPolarHBondContact O-CG 3.47Å; W183-R187 PolarHBondContact O-N 2.61Å; W183-L190 HydrophobicContact CZ3-CD1 4.43Å; W183-K280 HydrophobicContact CD2-CD 4.18Å; W183-K280 HydrophobicContact CE3-CD 4.15Å; W183-K280 HydrophobicContact CH2-CB 4.06Å; W183-K280 HydrophobicContact CH2-CD 4.15Å; W183-K280 HydrophobicContact CH2-CG 4.01Å; W183-K280 HydrophobicContact CZ2-CB 4.33Å; W183-K280 HydrophobicContact CZ2-CD 4.19Å; W183-K280 HydrophobicContact CZ2-CG 4.44Å; W183-K280 HydrophobicContact CZ3-CD 4.15Å; W183-K280 HydrophobicContact CZ3-CG 4.09Å; W183-H281 AromaticContact CE3-NE2 3.84Å; W183-H281 AromaticContact CZ3-CD2 3.53Å; W183-H281 AromaticContact CZ3-NE2 3.8Å; W183-L284 HydrophobicContact CH2-CD1 3.25Å; W183-L284 HydrophobicContact CH2-CG 3.99Å; W183-L284 HydrophobicContact CZ2-CD1 3.88Å; W183-L284 HydrophobicContact CZ3-CD1 3.83Å; W183-I345 HydrophobicContact CH2-CG2 4.08Å; W183-I345 HydrophobicContact CZ2-CG2 3.76Å; W183-L349 HydrophobicContact CZ2-CD2 4.37Å; W183-L349 PolarHBondContact NE1-O 3.06Å; W183-M351 HydrophobicContact CB-SD 3.96Å; W183-M351 HydrophobicContact CG-SD 4.39Å
184	D	98.3	Very high	97.6	Very high	44 Å²	44	44.6 Å²	44.6	24%	0.235	24%	0.238	C	C	.	.	H	α-helix	trans	-51.9	-55.2	168.5	53.7	-33.7	0	0	0	112.8	R182 M351	R182-D184 WeakPolarHBondContact CA-OD1 3.27Å; R182-D184 IonicContact CZ-OD1 3.79Å; R182-D184 IonicContact CZ-OD2 3.43Å; R182-D184 IonicContact NE-OD1 3.76Å; R182-D184 PolarHBondContact NE-OD1 3.34Å; R182-D184 IonicContact NE-OD2 2.8Å; R182-D184 PolarHBondContact NE-OD2 3.46Å; R182-D184 IonicContact NH2-OD1 3.78Å; R182-D184 IonicContact NH2-OD2 2.7Å; R182-D184 PolarHBondContact NH2-OD2 3.29Å; R182-D184 PolarHBondContact O-N 3.42Å; D184-M351 HydrophobicContact CB-CG 3.82Å
185	L	98.6	Very high	97.8	Very high	49 Å²	49	44.8 Å²	44.8	26%	0.257	25%	0.247	S	C	.	.	H	α-helix	trans	-71.6	-42.9	-177.4	-57.8	-176.6	0	0	0	111.8	R182 R187 D188 D189 L391	R182-L185 HydrophobicContact CB-CB 4.22Å; R182-L185 HydrophobicContact CB-CD1 4.11Å; R182-L185 HydrophobicContact CB-CG 4.18Å; R182-L185 HydrophobicContact CG-CD1 4.4Å; R182-L185 VanDerWaalsContact CZ-CD1 3.47Å; R182-L185 PolarHBondContact O-N 2.79Å; L185-R187 PolarHBondContact O-N 3.23Å; L185-D188 PolarHBondContact O-N 2.87Å; L185-D189 PolarHBondContact O-N 3.21Å; L185-L391 HydrophobicContact CD1-CD1 4.16Å; L185-L391 HydrophobicContact CD1-CD2 3.95Å; L185-L391 HydrophobicContact CD1-CG 4.28Å
186	M	98.7	Very high	98	Very high	22 Å²	22	48.6 Å²	48.6	11%	0.108	26%	0.263	C	S	.	.	H	α-helix	trans	-61.3	-33.8	178.9	-178.5	56.8	68.5	0	0	112	Y176 L180 R182 W183 D189 L190 H281	Y176-M186 HydrophobicContact CE1-CE 3.7Å; L180-M186 HydrophobicContact CD1-CE 4.23Å; R182-M186 PolarHBondContact O-N 2.81Å; W183-M186 HydrophobicContact CE3-CB 4.36Å; W183-M186 HydrophobicContact CE3-CG 4.35Å; W183-M186 HydrophobicContact CZ3-CG 4.44Å; M186-D189 PolarHBondContact O-N 3.12Å; M186-L190 HydrophobicContact CG-CD1 3.78Å; M186-L190 HydrophobicContact CG-CG 4.42Å; M186-L190 WeakPolarHBondContact O-CB 3.4Å; M186-L190 WeakPolarHBondContact O-CD1 3.43Å; M186-L190 VanDerWaalsContact O-CG 3.29Å; M186-L190 WeakPolarHBondContact O-CG 3.41Å; M186-L190 PolarHBondContact O-N 3.21Å; M186-L190 HydrophobicContact SD-CD1 3.87Å; M186-L190 HydrophobicContact SD-CG 3.96Å; M186-H281 WeakPolarHBondContact CG-CD2 3.28Å
187	R	98.7	Very high	98.1	Very high	24 Å²	24	50.2 Å²	50.2	9%	0.091	27%	0.269	C	S	.	.	H	α-helix	trans	-60.2	-46.1	172.2	-77	165.2	70.3	77.4	1.2	111.7	W183 L185 K191 L284 I345 L346 L349	W183-R187 HydrophobicContact CD2-CG 3.69Å; W183-R187 VanDerWaalsContact CE2-CG 3.48Å; W183-R187 HydrophobicContact CE3-CG 3.97Å; W183-R187 HydrophobicContact CG-CG 4.29Å; W183-R187 HydrophobicContact CH2-CG 3.92Å; W183-R187 HydrophobicContact CZ2-CG 3.62Å; W183-R187 HydrophobicContact CZ3-CG 4.06Å; W183-R187 WeakPolarHBondContact O-CB 3.3Å; W183-R187 VanDerWaalsContact O-CD 3.3Å; W183-R187 WeakPolarHBondContact O-CD 3.46Å; W183-R187 WeakPolarHBondContact O-CG 3.47Å; W183-R187 PolarHBondContact O-N 2.61Å; L185-R187 PolarHBondContact O-N 3.23Å; R187-K191 WeakPolarHBondContact O-CB 2.99Å; R187-K191 WeakPolarHBondContact O-CG 3.27Å; R187-K191 PolarHBondContact O-N 2.85Å; R187-L284 HydrophobicContact CB-CD1 4.03Å; R187-L284 HydrophobicContact CG-CD1 3.64Å; R187-I345 PolarHBondContact NH1-O 3.25Å; R187-L346 PolarHBondContact NH2-O 2.96Å; R187-L349 PolarHBondContact NH1-O 3.16Å
188	D	98.6	Very high	98.3	Very high	82 Å²	82	50.1 Å²	50.1	44%	0.439	27%	0.268	S	S	.	.	H	α-helix	trans	-65.8	-41.7	-178.9	-72.5	-20.1	0	0	0	111.4	L185 K191 K192	L185-D188 PolarHBondContact O-N 2.87Å; D188-K191 PolarHBondContact O-N 2.99Å; D188-K192 VanDerWaalsContact O-CG 3.28Å; D188-K192 WeakPolarHBondContact O-CG 3.35Å; D188-K192 PolarHBondContact O-N 2.89Å
189	D	98.8	Very high	98.5	Very high	66 Å²	66	46 Å²	46	35%	0.353	24%	0.242	S	C	.	.	H	α-helix	trans	-68.7	-39.7	179.4	-68.1	-20.6	0	0	0	112.4	L185 M186 K192 S193 V259	L185-D189 PolarHBondContact O-N 3.21Å; M186-D189 PolarHBondContact O-N 3.12Å; D189-K192 PolarHBondContact O-N 2.87Å; D189-K192 IonicContact OD1-NZ 3.17Å; D189-K192 PolarHBondContact OD1-NZ 2.8Å; D189-K192 VanDerWaalsContact OD1-NZ 3.15Å; D189-S193 PolarHBondContact O-N 3.34Å; D189-V259 HydrophobicContact CB-CG1 3.96Å
190	L	98.8	Very high	98.6	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66.2	-38.6	173.5	-73.2	164.6	0	0	0	112.1	W183 M186 S193 A194 L258 V259 H281 L284	W183-L190 HydrophobicContact CZ3-CD1 4.43Å; M186-L190 HydrophobicContact CG-CD1 3.78Å; M186-L190 HydrophobicContact CG-CG 4.42Å; M186-L190 WeakPolarHBondContact O-CB 3.4Å; M186-L190 WeakPolarHBondContact O-CD1 3.43Å; M186-L190 VanDerWaalsContact O-CG 3.29Å; M186-L190 WeakPolarHBondContact O-CG 3.41Å; M186-L190 PolarHBondContact O-N 3.21Å; M186-L190 HydrophobicContact SD-CD1 3.87Å; M186-L190 HydrophobicContact SD-CG 3.96Å; L190-S193 PolarHBondContact O-N 3.05Å; L190-A194 VanDerWaalsContact O-CB 3.32Å; L190-A194 WeakPolarHBondContact O-CB 3.49Å; L190-A194 PolarHBondContact O-N 2.96Å; L190-L258 HydrophobicContact CD2-CB 4.39Å; L190-V259 HydrophobicContact CD2-CG1 4.11Å; L190-V259 HydrophobicContact CG-CG1 4.32Å; L190-H281 HydrophobicContact CD1-CB 3.85Å; L190-L284 HydrophobicContact CB-CB 3.66Å; L190-L284 HydrophobicContact CB-CD1 4.28Å; L190-L284 HydrophobicContact CD1-CB 4.04Å; L190-L284 HydrophobicContact CD1-CD1 4.09Å; L190-L284 HydrophobicContact CG-CB 4.42Å
191	K	98.4	Very high	98.6	Very high	96 Å²	96	61.4 Å²	61.4	42%	0.417	30%	0.301	S	S	.	.	H	α-helix	trans	-62.7	-43.4	174.2	-74.4	172.3	87.8	179.7	0	111.6	R187 D188 A194 A195 L346	R187-K191 WeakPolarHBondContact O-CB 2.99Å; R187-K191 WeakPolarHBondContact O-CG 3.27Å; R187-K191 PolarHBondContact O-N 2.85Å; D188-K191 PolarHBondContact O-N 2.99Å; K191-A194 PolarHBondContact O-N 2.89Å; K191-A195 PolarHBondContact O-N 2.59Å; K191-A195 VanDerWaalsContact O-N 3.09Å; K191-L346 HydrophobicContact CD-CD2 3.48Å; K191-L346 VanDerWaalsContact CD-CD2 3.48Å; K191-L346 VanDerWaalsContact CE-CD2 3.48Å; K191-L346 HydrophobicContact CG-CD2 3.84Å
192	K	98.8	Very high	98.6	Very high	121 Å²	121	61.2 Å²	61.2	53%	0.526	30%	0.296	S	S	.	.	H	α-helix	trans	-61	-45.1	174.5	-70	167.1	-163.9	158.8	0	111.1	D188 D189 A195 Q196	D188-K192 VanDerWaalsContact O-CG 3.28Å; D188-K192 WeakPolarHBondContact O-CG 3.35Å; D188-K192 PolarHBondContact O-N 2.89Å; D189-K192 PolarHBondContact O-N 2.87Å; D189-K192 IonicContact OD1-NZ 3.17Å; D189-K192 PolarHBondContact OD1-NZ 2.8Å; D189-K192 VanDerWaalsContact OD1-NZ 3.15Å; K192-A195 PolarHBondContact O-N 2.89Å; K192-Q196 WeakPolarHBondContact O-CG 3.42Å; K192-Q196 PolarHBondContact O-N 3.1Å
193	S	98.8	Very high	98.6	Very high	11 Å²	11	61.8 Å²	61.8	8%	0.077	30%	0.302	C	S	.	.	H	α-helix	trans	-64.8	-43.6	177.8	-174.6	0	0	0	0	112.3	D189 L190 A195 Q196 W197 V259 C262	D189-S193 PolarHBondContact O-N 3.34Å; L190-S193 PolarHBondContact O-N 3.05Å; S193-A195 VanDerWaalsContact C-N 3.26Å; S193-A195 PolarHBondContact O-N 3.05Å; S193-Q196 WeakPolarHBondContact O-CB 3.46Å; S193-Q196 PolarHBondContact O-N 3.1Å; S193-W197 PolarHBondContact O-N 2.92Å; S193-W197 VanDerWaalsContact O-N 3.13Å; S193-V259 PolarHBondContact OG-O 3.16Å; S193-C262 WeakPolarHBondContact OG-CB 3.34Å
194	A	98.7	Very high	98.6	Very high	12 Å²	12	64.4 Å²	64.4	10%	0.099	32%	0.32	C	S	.	.	H	α-helix	trans	-57.9	-38.7	175.9	0	0	0	0	0	112.4	L190 K191 Q196 W197 L284 C285	L190-A194 VanDerWaalsContact O-CB 3.32Å; L190-A194 WeakPolarHBondContact O-CB 3.49Å; L190-A194 PolarHBondContact O-N 2.96Å; K191-A194 PolarHBondContact O-N 2.89Å; A194-Q196 VanDerWaalsContact C-N 3.32Å; A194-Q196 PolarHBondContact O-N 2.81Å; A194-W197 CarbonylContact O-C 3.41Å; A194-W197 VanDerWaalsContact O-C 3.23Å; A194-W197 PolarHBondContact O-N 3.13Å; A194-L284 VanDerWaalsContact CB-O 3.32Å; A194-L284 WeakPolarHBondContact CB-O 3.36Å; A194-C285 WeakPolarHBondContact CB-O 3.41Å
195	A	98.6	Very high	98.6	Very high	82 Å²	82	65.7 Å²	65.7	68%	0.678	32%	0.321	S	S	*	.	H	α-helix	trans	-66.5	-31.2	175.7	0	0	0	0	0	113.1	K191 K192 S193 W197	K191-A195 PolarHBondContact O-N 2.59Å; K191-A195 VanDerWaalsContact O-N 3.09Å; K192-A195 PolarHBondContact O-N 2.89Å; S193-A195 VanDerWaalsContact C-N 3.26Å; S193-A195 PolarHBondContact O-N 3.05Å; A195-W197 VanDerWaalsContact C-N 3.31Å
196	Q	98.6	Very high	98.6	Very high	121 Å²	121	63.3 Å²	63.3	57%	0.565	31%	0.309	S	S	*	.	H	α-helix	trans	-72.6	-26.7	174.3	-65.3	175	35.4	0	0	112.4	K192 S193 A194 P198 R201	K192-Q196 WeakPolarHBondContact O-CG 3.42Å; K192-Q196 PolarHBondContact O-N 3.1Å; S193-Q196 WeakPolarHBondContact O-CB 3.46Å; S193-Q196 PolarHBondContact O-N 3.1Å; A194-Q196 VanDerWaalsContact C-N 3.32Å; A194-Q196 PolarHBondContact O-N 2.81Å; Q196-P198 VanDerWaalsContact C-CD 3.41Å; Q196-P198 WeakPolarHBondContact O-CD 3.16Å; Q196-R201 PolarHBondContact O-NH1 2.95Å
197	W	98.8	Very high	98.6	Very high	68 Å²	68	62.4 Å²	62.4	26%	0.258	30%	0.304	S	S	.	.	S	Bend	trans	-117.3	68.8	-177	-65.4	108.2	0	0	0	112.1	S193 A194 A195 R201 K202 C262 Q263	S193-W197 PolarHBondContact O-N 2.92Å; S193-W197 VanDerWaalsContact O-N 3.13Å; A194-W197 CarbonylContact O-C 3.41Å; A194-W197 VanDerWaalsContact O-C 3.23Å; A194-W197 PolarHBondContact O-N 3.13Å; A195-W197 VanDerWaalsContact C-N 3.31Å; W197-R201 HydrophobicContact CE3-CB 4.46Å; W197-K202 HydrophobicContact CB-CG 4.27Å; W197-K202 WeakPolarHBondContact O-CE 3.25Å; W197-K202 PolarHBondContact O-NZ 3.4Å; W197-C262 WeakPolarHBondContact CB-O 3.49Å; W197-Q263 HydrophobicContact CD2-CB 3.62Å; W197-Q263 HydrophobicContact CE3-CB 3.93Å; W197-Q263 HydrophobicContact CG-CB 4.12Å; W197-Q263 HydrophobicContact CH2-CB 4.05Å; W197-Q263 HydrophobicContact CZ2-CB 3.76Å; W197-Q263 HydrophobicContact CZ3-CB 4.13Å
198	P	98.6	Very high	98.6	Very high	62 Å²	62	61.3 Å²	61.3	40%	0.403	30%	0.301	S	S	.	.			trans	-60.8	151.9	174.6	28.5	-35.8	0	0	0	110.6	Q196 K200 R201 K202	Q196-P198 VanDerWaalsContact C-CD 3.41Å; Q196-P198 WeakPolarHBondContact O-CD 3.16Å; P198-K200 VanDerWaalsContact C-N 3.29Å; P198-K200 PolarHBondContact O-N 2.94Å; P198-R201 HydrophobicContact CG-CB 4.15Å; P198-R201 HydrophobicContact CG-CG 3.99Å; P198-R201 WeakPolarHBondContact O-CB 3.26Å; P198-R201 PolarHBondContact O-N 3.29Å; P198-K202 PolarHBondContact O-N 3.21Å
199	W	98.8	Very high	98.6	Very high	13 Å²	13	58.5 Å²	58.5	5%	0.049	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-42.9	-48.6	-171.2	-179.2	-101.1	0	0	0	114.9	R201 K202 K265 Y266 L288 D331 A334 Q335 A338	W199-R201 PolarHBondContact O-N 2.82Å; W199-K202 HydrophobicContact CE3-CD 4.42Å; W199-K202 PolarHBondContact O-N 3.13Å; W199-K265 HydrophobicContact CH2-CB 4.44Å; W199-K265 HydrophobicContact CH2-CD 4.42Å; W199-K265 HydrophobicContact CH2-CG 4.5Å; W199-K265 HydrophobicContact CZ2-CD 4Å; W199-K265 WeakPolarHBondContact O-CE 3.38Å; W199-Y266 HydrophobicContact CH2-CE1 4.42Å; W199-L288 HydrophobicContact CH2-CB 3.92Å; W199-L288 HydrophobicContact CZ3-CB 4.12Å; W199-D331 WeakPolarHBondContact CZ2-OD1 3.38Å; W199-D331 VanDerWaalsContact NE1-CG 3.31Å; W199-D331 PolarHBondContact NE1-OD1 3.47Å; W199-D331 PolarHBondContact NE1-OD2 3.01Å; W199-A334 HydrophobicContact CH2-CB 4.06Å; W199-A334 HydrophobicContact CZ2-CB 3.85Å; W199-Q335 HydrophobicContact CB-CG 4.09Å; W199-Q335 HydrophobicContact CD2-CB 3.84Å; W199-Q335 HydrophobicContact CD2-CG 3.74Å; W199-Q335 HydrophobicContact CE3-CB 4.41Å; W199-Q335 HydrophobicContact CE3-CG 4.24Å; W199-Q335 HydrophobicContact CG-CB 4.07Å; W199-Q335 HydrophobicContact CG-CG 3.64Å; W199-Q335 HydrophobicContact CZ2-CB 4.06Å; W199-A338 HydrophobicContact CE3-CB 4.36Å; W199-A338 HydrophobicContact CH2-CB 4.43Å; W199-A338 HydrophobicContact CZ3-CB 3.74Å
200	K	98.4	Very high	98.6	Very high	188 Å²	188	55.5 Å²	55.5	82%	0.817	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-65.6	-19.6	-178.6	-65.4	-173.3	177.1	-176	0	114.7	P198	P198-K200 VanDerWaalsContact C-N 3.29Å; P198-K200 PolarHBondContact O-N 2.94Å
201	R	98.5	Very high	98.6	Very high	158 Å²	158	56.3 Å²	56.3	60%	0.596	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-93.9	-12.4	178.1	-72.3	-177.1	63	-154.9	-2.9	113.4	Q196 W197 P198 W199	Q196-R201 PolarHBondContact O-NH1 2.95Å; W197-R201 HydrophobicContact CE3-CB 4.46Å; P198-R201 HydrophobicContact CG-CB 4.15Å; P198-R201 HydrophobicContact CG-CG 3.99Å; P198-R201 WeakPolarHBondContact O-CB 3.26Å; P198-R201 PolarHBondContact O-N 3.29Å; W199-R201 PolarHBondContact O-N 2.82Å
202	K	98.8	Very high	98.6	Very high	10 Å²	10	55.4 Å²	55.4	4%	0.043	27%	0.268	C	S	.	.	S	Bend	trans	-73.2	145.4	-178.2	-64.5	-178.4	-172.9	-58.9	0	111.1	W197 P198 W199 C262 Q263 K265 C285 G286 S287	W197-K202 HydrophobicContact CB-CG 4.27Å; W197-K202 WeakPolarHBondContact O-CE 3.25Å; W197-K202 PolarHBondContact O-NZ 3.4Å; P198-K202 PolarHBondContact O-N 3.21Å; W199-K202 HydrophobicContact CE3-CD 4.42Å; W199-K202 PolarHBondContact O-N 3.13Å; K202-C262 PolarHBondContact NZ-O 3.31Å; K202-Q263 CarbonylContact C-O 3.53Å; K202-Q263 WeakPolarHBondContact CA-O 3.21Å; K202-Q263 WeakPolarHBondContact CB-O 3.22Å; K202-K265 HydrophobicContact CB-CB 4.34Å; K202-K265 HydrophobicContact CB-CG 3.44Å; K202-K265 VanDerWaalsContact CB-CG 3.44Å; K202-K265 HydrophobicContact CD-CG 4.31Å; K202-C285 PolarHBondContact NZ-O 2.81Å; K202-G286 VanDerWaalsContact CE-O 3.24Å; K202-G286 WeakPolarHBondContact CE-O 3.47Å; K202-S287 WeakPolarHBondContact CE-OG 3.13Å; K202-S287 PolarHBondContact NZ-OG 2.6Å
203	E	98.4	Very high	98.6	Very high	68 Å²	68	52 Å²	52	32%	0.318	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	132.6	174.6	-69.5	-172.2	-145.6	0	0	111.8	R205 Q263 Y264 K265	E203-R205 PolarHBondContact O-N 3.46Å; E203-R205 VanDerWaalsContact O-N 3.15Å; E203-R205 IonicContact OE2-CZ 3.67Å; E203-R205 IonicContact OE2-NE 3.77Å; E203-R205 PolarHBondContact OE2-NE 3.48Å; E203-R205 IonicContact OE2-NH2 3.28Å; E203-R205 PolarHBondContact OE2-NH2 3.18Å; E203-Q263 PolarHBondContact N-O 2.98Å; E203-Y264 HydrophobicContact CB-CD1 3.83Å; E203-Y264 HydrophobicContact CB-CE1 4.27Å; E203-Y264 WeakPolarHBondContact OE2-CE1 3.32Å; E203-K265 WeakPolarHBondContact O-CB 3.35Å; E203-K265 PolarHBondContact O-N 3.01Å
204	S	98.1	Very high	98.5	Very high	56 Å²	56	51.7 Å²	51.7	39%	0.392	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	25.9	-179.6	-55	0	0	0	0	114	Y266 K328	S204-Y266 VanDerWaalsContact O-CE2 3.28Å; S204-Y266 WeakPolarHBondContact O-CE2 3.32Å; S204-K328 WeakPolarHBondContact O-CE 3.31Å
205	R	97.8	Very high	98.5	Very high	70 Å²	70	55.2 Å²	55.2	26%	0.264	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	145.5	172.3	-64.6	-170.6	-66.5	157.7	3.5	109.9	E203 D229 D232	E203-R205 PolarHBondContact O-N 3.46Å; E203-R205 VanDerWaalsContact O-N 3.15Å; E203-R205 IonicContact OE2-CZ 3.67Å; E203-R205 IonicContact OE2-NE 3.77Å; E203-R205 PolarHBondContact OE2-NE 3.48Å; E203-R205 IonicContact OE2-NH2 3.28Å; E203-R205 PolarHBondContact OE2-NH2 3.18Å; R205-D229 WeakPolarHBondContact CG-O 3.33Å; R205-D232 IonicContact CZ-OD2 3.34Å; R205-D232 IonicContact NH1-OD2 3.22Å; R205-D232 IonicContact NH2-OD2 3.15Å
206	G	98.8	Very high	98.5	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	137.9	164.7	0	0	0	0	0	111	L230 V231 D232 Y266	G206-L230 PolarHBondContact N-O 3.04Å; G206-V231 CarbonylContact O-C 3.47Å; G206-V231 WeakPolarHBondContact O-CA 3.41Å; G206-D232 PolarHBondContact O-N 3.3Å; G206-Y266 CarbonylContact C-O 3.54Å
207	F	98.9	Very high	98.5	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.009	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	136	-178	-175.6	-101.7	0	0	0	114.1	R209 D232 I256 H261 Y264 Y266 L267 F268	F207-R209 HydrophobicContact CE1-CG 4.15Å; F207-R209 HydrophobicContact CE2-CG 4.07Å; F207-R209 HydrophobicContact CZ-CB 4.41Å; F207-R209 HydrophobicContact CZ-CG 3.53Å; F207-D232 WeakPolarHBondContact CA-O 3.35Å; F207-D232 HydrophobicContact CD2-CB 4.13Å; F207-D232 WeakPolarHBondContact CD2-O 3.5Å; F207-I256 HydrophobicContact CE2-CD1 4.44Å; F207-I256 HydrophobicContact CZ-CD1 3.96Å; F207-I256 HydrophobicContact CZ-CG2 4.41Å; F207-H261 HydrophobicContact CD1-CB 4.34Å; F207-H261 AromaticContact CD1-CD2 3.85Å; F207-H261 HydrophobicContact CE1-CB 4.17Å; F207-H261 AromaticContact CE1-CD2 3.5Å; F207-H261 VanDerWaalsContact CE1-CD2 3.5Å; F207-H261 WeakPolarHBondContact CE1-CD2 3.23Å; F207-H261 AromaticContact CE1-CE1 3.82Å; F207-H261 AromaticContact CE1-CG 3.59Å; F207-H261 AromaticContact CE1-ND1 3.8Å; F207-H261 AromaticContact CE1-NE2 3.67Å; F207-Y264 HydrophobicContact CB-CD1 3.71Å; F207-Y264 HydrophobicContact CB-CD2 3.8Å; F207-Y264 HydrophobicContact CB-CE1 4.28Å; F207-Y264 HydrophobicContact CB-CE2 4.36Å; F207-Y264 HydrophobicContact CB-CG 3.44Å; F207-Y264 VanDerWaalsContact CB-CG 3.44Å; F207-Y264 AromaticContact CD1-CD2 3.62Å; F207-Y264 HydrophobicContact CD1-CD2 3.62Å; F207-Y264 AromaticContact CD1-CE2 3.91Å; F207-Y264 HydrophobicContact CD1-CE2 3.91Å; F207-Y264 HydrophobicContact CD1-CG 4.19Å; F207-Y264 AromaticContact CD2-CD1 3.96Å; F207-Y264 HydrophobicContact CD2-CD1 3.96Å; F207-Y264 AromaticContact CD2-CD2 3.68Å; F207-Y264 HydrophobicContact CD2-CD2 3.68Å; F207-Y264 AromaticContact CD2-CE1 3.64Å; F207-Y264 HydrophobicContact CD2-CE1 3.64Å; F207-Y264 AromaticContact CD2-CE2 3.36Å; F207-Y264 HydrophobicContact CD2-CE2 3.36Å; F207-Y264 AromaticContact CD2-CG 3.98Å; F207-Y264 HydrophobicContact CD2-CG 3.98Å; F207-Y264 AromaticContact CD2-CZ 3.32Å; F207-Y264 HydrophobicContact CE1-CD2 4.04Å; F207-Y264 AromaticContact CE1-CE2 3.94Å; F207-Y264 HydrophobicContact CE1-CE2 3.94Å; F207-Y264 HydrophobicContact CE2-CD2 4.1Å; F207-Y264 HydrophobicContact CE2-CE1 4.25Å; F207-Y264 AromaticContact CE2-CE2 3.39Å; F207-Y264 HydrophobicContact CE2-CE2 3.39Å; F207-Y264 AromaticContact CE2-CZ 3.48Å; F207-Y264 VanDerWaalsContact CE2-CZ 3.48Å; F207-Y264 WeakPolarHBondContact CE2-OH 3.41Å; F207-Y264 AromaticContact CG-CD1 3.98Å; F207-Y264 HydrophobicContact CG-CD1 3.98Å; F207-Y264 AromaticContact CG-CD2 3.4Å; F207-Y264 HydrophobicContact CG-CD2 3.4Å; F207-Y264 VanDerWaalsContact CG-CD2 3.4Å; F207-Y264 HydrophobicContact CG-CE1 4.14Å; F207-Y264 AromaticContact CG-CE2 3.61Å; F207-Y264 HydrophobicContact CG-CE2 3.61Å; F207-Y264 AromaticContact CG-CG 3.61Å; F207-Y264 HydrophobicContact CG-CG 3.61Å; F207-Y264 AromaticContact CG-CZ 3.97Å; F207-Y264 HydrophobicContact CZ-CD2 4.25Å; F207-Y264 AromaticContact CZ-CE2 3.68Å; F207-Y264 HydrophobicContact CZ-CE2 3.68Å; F207-Y266 PolarHBondContact N-O 3.49Å; F207-L267 HydrophobicContact CB-CD2 4.05Å; F207-L267 HydrophobicContact CD1-CD2 3.92Å; F207-L267 HydrophobicContact CG-CD2 4.47Å; F207-F268 PolarHBondContact O-N 2.87Å; F207-F268 VanDerWaalsContact O-N 3.15Å
208	F	98.9	Very high	98.5	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.009	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	134	172.1	178.6	-95	0	0	0	111.9	R217 L220 D232 A233 E234 F268 F270	F208-R217 HydrophobicContact CZ-CG 4.45Å; F208-L220 HydrophobicContact CB-CD2 3.72Å; F208-L220 HydrophobicContact CG-CD2 4.17Å; F208-D232 PolarHBondContact N-O 3.36Å; F208-A233 HydrophobicContact CB-CB 3.84Å; F208-A233 WeakPolarHBondContact O-CA 3.05Å; F208-E234 PolarHBondContact O-N 2.92Å; F208-F268 HydrophobicContact CB-CB 4.35Å; F208-F268 HydrophobicContact CD2-CB 4.39Å; F208-F270 HydrophobicContact CD2-CD2 4.11Å; F208-F270 HydrophobicContact CD2-CE2 4.19Å; F208-F270 AromaticContact CE2-CD2 3.92Å; F208-F270 HydrophobicContact CE2-CD2 3.92Å; F208-F270 HydrophobicContact CE2-CE2 4.39Å
209	R	98.8	Very high	98.5	Very high	22 Å²	22	44.8 Å²	44.8	8%	0.083	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	125.3	163.2	-71.3	-66.8	-177.3	-79.8	5.2	109.7	F207 D232 E234 T236 I256 R278	F207-R209 HydrophobicContact CE1-CG 4.15Å; F207-R209 HydrophobicContact CE2-CG 4.07Å; F207-R209 HydrophobicContact CZ-CB 4.41Å; F207-R209 HydrophobicContact CZ-CG 3.53Å; R209-D232 IonicContact CZ-OD1 2.96Å; R209-D232 PolarHBondContact NH1-O 3.49Å; R209-D232 VanDerWaalsContact NH1-O 3.17Å; R209-D232 IonicContact NH1-OD1 2.92Å; R209-D232 PolarHBondContact NH1-OD1 3.41Å; R209-D232 IonicContact NH2-OD1 2.82Å; R209-D232 PolarHBondContact NH2-OD1 3.19Å; R209-D232 IonicContact NH2-OD2 3.65Å; R209-E234 IonicContact CZ-OE2 3.08Å; R209-E234 IonicContact NE-OE2 3.52Å; R209-E234 IonicContact NH2-OE2 2.64Å; R209-E234 PolarHBondContact NH2-OE2 2.78Å; R209-T236 HydrophobicContact CB-CG2 4.39Å; R209-I256 HydrophobicContact CB-CB 4.45Å; R209-I256 HydrophobicContact CG-CB 4.14Å; R209-I256 HydrophobicContact CG-CD1 3.89Å; R209-I256 HydrophobicContact CG-CG1 4.02Å; R209-R278 PolarHBondContact O-NH2 3.4Å
210	G	98.4	Very high	98.5	Very high	4 Å²	4	44.2 Å²	44.2	4%	0.041	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.5	167	175.6	0	0	0	0	0	111.9	Y235 T236	G210-Y235 WeakPolarHBondContact O-CA 3.44Å; G210-Y235 VanDerWaalsContact O-CD1 3.31Å; G210-Y235 WeakPolarHBondContact O-CD1 3.36Å; G210-T236 WeakPolarHBondContact CA-OG1 3.32Å; G210-T236 PolarHBondContact O-N 2.92Å; G210-T236 VanDerWaalsContact O-N 3.09Å
211	S	98.4	Very high	98.5	Very high	17 Å²	17	35.4 Å²	35.4	12%	0.119	18%	0.177	C	C	.	.			trans	-80.4	166.2	-178.4	66.6	0	0	0	0	113.7	T213 R217 T236 N238	S211-T213 VanDerWaalsContact C-N 3.3Å; S211-T213 PolarHBondContact O-N 2.05Å; S211-R217 PolarHBondContact O-NH1 3.27Å; S211-T236 WeakPolarHBondContact CA-O 3.21Å; S211-T236 WeakPolarHBondContact CB-O 3.32Å; S211-T236 PolarHBondContact N-OG1 3.23Å; S211-N238 WeakPolarHBondContact CB-ND2 3.04Å; S211-N238 PolarHBondContact OG-ND2 3.32Å; S211-N238 VanDerWaalsContact OG-ND2 3.12Å
212	R	98.4	Very high	98.6	Very high	77 Å²	77	32.2 Å²	32.2	29%	0.291	17%	0.171	S	C	.	.			trans	-78.7	64.7	177.8	-167.1	168.3	-178.3	-99.9	-2.6	113.7	S214 D218 Y235 D246	R212-S214 VanDerWaalsContact C-N 3.32Å; R212-D218 WeakPolarHBondContact CD-OD1 3.38Å; R212-D218 IonicContact CZ-OD1 2.91Å; R212-D218 IonicContact CZ-OD2 2.69Å; R212-D218 IonicContact NE-OD1 3.46Å; R212-D218 PolarHBondContact NE-OD1 2.8Å; R212-D218 IonicContact NE-OD2 3.7Å; R212-D218 PolarHBondContact NE-OD2 3.16Å; R212-D218 IonicContact NH2-OD1 2.69Å; R212-D218 IonicContact NH2-OD2 2.96Å; R212-D218 PolarHBondContact NH2-OD2 3.21Å; R212-Y235 VanDerWaalsContact CA-CE1 3.45Å; R212-Y235 HydrophobicContact CB-CD1 3.79Å; R212-Y235 HydrophobicContact CB-CD2 4.32Å; R212-Y235 HydrophobicContact CB-CE1 3.59Å; R212-Y235 HydrophobicContact CB-CE2 4.09Å; R212-Y235 HydrophobicContact CB-CG 4.18Å; R212-Y235 HydrophobicContact CG-CE1 3.96Å; R212-Y235 HydrophobicContact CG-CE2 3.94Å; R212-D246 WeakPolarHBondContact CB-O 3.44Å; R212-D246 WeakPolarHBondContact CD-O 3.44Å
213	T	98.1	Very high	98.5	Very high	48 Å²	48	32.3 Å²	32.3	29%	0.294	17%	0.172	S	C	.	.	S	Bend	trans	-81.8	-8.2	176.3	49.3	0	0	0	0	114	S211 R217 G272	S211-T213 VanDerWaalsContact C-N 3.3Å; S211-T213 PolarHBondContact O-N 2.05Å; T213-R217 PolarHBondContact OG1-NH1 3.36Å; T213-R217 PolarHBondContact OG1-NH2 3.13Å; T213-R217 VanDerWaalsContact OG1-NH2 3.08Å; T213-G272 CarbonylContact O-C 3.6Å; T213-G272 VanDerWaalsContact OG1-CA 3.23Å; T213-G272 WeakPolarHBondContact OG1-CA 3.25Å
214	S	98.3	Very high	98.6	Very high	5 Å²	5	29.5 Å²	29.5	4%	0.035	16%	0.16	C	C	.	.	S	Bend	trans	-149.3	138.7	170.9	175.4	0	0	0	0	108.4	R212 E216 R217	R212-S214 VanDerWaalsContact C-N 3.32Å; S214-E216 PolarHBondContact O-N 2.68Å; S214-E216 PolarHBondContact OG-N 3.38Å; S214-R217 PolarHBondContact O-N 3.42Å
215	P	98.3	Very high	98.6	Very high	86 Å²	86	31.4 Å²	31.4	56%	0.558	16%	0.159	S	C	*	.	G	3₁₀ helix	trans	-66.3	-16.4	173.6	28.9	-35.1	0	0	0	113.2	R217 D218	P215-R217 PolarHBondContact O-N 3.22Å; P215-D218 WeakPolarHBondContact O-CB 3.39Å; P215-D218 PolarHBondContact O-N 3.38Å
216	E	98.6	Very high	98.6	Very high	37 Å²	37	34.9 Å²	34.9	17%	0.173	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-61.6	-15.3	174.6	-68.4	173.5	-160.5	0	0	113.6	S214 P219 F270 R271 Q315	S214-E216 PolarHBondContact O-N 2.68Å; S214-E216 PolarHBondContact OG-N 3.38Å; E216-P219 WeakPolarHBondContact O-CD 3.42Å; E216-F270 WeakPolarHBondContact O-CE1 3.49Å; E216-R271 VanDerWaalsContact OE2-CD 3.29Å; E216-R271 WeakPolarHBondContact OE2-CD 3.49Å; E216-R271 WeakPolarHBondContact OE2-CG 3.1Å; E216-Q315 HydrophobicContact CG-CG 4.16Å; E216-Q315 PolarHBondContact OE1-NE2 3.19Å
217	R	98.8	Very high	98.6	Very high	5 Å²	5	35.9 Å²	35.9	2%	0.019	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-80.7	-17.8	173.9	-67.5	171.2	-171.3	-162.8	-1.6	112.7	F208 S211 T213 S214 P215 L220 V221 Y235 F270 R271	F208-R217 HydrophobicContact CZ-CG 4.45Å; S211-R217 PolarHBondContact O-NH1 3.27Å; T213-R217 PolarHBondContact OG1-NH1 3.36Å; T213-R217 PolarHBondContact OG1-NH2 3.13Å; T213-R217 VanDerWaalsContact OG1-NH2 3.08Å; S214-R217 PolarHBondContact O-N 3.42Å; P215-R217 PolarHBondContact O-N 3.22Å; R217-L220 PolarHBondContact O-N 3.06Å; R217-V221 PolarHBondContact O-N 3.21Å; R217-Y235 HydrophobicContact CB-CE1 3.89Å; R217-Y235 WeakPolarHBondContact CB-OH 3.27Å; R217-F270 HydrophobicContact CB-CD1 4.45Å; R217-F270 HydrophobicContact CG-CB 3.65Å; R217-F270 HydrophobicContact CG-CD1 3.78Å; R217-F270 HydrophobicContact CG-CD2 3.98Å; R217-F270 HydrophobicContact CG-CE1 4.36Å; R217-F270 HydrophobicContact CG-CG 3.56Å; R217-R271 PolarHBondContact NE-O 3.21Å; R217-R271 PolarHBondContact NH2-O 2.82Å
218	D	98.8	Very high	98.5	Very high	22 Å²	22	39.2 Å²	39.2	12%	0.118	21%	0.208	C	C	.	.	H	α-helix	trans	-59	-45	-173.5	-66.9	-15.9	0	0	0	113	R212 P215 L220 V221 L222 Y235 L248	R212-D218 WeakPolarHBondContact CD-OD1 3.38Å; R212-D218 IonicContact CZ-OD1 2.91Å; R212-D218 IonicContact CZ-OD2 2.69Å; R212-D218 IonicContact NE-OD1 3.46Å; R212-D218 PolarHBondContact NE-OD1 2.8Å; R212-D218 IonicContact NE-OD2 3.7Å; R212-D218 PolarHBondContact NE-OD2 3.16Å; R212-D218 IonicContact NH2-OD1 2.69Å; R212-D218 IonicContact NH2-OD2 2.96Å; R212-D218 PolarHBondContact NH2-OD2 3.21Å; P215-D218 WeakPolarHBondContact O-CB 3.39Å; P215-D218 PolarHBondContact O-N 3.38Å; D218-L220 PolarHBondContact O-N 3.22Å; D218-V221 PolarHBondContact O-N 3.37Å; D218-V221 VanDerWaalsContact O-N 3.14Å; D218-L222 WeakPolarHBondContact O-CG 3.45Å; D218-L222 PolarHBondContact O-N 2.95Å; D218-Y235 PolarHBondContact N-OH 3.25Å; D218-Y235 VanDerWaalsContact N-OH 3.11Å; D218-Y235 WeakPolarHBondContact OD1-CE2 3.37Å; D218-Y235 PolarHBondContact OD1-OH 3.26Å; D218-L248 HydrophobicContact CB-CD1 3.93Å
219	P	98.8	Very high	98.4	Very high	51 Å²	51	45.8 Å²	45.8	33%	0.331	24%	0.243	S	C	.	.	H	α-helix	trans	-62.2	-30.8	-176.9	-20.6	32.9	0	0	0	113	E216 L223 L317	E216-P219 WeakPolarHBondContact O-CD 3.42Å; P219-L223 VanDerWaalsContact O-CB 3.22Å; P219-L223 WeakPolarHBondContact O-CB 3.43Å; P219-L223 PolarHBondContact O-N 3.34Å; P219-L317 HydrophobicContact CB-CB 4.28Å; P219-L317 HydrophobicContact CB-CD2 4.06Å; P219-L317 HydrophobicContact CG-CD1 4.46Å
220	L	98.8	Very high	98.4	Very high	1 Å²	1	46 Å²	46	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-69.8	-43.2	175.7	-173.7	71.1	0	0	0	112	F208 R217 D218 L222 L223 S224 V231 A233 F268 F270 L317 L320	F208-L220 HydrophobicContact CB-CD2 3.72Å; F208-L220 HydrophobicContact CG-CD2 4.17Å; R217-L220 PolarHBondContact O-N 3.06Å; D218-L220 PolarHBondContact O-N 3.22Å; L220-L222 VanDerWaalsContact C-N 3.34Å; L220-L223 WeakPolarHBondContact O-CB 3.38Å; L220-L223 PolarHBondContact O-N 2.92Å; L220-S224 PolarHBondContact O-N 3.05Å; L220-V231 HydrophobicContact CD1-CG1 3.67Å; L220-V231 HydrophobicContact CD1-CG2 4.24Å; L220-V231 HydrophobicContact CG-CG1 4.04Å; L220-A233 HydrophobicContact CD2-CB 3.79Å; L220-A233 HydrophobicContact CG-CB 3.67Å; L220-F268 HydrophobicContact CD1-CD1 4.26Å; L220-F268 HydrophobicContact CD1-CD2 4.15Å; L220-F268 HydrophobicContact CD1-CE1 4.21Å; L220-F268 HydrophobicContact CD1-CE2 4.08Å; L220-F268 HydrophobicContact CD1-CG 4.26Å; L220-F268 HydrophobicContact CD1-CZ 4.14Å; L220-F268 HydrophobicContact CD2-CB 3.79Å; L220-F268 HydrophobicContact CD2-CD1 4.18Å; L220-F268 HydrophobicContact CD2-CD2 3.84Å; L220-F268 HydrophobicContact CD2-CG 3.64Å; L220-F270 HydrophobicContact CB-CE2 4.42Å; L220-F270 HydrophobicContact CB-CZ 3.77Å; L220-F270 HydrophobicContact CD2-CE2 3.46Å; L220-F270 VanDerWaalsContact CD2-CE2 3.46Å; L220-F270 HydrophobicContact CD2-CZ 3.61Å; L220-F270 HydrophobicContact CG-CZ 4.23Å; L220-L317 HydrophobicContact CB-CD2 3.71Å; L220-L317 HydrophobicContact CD1-CD2 4.49Å; L220-L320 HydrophobicContact CD1-CD2 3.5Å
221	V	98.8	Very high	98.4	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.012	24%	0.244	C	C	.	.	H	α-helix	trans	-67.4	-38.4	178.2	175.7	0	0	0	0	110.6	R217 D218 S224 R225 Y235 L248	R217-V221 PolarHBondContact O-N 3.21Å; D218-V221 PolarHBondContact O-N 3.37Å; D218-V221 VanDerWaalsContact O-N 3.14Å; V221-S224 PolarHBondContact O-N 3.35Å; V221-R225 VanDerWaalsContact O-CG 3.31Å; V221-R225 WeakPolarHBondContact O-CG 3.36Å; V221-R225 PolarHBondContact O-N 3.06Å; V221-R225 VanDerWaalsContact O-N 3.13Å; V221-Y235 HydrophobicContact CB-CD2 4.27Å; V221-Y235 HydrophobicContact CB-CE2 4.05Å; V221-Y235 HydrophobicContact CG1-CD2 3.95Å; V221-Y235 HydrophobicContact CG1-CE2 4.18Å; V221-Y235 HydrophobicContact CG2-CD1 4.28Å; V221-Y235 HydrophobicContact CG2-CD2 3.91Å; V221-Y235 HydrophobicContact CG2-CE1 4.1Å; V221-Y235 HydrophobicContact CG2-CE2 3.74Å; V221-Y235 HydrophobicContact CG2-CG 4.18Å; V221-L248 HydrophobicContact CG1-CD1 4.42Å
222	L	98.7	Very high	98.4	Very high	91 Å²	91	46 Å²	46	48%	0.476	24%	0.244	S	C	.	.	H	α-helix	trans	-66.1	-41.7	173.7	-66.3	175.5	0	0	0	111.6	D218 L220 S224 R225 E226 L248	D218-L222 WeakPolarHBondContact O-CG 3.45Å; D218-L222 PolarHBondContact O-N 2.95Å; L220-L222 VanDerWaalsContact C-N 3.34Å; L222-S224 VanDerWaalsContact C-N 3.33Å; L222-S224 PolarHBondContact O-N 3.41Å; L222-R225 PolarHBondContact O-N 3.33Å; L222-E226 PolarHBondContact O-N 3.02Å; L222-L248 HydrophobicContact CD2-CD1 4.19Å; L222-L248 HydrophobicContact CG-CD1 4.23Å
223	L	98.6	Very high	98.4	Very high	12 Å²	12	42.4 Å²	42.4	6%	0.063	23%	0.23	C	C	.	.	H	α-helix	trans	-59.7	-42.5	173.3	174.8	60.8	0	0	0	112	P219 L220 R225 E226 A227 L230 V231 L320 R321	P219-L223 VanDerWaalsContact O-CB 3.22Å; P219-L223 WeakPolarHBondContact O-CB 3.43Å; P219-L223 PolarHBondContact O-N 3.34Å; L220-L223 WeakPolarHBondContact O-CB 3.38Å; L220-L223 PolarHBondContact O-N 2.92Å; L223-R225 VanDerWaalsContact C-N 3.31Å; L223-R225 PolarHBondContact O-N 3.43Å; L223-E226 PolarHBondContact O-N 3.25Å; L223-A227 HydrophobicContact CD1-CB 4.38Å; L223-A227 PolarHBondContact O-N 2.93Å; L223-L230 HydrophobicContact CD1-CD2 4.3Å; L223-V231 HydrophobicContact CD2-CG2 3.82Å; L223-V231 HydrophobicContact CG-CG2 4.14Å; L223-L320 HydrophobicContact CD2-CD2 3.57Å; L223-L320 HydrophobicContact CD2-CG 4.17Å; L223-R321 HydrophobicContact CD1-CG 4.38Å; L223-R321 HydrophobicContact CD2-CG 4.49Å
224	S	98.8	Very high	98.5	Very high	10 Å²	10	44.2 Å²	44.2	7%	0.07	24%	0.236	C	C	.	.	H	α-helix	trans	-63.1	-37.9	177.1	-179.6	0	0	0	0	112.5	L220 V221 L222 E226 A227 P228 V231 D232 A233	L220-S224 PolarHBondContact O-N 3.05Å; V221-S224 PolarHBondContact O-N 3.35Å; L222-S224 VanDerWaalsContact C-N 3.33Å; L222-S224 PolarHBondContact O-N 3.41Å; S224-E226 VanDerWaalsContact C-N 3.34Å; S224-A227 CarbonylContact O-C 3.48Å; S224-P228 VanDerWaalsContact O-CA 3.26Å; S224-P228 WeakPolarHBondContact O-CA 3.47Å; S224-P228 VanDerWaalsContact O-N 3.14Å; S224-V231 WeakPolarHBondContact CA-O 3.42Å; S224-V231 VanDerWaalsContact CB-O 3.26Å; S224-V231 WeakPolarHBondContact CB-O 3.45Å; S224-V231 PolarHBondContact OG-O 3.46Å; S224-D232 WeakPolarHBondContact OG-CA 3.49Å; S224-A233 WeakPolarHBondContact CB-O 3.5Å; S224-A233 PolarHBondContact OG-N 3.3Å
225	R	98.4	Very high	98.5	Very high	95 Å²	95	44.3 Å²	44.3	36%	0.358	24%	0.235	S	C	.	.	H	α-helix	trans	-67.2	-34.9	174.7	-67.8	166.1	-176.8	-168.7	-1	112.6	V221 L222 L223 T247 L248 R250	V221-R225 VanDerWaalsContact O-CG 3.31Å; V221-R225 WeakPolarHBondContact O-CG 3.36Å; V221-R225 PolarHBondContact O-N 3.06Å; V221-R225 VanDerWaalsContact O-N 3.13Å; L222-R225 PolarHBondContact O-N 3.33Å; L223-R225 VanDerWaalsContact C-N 3.31Å; L223-R225 PolarHBondContact O-N 3.43Å; R225-T247 PolarHBondContact NH2-O 3.17Å; R225-L248 PolarHBondContact NH1-O 3.16Å; R225-L248 PolarHBondContact NH2-O 3.14Å; R225-R250 VanDerWaalsContact NH2-CG 3.32Å
226	E	98.4	Very high	98.5	Very high	143 Å²	143	40.7 Å²	40.7	67%	0.668	21%	0.211	S	C	*	.	H	α-helix	trans	-76.7	-41.5	178.5	-167.9	-157	138.1	0	0	112	L222 L223 S224 R321	L222-E226 PolarHBondContact O-N 3.02Å; L223-E226 PolarHBondContact O-N 3.25Å; S224-E226 VanDerWaalsContact C-N 3.34Å; E226-R321 IonicContact OE1-CZ 2.58Å; E226-R321 IonicContact OE1-NH2 3.76Å; E226-R321 PolarHBondContact OE1-NH2 3.49Å; E226-R321 IonicContact OE2-NH2 3.06Å; E226-R321 PolarHBondContact OE2-NH2 3.36Å
227	A	98.3	Very high	98.4	Very high	22 Å²	22	42.8 Å²	42.8	18%	0.182	22%	0.22	C	C	.	.			trans	-136.7	73.2	-172.6	0	0	0	0	0	111.2	L223 S224 D229 L230 V231	L223-A227 HydrophobicContact CD1-CB 4.38Å; L223-A227 PolarHBondContact O-N 2.93Å; S224-A227 CarbonylContact O-C 3.48Å; A227-D229 PolarHBondContact O-N 2.94Å; A227-L230 HydrophobicContact CB-CB 4.01Å; A227-L230 WeakPolarHBondContact O-CB 3.32Å; A227-L230 PolarHBondContact O-N 2.93Å; A227-V231 PolarHBondContact O-N 3.46Å
228	P	97.7	Very high	98.1	Very high	71 Å²	71	45.4 Å²	45.4	46%	0.461	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-21.5	-175.4	25.2	-35.2	0	0	0	114.1	S224 L230	S224-P228 VanDerWaalsContact O-CA 3.26Å; S224-P228 WeakPolarHBondContact O-CA 3.47Å; S224-P228 VanDerWaalsContact O-N 3.14Å; P228-L230 VanDerWaalsContact C-N 3.27Å
229	D	96.8	Very high	97.7	Very high	141 Å²	141	52.5 Å²	52.5	75%	0.754	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-16.2	173.1	-63	-31.1	0	0	0	112.7	R205 A227	R205-D229 WeakPolarHBondContact CG-O 3.33Å; A227-D229 PolarHBondContact O-N 2.94Å
230	L	98	Very high	97.4	Very high	26 Å²	26	53.5 Å²	53.5	14%	0.136	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-45.8	177.7	-176.3	60.4	0	0	0	111.5	G206 L223 A227 P228 R321 L324	G206-L230 PolarHBondContact N-O 3.04Å; L223-L230 HydrophobicContact CD1-CD2 4.3Å; A227-L230 HydrophobicContact CB-CB 4.01Å; A227-L230 WeakPolarHBondContact O-CB 3.32Å; A227-L230 PolarHBondContact O-N 2.93Å; P228-L230 VanDerWaalsContact C-N 3.27Å; L230-R321 HydrophobicContact CD2-CG 4.24Å; L230-L324 HydrophobicContact CD1-CB 4.2Å; L230-L324 HydrophobicContact CD1-CD1 3.95Å; L230-L324 HydrophobicContact CD2-CD1 4.3Å; L230-L324 HydrophobicContact CG-CD1 3.92Å
231	V	98.6	Very high	97.2	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	136.1	-177.2	-177.7	0	0	0	0	110.2	G206 L220 L223 S224 A227 A233 L324	G206-V231 CarbonylContact O-C 3.47Å; G206-V231 WeakPolarHBondContact O-CA 3.41Å; L220-V231 HydrophobicContact CD1-CG1 3.67Å; L220-V231 HydrophobicContact CD1-CG2 4.24Å; L220-V231 HydrophobicContact CG-CG1 4.04Å; L223-V231 HydrophobicContact CD2-CG2 3.82Å; L223-V231 HydrophobicContact CG-CG2 4.14Å; S224-V231 WeakPolarHBondContact CA-O 3.42Å; S224-V231 VanDerWaalsContact CB-O 3.26Å; S224-V231 WeakPolarHBondContact CB-O 3.45Å; S224-V231 PolarHBondContact OG-O 3.46Å; A227-V231 PolarHBondContact O-N 3.46Å; V231-A233 HydrophobicContact CG1-CB 3.58Å; V231-L324 HydrophobicContact CG2-CD1 3.82Å
232	D	98.8	Very high	97	Very high	21 Å²	21	66 Å²	66	11%	0.112	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	90	167.3	-174.4	-10.2	0	0	0	109	R205 G206 F207 F208 R209 S224	R205-D232 IonicContact CZ-OD2 3.34Å; R205-D232 IonicContact NH1-OD2 3.22Å; R205-D232 IonicContact NH2-OD2 3.15Å; G206-D232 PolarHBondContact O-N 3.3Å; F207-D232 WeakPolarHBondContact CA-O 3.35Å; F207-D232 HydrophobicContact CD2-CB 4.13Å; F207-D232 WeakPolarHBondContact CD2-O 3.5Å; F208-D232 PolarHBondContact N-O 3.36Å; R209-D232 IonicContact CZ-OD1 2.96Å; R209-D232 PolarHBondContact NH1-O 3.49Å; R209-D232 VanDerWaalsContact NH1-O 3.17Å; R209-D232 IonicContact NH1-OD1 2.92Å; R209-D232 PolarHBondContact NH1-OD1 3.41Å; R209-D232 IonicContact NH2-OD1 2.82Å; R209-D232 PolarHBondContact NH2-OD1 3.19Å; R209-D232 IonicContact NH2-OD2 3.65Å; S224-D232 WeakPolarHBondContact OG-CA 3.49Å
233	A	98.9	Very high	96.9	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.008	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	117.5	-176.3	0	0	0	0	0	111.3	F208 L220 S224 V231	F208-A233 HydrophobicContact CB-CB 3.84Å; F208-A233 WeakPolarHBondContact O-CA 3.05Å; L220-A233 HydrophobicContact CD2-CB 3.79Å; L220-A233 HydrophobicContact CG-CB 3.67Å; S224-A233 WeakPolarHBondContact CB-O 3.5Å; S224-A233 PolarHBondContact OG-N 3.3Å; V231-A233 HydrophobicContact CG1-CB 3.58Å
234	E	98.8	Very high	96.8	Very high	87 Å²	87	68 Å²	68	41%	0.407	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	150.2	-176.2	-57	-175.8	152.7	0	0	112.5	F208 R209 A253	F208-E234 PolarHBondContact O-N 2.92Å; R209-E234 IonicContact CZ-OE2 3.08Å; R209-E234 IonicContact NE-OE2 3.52Å; R209-E234 IonicContact NH2-OE2 2.64Å; R209-E234 PolarHBondContact NH2-OE2 2.78Å; E234-A253 HydrophobicContact CB-CB 3.52Å; E234-A253 HydrophobicContact CG-CB 4.45Å; E234-A253 WeakPolarHBondContact OE2-CB 3.15Å
235	Y	98.8	Very high	96.6	Very high	6 Å²	6	75 Å²	75	2%	0.024	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	124.3	177	-78.7	-50.9	0	0	0	112.1	G210 R212 R217 D218 V221 L248 P252 A253	G210-Y235 WeakPolarHBondContact O-CA 3.44Å; G210-Y235 VanDerWaalsContact O-CD1 3.31Å; G210-Y235 WeakPolarHBondContact O-CD1 3.36Å; R212-Y235 VanDerWaalsContact CA-CE1 3.45Å; R212-Y235 HydrophobicContact CB-CD1 3.79Å; R212-Y235 HydrophobicContact CB-CD2 4.32Å; R212-Y235 HydrophobicContact CB-CE1 3.59Å; R212-Y235 HydrophobicContact CB-CE2 4.09Å; R212-Y235 HydrophobicContact CB-CG 4.18Å; R212-Y235 HydrophobicContact CG-CE1 3.96Å; R212-Y235 HydrophobicContact CG-CE2 3.94Å; R217-Y235 HydrophobicContact CB-CE1 3.89Å; R217-Y235 WeakPolarHBondContact CB-OH 3.27Å; D218-Y235 PolarHBondContact N-OH 3.25Å; D218-Y235 VanDerWaalsContact N-OH 3.11Å; D218-Y235 WeakPolarHBondContact OD1-CE2 3.37Å; D218-Y235 PolarHBondContact OD1-OH 3.26Å; V221-Y235 HydrophobicContact CB-CD2 4.27Å; V221-Y235 HydrophobicContact CB-CE2 4.05Å; V221-Y235 HydrophobicContact CG1-CD2 3.95Å; V221-Y235 HydrophobicContact CG1-CE2 4.18Å; V221-Y235 HydrophobicContact CG2-CD1 4.28Å; V221-Y235 HydrophobicContact CG2-CD2 3.91Å; V221-Y235 HydrophobicContact CG2-CE1 4.1Å; V221-Y235 HydrophobicContact CG2-CE2 3.74Å; V221-Y235 HydrophobicContact CG2-CG 4.18Å; Y235-L248 HydrophobicContact CD2-CD1 4.22Å; Y235-L248 HydrophobicContact CD2-CG 4.07Å; Y235-L248 HydrophobicContact CE2-CD1 3.61Å; Y235-L248 HydrophobicContact CE2-CG 3.7Å; Y235-P252 WeakPolarHBondContact O-CA 3.48Å; Y235-A253 PolarHBondContact O-N 2.74Å
236	T	98.4	Very high	96.5	Very high	10 Å²	10	72.9 Å²	72.9	6%	0.061	37%	0.368	C	S	.	.			trans	-89.9	174.4	168.9	69.1	0	0	0	0	111	R209 G210 S211 A253 E255	R209-T236 HydrophobicContact CB-CG2 4.39Å; G210-T236 WeakPolarHBondContact CA-OG1 3.32Å; G210-T236 PolarHBondContact O-N 2.92Å; G210-T236 VanDerWaalsContact O-N 3.09Å; S211-T236 WeakPolarHBondContact CA-O 3.21Å; S211-T236 WeakPolarHBondContact CB-O 3.32Å; S211-T236 PolarHBondContact N-OG1 3.23Å; T236-A253 HydrophobicContact CG2-CB 4.39Å; T236-E255 HydrophobicContact CG2-CG 4.39Å
237	K	95.7	Very high	96.5	Very high	81 Å²	81	66.1 Å²	66.1	35%	0.352	34%	0.337	S	S	.	.			trans	-80	157.9	171	-73.3	178.7	162.6	155.2	0	111.5	W241 P252	K237-W241 HydrophobicContact CB-CB 4.36Å; K237-W241 HydrophobicContact CB-CG 4.43Å; K237-W241 HydrophobicContact CD-CD2 4.08Å; K237-W241 HydrophobicContact CD-CE3 4.42Å; K237-W241 HydrophobicContact CD-CG 4.18Å; K237-W241 HydrophobicContact CG-CB 4.26Å; K237-W241 HydrophobicContact CG-CD2 4.2Å; K237-W241 HydrophobicContact CG-CG 3.82Å; K237-P252 HydrophobicContact CD-CB 4.08Å; K237-P252 HydrophobicContact CD-CG 3.84Å; K237-P252 VanDerWaalsContact CE-CG 3.48Å; K237-P252 HydrophobicContact CG-CB 3.53Å; K237-P252 HydrophobicContact CG-CG 3.88Å
238	N	94.1	Very high	96.5	Very high	61 Å²	61	67 Å²	67	33%	0.326	34%	0.339	S	S	.	.			trans	-128.5	175.9	159.6	64.9	35.3	0	0	0	109	S211 A240 W241	S211-N238 WeakPolarHBondContact CB-ND2 3.04Å; S211-N238 PolarHBondContact OG-ND2 3.32Å; S211-N238 VanDerWaalsContact OG-ND2 3.12Å; N238-A240 PolarHBondContact O-N 3.25Å; N238-A240 VanDerWaalsContact O-N 3.11Å; N238-A240 WeakPolarHBondContact OD1-CA 3.32Å; N238-A240 WeakPolarHBondContact OD1-CB 3.5Å; N238-A240 PolarHBondContact OD1-N 3.18Å; N238-W241 VanDerWaalsContact O-CB 3.28Å; N238-W241 WeakPolarHBondContact O-CB 3.33Å; N238-W241 PolarHBondContact O-N 3.37Å; N238-W241 VanDerWaalsContact O-N 3.09Å; N238-W241 PolarHBondContact OD1-N 3.31Å
239	Q	89.9	Confident	96.4	Very high	171 Å²	171	66 Å²	66	80%	0.799	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.7	-177.7	-64.2	178.9	-5.1	0	0	114	A171	A171-Q239 PolarHBondContact O-NE2 2.94Å
240	A	93.2	Very high	96.5	Very high	71 Å²	71	66.6 Å²	66.6	59%	0.587	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	5.4	177.8	0	0	0	0	0	113.5	N238	N238-A240 PolarHBondContact O-N 3.25Å; N238-A240 VanDerWaalsContact O-N 3.11Å; N238-A240 WeakPolarHBondContact OD1-CA 3.32Å; N238-A240 WeakPolarHBondContact OD1-CB 3.5Å; N238-A240 PolarHBondContact OD1-N 3.18Å
241	W	93.6	Very high	96.5	Very high	84 Å²	84	69.6 Å²	69.6	32%	0.318	35%	0.353	S	S	.	.			trans	-61.6	133.9	179	-178.5	91.9	0	0	0	111.5	K237 N238 S243	K237-W241 HydrophobicContact CB-CB 4.36Å; K237-W241 HydrophobicContact CB-CG 4.43Å; K237-W241 HydrophobicContact CD-CD2 4.08Å; K237-W241 HydrophobicContact CD-CE3 4.42Å; K237-W241 HydrophobicContact CD-CG 4.18Å; K237-W241 HydrophobicContact CG-CB 4.26Å; K237-W241 HydrophobicContact CG-CD2 4.2Å; K237-W241 HydrophobicContact CG-CG 3.82Å; N238-W241 VanDerWaalsContact O-CB 3.28Å; N238-W241 WeakPolarHBondContact O-CB 3.33Å; N238-W241 PolarHBondContact O-N 3.37Å; N238-W241 VanDerWaalsContact O-N 3.09Å; N238-W241 PolarHBondContact OD1-N 3.31Å; W241-S243 PolarHBondContact NE1-O 3.44Å
242	K	95.2	Very high	96.4	Very high	181 Å²	181	71.6 Å²	71.6	79%	0.787	37%	0.366	S	S	*	.			trans	-124.4	-32.7	179.9	-63.2	-179.6	-176.5	179.9	0	113	D246	K242-D246 PolarHBondContact N-OD2 2.64Å
243	S	96.3	Very high	96.4	Very high	52 Å²	52	71.2 Å²	71.2	36%	0.364	37%	0.366	S	S	.	.	S	Bend	trans	-159.5	172	-176.4	67	0	0	0	0	111.8	W241 K245 D246	W241-S243 PolarHBondContact NE1-O 3.44Å; S243-K245 PolarHBondContact O-N 3Å; S243-K245 WeakPolarHBondContact OG-CB 3.18Å; S243-K245 PolarHBondContact OG-N 3.18Å; S243-D246 PolarHBondContact N-OD2 3.27Å; S243-D246 VanDerWaalsContact N-OD2 3.1Å; S243-D246 WeakPolarHBondContact O-CB 3.16Å; S243-D246 PolarHBondContact O-N 3.5Å
244	E	95.9	Very high	96.3	Very high	93 Å²	93	79 Å²	79	44%	0.435	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-61.8	-14.5	174.6	-63.6	-168.6	153.8	0	0	113.7	D246 T247 L248 G249	E244-D246 PolarHBondContact O-N 2.67Å; E244-T247 WeakPolarHBondContact CA-OG1 3.18Å; E244-T247 CarbonylContact O-C 3.58Å; E244-T247 VanDerWaalsContact O-C 3.31Å; E244-T247 PolarHBondContact O-N 3.28Å; E244-T247 PolarHBondContact O-OG1 3.18Å; E244-T247 VanDerWaalsContact O-OG1 3.07Å; E244-L248 PolarHBondContact O-N 3.08Å; E244-L248 VanDerWaalsContact O-N 3.14Å; E244-G249 WeakPolarHBondContact O-CA 3.12Å; E244-G249 PolarHBondContact O-N 3.39Å
245	K	95.9	Very high	96.3	Very high	158 Å²	158	77.3 Å²	77.3	69%	0.687	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-57.5	-32.9	169.4	-173.9	177.8	176.2	179.1	0	111.7	S243 T247 L248	S243-K245 PolarHBondContact O-N 3Å; S243-K245 WeakPolarHBondContact OG-CB 3.18Å; S243-K245 PolarHBondContact OG-N 3.18Å; K245-T247 PolarHBondContact O-N 2.73Å; K245-L248 PolarHBondContact O-N 2.77Å
246	D	95.9	Very high	96.3	Very high	50 Å²	50	78.8 Å²	78.8	27%	0.267	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-74	-9.2	178.5	-55.9	-44.4	0	0	0	112.6	R212 K242 S243 E244	R212-D246 WeakPolarHBondContact CB-O 3.44Å; R212-D246 WeakPolarHBondContact CD-O 3.44Å; K242-D246 PolarHBondContact N-OD2 2.64Å; S243-D246 PolarHBondContact N-OD2 3.27Å; S243-D246 VanDerWaalsContact N-OD2 3.1Å; S243-D246 WeakPolarHBondContact O-CB 3.16Å; S243-D246 PolarHBondContact O-N 3.5Å; E244-D246 PolarHBondContact O-N 2.67Å
247	T	97.9	Very high	96.3	Very high	1 Å²	1	79.8 Å²	79.8	1%	0.006	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-124	23.9	176.9	46.4	0	0	0	0	111.3	R225 E244 K245 G249 R250 P252	R225-T247 PolarHBondContact NH2-O 3.17Å; E244-T247 WeakPolarHBondContact CA-OG1 3.18Å; E244-T247 CarbonylContact O-C 3.58Å; E244-T247 VanDerWaalsContact O-C 3.31Å; E244-T247 PolarHBondContact O-N 3.28Å; E244-T247 PolarHBondContact O-OG1 3.18Å; E244-T247 VanDerWaalsContact O-OG1 3.07Å; K245-T247 PolarHBondContact O-N 2.73Å; T247-G249 PolarHBondContact O-N 2.7Å; T247-R250 VanDerWaalsContact CB-O 3.3Å; T247-R250 WeakPolarHBondContact CB-O 3.34Å; T247-R250 PolarHBondContact OG1-O 2.66Å; T247-P252 HydrophobicContact CG2-CB 4.11Å
248	L	97.4	Very high	96.4	Very high	42 Å²	42	76.6 Å²	76.6	22%	0.22	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	48.2	-179.1	-65.5	-177.7	0	0	0	113.9	D218 V221 L222 R225 Y235 E244 K245 R250	D218-L248 HydrophobicContact CB-CD1 3.93Å; V221-L248 HydrophobicContact CG1-CD1 4.42Å; L222-L248 HydrophobicContact CD2-CD1 4.19Å; L222-L248 HydrophobicContact CG-CD1 4.23Å; R225-L248 PolarHBondContact NH1-O 3.16Å; R225-L248 PolarHBondContact NH2-O 3.14Å; Y235-L248 HydrophobicContact CD2-CD1 4.22Å; Y235-L248 HydrophobicContact CD2-CG 4.07Å; Y235-L248 HydrophobicContact CE2-CD1 3.61Å; Y235-L248 HydrophobicContact CE2-CG 3.7Å; E244-L248 PolarHBondContact O-N 3.08Å; E244-L248 VanDerWaalsContact O-N 3.14Å; K245-L248 PolarHBondContact O-N 2.77Å; L248-R250 PolarHBondContact O-N 3.38Å
249	G	97.5	Very high	96.6	Very high	48 Å²	48	75.8 Å²	75.8	50%	0.495	39%	0.392	S	S	.	.	S	Bend	trans	70.6	26.2	173.7	0	0	0	0	0	114.5	E244 T247	E244-G249 WeakPolarHBondContact O-CA 3.12Å; E244-G249 PolarHBondContact O-N 3.39Å; T247-G249 PolarHBondContact O-N 2.7Å
250	R	97.3	Very high	97	Very high	155 Å²	155	72.1 Å²	72.1	59%	0.585	38%	0.375	S	S	*	.	S	Bend	trans	-130	155.8	173.2	-66.4	-66.1	-173.7	169.4	1.2	110.2	R225 T247 L248	R225-R250 VanDerWaalsContact NH2-CG 3.32Å; T247-R250 VanDerWaalsContact CB-O 3.3Å; T247-R250 WeakPolarHBondContact CB-O 3.34Å; T247-R250 PolarHBondContact OG1-O 2.66Å; L248-R250 PolarHBondContact O-N 3.38Å
251	P	97.8	Very high	97.3	Very high	89 Å²	89	69 Å²	69	58%	0.578	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-53.7	146.9	166.7	-25.4	35	0	0	0	110.9
252	P	97.8	Very high	97.6	Very high	42 Å²	42	65 Å²	65	27%	0.273	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-63.6	142.8	175.7	33.5	-42.3	0	0	0	111.7	Y235 K237 T247	Y235-P252 WeakPolarHBondContact O-CA 3.48Å; K237-P252 HydrophobicContact CD-CB 4.08Å; K237-P252 HydrophobicContact CD-CG 3.84Å; K237-P252 VanDerWaalsContact CE-CG 3.48Å; K237-P252 HydrophobicContact CG-CB 3.53Å; K237-P252 HydrophobicContact CG-CG 3.88Å; T247-P252 HydrophobicContact CG2-CB 4.11Å
253	A	98.3	Very high	97.7	Very high	12 Å²	12	58.2 Å²	58.2	10%	0.099	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-70.2	157.2	166.9	0	0	0	0	0	111.2	E234 Y235 T236	E234-A253 HydrophobicContact CB-CB 3.52Å; E234-A253 HydrophobicContact CG-CB 4.45Å; E234-A253 WeakPolarHBondContact OE2-CB 3.15Å; Y235-A253 PolarHBondContact O-N 2.74Å; T236-A253 HydrophobicContact CG2-CB 4.39Å
254	Q	97.8	Very high	97.9	Very high	165 Å²	165	56.5 Å²	56.5	77%	0.771	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-66.2	143.1	169.2	-68.2	-177.8	-7.5	0	0	110.6
255	E	97.6	Very high	98	Very high	51 Å²	51	52.7 Å²	52.7	24%	0.238	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-67.3	130.5	171.2	-63.5	72.7	-160.1	0	0	110	V172 I175 T236	V172-E255 HydrophobicContact CG1-CB 4.08Å; V172-E255 HydrophobicContact CG1-CG 3.53Å; I175-E255 HydrophobicContact CD1-CB 3.97Å; I175-E255 HydrophobicContact CG1-CB 4.26Å; I175-E255 HydrophobicContact CG2-CB 4.45Å; T236-E255 HydrophobicContact CG2-CG 4.39Å
256	I	98.3	Very high	98.2	Very high	38 Å²	38	45.2 Å²	45.2	20%	0.195	24%	0.24	C	C	.	.			trans	-111.2	128	178.6	-63.2	-170.2	0	0	0	108.6	F207 R209 E260 H261	F207-I256 HydrophobicContact CE2-CD1 4.44Å; F207-I256 HydrophobicContact CZ-CD1 3.96Å; F207-I256 HydrophobicContact CZ-CG2 4.41Å; R209-I256 HydrophobicContact CB-CB 4.45Å; R209-I256 HydrophobicContact CG-CB 4.14Å; R209-I256 HydrophobicContact CG-CD1 3.89Å; R209-I256 HydrophobicContact CG-CG1 4.02Å; I256-E260 HydrophobicContact CG2-CB 3.61Å; I256-H261 PolarHBondContact O-CE1 3.09Å; I256-H261 VanDerWaalsContact O-CE1 3.29Å
257	P	98.4	Very high	98.3	Very high	30 Å²	30	42.9 Å²	42.9	20%	0.195	23%	0.227	C	C	.	.			trans	-55.7	147.9	173.8	-25.1	34	0	0	0	112.4	I175 V259 E260 H261	I175-P257 HydrophobicContact CB-CG 4.31Å; I175-P257 HydrophobicContact CG2-CG 3.72Å; P257-V259 HydrophobicContact CB-CG2 3.92Å; P257-V259 PolarHBondContact O-N 2.82Å; P257-E260 HydrophobicContact CB-CG 4.47Å; P257-E260 WeakPolarHBondContact CD-OE1 3.32Å; P257-E260 WeakPolarHBondContact CG-OE1 3.47Å; P257-E260 PolarHBondContact O-N 2.87Å; P257-H261 PolarHBondContact O-CE1 2.99Å; P257-H261 PolarHBondContact O-ND1 2.73Å
258	L	98.7	Very high	98.3	Very high	14 Å²	14	42.9 Å²	42.9	7%	0.073	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-62.9	-31.5	-178.3	-74.7	164.7	0	0	0	112.1	Y176 L180 L190 E260 H261 H281	Y176-L258 HydrophobicContact CE2-CD1 4.49Å; Y176-L258 WeakPolarHBondContact OH-CB 3.17Å; Y176-L258 WeakPolarHBondContact OH-CD1 3.36Å; Y176-L258 VanDerWaalsContact OH-CG 3.3Å; Y176-L258 WeakPolarHBondContact OH-CG 3.01Å; Y176-L258 PolarHBondContact OH-N 3.37Å; L180-L258 HydrophobicContact CD1-CD1 4.18Å; L190-L258 HydrophobicContact CD2-CB 4.39Å; L258-E260 VanDerWaalsContact C-N 3.26Å; L258-E260 PolarHBondContact O-N 2.79Å; L258-H261 VanDerWaalsContact O-CB 3.27Å; L258-H261 WeakPolarHBondContact O-CB 3.31Å; L258-H261 PolarHBondContact O-N 2.95Å; L258-H261 VanDerWaalsContact O-N 3.11Å; L258-H281 HydrophobicContact CD1-CB 3.92Å; L258-H281 HydrophobicContact CD2-CB 4.24Å; L258-H281 HydrophobicContact CG-CB 4.49Å
259	V	98.7	Very high	98.4	Very high	44 Å²	44	41 Å²	41	27%	0.267	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-62.4	-31.7	175.1	-65	0	0	0	0	113	D189 L190 S193 P257 H261 C262	D189-V259 HydrophobicContact CB-CG1 3.96Å; L190-V259 HydrophobicContact CD2-CG1 4.11Å; L190-V259 HydrophobicContact CG-CG1 4.32Å; S193-V259 PolarHBondContact OG-O 3.16Å; P257-V259 HydrophobicContact CB-CG2 3.92Å; P257-V259 PolarHBondContact O-N 2.82Å; V259-H261 VanDerWaalsContact C-N 3.27Å; V259-H261 PolarHBondContact O-N 3.01Å; V259-C262 WeakPolarHBondContact O-CB 3.39Å; V259-C262 PolarHBondContact O-N 3.08Å; V259-C262 PolarHBondContact O-SG 2.93Å; V259-C262 VanDerWaalsContact O-SG 3.38Å
260	E	98.8	Very high	98.5	Very high	95 Å²	95	38.7 Å²	38.7	44%	0.444	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-78.6	-12	177.9	-70.2	-179.6	-141.5	0	0	112.6	I256 P257 L258 C262 Q263	I256-E260 HydrophobicContact CG2-CB 3.61Å; P257-E260 HydrophobicContact CB-CG 4.47Å; P257-E260 WeakPolarHBondContact CD-OE1 3.32Å; P257-E260 WeakPolarHBondContact CG-OE1 3.47Å; P257-E260 PolarHBondContact O-N 2.87Å; L258-E260 VanDerWaalsContact C-N 3.26Å; L258-E260 PolarHBondContact O-N 2.79Å; E260-C262 PolarHBondContact O-N 2.58Å; E260-Q263 WeakPolarHBondContact O-CG 3.3Å; E260-Q263 PolarHBondContact O-NE2 2.98Å
261	H	98.8	Very high	98.6	Very high	4 Å²	4	33.7 Å²	33.7	2%	0.019	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-68.6	-23.1	172.2	-64.9	38.9	0	0	0	111.2	F207 I256 P257 L258 V259 Q263 Y264 L267	F207-H261 HydrophobicContact CD1-CB 4.34Å; F207-H261 AromaticContact CD1-CD2 3.85Å; F207-H261 HydrophobicContact CE1-CB 4.17Å; F207-H261 AromaticContact CE1-CD2 3.5Å; F207-H261 VanDerWaalsContact CE1-CD2 3.5Å; F207-H261 WeakPolarHBondContact CE1-CD2 3.23Å; F207-H261 AromaticContact CE1-CE1 3.82Å; F207-H261 AromaticContact CE1-CG 3.59Å; F207-H261 AromaticContact CE1-ND1 3.8Å; F207-H261 AromaticContact CE1-NE2 3.67Å; I256-H261 PolarHBondContact O-CE1 3.09Å; I256-H261 VanDerWaalsContact O-CE1 3.29Å; P257-H261 PolarHBondContact O-CE1 2.99Å; P257-H261 PolarHBondContact O-ND1 2.73Å; L258-H261 VanDerWaalsContact O-CB 3.27Å; L258-H261 WeakPolarHBondContact O-CB 3.31Å; L258-H261 PolarHBondContact O-N 2.95Å; L258-H261 VanDerWaalsContact O-N 3.11Å; V259-H261 VanDerWaalsContact C-N 3.27Å; V259-H261 PolarHBondContact O-N 3.01Å; H261-Q263 PolarHBondContact O-N 3.29Å; H261-Y264 PolarHBondContact O-N 3.07Å; H261-L267 HydrophobicContact CB-CD1 4.23Å; H261-L267 HydrophobicContact CB-CD2 4.07Å
262	C	98.9	Very high	98.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-67.2	-12.1	-172.9	-54.4	0	0	0	0	114.1	S193 W197 K202 V259 E260 Y264 C285	S193-C262 WeakPolarHBondContact OG-CB 3.34Å; W197-C262 WeakPolarHBondContact CB-O 3.49Å; K202-C262 PolarHBondContact NZ-O 3.31Å; V259-C262 WeakPolarHBondContact O-CB 3.39Å; V259-C262 PolarHBondContact O-N 3.08Å; V259-C262 PolarHBondContact O-SG 2.93Å; V259-C262 VanDerWaalsContact O-SG 3.38Å; E260-C262 PolarHBondContact O-N 2.58Å; C262-Y264 PolarHBondContact O-N 3.14Å; C262-C285 WeakPolarHBondContact CA-SG 3.46Å; C262-C285 HydrophobicContact CB-CB 3.49Å; C262-C285 VanDerWaalsContact CB-CB 3.49Å; C262-C285 WeakPolarHBondContact CB-SG 3.48Å; C262-C285 PolarHBondContact N-SG 2.8Å; C262-C285 VanDerWaalsContact N-SG 3.41Å; C262-C285 WeakPolarHBondContact SG-CA 3.35Å; C262-C285 WeakPolarHBondContact SG-CB 3.25Å; C262-C285 CovalentContact SG-SG 2.05Å; C262-C285 PolarHBondContact SG-SG 3.46Å
263	Q	98.8	Very high	98.6	Very high	40 Å²	40	30.6 Å²	30.6	19%	0.187	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-72.5	-13	172.8	73.7	-166.2	-47.4	0	0	113.8	W197 K202 E203 E260 H261	W197-Q263 HydrophobicContact CD2-CB 3.62Å; W197-Q263 HydrophobicContact CE3-CB 3.93Å; W197-Q263 HydrophobicContact CG-CB 4.12Å; W197-Q263 HydrophobicContact CH2-CB 4.05Å; W197-Q263 HydrophobicContact CZ2-CB 3.76Å; W197-Q263 HydrophobicContact CZ3-CB 4.13Å; K202-Q263 CarbonylContact C-O 3.53Å; K202-Q263 WeakPolarHBondContact CA-O 3.21Å; K202-Q263 WeakPolarHBondContact CB-O 3.22Å; E203-Q263 PolarHBondContact N-O 2.98Å; E260-Q263 WeakPolarHBondContact O-CG 3.3Å; E260-Q263 PolarHBondContact O-NE2 2.98Å; H261-Q263 PolarHBondContact O-N 3.29Å
264	Y	98.9	Very high	98.6	Very high	15 Å²	15	30.1 Å²	30.1	6%	0.059	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	141.5	-179.4	-59.7	-88.4	0	0	0	112	E203 F207 H261 C262 S287	E203-Y264 HydrophobicContact CB-CD1 3.83Å; E203-Y264 HydrophobicContact CB-CE1 4.27Å; E203-Y264 WeakPolarHBondContact OE2-CE1 3.32Å; F207-Y264 HydrophobicContact CB-CD1 3.71Å; F207-Y264 HydrophobicContact CB-CD2 3.8Å; F207-Y264 HydrophobicContact CB-CE1 4.28Å; F207-Y264 HydrophobicContact CB-CE2 4.36Å; F207-Y264 HydrophobicContact CB-CG 3.44Å; F207-Y264 VanDerWaalsContact CB-CG 3.44Å; F207-Y264 AromaticContact CD1-CD2 3.62Å; F207-Y264 HydrophobicContact CD1-CD2 3.62Å; F207-Y264 AromaticContact CD1-CE2 3.91Å; F207-Y264 HydrophobicContact CD1-CE2 3.91Å; F207-Y264 HydrophobicContact CD1-CG 4.19Å; F207-Y264 AromaticContact CD2-CD1 3.96Å; F207-Y264 HydrophobicContact CD2-CD1 3.96Å; F207-Y264 AromaticContact CD2-CD2 3.68Å; F207-Y264 HydrophobicContact CD2-CD2 3.68Å; F207-Y264 AromaticContact CD2-CE1 3.64Å; F207-Y264 HydrophobicContact CD2-CE1 3.64Å; F207-Y264 AromaticContact CD2-CE2 3.36Å; F207-Y264 HydrophobicContact CD2-CE2 3.36Å; F207-Y264 AromaticContact CD2-CG 3.98Å; F207-Y264 HydrophobicContact CD2-CG 3.98Å; F207-Y264 AromaticContact CD2-CZ 3.32Å; F207-Y264 HydrophobicContact CE1-CD2 4.04Å; F207-Y264 AromaticContact CE1-CE2 3.94Å; F207-Y264 HydrophobicContact CE1-CE2 3.94Å; F207-Y264 HydrophobicContact CE2-CD2 4.1Å; F207-Y264 HydrophobicContact CE2-CE1 4.25Å; F207-Y264 AromaticContact CE2-CE2 3.39Å; F207-Y264 HydrophobicContact CE2-CE2 3.39Å; F207-Y264 AromaticContact CE2-CZ 3.48Å; F207-Y264 VanDerWaalsContact CE2-CZ 3.48Å; F207-Y264 WeakPolarHBondContact CE2-OH 3.41Å; F207-Y264 AromaticContact CG-CD1 3.98Å; F207-Y264 HydrophobicContact CG-CD1 3.98Å; F207-Y264 AromaticContact CG-CD2 3.4Å; F207-Y264 HydrophobicContact CG-CD2 3.4Å; F207-Y264 VanDerWaalsContact CG-CD2 3.4Å; F207-Y264 HydrophobicContact CG-CE1 4.14Å; F207-Y264 AromaticContact CG-CE2 3.61Å; F207-Y264 HydrophobicContact CG-CE2 3.61Å; F207-Y264 AromaticContact CG-CG 3.61Å; F207-Y264 HydrophobicContact CG-CG 3.61Å; F207-Y264 AromaticContact CG-CZ 3.97Å; F207-Y264 HydrophobicContact CZ-CD2 4.25Å; F207-Y264 AromaticContact CZ-CE2 3.68Å; F207-Y264 HydrophobicContact CZ-CE2 3.68Å; H261-Y264 PolarHBondContact O-N 3.07Å; C262-Y264 PolarHBondContact O-N 3.14Å; Y264-S287 VanDerWaalsContact O-CB 3.26Å; Y264-S287 WeakPolarHBondContact O-CB 3Å; Y264-S287 PolarHBondContact O-OG 3.06Å
265	K	98.9	Very high	98.6	Very high	13 Å²	13	22.7 Å²	22.7	6%	0.057	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	-39.8	177.7	-78.1	-168.5	171.3	-169.6	0	112.6	W199 K202 E203 S287 L288 D331	W199-K265 HydrophobicContact CH2-CB 4.44Å; W199-K265 HydrophobicContact CH2-CD 4.42Å; W199-K265 HydrophobicContact CH2-CG 4.5Å; W199-K265 HydrophobicContact CZ2-CD 4Å; W199-K265 WeakPolarHBondContact O-CE 3.38Å; K202-K265 HydrophobicContact CB-CB 4.34Å; K202-K265 HydrophobicContact CB-CG 3.44Å; K202-K265 VanDerWaalsContact CB-CG 3.44Å; K202-K265 HydrophobicContact CD-CG 4.31Å; E203-K265 WeakPolarHBondContact O-CB 3.35Å; E203-K265 PolarHBondContact O-N 3.01Å; K265-S287 CarbonylContact O-C 3.52Å; K265-S287 WeakPolarHBondContact O-CB 3.42Å; K265-L288 PolarHBondContact O-N 2.84Å; K265-D331 IonicContact NZ-OD1 2.83Å; K265-D331 PolarHBondContact NZ-OD1 2.97Å; K265-D331 IonicContact NZ-OD2 3.8Å; K265-D331 PolarHBondContact NZ-OD2 3.13Å
266	Y	98.9	Very high	98.7	Very high	1 Å²	1	21.2 Å²	21.2	0%	0.004	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	107.2	-167.7	-44.1	-51.4	0	0	0	110	W199 S204 G206 F207 L288 F290 L324 V327 K328	W199-Y266 HydrophobicContact CH2-CE1 4.42Å; S204-Y266 VanDerWaalsContact O-CE2 3.28Å; S204-Y266 WeakPolarHBondContact O-CE2 3.32Å; G206-Y266 CarbonylContact C-O 3.54Å; F207-Y266 PolarHBondContact N-O 3.49Å; Y266-L288 WeakPolarHBondContact CA-O 3.49Å; Y266-L288 HydrophobicContact CD1-CB 4.27Å; Y266-L288 HydrophobicContact CD1-CD2 4.38Å; Y266-F290 AromaticContact CD1-CE2 3.91Å; Y266-F290 HydrophobicContact CD1-CE2 3.91Å; Y266-F290 HydrophobicContact CG-CE2 4.09Å; Y266-L324 HydrophobicContact CD2-CD2 3.95Å; Y266-L324 HydrophobicContact CG-CD2 4.23Å; Y266-V327 HydrophobicContact CD1-CG2 3.99Å; Y266-V327 HydrophobicContact CE1-CB 4.21Å; Y266-V327 HydrophobicContact CE1-CG2 3.54Å; Y266-V327 HydrophobicContact CE2-CG2 4.33Å; Y266-K328 HydrophobicContact CE2-CG 4.07Å; Y266-K328 WeakPolarHBondContact OH-CG 3.36Å
267	L	99	Very high	98.7	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	124.7	-174.7	-63.6	-177.5	0	0	0	111.3	F207 H261 L282 C285 L288 V289 F290	F207-L267 HydrophobicContact CB-CD2 4.05Å; F207-L267 HydrophobicContact CD1-CD2 3.92Å; F207-L267 HydrophobicContact CG-CD2 4.47Å; H261-L267 HydrophobicContact CB-CD1 4.23Å; H261-L267 HydrophobicContact CB-CD2 4.07Å; L267-L282 HydrophobicContact CB-CB 4.15Å; L267-L282 HydrophobicContact CB-CD1 4.02Å; L267-L282 HydrophobicContact CB-CD2 4.17Å; L267-L282 HydrophobicContact CB-CG 4.33Å; L267-L282 HydrophobicContact CD1-CB 4.06Å; L267-L282 HydrophobicContact CD1-CD2 4.03Å; L267-C285 HydrophobicContact CD1-CB 4.04Å; L267-L288 PolarHBondContact N-O 3.43Å; L267-V289 WeakPolarHBondContact O-CA 3.49Å; L267-F290 PolarHBondContact O-N 2.98Å
268	F	98.9	Very high	98.7	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.009	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	135.2	-178	-70	-86.5	0	0	0	113.5	F207 F208 L220 F270 F290 V292 L320 L324	F207-F268 PolarHBondContact O-N 2.87Å; F207-F268 VanDerWaalsContact O-N 3.15Å; F208-F268 HydrophobicContact CB-CB 4.35Å; F208-F268 HydrophobicContact CD2-CB 4.39Å; L220-F268 HydrophobicContact CD1-CD1 4.26Å; L220-F268 HydrophobicContact CD1-CD2 4.15Å; L220-F268 HydrophobicContact CD1-CE1 4.21Å; L220-F268 HydrophobicContact CD1-CE2 4.08Å; L220-F268 HydrophobicContact CD1-CG 4.26Å; L220-F268 HydrophobicContact CD1-CZ 4.14Å; L220-F268 HydrophobicContact CD2-CB 3.79Å; L220-F268 HydrophobicContact CD2-CD1 4.18Å; L220-F268 HydrophobicContact CD2-CD2 3.84Å; L220-F268 HydrophobicContact CD2-CG 3.64Å; F268-F270 HydrophobicContact CB-CD2 4.33Å; F268-F270 HydrophobicContact CB-CE2 3.67Å; F268-F270 HydrophobicContact CG-CE2 4.39Å; F268-F290 WeakPolarHBondContact CA-O 3.09Å; F268-F290 HydrophobicContact CD1-CB 3.48Å; F268-F290 VanDerWaalsContact CD1-CB 3.48Å; F268-F290 HydrophobicContact CD1-CG 4.29Å; F268-F290 HydrophobicContact CE1-CB 3.39Å; F268-F290 AromaticContact CE1-CD1 3.77Å; F268-F290 HydrophobicContact CE1-CD1 3.77Å; F268-F290 AromaticContact CE1-CG 3.71Å; F268-F290 HydrophobicContact CE1-CG 3.71Å; F268-F290 HydrophobicContact CG-CB 4.21Å; F268-F290 HydrophobicContact CZ-CB 4.09Å; F268-F290 HydrophobicContact CZ-CD1 4.09Å; F268-F290 HydrophobicContact CZ-CG 4.01Å; F268-V292 HydrophobicContact CD1-CG2 4.47Å; F268-L320 HydrophobicContact CE1-CD1 3.34Å; F268-L320 HydrophobicContact CE1-CD2 4.27Å; F268-L320 HydrophobicContact CE1-CG 4.46Å; F268-L320 HydrophobicContact CZ-CD1 3.55Å; F268-L320 HydrophobicContact CZ-CD2 4.45Å; F268-L324 HydrophobicContact CZ-CD1 4.39Å; F268-L324 HydrophobicContact CZ-CD2 4.17Å; F268-L324 HydrophobicContact CZ-CG 4.5Å
269	N	98.9	Very high	98.7	Very high	1 Å²	1	20 Å²	20	1%	0.005	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	139.1	168.2	-175.6	64.8	0	0	0	111.4	L279 L282 V289 F290 H291 V292	N269-L279 HydrophobicContact CB-CB 4.5Å; N269-L279 HydrophobicContact CB-CD1 3.7Å; N269-L279 PolarHBondContact OD1-N 3.42Å; N269-L282 HydrophobicContact CB-CD1 3.87Å; N269-V289 HydrophobicContact CB-CG1 4.47Å; N269-F290 PolarHBondContact N-O 3.24Å; N269-H291 PolarHBondContact ND2-CE1 2.76Å; N269-H291 VanDerWaalsContact ND2-CE1 3.31Å; N269-H291 PolarHBondContact ND2-ND1 2.85Å; N269-H291 VanDerWaalsContact ND2-ND1 3.16Å; N269-V292 PolarHBondContact O-N 3.36Å
270	F	98.9	Very high	98.7	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.089	C	C	.	.			trans	-136.9	156.6	176.3	-65.2	-100.8	0	0	0	109.9	F208 E216 R217 L220 F268 S276 V292 L317	F208-F270 HydrophobicContact CD2-CD2 4.11Å; F208-F270 HydrophobicContact CD2-CE2 4.19Å; F208-F270 AromaticContact CE2-CD2 3.92Å; F208-F270 HydrophobicContact CE2-CD2 3.92Å; F208-F270 HydrophobicContact CE2-CE2 4.39Å; E216-F270 WeakPolarHBondContact O-CE1 3.49Å; R217-F270 HydrophobicContact CB-CD1 4.45Å; R217-F270 HydrophobicContact CG-CB 3.65Å; R217-F270 HydrophobicContact CG-CD1 3.78Å; R217-F270 HydrophobicContact CG-CD2 3.98Å; R217-F270 HydrophobicContact CG-CE1 4.36Å; R217-F270 HydrophobicContact CG-CG 3.56Å; L220-F270 HydrophobicContact CB-CE2 4.42Å; L220-F270 HydrophobicContact CB-CZ 3.77Å; L220-F270 HydrophobicContact CD2-CE2 3.46Å; L220-F270 VanDerWaalsContact CD2-CE2 3.46Å; L220-F270 HydrophobicContact CD2-CZ 3.61Å; L220-F270 HydrophobicContact CG-CZ 4.23Å; F268-F270 HydrophobicContact CB-CD2 4.33Å; F268-F270 HydrophobicContact CB-CE2 3.67Å; F268-F270 HydrophobicContact CG-CE2 4.39Å; F270-S276 WeakPolarHBondContact O-CB 3.5Å; F270-V292 HydrophobicContact CD1-CB 3.63Å; F270-V292 HydrophobicContact CD1-CG1 3.74Å; F270-V292 HydrophobicContact CD1-CG2 3.88Å; F270-V292 HydrophobicContact CE1-CB 3.74Å; F270-V292 HydrophobicContact CE1-CG1 3.73Å; F270-V292 HydrophobicContact CE1-CG2 3.5Å; F270-V292 HydrophobicContact CE2-CG2 4.29Å; F270-V292 HydrophobicContact CG-CB 4.24Å; F270-V292 HydrophobicContact CG-CG2 4.42Å; F270-V292 HydrophobicContact CZ-CB 4.39Å; F270-V292 HydrophobicContact CZ-CG2 3.7Å; F270-L317 HydrophobicContact CE1-CD1 4.08Å; F270-L317 HydrophobicContact CE1-CD2 4.02Å; F270-L317 HydrophobicContact CE1-CG 4.49Å; F270-L317 HydrophobicContact CZ-CD2 4.01Å
271	R	98.7	Very high	98.7	Very high	50 Å²	50	13.6 Å²	13.6	19%	0.189	7%	0.068	C	C	.	.			trans	-57.2	156	160.3	62.4	149.6	-70.6	169.5	1.6	112.1	E216 R217 V273 A274 W296	E216-R271 VanDerWaalsContact OE2-CD 3.29Å; E216-R271 WeakPolarHBondContact OE2-CD 3.49Å; E216-R271 WeakPolarHBondContact OE2-CG 3.1Å; R217-R271 PolarHBondContact NE-O 3.21Å; R217-R271 PolarHBondContact NH2-O 2.82Å; R271-V273 PolarHBondContact NH2-O 3.22Å; R271-A274 CarbonylContact C-O 3.08Å; R271-A274 WeakPolarHBondContact CA-O 3.46Å; R271-A274 WeakPolarHBondContact CB-O 3.38Å; R271-W296 HydrophobicContact CB-CB 4.26Å; R271-W296 HydrophobicContact CB-CG 4.14Å
272	G	97.5	Very high	98.7	Very high	6 Å²	6	13.5 Å²	13.5	6%	0.062	7%	0.068	C	C	.	.	S	Bend	trans	-111.7	-122.3	168.5	0	0	0	0	0	109.6	T213 A274	T213-G272 CarbonylContact O-C 3.6Å; T213-G272 VanDerWaalsContact OG1-CA 3.23Å; T213-G272 WeakPolarHBondContact OG1-CA 3.25Å; G272-A274 VanDerWaalsContact C-N 3.3Å; G272-A274 PolarHBondContact N-O 3.04Å
273	V	98	Very high	98.7	Very high	61 Å²	61	13.5 Å²	13.5	37%	0.37	7%	0.068	S	C	.	.	S	Bend	trans	-64.7	-38.5	165.4	175.3	0	0	0	0	110.9	D132 Y133 R271	D132-V273 HydrophobicContact CB-CB 3.98Å; D132-V273 HydrophobicContact CB-CG1 3.66Å; Y133-V273 HydrophobicContact CD2-CG1 4.01Å; R271-V273 PolarHBondContact NH2-O 3.22Å
274	A	98.5	Very high	98.8	Very high	2 Å²	2	11.6 Å²	11.6	2%	0.017	6%	0.059	C	C	.	.	S	Bend	trans	-135.2	-147	170.5	0	0	0	0	0	109.1	D132 F149 R271 G272 W296	D132-A274 WeakPolarHBondContact O-CB 3.45Å; F149-A274 HydrophobicContact CE1-CB 4.37Å; F149-A274 HydrophobicContact CZ-CB 4.1Å; R271-A274 CarbonylContact C-O 3.08Å; R271-A274 WeakPolarHBondContact CA-O 3.46Å; R271-A274 WeakPolarHBondContact CB-O 3.38Å; G272-A274 VanDerWaalsContact C-N 3.3Å; G272-A274 PolarHBondContact N-O 3.04Å; A274-W296 HydrophobicContact CB-CD2 4.29Å; A274-W296 HydrophobicContact CB-CE3 3.47Å; A274-W296 VanDerWaalsContact CB-CE3 3.47Å; A274-W296 HydrophobicContact CB-CH2 4.18Å; A274-W296 HydrophobicContact CB-CZ3 3.4Å
275	A	98.8	Very high	98.7	Very high	9 Å²	9	10.9 Å²	10.9	7%	0.074	6%	0.057	C	C	.	.	S	Bend	trans	-57.6	152.5	168.7	0	0	0	0	0	111.6	S150 W296 E298 Y301	S150-A275 WeakPolarHBondContact OG-CB 3.5Å; S150-A275 PolarHBondContact OG-N 3.47Å; S150-A275 VanDerWaalsContact OG-N 3.08Å; A275-W296 HydrophobicContact CB-CB 4.3Å; A275-E298 HydrophobicContact CB-CG 3.72Å; A275-Y301 HydrophobicContact CB-CE2 4.2Å
276	S	98.8	Very high	98.7	Very high	19 Å²	19	10.9 Å²	10.9	13%	0.133	6%	0.06	C	C	.	.			trans	-107	128.3	-178.4	-172.7	0	0	0	0	111.7	F270 R278 L279 Y301	F270-S276 WeakPolarHBondContact O-CB 3.5Å; S276-R278 PolarHBondContact O-N 2.94Å; S276-R278 PolarHBondContact OG-N 3.45Å; S276-L279 PolarHBondContact O-N 2.04Å; S276-Y301 PolarHBondContact O-OH 2.77Å
277	F	98.8	Very high	98.7	Very high	19 Å²	19	10.9 Å²	10.9	8%	0.083	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-15.7	174.1	-55.5	-35.6	0	0	0	114.7	F149 A162 W163 T164 P170 L180 L279 K280 H281	F149-F277 AromaticContact CD2-CE1 3.62Å; F149-F277 HydrophobicContact CD2-CE1 3.62Å; F149-F277 HydrophobicContact CD2-CZ 4.33Å; F149-F277 HydrophobicContact CE2-CD1 4.13Å; F149-F277 AromaticContact CE2-CE1 3.35Å; F149-F277 HydrophobicContact CE2-CE1 3.35Å; F149-F277 HydrophobicContact CE2-CZ 4.03Å; F149-F277 HydrophobicContact CG-CE1 4.44Å; F149-F277 HydrophobicContact CZ-CE1 4.01Å; F149-F277 HydrophobicContact CZ-CZ 4.26Å; A162-F277 HydrophobicContact CB-CD1 4.47Å; A162-F277 HydrophobicContact CB-CE1 3.64Å; A162-F277 HydrophobicContact CB-CZ 4.19Å; W163-F277 AromaticContact CE2-CZ 3.91Å; W163-F277 HydrophobicContact CZ2-CE2 4.47Å; W163-F277 AromaticContact CZ2-CZ 3.83Å; W163-F277 HydrophobicContact CZ2-CZ 3.83Å; W163-F277 AromaticContact NE1-CE2 3.97Å; W163-F277 AromaticContact NE1-CZ 3.86Å; T164-F277 HydrophobicContact CG2-CB 4.26Å; T164-F277 HydrophobicContact CG2-CD1 3.64Å; T164-F277 HydrophobicContact CG2-CD2 3.84Å; T164-F277 HydrophobicContact CG2-CE1 3.8Å; T164-F277 HydrophobicContact CG2-CE2 4.01Å; T164-F277 HydrophobicContact CG2-CG 3.66Å; T164-F277 HydrophobicContact CG2-CZ 4Å; P170-F277 HydrophobicContact CG-CD2 4.37Å; L180-F277 HydrophobicContact CD2-CB 4.26Å; F277-L279 VanDerWaalsContact C-N 3.3Å; F277-L279 PolarHBondContact O-N 3.37Å; F277-K280 PolarHBondContact O-NZ 2.93Å; F277-H281 PolarHBondContact O-CE1 3.41Å; F277-H281 PolarHBondContact O-ND1 2.9Å
278	R	98.8	Very high	98.7	Very high	36 Å²	36	10.8 Å²	10.8	14%	0.136	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-41.5	176.1	176.7	179.4	-73.5	89.3	3.4	111.9	R209 S276 K280 H281 L282	R209-R278 PolarHBondContact O-NH2 3.4Å; S276-R278 PolarHBondContact O-N 2.94Å; S276-R278 PolarHBondContact OG-N 3.45Å; R278-K280 PolarHBondContact O-N 2.77Å; R278-H281 WeakPolarHBondContact O-CB 3.39Å; R278-H281 PolarHBondContact O-N 3.46Å; R278-L282 HydrophobicContact CG-CD1 3.92Å; R278-L282 HydrophobicContact CG-CD2 3.68Å; R278-L282 HydrophobicContact CG-CG 3.81Å; R278-L282 PolarHBondContact O-N 3.43Å
279	L	98.9	Very high	98.7	Very high	1 Å²	1	10.7 Å²	10.7	1%	0.005	6%	0.059	C	C	.	.	H	α-helix	trans	-51	-54.2	-166.2	-178.3	59.9	0	0	0	113.2	N269 S276 F277 H281 L282 F283 V289 Y301 L304	N269-L279 HydrophobicContact CB-CB 4.5Å; N269-L279 HydrophobicContact CB-CD1 3.7Å; N269-L279 PolarHBondContact OD1-N 3.42Å; S276-L279 PolarHBondContact O-N 2.04Å; F277-L279 VanDerWaalsContact C-N 3.3Å; F277-L279 PolarHBondContact O-N 3.37Å; L279-H281 PolarHBondContact O-N 2.64Å; L279-H281 VanDerWaalsContact O-N 3.14Å; L279-L282 PolarHBondContact O-N 2.95Å; L279-L282 VanDerWaalsContact O-N 3.16Å; L279-F283 HydrophobicContact CD1-CD2 4.44Å; L279-F283 HydrophobicContact CD1-CE2 3.58Å; L279-F283 HydrophobicContact CD1-CZ 4.09Å; L279-F283 HydrophobicContact CD2-CE2 4.45Å; L279-F283 HydrophobicContact CG-CE2 3.79Å; L279-F283 WeakPolarHBondContact O-CD2 3.3Å; L279-V289 HydrophobicContact CD1-CG1 3.75Å; L279-Y301 HydrophobicContact CB-CE1 4.47Å; L279-Y301 WeakPolarHBondContact CB-OH 3.16Å; L279-Y301 HydrophobicContact CD2-CD1 4.06Å; L279-Y301 HydrophobicContact CD2-CD2 4.08Å; L279-Y301 HydrophobicContact CD2-CE1 3.55Å; L279-Y301 HydrophobicContact CD2-CE2 3.58Å; L279-Y301 HydrophobicContact CD2-CG 4.3Å; L279-Y301 WeakPolarHBondContact CD2-OH 3.43Å; L279-L304 HydrophobicContact CD2-CD1 4.08Å
280	K	98.8	Very high	98.7	Very high	1 Å²	1	10.7 Å²	10.7	0%	0.004	6%	0.059	C	C	.	.	H	α-helix	trans	-58.2	-29.9	-177	62.3	176.8	179.5	-70.4	0	113.9	F165 W183 F277 R278 F300 L349	F165-K280 HydrophobicContact CD1-CD 4.48Å; F165-K280 HydrophobicContact CE1-CD 3.65Å; F165-K280 HydrophobicContact CZ-CD 3.89Å; W183-K280 HydrophobicContact CD2-CD 4.18Å; W183-K280 HydrophobicContact CE3-CD 4.15Å; W183-K280 HydrophobicContact CH2-CB 4.06Å; W183-K280 HydrophobicContact CH2-CD 4.15Å; W183-K280 HydrophobicContact CH2-CG 4.01Å; W183-K280 HydrophobicContact CZ2-CB 4.33Å; W183-K280 HydrophobicContact CZ2-CD 4.19Å; W183-K280 HydrophobicContact CZ2-CG 4.44Å; W183-K280 HydrophobicContact CZ3-CD 4.15Å; W183-K280 HydrophobicContact CZ3-CG 4.09Å; F277-K280 PolarHBondContact O-NZ 2.93Å; R278-K280 PolarHBondContact O-N 2.77Å; K280-F300 HydrophobicContact CB-CE2 4.28Å; K280-F300 HydrophobicContact CB-CZ 3.88Å; K280-L349 HydrophobicContact CB-CD2 3.82Å; K280-L349 HydrophobicContact CD-CD2 4.22Å
281	H	98.9	Very high	98.7	Very high	4 Å²	4	11.3 Å²	11.3	2%	0.019	6%	0.062	C	C	.	.	H	α-helix	trans	-75.2	-37.6	-178.1	-58.1	91	0	0	0	111.7	W183 M186 L190 L258 F277 R278 L279 F283 L284	W183-H281 AromaticContact CE3-NE2 3.84Å; W183-H281 AromaticContact CZ3-CD2 3.53Å; W183-H281 AromaticContact CZ3-NE2 3.8Å; M186-H281 WeakPolarHBondContact CG-CD2 3.28Å; L190-H281 HydrophobicContact CD1-CB 3.85Å; L258-H281 HydrophobicContact CD1-CB 3.92Å; L258-H281 HydrophobicContact CD2-CB 4.24Å; L258-H281 HydrophobicContact CG-CB 4.49Å; F277-H281 PolarHBondContact O-CE1 3.41Å; F277-H281 PolarHBondContact O-ND1 2.9Å; R278-H281 WeakPolarHBondContact O-CB 3.39Å; R278-H281 PolarHBondContact O-N 3.46Å; L279-H281 PolarHBondContact O-N 2.64Å; L279-H281 VanDerWaalsContact O-N 3.14Å; H281-F283 VanDerWaalsContact C-N 3.3Å; H281-F283 PolarHBondContact O-N 3.35Å; H281-L284 PolarHBondContact O-N 3.33Å; H281-L284 VanDerWaalsContact O-N 3.13Å
282	L	98.9	Very high	98.8	Very high	2 Å²	2	9.1 Å²	9.1	1%	0.01	5%	0.054	C	C	.	.	H	α-helix	trans	-61.9	-39.2	-174.9	-54.8	-176.1	0	0	0	112.1	L267 N269 R278 L279 L284 C285 V289	L267-L282 HydrophobicContact CB-CB 4.15Å; L267-L282 HydrophobicContact CB-CD1 4.02Å; L267-L282 HydrophobicContact CB-CD2 4.17Å; L267-L282 HydrophobicContact CB-CG 4.33Å; L267-L282 HydrophobicContact CD1-CB 4.06Å; L267-L282 HydrophobicContact CD1-CD2 4.03Å; N269-L282 HydrophobicContact CB-CD1 3.87Å; R278-L282 HydrophobicContact CG-CD1 3.92Å; R278-L282 HydrophobicContact CG-CD2 3.68Å; R278-L282 HydrophobicContact CG-CG 3.81Å; R278-L282 PolarHBondContact O-N 3.43Å; L279-L282 PolarHBondContact O-N 2.95Å; L279-L282 VanDerWaalsContact O-N 3.16Å; L282-L284 VanDerWaalsContact C-N 3.28Å; L282-L284 PolarHBondContact O-N 3.15Å; L282-C285 WeakPolarHBondContact O-CB 3.47Å; L282-C285 PolarHBondContact O-N 3.43Å; L282-V289 HydrophobicContact CB-CG2 3.66Å; L282-V289 HydrophobicContact CD1-CG1 4.29Å
283	F	98.9	Very high	98.8	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60.3	-37.5	177.7	-71.2	-68.9	0	0	0	112.7	L279 H281 C285 G286 V289 L304 H309 Y310 Q342 I345	L279-F283 HydrophobicContact CD1-CD2 4.44Å; L279-F283 HydrophobicContact CD1-CE2 3.58Å; L279-F283 HydrophobicContact CD1-CZ 4.09Å; L279-F283 HydrophobicContact CD2-CE2 4.45Å; L279-F283 HydrophobicContact CG-CE2 3.79Å; L279-F283 WeakPolarHBondContact O-CD2 3.3Å; H281-F283 VanDerWaalsContact C-N 3.3Å; H281-F283 PolarHBondContact O-N 3.35Å; F283-C285 PolarHBondContact O-N 3.22Å; F283-G286 PolarHBondContact O-N 2.88Å; F283-V289 HydrophobicContact CD1-CB 4.15Å; F283-V289 HydrophobicContact CD1-CG2 3.48Å; F283-V289 VanDerWaalsContact CD1-CG2 3.48Å; F283-V289 HydrophobicContact CD2-CG2 4.27Å; F283-V289 HydrophobicContact CE1-CB 3.68Å; F283-V289 HydrophobicContact CE1-CG1 4.29Å; F283-V289 HydrophobicContact CE1-CG2 3.55Å; F283-V289 HydrophobicContact CE2-CG1 4.48Å; F283-V289 HydrophobicContact CE2-CG2 4.34Å; F283-V289 HydrophobicContact CG-CG2 3.87Å; F283-V289 HydrophobicContact CZ-CB 3.96Å; F283-V289 HydrophobicContact CZ-CG1 4.04Å; F283-V289 HydrophobicContact CZ-CG2 4Å; F283-L304 HydrophobicContact CE2-CD1 3.73Å; F283-L304 HydrophobicContact CE2-CD2 4.05Å; F283-L304 HydrophobicContact CZ-CD1 4.19Å; F283-L304 HydrophobicContact CZ-CD2 3.99Å; F283-H309 WeakPolarHBondContact CE1-O 3.49Å; F283-Y310 HydrophobicContact CZ-CD1 4.11Å; F283-Y310 HydrophobicContact CZ-CG 4.46Å; F283-Q342 WeakPolarHBondContact O-CA 3.49Å; F283-Q342 VanDerWaalsContact O-CB 3.25Å; F283-Q342 WeakPolarHBondContact O-CB 3.22Å; F283-Q342 VanDerWaalsContact O-CG 3.31Å; F283-Q342 WeakPolarHBondContact O-CG 3.44Å; F283-I345 HydrophobicContact CB-CB 4.19Å; F283-I345 HydrophobicContact CB-CG1 3.64Å; F283-I345 HydrophobicContact CD2-CD1 4.17Å; F283-I345 HydrophobicContact CD2-CG1 3.71Å; F283-I345 HydrophobicContact CG-CG1 3.8Å
284	L	98.9	Very high	98.7	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-68.6	-18.4	-176.9	-68.3	-173.1	0	0	0	113.6	W183 R187 L190 A194 H281 L282 G286 Q342 I345 L346	W183-L284 HydrophobicContact CH2-CD1 3.25Å; W183-L284 HydrophobicContact CH2-CG 3.99Å; W183-L284 HydrophobicContact CZ2-CD1 3.88Å; W183-L284 HydrophobicContact CZ3-CD1 3.83Å; R187-L284 HydrophobicContact CB-CD1 4.03Å; R187-L284 HydrophobicContact CG-CD1 3.64Å; L190-L284 HydrophobicContact CB-CB 3.66Å; L190-L284 HydrophobicContact CB-CD1 4.28Å; L190-L284 HydrophobicContact CD1-CB 4.04Å; L190-L284 HydrophobicContact CD1-CD1 4.09Å; L190-L284 HydrophobicContact CG-CB 4.42Å; A194-L284 VanDerWaalsContact CB-O 3.32Å; A194-L284 WeakPolarHBondContact CB-O 3.36Å; H281-L284 PolarHBondContact O-N 3.33Å; H281-L284 VanDerWaalsContact O-N 3.13Å; L282-L284 VanDerWaalsContact C-N 3.28Å; L282-L284 PolarHBondContact O-N 3.15Å; L284-G286 PolarHBondContact O-N 3.04Å; L284-Q342 PolarHBondContact O-NE2 3.47Å; L284-I345 HydrophobicContact CD1-CG2 4.42Å; L284-I345 HydrophobicContact CD2-CB 4.17Å; L284-I345 HydrophobicContact CD2-CG2 3.7Å; L284-I345 HydrophobicContact CG-CG2 3.9Å; L284-L346 HydrophobicContact CD2-CD2 3.57Å; L284-L346 HydrophobicContact CD2-CG 3.78Å
285	C	98.9	Very high	98.7	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.007	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-12.3	171.4	-75.7	0	0	0	0	114.2	A194 K202 C262 L267 L282 F283 S287	A194-C285 WeakPolarHBondContact CB-O 3.41Å; K202-C285 PolarHBondContact NZ-O 2.81Å; C262-C285 WeakPolarHBondContact CA-SG 3.46Å; C262-C285 HydrophobicContact CB-CB 3.49Å; C262-C285 VanDerWaalsContact CB-CB 3.49Å; C262-C285 WeakPolarHBondContact CB-SG 3.48Å; C262-C285 PolarHBondContact N-SG 2.8Å; C262-C285 VanDerWaalsContact N-SG 3.41Å; C262-C285 WeakPolarHBondContact SG-CA 3.35Å; C262-C285 WeakPolarHBondContact SG-CB 3.25Å; C262-C285 CovalentContact SG-SG 2.05Å; C262-C285 PolarHBondContact SG-SG 3.46Å; L267-C285 HydrophobicContact CD1-CB 4.04Å; L282-C285 WeakPolarHBondContact O-CB 3.47Å; L282-C285 PolarHBondContact O-N 3.43Å; F283-C285 PolarHBondContact O-N 3.22Å; C285-S287 PolarHBondContact O-N 2.92Å
286	G	98.8	Very high	98.7	Very high	13 Å²	13	19.4 Å²	19.4	13%	0.134	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	23.2	-169.8	0	0	0	0	0	112.2	K202 F283 L284	K202-G286 VanDerWaalsContact CE-O 3.24Å; K202-G286 WeakPolarHBondContact CE-O 3.47Å; F283-G286 PolarHBondContact O-N 2.88Å; L284-G286 PolarHBondContact O-N 3.04Å
287	S	98.9	Very high	98.7	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.104	C	C	.	.	P	Polyproline II helix	trans	-97	156	175	-60.5	0	0	0	0	109.4	K202 Y264 K265 C285 V289	K202-S287 WeakPolarHBondContact CE-OG 3.13Å; K202-S287 PolarHBondContact NZ-OG 2.6Å; Y264-S287 VanDerWaalsContact O-CB 3.26Å; Y264-S287 WeakPolarHBondContact O-CB 3Å; Y264-S287 PolarHBondContact O-OG 3.06Å; K265-S287 CarbonylContact O-C 3.52Å; K265-S287 WeakPolarHBondContact O-CB 3.42Å; C285-S287 PolarHBondContact O-N 2.92Å; S287-V289 PolarHBondContact O-N 3.3Å
288	L	98.9	Very high	98.7	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	119.9	175.6	-178.1	58.4	0	0	0	109.8	W199 K265 Y266 L267 F290 I311 V327 A334 I337 A338	W199-L288 HydrophobicContact CH2-CB 3.92Å; W199-L288 HydrophobicContact CZ3-CB 4.12Å; K265-L288 PolarHBondContact O-N 2.84Å; Y266-L288 WeakPolarHBondContact CA-O 3.49Å; Y266-L288 HydrophobicContact CD1-CB 4.27Å; Y266-L288 HydrophobicContact CD1-CD2 4.38Å; L267-L288 PolarHBondContact N-O 3.43Å; L288-F290 HydrophobicContact CD2-CE2 3.92Å; L288-F290 HydrophobicContact CD2-CZ 4.5Å; L288-F290 HydrophobicContact CG-CD2 4.4Å; L288-F290 HydrophobicContact CG-CE2 4Å; L288-I311 HydrophobicContact CD1-CD1 4.41Å; L288-I311 HydrophobicContact CD1-CG1 3.95Å; L288-I311 HydrophobicContact CD2-CD1 4.19Å; L288-I311 HydrophobicContact CD2-CG1 3.7Å; L288-I311 HydrophobicContact CG-CG1 3.9Å; L288-V327 HydrophobicContact CD2-CB 4.1Å; L288-V327 HydrophobicContact CD2-CG1 3.69Å; L288-A334 HydrophobicContact CD2-CB 3.75Å; L288-I337 HydrophobicContact CD1-CB 3.77Å; L288-I337 HydrophobicContact CD1-CG2 3.5Å; L288-I337 VanDerWaalsContact CD1-CG2 3.5Å; L288-A338 HydrophobicContact CB-CB 4.06Å; L288-A338 HydrophobicContact CD1-CB 4.34Å
289	V	99	Very high	98.7	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	132.2	178.1	179.8	0	0	0	0	110.1	L267 N269 L279 L282 F283 S287 Y310 I311	L267-V289 WeakPolarHBondContact O-CA 3.49Å; N269-V289 HydrophobicContact CB-CG1 4.47Å; L279-V289 HydrophobicContact CD1-CG1 3.75Å; L282-V289 HydrophobicContact CB-CG2 3.66Å; L282-V289 HydrophobicContact CD1-CG1 4.29Å; F283-V289 HydrophobicContact CD1-CB 4.15Å; F283-V289 HydrophobicContact CD1-CG2 3.48Å; F283-V289 VanDerWaalsContact CD1-CG2 3.48Å; F283-V289 HydrophobicContact CD2-CG2 4.27Å; F283-V289 HydrophobicContact CE1-CB 3.68Å; F283-V289 HydrophobicContact CE1-CG1 4.29Å; F283-V289 HydrophobicContact CE1-CG2 3.55Å; F283-V289 HydrophobicContact CE2-CG1 4.48Å; F283-V289 HydrophobicContact CE2-CG2 4.34Å; F283-V289 HydrophobicContact CG-CG2 3.87Å; F283-V289 HydrophobicContact CZ-CB 3.96Å; F283-V289 HydrophobicContact CZ-CG1 4.04Å; F283-V289 HydrophobicContact CZ-CG2 4Å; S287-V289 PolarHBondContact O-N 3.3Å; V289-Y310 WeakPolarHBondContact O-CB 3.49Å; V289-I311 PolarHBondContact O-N 3.28Å
290	F	98.9	Very high	98.7	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	108.6	167.8	-79.3	-112.6	0	0	0	107.8	Y266 L267 F268 N269 L288 I311 V313 L320 L323 L324 V327	Y266-F290 AromaticContact CD1-CE2 3.91Å; Y266-F290 HydrophobicContact CD1-CE2 3.91Å; Y266-F290 HydrophobicContact CG-CE2 4.09Å; L267-F290 PolarHBondContact O-N 2.98Å; F268-F290 WeakPolarHBondContact CA-O 3.09Å; F268-F290 HydrophobicContact CD1-CB 3.48Å; F268-F290 VanDerWaalsContact CD1-CB 3.48Å; F268-F290 HydrophobicContact CD1-CG 4.29Å; F268-F290 HydrophobicContact CE1-CB 3.39Å; F268-F290 AromaticContact CE1-CD1 3.77Å; F268-F290 HydrophobicContact CE1-CD1 3.77Å; F268-F290 AromaticContact CE1-CG 3.71Å; F268-F290 HydrophobicContact CE1-CG 3.71Å; F268-F290 HydrophobicContact CG-CB 4.21Å; F268-F290 HydrophobicContact CZ-CB 4.09Å; F268-F290 HydrophobicContact CZ-CD1 4.09Å; F268-F290 HydrophobicContact CZ-CG 4.01Å; N269-F290 PolarHBondContact N-O 3.24Å; L288-F290 HydrophobicContact CD2-CE2 3.92Å; L288-F290 HydrophobicContact CD2-CZ 4.5Å; L288-F290 HydrophobicContact CG-CD2 4.4Å; L288-F290 HydrophobicContact CG-CE2 4Å; F290-I311 WeakPolarHBondContact CA-O 3.47Å; F290-I311 HydrophobicContact CD1-CB 4.01Å; F290-I311 HydrophobicContact CD1-CG2 3.87Å; F290-I311 HydrophobicContact CD2-CB 4.37Å; F290-I311 HydrophobicContact CD2-CG1 4.44Å; F290-I311 HydrophobicContact CE1-CB 4.06Å; F290-I311 HydrophobicContact CE1-CG1 4.32Å; F290-I311 HydrophobicContact CE1-CG2 3.73Å; F290-I311 HydrophobicContact CE2-CB 4.4Å; F290-I311 HydrophobicContact CE2-CG1 4.09Å; F290-I311 HydrophobicContact CG-CB 4.16Å; F290-I311 HydrophobicContact CZ-CB 4.24Å; F290-I311 HydrophobicContact CZ-CG1 4.02Å; F290-I311 HydrophobicContact CZ-CG2 4.26Å; F290-V313 HydrophobicContact CB-CG2 3.96Å; F290-V313 HydrophobicContact CD1-CG2 3.63Å; F290-V313 HydrophobicContact CG-CG2 4.27Å; F290-L320 HydrophobicContact CD1-CD1 4.27Å; F290-L323 HydrophobicContact CE1-CB 3.92Å; F290-L324 HydrophobicContact CE1-CD2 4.17Å; F290-L324 HydrophobicContact CE1-CG 4.41Å; F290-L324 HydrophobicContact CE2-CD2 4.5Å; F290-L324 HydrophobicContact CZ-CD2 3.98Å; F290-V327 HydrophobicContact CE2-CG2 4.33Å; F290-V327 HydrophobicContact CZ-CB 4.47Å; F290-V327 HydrophobicContact CZ-CG1 3.94Å; F290-V327 HydrophobicContact CZ-CG2 3.75Å
291	H	98.9	Very high	98.7	Very high	14 Å²	14	18.4 Å²	18.4	7%	0.065	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	115.5	-179	-172	10.1	0	0	0	110	N269 Y301 Y310 I311 V313	N269-H291 PolarHBondContact ND2-CE1 2.76Å; N269-H291 VanDerWaalsContact ND2-CE1 3.31Å; N269-H291 PolarHBondContact ND2-ND1 2.85Å; N269-H291 VanDerWaalsContact ND2-ND1 3.16Å; H291-Y301 AromaticContact NE2-CE2 3.87Å; H291-Y310 HydrophobicContact CB-CD2 3.54Å; H291-Y310 HydrophobicContact CB-CE2 3.69Å; H291-Y310 HydrophobicContact CB-CG 4.22Å; H291-I311 PolarHBondContact N-O 2.66Å; H291-V313 PolarHBondContact O-N 3.15Å
292	V	98.9	Very high	98.6	Very high	3 Å²	3	20.5 Å²	20.5	2%	0.018	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	126.4	-179.8	179.8	0	0	0	0	110.5	F268 N269 F270 V313 L317	F268-V292 HydrophobicContact CD1-CG2 4.47Å; N269-V292 PolarHBondContact O-N 3.36Å; F270-V292 HydrophobicContact CD1-CB 3.63Å; F270-V292 HydrophobicContact CD1-CG1 3.74Å; F270-V292 HydrophobicContact CD1-CG2 3.88Å; F270-V292 HydrophobicContact CE1-CB 3.74Å; F270-V292 HydrophobicContact CE1-CG1 3.73Å; F270-V292 HydrophobicContact CE1-CG2 3.5Å; F270-V292 HydrophobicContact CE2-CG2 4.29Å; F270-V292 HydrophobicContact CG-CB 4.24Å; F270-V292 HydrophobicContact CG-CG2 4.42Å; F270-V292 HydrophobicContact CZ-CB 4.39Å; F270-V292 HydrophobicContact CZ-CG2 3.7Å; V292-V313 HydrophobicContact CB-CB 4.45Å; V292-V313 HydrophobicContact CG2-CB 3.82Å; V292-V313 HydrophobicContact CG2-CG1 4.01Å; V292-V313 HydrophobicContact CG2-CG2 4.33Å; V292-L317 HydrophobicContact CG1-CD1 3.7Å; V292-L317 HydrophobicContact CG1-CG 4.43Å
293	G	98.1	Very high	98.6	Very high	18 Å²	18	22.2 Å²	22.2	19%	0.186	12%	0.117	C	C	.	.			trans	72.7	167.9	-177	0	0	0	0	0	113.4	V313	G293-V313 PolarHBondContact N-O 3.16Å
294	E	97.2	Very high	98.5	Very high	168 Å²	168	22.4 Å²	22.4	79%	0.785	12%	0.118	S	C	*	.	S	Bend	trans	-133.1	-3.6	-176.1	65	-175.9	-178.6	0	0	114.4
295	E	98.2	Very high	98.5	Very high	93 Å²	93	25.2 Å²	25.2	44%	0.435	13%	0.132	S	C	.	.	S	Bend	trans	-74.6	-42.9	-171.5	-59.5	-177.2	147.8	0	0	113.7	T152	T152-E295 WeakPolarHBondContact CA-O 3.26Å; T152-E295 WeakPolarHBondContact CB-O 3.24Å; T152-E295 HydrophobicContact CG2-CB 4.06Å
296	W	98.8	Very high	98.5	Very high	15 Å²	15	27.5 Å²	27.5	6%	0.057	15%	0.147	C	C	.	.			trans	-90.6	119.6	-169.7	-76	89.6	0	0	0	111.9	Y133 P134 T152 R271 A274 A275 Y301	Y133-W296 AromaticContact CD2-CH2 3.73Å; Y133-W296 HydrophobicContact CD2-CH2 3.73Å; Y133-W296 HydrophobicContact CD2-CZ2 4.37Å; Y133-W296 HydrophobicContact CE1-CH2 4.45Å; Y133-W296 AromaticContact CE2-CH2 3.24Å; Y133-W296 HydrophobicContact CE2-CH2 3.24Å; Y133-W296 AromaticContact CE2-CZ2 3.53Å; Y133-W296 HydrophobicContact CE2-CZ2 3.53Å; Y133-W296 HydrophobicContact CE2-CZ3 4.39Å; Y133-W296 AromaticContact CZ-CH2 3.65Å; Y133-W296 AromaticContact CZ-CZ2 3.93Å; P134-W296 HydrophobicContact CG-CH2 4.16Å; P134-W296 HydrophobicContact CG-CZ3 4.07Å; T152-W296 HydrophobicContact CG2-CD2 3.68Å; T152-W296 HydrophobicContact CG2-CE3 3.97Å; T152-W296 HydrophobicContact CG2-CG 4.09Å; T152-W296 HydrophobicContact CG2-CH2 4.21Å; T152-W296 HydrophobicContact CG2-CZ2 3.91Å; T152-W296 HydrophobicContact CG2-CZ3 4.23Å; R271-W296 HydrophobicContact CB-CB 4.26Å; R271-W296 HydrophobicContact CB-CG 4.14Å; A274-W296 HydrophobicContact CB-CD2 4.29Å; A274-W296 HydrophobicContact CB-CE3 3.47Å; A274-W296 VanDerWaalsContact CB-CE3 3.47Å; A274-W296 HydrophobicContact CB-CH2 4.18Å; A274-W296 HydrophobicContact CB-CZ3 3.4Å; A275-W296 HydrophobicContact CB-CB 4.3Å; W296-Y301 WeakPolarHBondContact O-CD2 3.47Å; W296-Y301 VanDerWaalsContact O-CE2 3.31Å; W296-Y301 WeakPolarHBondContact O-CE2 3.44Å
297	L	98.8	Very high	98.5	Very high	44 Å²	44	28.1 Å²	28.1	23%	0.23	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	149.5	-171.9	-54.1	177.4	0	0	0	111.9	S150 K151 M159 Y301	S150-L297 WeakPolarHBondContact CA-O 3.18Å; S150-L297 WeakPolarHBondContact CB-O 3.34Å; S150-L297 PolarHBondContact OG-O 2.9Å; K151-L297 PolarHBondContact N-O 2.94Å; K151-L297 PolarHBondContact O-N 3.31Å; M159-L297 HydrophobicContact CE-CB 4.31Å; M159-L297 HydrophobicContact SD-CB 3.94Å; L297-Y301 HydrophobicContact CD2-CD2 4.19Å
298	E	98.9	Very high	98.5	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	167.4	148.7	-58.1	-176.9	-111.7	0	0	108.1	F149 A275 F300 Y301	F149-E298 HydrophobicContact CD2-CG 4.16Å; F149-E298 HydrophobicContact CE2-CG 4.2Å; A275-E298 HydrophobicContact CB-CG 3.72Å; E298-F300 HydrophobicContact CB-CD1 4.02Å; E298-F300 HydrophobicContact CB-CE1 3.76Å; E298-F300 HydrophobicContact CG-CE1 4.34Å; E298-F300 PolarHBondContact O-N 2.92Å; E298-Y301 HydrophobicContact CB-CD1 3.66Å; E298-Y301 HydrophobicContact CB-CE1 3.57Å; E298-Y301 HydrophobicContact CG-CD1 4.24Å; E298-Y301 HydrophobicContact CG-CE1 3.63Å; E298-Y301 WeakPolarHBondContact O-CB 3.41Å; E298-Y301 PolarHBondContact O-N 3.17Å; E298-Y301 PolarHBondContact OE1-OH 3.24Å
299	F	98.6	Very high	98.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-28.4	-172.5	83.8	-81.1	0	0	0	115.3	H56 V59 M159 P161 F165 L349 Y357	H56-F299 HydrophobicContact CB-CD2 4.07Å; H56-F299 HydrophobicContact CB-CE2 4.22Å; H56-F299 AromaticContact CD2-CE2 3.82Å; H56-F299 AromaticContact CG-CE2 3.99Å; V59-F299 WeakPolarHBondContact CG2-O 3.41Å; M159-F299 HydrophobicContact CB-CB 4.13Å; P161-F299 HydrophobicContact CB-CD1 4.02Å; P161-F299 HydrophobicContact CB-CE1 3.63Å; P161-F299 HydrophobicContact CB-CZ 4.14Å; P161-F299 HydrophobicContact CG-CD1 4.01Å; P161-F299 HydrophobicContact CG-CE1 3.81Å; P161-F299 HydrophobicContact CG-CE2 4.34Å; P161-F299 HydrophobicContact CG-CG 4.36Å; P161-F299 HydrophobicContact CG-CZ 3.99Å; F165-F299 AromaticContact CE2-CE1 3.83Å; F165-F299 HydrophobicContact CE2-CE1 3.83Å; F165-F299 HydrophobicContact CZ-CE1 4.07Å; F299-L349 HydrophobicContact CE1-CD1 4.22Å; F299-L349 HydrophobicContact CZ-CD1 3.68Å; F299-Y357 HydrophobicContact CB-CE1 4.21Å; F299-Y357 HydrophobicContact CB-CE2 4.39Å; F299-Y357 HydrophobicContact CD2-CD1 4.12Å; F299-Y357 AromaticContact CD2-CD2 3.53Å; F299-Y357 HydrophobicContact CD2-CD2 3.53Å; F299-Y357 HydrophobicContact CD2-CE1 4.15Å; F299-Y357 AromaticContact CD2-CE2 3.57Å; F299-Y357 HydrophobicContact CD2-CE2 3.57Å; F299-Y357 AromaticContact CD2-CG 3.8Å; F299-Y357 HydrophobicContact CD2-CG 3.8Å; F299-Y357 AromaticContact CD2-CZ 3.88Å; F299-Y357 AromaticContact CE2-CD2 3.83Å; F299-Y357 HydrophobicContact CE2-CD2 3.83Å; F299-Y357 HydrophobicContact CE2-CE2 4.33Å; F299-Y357 AromaticContact CE2-CG 3.92Å; F299-Y357 HydrophobicContact CE2-CG 3.92Å; F299-Y357 HydrophobicContact CG-CE1 4.34Å; F299-Y357 HydrophobicContact CG-CE2 4.38Å
300	F	98.4	Very high	98.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-10.6	-178	68.2	-88.9	0	0	0	114	F165 K280 E298 Q303 L304 I345 L349	F165-F300 HydrophobicContact CZ-CE1 4.33Å; K280-F300 HydrophobicContact CB-CE2 4.28Å; K280-F300 HydrophobicContact CB-CZ 3.88Å; E298-F300 HydrophobicContact CB-CD1 4.02Å; E298-F300 HydrophobicContact CB-CE1 3.76Å; E298-F300 HydrophobicContact CG-CE1 4.34Å; E298-F300 PolarHBondContact O-N 2.92Å; F300-Q303 PolarHBondContact O-N 3.11Å; F300-L304 HydrophobicContact CD2-CD1 3.8Å; F300-L304 HydrophobicContact CD2-CG 4.49Å; F300-L304 HydrophobicContact CE2-CD1 3.7Å; F300-I345 HydrophobicContact CD2-CD1 4.42Å; F300-I345 HydrophobicContact CE2-CD1 4.33Å; F300-L349 HydrophobicContact CB-CD1 3.79Å; F300-L349 HydrophobicContact CD1-CD1 3.94Å; F300-L349 HydrophobicContact CD1-CD2 4.1Å; F300-L349 HydrophobicContact CD2-CD1 4.45Å; F300-L349 HydrophobicContact CD2-CD2 3.89Å; F300-L349 HydrophobicContact CE1-CD2 4.12Å; F300-L349 HydrophobicContact CE2-CD2 3.91Å; F300-L349 HydrophobicContact CG-CD1 3.81Å; F300-L349 HydrophobicContact CG-CD2 3.98Å; F300-L349 HydrophobicContact CZ-CD2 4.01Å
301	Y	98.7	Very high	98.5	Very high	10 Å²	10	29.4 Å²	29.4	4%	0.039	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-61.1	-40.4	-175.6	-79.8	36.1	0	0	0	113	A275 S276 L279 H291 W296 L297 E298 Q303 L304	A275-Y301 HydrophobicContact CB-CE2 4.2Å; S276-Y301 PolarHBondContact O-OH 2.77Å; L279-Y301 HydrophobicContact CB-CE1 4.47Å; L279-Y301 WeakPolarHBondContact CB-OH 3.16Å; L279-Y301 HydrophobicContact CD2-CD1 4.06Å; L279-Y301 HydrophobicContact CD2-CD2 4.08Å; L279-Y301 HydrophobicContact CD2-CE1 3.55Å; L279-Y301 HydrophobicContact CD2-CE2 3.58Å; L279-Y301 HydrophobicContact CD2-CG 4.3Å; L279-Y301 WeakPolarHBondContact CD2-OH 3.43Å; H291-Y301 AromaticContact NE2-CE2 3.87Å; W296-Y301 WeakPolarHBondContact O-CD2 3.47Å; W296-Y301 VanDerWaalsContact O-CE2 3.31Å; W296-Y301 WeakPolarHBondContact O-CE2 3.44Å; L297-Y301 HydrophobicContact CD2-CD2 4.19Å; E298-Y301 HydrophobicContact CB-CD1 3.66Å; E298-Y301 HydrophobicContact CB-CE1 3.57Å; E298-Y301 HydrophobicContact CG-CD1 4.24Å; E298-Y301 HydrophobicContact CG-CE1 3.63Å; E298-Y301 WeakPolarHBondContact O-CB 3.41Å; E298-Y301 PolarHBondContact O-N 3.17Å; E298-Y301 PolarHBondContact OE1-OH 3.24Å; Y301-Q303 PolarHBondContact O-N 2.91Å; Y301-L304 WeakPolarHBondContact O-CA 3.46Å; Y301-L304 WeakPolarHBondContact O-CB 3.31Å; Y301-L304 PolarHBondContact O-N 3.25Å
302	P	97.8	Very high	98.5	Very high	48 Å²	48	30.2 Å²	30.2	31%	0.312	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-60	-20	-179.3	-29.6	39.9	0	0	0	114.9	V59 L305	V59-P302 HydrophobicContact CG2-CB 3.82Å; V59-P302 HydrophobicContact CG2-CG 3.62Å; P302-L305 WeakPolarHBondContact O-CD2 3.38Å
303	Q	97.6	Very high	98.5	Very high	38 Å²	38	30.4 Å²	30.4	18%	0.178	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-90.4	-12.2	175.7	-62.1	-59.4	-42.5	0	0	113.1	C55 H56 S58 F300 Y301 L305 H309 F344	C55-Q303 WeakPolarHBondContact O-CG 3.33Å; C55-Q303 PolarHBondContact O-NE2 3.05Å; C55-Q303 VanDerWaalsContact O-NE2 3.15Å; H56-Q303 WeakPolarHBondContact ND1-CG 3.22Å; S58-Q303 PolarHBondContact OG-NE2 3.36Å; F300-Q303 PolarHBondContact O-N 3.11Å; Y301-Q303 PolarHBondContact O-N 2.91Å; Q303-L305 PolarHBondContact O-N 3.41Å; Q303-H309 PolarHBondContact O-CE1 3.3Å; Q303-F344 HydrophobicContact CB-CE1 4.31Å; Q303-F344 HydrophobicContact CB-CE2 3.91Å; Q303-F344 HydrophobicContact CB-CZ 3.37Å
304	L	98.3	Very high	98.5	Very high	5 Å²	5	35.1 Å²	35.1	3%	0.026	17%	0.174	C	C	.	.	S	Bend	trans	-83.6	99.4	167.4	-71.1	169.7	0	0	0	108.9	L279 F283 F300 Y301 H309 Y310 F344 I345	L279-L304 HydrophobicContact CD2-CD1 4.08Å; F283-L304 HydrophobicContact CE2-CD1 3.73Å; F283-L304 HydrophobicContact CE2-CD2 4.05Å; F283-L304 HydrophobicContact CZ-CD1 4.19Å; F283-L304 HydrophobicContact CZ-CD2 3.99Å; F300-L304 HydrophobicContact CD2-CD1 3.8Å; F300-L304 HydrophobicContact CD2-CG 4.49Å; F300-L304 HydrophobicContact CE2-CD1 3.7Å; Y301-L304 WeakPolarHBondContact O-CA 3.46Å; Y301-L304 WeakPolarHBondContact O-CB 3.31Å; Y301-L304 PolarHBondContact O-N 3.25Å; L304-H309 HydrophobicContact CD2-CB 4.08Å; L304-Y310 HydrophobicContact CB-CD1 4.3Å; L304-Y310 HydrophobicContact CB-CE1 3.91Å; L304-Y310 VanDerWaalsContact O-CE1 3.25Å; L304-Y310 WeakPolarHBondContact O-CE1 3.44Å; L304-Y310 PolarHBondContact O-OH 2.56Å; L304-F344 HydrophobicContact CD2-CD1 3.4Å; L304-F344 VanDerWaalsContact CD2-CD1 3.4Å; L304-F344 HydrophobicContact CD2-CE1 3.81Å; L304-F344 HydrophobicContact CD2-CG 4.16Å; L304-F344 HydrophobicContact CG-CD1 4.12Å; L304-F344 HydrophobicContact CG-CE1 4Å; L304-I345 HydrophobicContact CD1-CD1 4.35Å; L304-I345 HydrophobicContact CD2-CD1 4.19Å
305	L	98.5	Very high	98.5	Very high	58 Å²	58	30.8 Å²	30.8	30%	0.304	15%	0.154	S	C	.	.			trans	-86.4	137.3	-179.9	-52.9	-174	0	0	0	113.7	Y45 P302 Q303 V308 H309	Y45-L305 HydrophobicContact CD2-CD1 3.63Å; Y45-L305 HydrophobicContact CE2-CD1 4.34Å; P302-L305 WeakPolarHBondContact O-CD2 3.38Å; Q303-L305 PolarHBondContact O-N 3.41Å; L305-V308 HydrophobicContact CB-CB 4.01Å; L305-V308 HydrophobicContact CB-CG2 3.85Å; L305-V308 HydrophobicContact CD1-CG2 4.38Å; L305-V308 PolarHBondContact O-N 3.21Å; L305-H309 PolarHBondContact N-ND1 3.35Å; L305-H309 PolarHBondContact O-N 2.76Å
306	P	98.8	Very high	98.5	Very high	50 Å²	50	31.2 Å²	31.2	33%	0.325	16%	0.159	S	C	.	.	B	Isolated β-bridge	trans	-60.8	144.4	173.3	26.4	-34	0	0	0	110.8	V308 Y310 P312	P306-V308 PolarHBondContact O-N 3.35Å; P306-Y310 HydrophobicContact CB-CE2 4.04Å; P306-P312 HydrophobicContact CB-CB 3.92Å; P306-P312 HydrophobicContact CB-CG 3.69Å
307	W	98.8	Very high	98.5	Very high	26 Å²	26	31.2 Å²	31.2	10%	0.098	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	-18.6	-176.9	-49.3	107.6	0	0	0	116	Y34 K37 I38 A41 Y310 I311 P312 L323	Y34-W307 AromaticContact CD1-CH2 3.48Å; Y34-W307 HydrophobicContact CD1-CH2 3.48Å; Y34-W307 VanDerWaalsContact CD1-CH2 3.48Å; Y34-W307 HydrophobicContact CD1-CZ2 4.08Å; Y34-W307 HydrophobicContact CD1-CZ3 4.03Å; Y34-W307 AromaticContact CE1-CH2 3.84Å; Y34-W307 HydrophobicContact CE1-CH2 3.84Å; Y34-W307 HydrophobicContact CE1-CZ2 4.34Å; K37-W307 HydrophobicContact CB-CD2 4.33Å; K37-W307 HydrophobicContact CB-CG 4.28Å; K37-W307 HydrophobicContact CD-CZ2 4Å; I38-W307 HydrophobicContact CD1-CE3 4.28Å; I38-W307 HydrophobicContact CG1-CB 3.95Å; I38-W307 HydrophobicContact CG1-CD2 4.32Å; I38-W307 HydrophobicContact CG1-CE3 3.83Å; I38-W307 HydrophobicContact CG1-CG 4.42Å; A41-W307 HydrophobicContact CB-CB 3.89Å; W307-Y310 WeakPolarHBondContact CA-O 3.22Å; W307-Y310 PolarHBondContact N-O 2.8Å; W307-I311 HydrophobicContact CE3-CD1 3.97Å; W307-I311 HydrophobicContact CH2-CG2 4.2Å; W307-I311 HydrophobicContact CZ3-CD1 3.74Å; W307-I311 HydrophobicContact CZ3-CG2 4.06Å; W307-P312 HydrophobicContact CD2-CG 4.04Å; W307-P312 VanDerWaalsContact CE2-CD 3.5Å; W307-P312 HydrophobicContact CG-CG 4.47Å; W307-P312 HydrophobicContact CH2-CG 4.23Å; W307-P312 HydrophobicContact CZ2-CG 3.46Å; W307-P312 VanDerWaalsContact CZ2-CG 3.46Å; W307-L323 HydrophobicContact CH2-CD2 3.62Å; W307-L323 HydrophobicContact CZ3-CD2 4.34Å
308	V	98.8	Very high	98.5	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.006	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-53.5	169.9	-174	0	0	0	0	109.9	A41 Y45 L305 P306 R340	A41-V308 HydrophobicContact CB-CG2 3.86Å; Y45-V308 HydrophobicContact CD1-CG1 3.8Å; Y45-V308 HydrophobicContact CD2-CG1 4.11Å; Y45-V308 HydrophobicContact CE1-CG1 4.14Å; Y45-V308 HydrophobicContact CE2-CG1 4.42Å; Y45-V308 HydrophobicContact CG-CG1 3.77Å; Y45-V308 HydrophobicContact CG-CG2 4.38Å; L305-V308 HydrophobicContact CB-CB 4.01Å; L305-V308 HydrophobicContact CB-CG2 3.85Å; L305-V308 HydrophobicContact CD1-CG2 4.38Å; L305-V308 PolarHBondContact O-N 3.21Å; P306-V308 PolarHBondContact O-N 3.35Å; V308-R340 WeakPolarHBondContact O-CB 3.41Å; V308-R340 PolarHBondContact O-NE 3.46Å
309	H	98.9	Very high	98.4	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.009	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-26.4	-172	-57.4	126.3	0	0	0	113.8	Y45 F283 Q303 L304 L305 I337 F344	Y45-H309 AromaticContact CE2-CE1 3.73Å; Y45-H309 AromaticContact CE2-NE2 3.95Å; Y45-H309 AromaticContact CZ-CE1 3.91Å; Y45-H309 AromaticContact CZ-NE2 3.65Å; Y45-H309 PolarHBondContact OH-NE2 2.73Å; F283-H309 WeakPolarHBondContact CE1-O 3.49Å; Q303-H309 PolarHBondContact O-CE1 3.3Å; L304-H309 HydrophobicContact CD2-CB 4.08Å; L305-H309 PolarHBondContact N-ND1 3.35Å; L305-H309 PolarHBondContact O-N 2.76Å; H309-I337 VanDerWaalsContact C-CG2 3.48Å; H309-F344 AromaticContact CE1-CD2 3.83Å; H309-F344 AromaticContact NE2-CD2 3.82Å
310	Y	98.9	Very high	98.4	Very high	23 Å²	23	33.8 Å²	33.8	9%	0.09	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-151.5	169.3	-177.6	63.3	-94.8	0	0	0	112	F283 V289 H291 L304 P306 W307 P312	F283-Y310 HydrophobicContact CZ-CD1 4.11Å; F283-Y310 HydrophobicContact CZ-CG 4.46Å; V289-Y310 WeakPolarHBondContact O-CB 3.49Å; H291-Y310 HydrophobicContact CB-CD2 3.54Å; H291-Y310 HydrophobicContact CB-CE2 3.69Å; H291-Y310 HydrophobicContact CB-CG 4.22Å; L304-Y310 HydrophobicContact CB-CD1 4.3Å; L304-Y310 HydrophobicContact CB-CE1 3.91Å; L304-Y310 VanDerWaalsContact O-CE1 3.25Å; L304-Y310 WeakPolarHBondContact O-CE1 3.44Å; L304-Y310 PolarHBondContact O-OH 2.56Å; P306-Y310 HydrophobicContact CB-CE2 4.04Å; W307-Y310 WeakPolarHBondContact CA-O 3.22Å; W307-Y310 PolarHBondContact N-O 2.8Å; Y310-P312 HydrophobicContact CE2-CB 4.07Å; Y310-P312 WeakPolarHBondContact O-CD 3.32Å
311	I	98.9	Very high	98.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	113.9	170.9	-55.7	-60.5	0	0	0	109.3	L288 V289 F290 H291 W307 L323 V327 I337	L288-I311 HydrophobicContact CD1-CD1 4.41Å; L288-I311 HydrophobicContact CD1-CG1 3.95Å; L288-I311 HydrophobicContact CD2-CD1 4.19Å; L288-I311 HydrophobicContact CD2-CG1 3.7Å; L288-I311 HydrophobicContact CG-CG1 3.9Å; V289-I311 PolarHBondContact O-N 3.28Å; F290-I311 WeakPolarHBondContact CA-O 3.47Å; F290-I311 HydrophobicContact CD1-CB 4.01Å; F290-I311 HydrophobicContact CD1-CG2 3.87Å; F290-I311 HydrophobicContact CD2-CB 4.37Å; F290-I311 HydrophobicContact CD2-CG1 4.44Å; F290-I311 HydrophobicContact CE1-CB 4.06Å; F290-I311 HydrophobicContact CE1-CG1 4.32Å; F290-I311 HydrophobicContact CE1-CG2 3.73Å; F290-I311 HydrophobicContact CE2-CB 4.4Å; F290-I311 HydrophobicContact CE2-CG1 4.09Å; F290-I311 HydrophobicContact CG-CB 4.16Å; F290-I311 HydrophobicContact CZ-CB 4.24Å; F290-I311 HydrophobicContact CZ-CG1 4.02Å; F290-I311 HydrophobicContact CZ-CG2 4.26Å; H291-I311 PolarHBondContact N-O 2.66Å; W307-I311 HydrophobicContact CE3-CD1 3.97Å; W307-I311 HydrophobicContact CH2-CG2 4.2Å; W307-I311 HydrophobicContact CZ3-CD1 3.74Å; W307-I311 HydrophobicContact CZ3-CG2 4.06Å; I311-L323 HydrophobicContact CG2-CB 4.33Å; I311-L323 HydrophobicContact CG2-CD1 4.01Å; I311-L323 HydrophobicContact CG2-CD2 4.02Å; I311-L323 HydrophobicContact CG2-CG 4.36Å; I311-V327 HydrophobicContact CD1-CG1 4.04Å; I311-V327 HydrophobicContact CG1-CG1 4.13Å; I311-I337 HydrophobicContact CD1-CD1 3.75Å
312	P	98.9	Very high	98.4	Very high	31 Å²	31	42.9 Å²	42.9	20%	0.201	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	137.1	171.4	32.2	-35.9	0	0	0	109.7	P306 W307 Y310 L323	P306-P312 HydrophobicContact CB-CB 3.92Å; P306-P312 HydrophobicContact CB-CG 3.69Å; W307-P312 HydrophobicContact CD2-CG 4.04Å; W307-P312 VanDerWaalsContact CE2-CD 3.5Å; W307-P312 HydrophobicContact CG-CG 4.47Å; W307-P312 HydrophobicContact CH2-CG 4.23Å; W307-P312 HydrophobicContact CZ2-CG 3.46Å; W307-P312 VanDerWaalsContact CZ2-CG 3.46Å; Y310-P312 HydrophobicContact CE2-CB 4.07Å; Y310-P312 WeakPolarHBondContact O-CD 3.32Å; P312-L323 WeakPolarHBondContact O-CD1 3.47Å
313	V	98.9	Very high	98.4	Very high	7 Å²	7	40.6 Å²	40.6	4%	0.042	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	138	177.2	-175	0	0	0	0	108.1	F290 H291 V292 G293 L317 L320 L323	F290-V313 HydrophobicContact CB-CG2 3.96Å; F290-V313 HydrophobicContact CD1-CG2 3.63Å; F290-V313 HydrophobicContact CG-CG2 4.27Å; H291-V313 PolarHBondContact O-N 3.15Å; V292-V313 HydrophobicContact CB-CB 4.45Å; V292-V313 HydrophobicContact CG2-CB 3.82Å; V292-V313 HydrophobicContact CG2-CG1 4.01Å; V292-V313 HydrophobicContact CG2-CG2 4.33Å; G293-V313 PolarHBondContact N-O 3.16Å; V313-L317 HydrophobicContact CG1-CG 4.39Å; V313-L320 HydrophobicContact CG1-CB 4.34Å; V313-L320 HydrophobicContact CG1-CD1 4.41Å; V313-L323 HydrophobicContact CB-CD1 4.34Å; V313-L323 HydrophobicContact CG1-CD1 4.35Å; V313-L323 HydrophobicContact CG2-CD1 3.96Å
314	K	98.6	Very high	98.5	Very high	117 Å²	117	38.8 Å²	38.8	51%	0.509	20%	0.195	S	C	.	.			trans	-58.9	147.6	175.2	-73	171.4	-177.8	179.7	0	111	D316 L317 S318 D319	K314-D316 VanDerWaalsContact CB-OD1 3.31Å; K314-D316 WeakPolarHBondContact CB-OD1 3.08Å; K314-D316 PolarHBondContact O-N 2.75Å; K314-D316 VanDerWaalsContact O-N 3.16Å; K314-L317 WeakPolarHBondContact O-CA 3.29Å; K314-L317 PolarHBondContact O-N 3.31Å; K314-S318 VanDerWaalsContact CD-OG 3.24Å; K314-S318 WeakPolarHBondContact CD-OG 3.18Å; K314-D319 HydrophobicContact CD-CB 4.23Å; K314-D319 WeakPolarHBondContact CG-OD2 3.16Å; K314-D319 PolarHBondContact N-OD1 3.23Å; K314-D319 VanDerWaalsContact N-OD1 3.09Å
315	Q	97.2	Very high	98.5	Very high	77 Å²	77	41.8 Å²	41.8	36%	0.36	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.3	-178.5	-173.4	175.5	-15.5	0	0	113.5	E216 L317	E216-Q315 HydrophobicContact CG-CG 4.16Å; E216-Q315 PolarHBondContact OE1-NE2 3.19Å; Q315-L317 VanDerWaalsContact O-CD1 3.28Å; Q315-L317 WeakPolarHBondContact O-CD1 3.19Å
316	D	97.5	Very high	98.5	Very high	102 Å²	102	39.1 Å²	39.1	55%	0.545	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-2.9	176	68.7	-3	0	0	0	114.1	K314 S318	K314-D316 VanDerWaalsContact CB-OD1 3.31Å; K314-D316 WeakPolarHBondContact CB-OD1 3.08Å; K314-D316 PolarHBondContact O-N 2.75Å; K314-D316 VanDerWaalsContact O-N 3.16Å; D316-S318 VanDerWaalsContact CG-OG 3.31Å; D316-S318 PolarHBondContact O-N 2.88Å; D316-S318 WeakPolarHBondContact OD1-CB 3.4Å; D316-S318 PolarHBondContact OD1-N 3.41Å; D316-S318 PolarHBondContact OD1-OG 3.3Å; D316-S318 PolarHBondContact OD2-OG 3.39Å
317	L	98.4	Very high	98.5	Very high	15 Å²	15	36.8 Å²	36.8	8%	0.079	18%	0.179	C	C	.	.			trans	61	18	-177.6	-66.4	67.6	0	0	0	113.9	P219 L220 F270 V292 V313 K314 Q315 D319 L320	P219-L317 HydrophobicContact CB-CB 4.28Å; P219-L317 HydrophobicContact CB-CD2 4.06Å; P219-L317 HydrophobicContact CG-CD1 4.46Å; L220-L317 HydrophobicContact CB-CD2 3.71Å; L220-L317 HydrophobicContact CD1-CD2 4.49Å; F270-L317 HydrophobicContact CE1-CD1 4.08Å; F270-L317 HydrophobicContact CE1-CD2 4.02Å; F270-L317 HydrophobicContact CE1-CG 4.49Å; F270-L317 HydrophobicContact CZ-CD2 4.01Å; V292-L317 HydrophobicContact CG1-CD1 3.7Å; V292-L317 HydrophobicContact CG1-CG 4.43Å; V313-L317 HydrophobicContact CG1-CG 4.39Å; K314-L317 WeakPolarHBondContact O-CA 3.29Å; K314-L317 PolarHBondContact O-N 3.31Å; Q315-L317 VanDerWaalsContact O-CD1 3.28Å; Q315-L317 WeakPolarHBondContact O-CD1 3.19Å; L317-D319 PolarHBondContact O-N 2.81Å; L317-D319 VanDerWaalsContact O-N 3.16Å; L317-L320 HydrophobicContact CB-CB 4.12Å; L317-L320 HydrophobicContact CB-CD2 4.34Å; L317-L320 HydrophobicContact CD2-CD2 3.89Å; L317-L320 HydrophobicContact CG-CD2 4.39Å; L317-L320 VanDerWaalsContact O-CB 3.24Å; L317-L320 WeakPolarHBondContact O-CB 3.49Å; L317-L320 PolarHBondContact O-N 3.45Å
318	S	98.3	Very high	98.4	Very high	75 Å²	75	38.9 Å²	38.9	52%	0.524	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-25.8	-177.4	55.8	0	0	0	0	113.6	K314 D316	K314-S318 VanDerWaalsContact CD-OG 3.24Å; K314-S318 WeakPolarHBondContact CD-OG 3.18Å; D316-S318 VanDerWaalsContact CG-OG 3.31Å; D316-S318 PolarHBondContact O-N 2.88Å; D316-S318 WeakPolarHBondContact OD1-CB 3.4Å; D316-S318 PolarHBondContact OD1-N 3.41Å; D316-S318 PolarHBondContact OD1-OG 3.3Å; D316-S318 PolarHBondContact OD2-OG 3.39Å
319	D	98.1	Very high	98.4	Very high	22 Å²	22	42.7 Å²	42.7	12%	0.118	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-2	178.4	58.8	-7.1	0	0	0	114.1	K314 L317 R321 E322 L323	K314-D319 HydrophobicContact CD-CB 4.23Å; K314-D319 WeakPolarHBondContact CG-OD2 3.16Å; K314-D319 PolarHBondContact N-OD1 3.23Å; K314-D319 VanDerWaalsContact N-OD1 3.09Å; L317-D319 PolarHBondContact O-N 2.81Å; L317-D319 VanDerWaalsContact O-N 3.16Å; D319-R321 PolarHBondContact O-N 3.11Å; D319-E322 PolarHBondContact O-N 3.49Å; D319-L323 HydrophobicContact CB-CD1 4.26Å; D319-L323 HydrophobicContact CB-CG 4.41Å; D319-L323 WeakPolarHBondContact O-CG 3.32Å; D319-L323 PolarHBondContact O-N 2.69Å
320	L	98.3	Very high	98.4	Very high	3 Å²	3	44 Å²	44	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-60.2	-46	-168.5	175.1	57.4	0	0	0	114.1	L220 L223 F268 F290 V313 L317 E322 L323 L324	L220-L320 HydrophobicContact CD1-CD2 3.5Å; L223-L320 HydrophobicContact CD2-CD2 3.57Å; L223-L320 HydrophobicContact CD2-CG 4.17Å; F268-L320 HydrophobicContact CE1-CD1 3.34Å; F268-L320 HydrophobicContact CE1-CD2 4.27Å; F268-L320 HydrophobicContact CE1-CG 4.46Å; F268-L320 HydrophobicContact CZ-CD1 3.55Å; F268-L320 HydrophobicContact CZ-CD2 4.45Å; F290-L320 HydrophobicContact CD1-CD1 4.27Å; V313-L320 HydrophobicContact CG1-CB 4.34Å; V313-L320 HydrophobicContact CG1-CD1 4.41Å; L317-L320 HydrophobicContact CB-CB 4.12Å; L317-L320 HydrophobicContact CB-CD2 4.34Å; L317-L320 HydrophobicContact CD2-CD2 3.89Å; L317-L320 HydrophobicContact CG-CD2 4.39Å; L317-L320 VanDerWaalsContact O-CB 3.24Å; L317-L320 WeakPolarHBondContact O-CB 3.49Å; L317-L320 PolarHBondContact O-N 3.45Å; L320-E322 VanDerWaalsContact C-N 3.28Å; L320-E322 PolarHBondContact O-N 3Å; L320-L323 PolarHBondContact O-N 3.26Å; L320-L324 HydrophobicContact CD1-CD1 3.98Å; L320-L324 HydrophobicContact CD1-CG 4.01Å; L320-L324 HydrophobicContact CG-CD1 4.13Å; L320-L324 PolarHBondContact O-N 3.01Å
321	R	98.3	Very high	98.4	Very high	113 Å²	113	45.1 Å²	45.1	43%	0.426	22%	0.221	S	C	.	.	H	α-helix	trans	-62.8	-39.2	-178.9	-72.2	-180	177.1	-101.1	11.3	111.5	L223 E226 L230 D319 Q325	L223-R321 HydrophobicContact CD1-CG 4.38Å; L223-R321 HydrophobicContact CD2-CG 4.49Å; E226-R321 IonicContact OE1-CZ 2.58Å; E226-R321 IonicContact OE1-NH2 3.76Å; E226-R321 PolarHBondContact OE1-NH2 3.49Å; E226-R321 IonicContact OE2-NH2 3.06Å; E226-R321 PolarHBondContact OE2-NH2 3.36Å; L230-R321 HydrophobicContact CD2-CG 4.24Å; D319-R321 PolarHBondContact O-N 3.11Å; R321-Q325 PolarHBondContact O-N 2.85Å
322	E	98.2	Very high	98.3	Very high	88 Å²	88	50.7 Å²	50.7	41%	0.411	25%	0.251	S	S	.	.	H	α-helix	trans	-66.2	-45.4	176.9	-172	-176.4	-161.7	0	0	111	W31 Y34 D319 L320 L324 Q325 F326	W31-E322 HydrophobicContact CH2-CG 4.37Å; W31-E322 HydrophobicContact CZ3-CG 3.77Å; Y34-E322 HydrophobicContact CE2-CG 3.98Å; Y34-E322 PolarHBondContact OH-OE2 3.34Å; D319-E322 PolarHBondContact O-N 3.49Å; L320-E322 VanDerWaalsContact C-N 3.28Å; L320-E322 PolarHBondContact O-N 3Å; E322-L324 PolarHBondContact O-N 3.15Å; E322-Q325 PolarHBondContact O-N 2.89Å; E322-F326 WeakPolarHBondContact O-CB 3.4Å; E322-F326 PolarHBondContact O-N 3.5Å
323	L	98.8	Very high	98.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.8	-42.4	177.4	-67.2	172.9	0	0	0	112.6	Y34 F290 W307 I311 P312 V313 D319 L320 Q325 F326 V327	Y34-L323 HydrophobicContact CD1-CD2 4.04Å; Y34-L323 HydrophobicContact CE1-CD2 3.4Å; F290-L323 HydrophobicContact CE1-CB 3.92Å; W307-L323 HydrophobicContact CH2-CD2 3.62Å; W307-L323 HydrophobicContact CZ3-CD2 4.34Å; I311-L323 HydrophobicContact CG2-CB 4.33Å; I311-L323 HydrophobicContact CG2-CD1 4.01Å; I311-L323 HydrophobicContact CG2-CD2 4.02Å; I311-L323 HydrophobicContact CG2-CG 4.36Å; P312-L323 WeakPolarHBondContact O-CD1 3.47Å; V313-L323 HydrophobicContact CB-CD1 4.34Å; V313-L323 HydrophobicContact CG1-CD1 4.35Å; V313-L323 HydrophobicContact CG2-CD1 3.96Å; D319-L323 HydrophobicContact CB-CD1 4.26Å; D319-L323 HydrophobicContact CB-CG 4.41Å; D319-L323 WeakPolarHBondContact O-CG 3.32Å; D319-L323 PolarHBondContact O-N 2.69Å; L320-L323 PolarHBondContact O-N 3.26Å; L323-Q325 VanDerWaalsContact C-N 3.32Å; L323-Q325 PolarHBondContact O-N 3.11Å; L323-F326 WeakPolarHBondContact O-CB 3.45Å; L323-F326 PolarHBondContact O-N 2.76Å; L323-V327 PolarHBondContact O-N 3.07Å
324	L	98.7	Very high	98.3	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.4	-38.3	175	-78.5	173	0	0	0	111.9	L230 V231 Y266 F268 F290 L320 E322 V327 K328	L230-L324 HydrophobicContact CD1-CB 4.2Å; L230-L324 HydrophobicContact CD1-CD1 3.95Å; L230-L324 HydrophobicContact CD2-CD1 4.3Å; L230-L324 HydrophobicContact CG-CD1 3.92Å; V231-L324 HydrophobicContact CG2-CD1 3.82Å; Y266-L324 HydrophobicContact CD2-CD2 3.95Å; Y266-L324 HydrophobicContact CG-CD2 4.23Å; F268-L324 HydrophobicContact CZ-CD1 4.39Å; F268-L324 HydrophobicContact CZ-CD2 4.17Å; F268-L324 HydrophobicContact CZ-CG 4.5Å; F290-L324 HydrophobicContact CE1-CD2 4.17Å; F290-L324 HydrophobicContact CE1-CG 4.41Å; F290-L324 HydrophobicContact CE2-CD2 4.5Å; F290-L324 HydrophobicContact CZ-CD2 3.98Å; L320-L324 HydrophobicContact CD1-CD1 3.98Å; L320-L324 HydrophobicContact CD1-CG 4.01Å; L320-L324 HydrophobicContact CG-CD1 4.13Å; L320-L324 PolarHBondContact O-N 3.01Å; E322-L324 PolarHBondContact O-N 3.15Å; L324-V327 WeakPolarHBondContact O-CG2 3.42Å; L324-K328 WeakPolarHBondContact O-CB 3.44Å; L324-K328 VanDerWaalsContact O-CG 3.24Å; L324-K328 WeakPolarHBondContact O-CG 3.5Å; L324-K328 PolarHBondContact O-N 2.95Å
325	Q	98.3	Very high	98.3	Very high	68 Å²	68	48.6 Å²	48.6	32%	0.318	24%	0.241	S	C	.	.	H	α-helix	trans	-68.3	-42.9	175.2	-168.9	65.4	28.8	0	0	111.4	W31 R321 E322 L323 V327 K328 E329	W31-Q325 HydrophobicContact CH2-CB 3.92Å; W31-Q325 HydrophobicContact CH2-CG 3.85Å; W31-Q325 HydrophobicContact CZ2-CB 4.23Å; W31-Q325 HydrophobicContact CZ2-CG 3.75Å; R321-Q325 PolarHBondContact O-N 2.85Å; E322-Q325 PolarHBondContact O-N 2.89Å; L323-Q325 VanDerWaalsContact C-N 3.32Å; L323-Q325 PolarHBondContact O-N 3.11Å; Q325-V327 PolarHBondContact O-N 2.92Å; Q325-K328 PolarHBondContact O-N 2.88Å; Q325-E329 WeakPolarHBondContact CG-OE1 3.15Å; Q325-E329 PolarHBondContact NE2-OE1 2.81Å; Q325-E329 PolarHBondContact O-N 2.68Å
326	F	98.6	Very high	98.4	Very high	2 Å²	2	50 Å²	50	1%	0.009	25%	0.248	C	C	.	.	H	α-helix	trans	-55	-52.5	176.8	164.2	-111.1	0	0	0	111.6	W31 Y34 L35 I38 E322 L323 K328 E329 N330	W31-F326 HydrophobicContact CB-CD2 3.73Å; W31-F326 HydrophobicContact CB-CE2 3.96Å; W31-F326 HydrophobicContact CD2-CB 4.17Å; W31-F326 AromaticContact CD2-CD2 3.86Å; W31-F326 HydrophobicContact CD2-CD2 3.86Å; W31-F326 HydrophobicContact CE3-CB 3.85Å; W31-F326 HydrophobicContact CE3-CD2 4.04Å; W31-F326 HydrophobicContact CE3-CG 4.39Å; W31-F326 AromaticContact CG-CD2 3.76Å; W31-F326 HydrophobicContact CG-CD2 3.76Å; W31-F326 HydrophobicContact CG-CE2 4.4Å; W31-F326 HydrophobicContact CH2-CB 4.33Å; W31-F326 HydrophobicContact CZ3-CB 3.94Å; Y34-F326 HydrophobicContact CD2-CB 4.15Å; Y34-F326 HydrophobicContact CD2-CD1 4.4Å; Y34-F326 HydrophobicContact CD2-CD2 4.03Å; Y34-F326 AromaticContact CD2-CG 3.91Å; Y34-F326 HydrophobicContact CD2-CG 3.91Å; Y34-F326 HydrophobicContact CE2-CB 4.49Å; Y34-F326 HydrophobicContact CG-CD1 4.22Å; Y34-F326 HydrophobicContact CG-CD2 4.29Å; Y34-F326 HydrophobicContact CG-CE1 4.44Å; Y34-F326 HydrophobicContact CG-CG 4.15Å; L35-F326 HydrophobicContact CD2-CE2 4.09Å; L35-F326 HydrophobicContact CD2-CZ 4.34Å; L35-F326 HydrophobicContact CG-CE2 4.49Å; I38-F326 HydrophobicContact CD1-CE1 3.91Å; I38-F326 HydrophobicContact CD1-CZ 3.59Å; E322-F326 WeakPolarHBondContact O-CB 3.4Å; E322-F326 PolarHBondContact O-N 3.5Å; L323-F326 WeakPolarHBondContact O-CB 3.45Å; L323-F326 PolarHBondContact O-N 2.76Å; F326-K328 VanDerWaalsContact C-N 3.28Å; F326-K328 PolarHBondContact O-N 3.21Å; F326-E329 PolarHBondContact O-N 3.18Å; F326-N330 HydrophobicContact CD2-CB 4.45Å; F326-N330 VanDerWaalsContact CD2-ND2 3.3Å; F326-N330 WeakPolarHBondContact CD2-ND2 3.42Å; F326-N330 HydrophobicContact CE2-CB 4.03Å; F326-N330 WeakPolarHBondContact CE2-ND2 3.48Å; F326-N330 HydrophobicContact CZ-CB 4.43Å; F326-N330 WeakPolarHBondContact O-CB 3.42Å; F326-N330 PolarHBondContact O-N 3.22Å; F326-N330 PolarHBondContact O-ND2 3.02Å
327	V	98.6	Very high	98.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-69.9	-24.8	-177.5	-59.8	0	0	0	0	113.2	Y266 L288 F290 I311 L323 L324 Q325 N330 D331 A334	Y266-V327 HydrophobicContact CD1-CG2 3.99Å; Y266-V327 HydrophobicContact CE1-CB 4.21Å; Y266-V327 HydrophobicContact CE1-CG2 3.54Å; Y266-V327 HydrophobicContact CE2-CG2 4.33Å; L288-V327 HydrophobicContact CD2-CB 4.1Å; L288-V327 HydrophobicContact CD2-CG1 3.69Å; F290-V327 HydrophobicContact CE2-CG2 4.33Å; F290-V327 HydrophobicContact CZ-CB 4.47Å; F290-V327 HydrophobicContact CZ-CG1 3.94Å; F290-V327 HydrophobicContact CZ-CG2 3.75Å; I311-V327 HydrophobicContact CD1-CG1 4.04Å; I311-V327 HydrophobicContact CG1-CG1 4.13Å; L323-V327 PolarHBondContact O-N 3.07Å; L324-V327 WeakPolarHBondContact O-CG2 3.42Å; Q325-V327 PolarHBondContact O-N 2.92Å; V327-N330 CarbonylContact O-C 3.54Å; V327-D331 WeakPolarHBondContact O-CA 3.36Å; V327-D331 PolarHBondContact O-N 2.73Å; V327-A334 HydrophobicContact CB-CB 3.86Å; V327-A334 HydrophobicContact CG1-CB 4.32Å
328	K	98.1	Very high	98.5	Very high	71 Å²	71	44.5 Å²	44.5	31%	0.309	22%	0.219	S	C	.	.	H	α-helix	trans	-72.3	-40.8	173.7	-77.5	175.6	179	-172.6	0	111.8	S204 Y266 L324 Q325 F326 N330	S204-K328 WeakPolarHBondContact O-CE 3.31Å; Y266-K328 HydrophobicContact CE2-CG 4.07Å; Y266-K328 WeakPolarHBondContact OH-CG 3.36Å; L324-K328 WeakPolarHBondContact O-CB 3.44Å; L324-K328 VanDerWaalsContact O-CG 3.24Å; L324-K328 WeakPolarHBondContact O-CG 3.5Å; L324-K328 PolarHBondContact O-N 2.95Å; Q325-K328 PolarHBondContact O-N 2.88Å; F326-K328 VanDerWaalsContact C-N 3.28Å; F326-K328 PolarHBondContact O-N 3.21Å; K328-N330 VanDerWaalsContact C-N 3.32Å
329	E	98	Very high	98.5	Very high	80 Å²	80	44.4 Å²	44.4	37%	0.374	22%	0.215	S	C	.	.	H	α-helix	trans	-81.3	-11.4	178.7	-68.9	-177.3	-155.1	0	0	113.1	R30 W31 Q325 F326	R30-E329 IonicContact NH1-OE1 3.13Å; R30-E329 PolarHBondContact NH1-OE1 2.93Å; R30-E329 VanDerWaalsContact NH1-OE1 3.13Å; R30-E329 IonicContact NH1-OE2 3.83Å; W31-E329 WeakPolarHBondContact CZ2-OE2 3.28Å; W31-E329 PolarHBondContact NE1-OE2 3.03Å; Q325-E329 WeakPolarHBondContact CG-OE1 3.15Å; Q325-E329 PolarHBondContact NE2-OE1 2.81Å; Q325-E329 PolarHBondContact O-N 2.68Å; F326-E329 PolarHBondContact O-N 3.18Å
330	N	98.4	Very high	98.6	Very high	31 Å²	31	46.3 Å²	46.3	17%	0.166	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.2	53.6	179.9	-58.3	-96.1	0	0	0	110.5	F326 V327 K328 D332 I333 A334	F326-N330 HydrophobicContact CD2-CB 4.45Å; F326-N330 VanDerWaalsContact CD2-ND2 3.3Å; F326-N330 WeakPolarHBondContact CD2-ND2 3.42Å; F326-N330 HydrophobicContact CE2-CB 4.03Å; F326-N330 WeakPolarHBondContact CE2-ND2 3.48Å; F326-N330 HydrophobicContact CZ-CB 4.43Å; F326-N330 WeakPolarHBondContact O-CB 3.42Å; F326-N330 PolarHBondContact O-N 3.22Å; F326-N330 PolarHBondContact O-ND2 3.02Å; V327-N330 CarbonylContact O-C 3.54Å; K328-N330 VanDerWaalsContact C-N 3.32Å; N330-D332 VanDerWaalsContact C-N 3.33Å; N330-D332 PolarHBondContact O-N 3.46Å; N330-I333 HydrophobicContact CB-CB 4.31Å; N330-I333 HydrophobicContact CB-CD1 4.27Å; N330-I333 PolarHBondContact O-N 2.9Å; N330-A334 PolarHBondContact O-N 2.8Å
331	D	98.6	Very high	98.6	Very high	45 Å²	45	46.1 Å²	46.1	24%	0.241	22%	0.219	C	C	.	.	H	α-helix	trans	-61.3	-35.5	-169.3	-164.9	62.7	0	0	0	113.8	W199 K265 V327 A334 Q335	W199-D331 WeakPolarHBondContact CZ2-OD1 3.38Å; W199-D331 VanDerWaalsContact NE1-CG 3.31Å; W199-D331 PolarHBondContact NE1-OD1 3.47Å; W199-D331 PolarHBondContact NE1-OD2 3.01Å; K265-D331 IonicContact NZ-OD1 2.83Å; K265-D331 PolarHBondContact NZ-OD1 2.97Å; K265-D331 IonicContact NZ-OD2 3.8Å; K265-D331 PolarHBondContact NZ-OD2 3.13Å; V327-D331 WeakPolarHBondContact O-CA 3.36Å; V327-D331 PolarHBondContact O-N 2.73Å; D331-A334 WeakPolarHBondContact O-CB 3.25Å; D331-A334 PolarHBondContact O-N 3.45Å; D331-Q335 WeakPolarHBondContact O-CB 3.42Å; D331-Q335 PolarHBondContact O-N 3.23Å
332	D	98.6	Very high	98.6	Very high	117 Å²	117	42.7 Å²	42.7	63%	0.626	21%	0.208	S	C	*	.	H	α-helix	trans	-63.8	-43.9	177.4	-65.6	-33.6	0	0	0	111	N330 A334 Q335 E336	N330-D332 VanDerWaalsContact C-N 3.33Å; N330-D332 PolarHBondContact O-N 3.46Å; D332-A334 VanDerWaalsContact C-N 3.34Å; D332-A334 PolarHBondContact O-N 3.41Å; D332-Q335 WeakPolarHBondContact O-CB 3.41Å; D332-Q335 PolarHBondContact O-N 3.34Å; D332-E336 WeakPolarHBondContact O-CG 3.26Å; D332-E336 PolarHBondContact O-N 3.21Å
333	I	98.6	Very high	98.6	Very high	43 Å²	43	46.5 Å²	46.5	22%	0.221	22%	0.219	C	C	.	.	H	α-helix	trans	-65.2	-41.2	176.5	-61.5	-179.8	0	0	0	110.5	L35 I38 N330 Q335 E336 I337	L35-I333 HydrophobicContact CD2-CD1 3.21Å; I38-I333 HydrophobicContact CD1-CG2 3.68Å; N330-I333 HydrophobicContact CB-CB 4.31Å; N330-I333 HydrophobicContact CB-CD1 4.27Å; N330-I333 PolarHBondContact O-N 2.9Å; I333-Q335 VanDerWaalsContact C-N 3.31Å; I333-Q335 PolarHBondContact O-N 2.87Å; I333-E336 PolarHBondContact O-N 2.77Å; I333-I337 HydrophobicContact CG2-CD1 4.29Å; I333-I337 WeakPolarHBondContact O-CG1 3.38Å; I333-I337 PolarHBondContact O-N 3.37Å; I333-I337 VanDerWaalsContact O-N 3.11Å
334	A	98.9	Very high	98.6	Very high	2 Å²	2	46.8 Å²	46.8	2%	0.017	22%	0.22	C	C	.	.	H	α-helix	trans	-59.3	-43.2	174.9	0	0	0	0	0	111.6	W199 L288 V327 N330 D331 D332 I337 A338	W199-A334 HydrophobicContact CH2-CB 4.06Å; W199-A334 HydrophobicContact CZ2-CB 3.85Å; L288-A334 HydrophobicContact CD2-CB 3.75Å; V327-A334 HydrophobicContact CB-CB 3.86Å; V327-A334 HydrophobicContact CG1-CB 4.32Å; N330-A334 PolarHBondContact O-N 2.8Å; D331-A334 WeakPolarHBondContact O-CB 3.25Å; D331-A334 PolarHBondContact O-N 3.45Å; D332-A334 VanDerWaalsContact C-N 3.34Å; D332-A334 PolarHBondContact O-N 3.41Å; A334-I337 PolarHBondContact O-N 3.19Å; A334-A338 PolarHBondContact O-N 2.96Å; A334-A338 VanDerWaalsContact O-N 3.11Å
335	Q	98.9	Very high	98.6	Very high	66 Å²	66	46.8 Å²	46.8	31%	0.308	22%	0.22	S	C	.	.	H	α-helix	trans	-63.5	-43.6	176.1	-171.5	177.2	-2.1	0	0	111.7	W199 D331 D332 I333 I337 A338 V339	W199-Q335 HydrophobicContact CB-CG 4.09Å; W199-Q335 HydrophobicContact CD2-CB 3.84Å; W199-Q335 HydrophobicContact CD2-CG 3.74Å; W199-Q335 HydrophobicContact CE3-CB 4.41Å; W199-Q335 HydrophobicContact CE3-CG 4.24Å; W199-Q335 HydrophobicContact CG-CB 4.07Å; W199-Q335 HydrophobicContact CG-CG 3.64Å; W199-Q335 HydrophobicContact CZ2-CB 4.06Å; D331-Q335 WeakPolarHBondContact O-CB 3.42Å; D331-Q335 PolarHBondContact O-N 3.23Å; D332-Q335 WeakPolarHBondContact O-CB 3.41Å; D332-Q335 PolarHBondContact O-N 3.34Å; I333-Q335 VanDerWaalsContact C-N 3.31Å; I333-Q335 PolarHBondContact O-N 2.87Å; Q335-I337 PolarHBondContact O-N 2.89Å; Q335-A338 WeakPolarHBondContact O-CB 3.26Å; Q335-A338 PolarHBondContact O-N 3.14Å; Q335-V339 HydrophobicContact CG-CG2 4.35Å; Q335-V339 VanDerWaalsContact O-CG2 3.32Å; Q335-V339 WeakPolarHBondContact O-CG2 3.36Å; Q335-V339 PolarHBondContact O-N 2.88Å
336	E	98.9	Very high	98.6	Very high	107 Å²	107	45.1 Å²	45.1	50%	0.5	21%	0.213	S	C	.	.	H	α-helix	trans	-60.5	-43.1	178.9	-74.1	-178.9	-169.1	0	0	112.9	D332 I333 V339 R340	D332-E336 WeakPolarHBondContact O-CG 3.26Å; D332-E336 PolarHBondContact O-N 3.21Å; I333-E336 PolarHBondContact O-N 2.77Å; E336-V339 PolarHBondContact O-N 2.96Å; E336-R340 WeakPolarHBondContact O-CG 3.31Å; E336-R340 PolarHBondContact O-N 3.46Å; E336-R340 IonicContact OE2-NH1 2.69Å; E336-R340 PolarHBondContact OE2-NH1 2.88Å
337	I	98.9	Very high	98.5	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.9	-46.5	175.6	-62.8	167.9	0	0	0	109.8	I38 L288 H309 I311 I333 A334 Q335 V339 R340 G341	I38-I337 HydrophobicContact CD1-CD1 3.98Å; I38-I337 HydrophobicContact CG1-CD1 4.24Å; L288-I337 HydrophobicContact CD1-CB 3.77Å; L288-I337 HydrophobicContact CD1-CG2 3.5Å; L288-I337 VanDerWaalsContact CD1-CG2 3.5Å; H309-I337 VanDerWaalsContact C-CG2 3.48Å; I311-I337 HydrophobicContact CD1-CD1 3.75Å; I333-I337 HydrophobicContact CG2-CD1 4.29Å; I333-I337 WeakPolarHBondContact O-CG1 3.38Å; I333-I337 PolarHBondContact O-N 3.37Å; I333-I337 VanDerWaalsContact O-N 3.11Å; A334-I337 PolarHBondContact O-N 3.19Å; Q335-I337 PolarHBondContact O-N 2.89Å; I337-V339 VanDerWaalsContact C-N 3.33Å; I337-V339 PolarHBondContact O-N 3.29Å; I337-R340 PolarHBondContact O-N 3.17Å; I337-G341 PolarHBondContact O-N 3.34Å
338	A	98.9	Very high	98.4	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.008	23%	0.231	C	C	.	.	H	α-helix	trans	-58.8	-43.7	178.2	0	0	0	0	0	112.1	W199 L288 A334 Q335 G341 Q342	W199-A338 HydrophobicContact CE3-CB 4.36Å; W199-A338 HydrophobicContact CH2-CB 4.43Å; W199-A338 HydrophobicContact CZ3-CB 3.74Å; L288-A338 HydrophobicContact CB-CB 4.06Å; L288-A338 HydrophobicContact CD1-CB 4.34Å; A334-A338 PolarHBondContact O-N 2.96Å; A334-A338 VanDerWaalsContact O-N 3.11Å; Q335-A338 WeakPolarHBondContact O-CB 3.26Å; Q335-A338 PolarHBondContact O-N 3.14Å; A338-G341 PolarHBondContact O-N 3.31Å; A338-Q342 WeakPolarHBondContact O-CB 3.28Å; A338-Q342 PolarHBondContact O-N 3.31Å
339	V	98.9	Very high	98.4	Very high	73 Å²	73	45.2 Å²	45.2	44%	0.442	22%	0.217	S	C	.	.	H	α-helix	trans	-63.6	-44.7	177.6	168.3	0	0	0	0	111.2	Q335 E336 I337 Q342 R343	Q335-V339 HydrophobicContact CG-CG2 4.35Å; Q335-V339 VanDerWaalsContact O-CG2 3.32Å; Q335-V339 WeakPolarHBondContact O-CG2 3.36Å; Q335-V339 PolarHBondContact O-N 2.88Å; E336-V339 PolarHBondContact O-N 2.96Å; I337-V339 VanDerWaalsContact C-N 3.33Å; I337-V339 PolarHBondContact O-N 3.29Å; V339-Q342 PolarHBondContact O-N 3.23Å; V339-R343 VanDerWaalsContact O-CB 3.3Å; V339-R343 WeakPolarHBondContact O-CB 3.32Å; V339-R343 PolarHBondContact O-N 3.01Å
340	R	98.8	Very high	98.4	Very high	62 Å²	62	43.7 Å²	43.7	23%	0.234	21%	0.208	C	C	.	.	H	α-helix	trans	-61.4	-46	176.5	-73.8	-173	-65.3	-97.1	4.3	111.5	V308 E336 I337 R343 F344	V308-R340 WeakPolarHBondContact O-CB 3.41Å; V308-R340 PolarHBondContact O-NE 3.46Å; E336-R340 WeakPolarHBondContact O-CG 3.31Å; E336-R340 PolarHBondContact O-N 3.46Å; E336-R340 IonicContact OE2-NH1 2.69Å; E336-R340 PolarHBondContact OE2-NH1 2.88Å; I337-R340 PolarHBondContact O-N 3.17Å; R340-R343 PolarHBondContact O-N 3.46Å; R340-F344 WeakPolarHBondContact O-CB 3.38Å; R340-F344 PolarHBondContact O-N 3.48Å
341	G	98.8	Very high	98.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-62.6	-44.2	177.5	0	0	0	0	0	113.2	I337 A338 F344 I345	I337-G341 PolarHBondContact O-N 3.34Å; A338-G341 PolarHBondContact O-N 3.31Å; G341-F344 PolarHBondContact O-N 2.91Å; G341-I345 PolarHBondContact O-N 3.38Å
342	Q	98.8	Very high	98.2	Very high	41 Å²	41	47.2 Å²	47.2	19%	0.192	22%	0.222	C	C	.	.	H	α-helix	trans	-59.2	-48.6	174.8	-175.6	179.4	39.7	0	0	111.2	F283 L284 A338 V339 F344 I345 L346	F283-Q342 WeakPolarHBondContact O-CA 3.49Å; F283-Q342 VanDerWaalsContact O-CB 3.25Å; F283-Q342 WeakPolarHBondContact O-CB 3.22Å; F283-Q342 VanDerWaalsContact O-CG 3.31Å; F283-Q342 WeakPolarHBondContact O-CG 3.44Å; L284-Q342 PolarHBondContact O-NE2 3.47Å; A338-Q342 WeakPolarHBondContact O-CB 3.28Å; A338-Q342 PolarHBondContact O-N 3.31Å; V339-Q342 PolarHBondContact O-N 3.23Å; Q342-F344 VanDerWaalsContact C-N 3.35Å; Q342-F344 PolarHBondContact O-N 2.85Å; Q342-I345 PolarHBondContact O-N 3.5Å; Q342-L346 HydrophobicContact CG-CD1 3.99Å; Q342-L346 HydrophobicContact CG-CG 4.45Å; Q342-L346 WeakPolarHBondContact O-CG 3.44Å; Q342-L346 PolarHBondContact O-N 3.26Å
343	R	98.4	Very high	98.2	Very high	168 Å²	168	41.9 Å²	41.9	63%	0.634	19%	0.193	S	C	*	.	H	α-helix	trans	-62.2	-41.9	-179.1	-169.3	171.5	-171.8	165.5	3.1	111.9	V339 R340 I345 L346 D347	V339-R343 VanDerWaalsContact O-CB 3.3Å; V339-R343 WeakPolarHBondContact O-CB 3.32Å; V339-R343 PolarHBondContact O-N 3.01Å; R340-R343 PolarHBondContact O-N 3.46Å; R343-I345 PolarHBondContact O-N 3.01Å; R343-L346 PolarHBondContact O-N 3.35Å; R343-D347 VanDerWaalsContact CG-OD2 3.26Å; R343-D347 WeakPolarHBondContact CG-OD2 3.49Å; R343-D347 IonicContact NE-OD2 2.6Å; R343-D347 WeakPolarHBondContact O-CB 3.43Å; R343-D347 PolarHBondContact O-N 3.05Å
344	F	98.4	Very high	98.2	Very high	5 Å²	5	39.8 Å²	39.8	2%	0.022	18%	0.183	C	C	.	.	H	α-helix	trans	-56.1	-48.5	175.9	-179.4	-87.9	0	0	0	112.1	H56 Q303 L304 H309 R340 G341 Q342 L346 D347 H348	H56-F344 AromaticContact CE1-CZ 3.96Å; Q303-F344 HydrophobicContact CB-CE1 4.31Å; Q303-F344 HydrophobicContact CB-CE2 3.91Å; Q303-F344 HydrophobicContact CB-CZ 3.37Å; L304-F344 HydrophobicContact CD2-CD1 3.4Å; L304-F344 VanDerWaalsContact CD2-CD1 3.4Å; L304-F344 HydrophobicContact CD2-CE1 3.81Å; L304-F344 HydrophobicContact CD2-CG 4.16Å; L304-F344 HydrophobicContact CG-CD1 4.12Å; L304-F344 HydrophobicContact CG-CE1 4Å; H309-F344 AromaticContact CE1-CD2 3.83Å; H309-F344 AromaticContact NE2-CD2 3.82Å; R340-F344 WeakPolarHBondContact O-CB 3.38Å; R340-F344 PolarHBondContact O-N 3.48Å; G341-F344 PolarHBondContact O-N 2.91Å; Q342-F344 VanDerWaalsContact C-N 3.35Å; Q342-F344 PolarHBondContact O-N 2.85Å; F344-L346 VanDerWaalsContact C-N 3.34Å; F344-L346 PolarHBondContact O-N 3.25Å; F344-D347 PolarHBondContact O-N 3.34Å; F344-H348 HydrophobicContact CD2-CB 4.49Å; F344-H348 AromaticContact CD2-CD2 3.61Å; F344-H348 HydrophobicContact CE1-CB 4.41Å; F344-H348 HydrophobicContact CE2-CB 4.13Å; F344-H348 AromaticContact CE2-CD2 3.8Å; F344-H348 HydrophobicContact CZ-CB 4.05Å; F344-H348 WeakPolarHBondContact O-CA 3.41Å; F344-H348 WeakPolarHBondContact O-CB 3.43Å; F344-H348 PolarHBondContact O-N 3.49Å
345	I	98.4	Very high	98.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.3	-33.3	179.4	-63.2	-63.7	0	0	0	112	W183 R187 F283 L284 F300 L304 G341 Q342 R343 L349	W183-I345 HydrophobicContact CH2-CG2 4.08Å; W183-I345 HydrophobicContact CZ2-CG2 3.76Å; R187-I345 PolarHBondContact NH1-O 3.25Å; F283-I345 HydrophobicContact CB-CB 4.19Å; F283-I345 HydrophobicContact CB-CG1 3.64Å; F283-I345 HydrophobicContact CD2-CD1 4.17Å; F283-I345 HydrophobicContact CD2-CG1 3.71Å; F283-I345 HydrophobicContact CG-CG1 3.8Å; L284-I345 HydrophobicContact CD1-CG2 4.42Å; L284-I345 HydrophobicContact CD2-CB 4.17Å; L284-I345 HydrophobicContact CD2-CG2 3.7Å; L284-I345 HydrophobicContact CG-CG2 3.9Å; F300-I345 HydrophobicContact CD2-CD1 4.42Å; F300-I345 HydrophobicContact CE2-CD1 4.33Å; L304-I345 HydrophobicContact CD1-CD1 4.35Å; L304-I345 HydrophobicContact CD2-CD1 4.19Å; G341-I345 PolarHBondContact O-N 3.38Å; Q342-I345 PolarHBondContact O-N 3.5Å; R343-I345 PolarHBondContact O-N 3.01Å; I345-L349 HydrophobicContact CD1-CB 4.28Å; I345-L349 HydrophobicContact CD1-CD2 3.84Å; I345-L349 HydrophobicContact CG2-CB 4.32Å; I345-L349 HydrophobicContact CG2-CD2 4.41Å; I345-L349 PolarHBondContact O-N 3.41Å
346	L	97.7	Very high	98	Very high	34 Å²	34	39.1 Å²	39.1	18%	0.178	19%	0.185	C	C	.	.	H	α-helix	trans	-63.7	-43.3	174.7	-74.5	173.5	0	0	0	111.9	R187 K191 L284 Q342 R343 F344 R350	R187-L346 PolarHBondContact NH2-O 2.96Å; K191-L346 HydrophobicContact CD-CD2 3.48Å; K191-L346 VanDerWaalsContact CD-CD2 3.48Å; K191-L346 VanDerWaalsContact CE-CD2 3.48Å; K191-L346 HydrophobicContact CG-CD2 3.84Å; L284-L346 HydrophobicContact CD2-CD2 3.57Å; L284-L346 HydrophobicContact CD2-CG 3.78Å; Q342-L346 HydrophobicContact CG-CD1 3.99Å; Q342-L346 HydrophobicContact CG-CG 4.45Å; Q342-L346 WeakPolarHBondContact O-CG 3.44Å; Q342-L346 PolarHBondContact O-N 3.26Å; R343-L346 PolarHBondContact O-N 3.35Å; F344-L346 VanDerWaalsContact C-N 3.34Å; F344-L346 PolarHBondContact O-N 3.25Å; L346-R350 WeakPolarHBondContact O-CG 3.4Å
347	D	96.6	Very high	98	Very high	60 Å²	60	34.1 Å²	34.1	32%	0.321	16%	0.161	S	C	.	.	H	α-helix	trans	-95.2	-22.8	-168.3	-62.9	-12.8	0	0	0	113.3	R343 F344 R350	R343-D347 VanDerWaalsContact CG-OD2 3.26Å; R343-D347 WeakPolarHBondContact CG-OD2 3.49Å; R343-D347 IonicContact NE-OD2 2.6Å; R343-D347 WeakPolarHBondContact O-CB 3.43Å; R343-D347 PolarHBondContact O-N 3.05Å; F344-D347 PolarHBondContact O-N 3.34Å; D347-R350 PolarHBondContact O-NE 3.09Å; D347-R350 PolarHBondContact O-NH2 3.16Å
348	H	96.9	Very high	97.9	Very high	14 Å²	14	34.1 Å²	34.1	7%	0.065	16%	0.161	C	C	.	.	H	α-helix	trans	-130.3	9	-170.3	-52.6	-60	0	0	0	115.1	C48 H56 F344 D353	C48-H348 PolarHBondContact O-CE1 2.02Å; C48-H348 VanDerWaalsContact SG-CD2 3.53Å; C48-H348 PolarHBondContact SG-CE1 3.29Å; C48-H348 PolarHBondContact SG-ND1 2.91Å; C48-H348 VanDerWaalsContact SG-ND1 3.41Å; H56-H348 PolarHBondContact NE2-O 3.47Å; F344-H348 HydrophobicContact CD2-CB 4.49Å; F344-H348 AromaticContact CD2-CD2 3.61Å; F344-H348 HydrophobicContact CE1-CB 4.41Å; F344-H348 HydrophobicContact CE2-CB 4.13Å; F344-H348 AromaticContact CE2-CD2 3.8Å; F344-H348 HydrophobicContact CZ-CB 4.05Å; F344-H348 WeakPolarHBondContact O-CA 3.41Å; F344-H348 WeakPolarHBondContact O-CB 3.43Å; F344-H348 PolarHBondContact O-N 3.49Å; H348-D353 VanDerWaalsContact C-OD2 3.27Å
349	L	97.7	Very high	97.9	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.17	C	C	.	.	S	Bend	trans	-137.1	47.8	172.3	-162.3	67.3	0	0	0	111.4	F165 W183 R187 K280 F299 F300 I345 D353	F165-L349 HydrophobicContact CE1-CD1 4.33Å; F165-L349 HydrophobicContact CE1-CD2 4.25Å; F165-L349 HydrophobicContact CE1-CG 4.13Å; F165-L349 HydrophobicContact CZ-CD1 4.06Å; F165-L349 HydrophobicContact CZ-CD2 4.23Å; F165-L349 HydrophobicContact CZ-CG 4.27Å; W183-L349 HydrophobicContact CZ2-CD2 4.37Å; W183-L349 PolarHBondContact NE1-O 3.06Å; R187-L349 PolarHBondContact NH1-O 3.16Å; K280-L349 HydrophobicContact CB-CD2 3.82Å; K280-L349 HydrophobicContact CD-CD2 4.22Å; F299-L349 HydrophobicContact CE1-CD1 4.22Å; F299-L349 HydrophobicContact CZ-CD1 3.68Å; F300-L349 HydrophobicContact CB-CD1 3.79Å; F300-L349 HydrophobicContact CD1-CD1 3.94Å; F300-L349 HydrophobicContact CD1-CD2 4.1Å; F300-L349 HydrophobicContact CD2-CD1 4.45Å; F300-L349 HydrophobicContact CD2-CD2 3.89Å; F300-L349 HydrophobicContact CE1-CD2 4.12Å; F300-L349 HydrophobicContact CE2-CD2 3.91Å; F300-L349 HydrophobicContact CG-CD1 3.81Å; F300-L349 HydrophobicContact CG-CD2 3.98Å; F300-L349 HydrophobicContact CZ-CD2 4.01Å; I345-L349 HydrophobicContact CD1-CB 4.28Å; I345-L349 HydrophobicContact CD1-CD2 3.84Å; I345-L349 HydrophobicContact CG2-CB 4.32Å; I345-L349 HydrophobicContact CG2-CD2 4.41Å; I345-L349 PolarHBondContact O-N 3.41Å; L349-D353 PolarHBondContact N-OD2 2.95Å
350	R	97.6	Very high	97.8	Very high	49 Å²	49	37.9 Å²	37.9	19%	0.185	17%	0.169	C	C	.	.	S	Bend	trans	-81.6	168.4	173.3	-58.8	162.7	-64.2	-178.3	-3.3	110.4	P50 L346 D347 E352 D353 V354	P50-R350 PolarHBondContact O-NH1 2.91Å; P50-R350 PolarHBondContact O-NH2 3.33Å; L346-R350 WeakPolarHBondContact O-CG 3.4Å; D347-R350 PolarHBondContact O-NE 3.09Å; D347-R350 PolarHBondContact O-NH2 3.16Å; R350-E352 HydrophobicContact CB-CG 3.74Å; R350-E352 IonicContact CZ-OE1 2.64Å; R350-E352 IonicContact NE-OE1 3.6Å; R350-E352 PolarHBondContact NE-OE1 3.21Å; R350-E352 IonicContact NH1-OE1 3.65Å; R350-E352 PolarHBondContact NH1-OE1 2.95Å; R350-E352 IonicContact NH2-OE1 3.14Å; R350-E352 PolarHBondContact O-N 2.91Å; R350-D353 VanDerWaalsContact CB-OD2 3.28Å; R350-D353 WeakPolarHBondContact CB-OD2 3.4Å; R350-D353 IonicContact CZ-OD1 2.81Å; R350-D353 IonicContact CZ-OD2 3.67Å; R350-D353 PolarHBondContact N-OD2 3.05Å; R350-D353 IonicContact NE-OD1 3.61Å; R350-D353 IonicContact NE-OD2 3.46Å; R350-D353 PolarHBondContact NE-OD2 2.86Å; R350-D353 IonicContact NH2-OD1 3.78Å; R350-D353 PolarHBondContact NH2-OD1 3.23Å; R350-D353 IonicContact NH2-OD2 3.22Å; R350-D353 PolarHBondContact NH2-OD2 2.99Å; R350-D353 WeakPolarHBondContact O-CB 3.47Å; R350-D353 PolarHBondContact O-N 2.66Å; R350-V354 WeakPolarHBondContact O-CG2 3.39Å; R350-V354 PolarHBondContact O-N 2.85Å; R350-V354 VanDerWaalsContact O-N 3.09Å
351	M	97.8	Very high	97.8	Very high	33 Å²	33	34.9 Å²	34.9	16%	0.163	16%	0.158	C	C	.	.	H	α-helix	trans	-61.4	-32.1	174.6	-71.7	-59.9	-76.2	0	0	113.1	F113 W166 W183 D184 V354 S355	F113-M351 HydrophobicContact CE1-CE 3.56Å; F113-M351 HydrophobicContact CZ-CE 3.71Å; W166-M351 HydrophobicContact CE3-CE 4.18Å; W183-M351 HydrophobicContact CB-SD 3.96Å; W183-M351 HydrophobicContact CG-SD 4.39Å; D184-M351 HydrophobicContact CB-CG 3.82Å; M351-V354 PolarHBondContact O-N 3.04Å; M351-S355 WeakPolarHBondContact O-CB 3.23Å; M351-S355 PolarHBondContact O-N 2.92Å; M351-S355 PolarHBondContact O-OG 3.11Å
352	E	96.5	Very high	97.8	Very high	116 Å²	116	34.9 Å²	34.9	54%	0.542	16%	0.158	S	C	.	.	H	α-helix	trans	-65.9	-36.5	172.1	60.3	-157.4	-127.5	0	0	112.5	R350 C356	R350-E352 HydrophobicContact CB-CG 3.74Å; R350-E352 IonicContact CZ-OE1 2.64Å; R350-E352 IonicContact NE-OE1 3.6Å; R350-E352 PolarHBondContact NE-OE1 3.21Å; R350-E352 IonicContact NH1-OE1 3.65Å; R350-E352 PolarHBondContact NH1-OE1 2.95Å; R350-E352 IonicContact NH2-OE1 3.14Å; R350-E352 PolarHBondContact O-N 2.91Å; E352-C356 WeakPolarHBondContact O-CB 3.24Å; E352-C356 PolarHBondContact O-N 2.69Å
353	D	97.3	Very high	97.8	Very high	5 Å²	5	35.5 Å²	35.5	3%	0.027	16%	0.164	C	C	.	.	H	α-helix	trans	-67.6	-40	175.2	-58.2	-57.7	0	0	0	111	H348 L349 R350 Y357	H348-D353 VanDerWaalsContact C-OD2 3.27Å; L349-D353 PolarHBondContact N-OD2 2.95Å; R350-D353 VanDerWaalsContact CB-OD2 3.28Å; R350-D353 WeakPolarHBondContact CB-OD2 3.4Å; R350-D353 IonicContact CZ-OD1 2.81Å; R350-D353 IonicContact CZ-OD2 3.67Å; R350-D353 PolarHBondContact N-OD2 3.05Å; R350-D353 IonicContact NE-OD1 3.61Å; R350-D353 IonicContact NE-OD2 3.46Å; R350-D353 PolarHBondContact NE-OD2 2.86Å; R350-D353 IonicContact NH2-OD1 3.78Å; R350-D353 PolarHBondContact NH2-OD1 3.23Å; R350-D353 IonicContact NH2-OD2 3.22Å; R350-D353 PolarHBondContact NH2-OD2 2.99Å; R350-D353 WeakPolarHBondContact O-CB 3.47Å; R350-D353 PolarHBondContact O-N 2.66Å; D353-Y357 WeakPolarHBondContact O-CB 3.31Å; D353-Y357 PolarHBondContact O-N 2.98Å
354	V	98.1	Very high	97.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.9	-49.3	175.5	173.6	0	0	0	0	111	F113 P161 F165 R350 M351 Y357 W358	F113-V354 HydrophobicContact CD1-CG1 3.87Å; F113-V354 HydrophobicContact CD2-CG1 4.47Å; F113-V354 HydrophobicContact CE1-CB 4.32Å; F113-V354 HydrophobicContact CE1-CG1 3.47Å; F113-V354 VanDerWaalsContact CE1-CG1 3.47Å; F113-V354 HydrophobicContact CE2-CG1 4.15Å; F113-V354 HydrophobicContact CG-CG1 4.36Å; F113-V354 HydrophobicContact CZ-CG1 3.64Å; P161-V354 HydrophobicContact CB-CG1 3.71Å; P161-V354 HydrophobicContact CG-CG1 4.35Å; F165-V354 HydrophobicContact CB-CG1 4.08Å; F165-V354 HydrophobicContact CD1-CG2 3.63Å; F165-V354 HydrophobicContact CD2-CG1 4.19Å; F165-V354 HydrophobicContact CD2-CG2 4.17Å; F165-V354 HydrophobicContact CE1-CG2 3.76Å; F165-V354 HydrophobicContact CE2-CG2 4.3Å; F165-V354 HydrophobicContact CG-CG1 4.07Å; F165-V354 HydrophobicContact CG-CG2 3.85Å; F165-V354 HydrophobicContact CZ-CG2 4.1Å; R350-V354 WeakPolarHBondContact O-CG2 3.39Å; R350-V354 PolarHBondContact O-N 2.85Å; R350-V354 VanDerWaalsContact O-N 3.09Å; M351-V354 PolarHBondContact O-N 3.04Å; V354-Y357 PolarHBondContact O-N 3.28Å; V354-W358 PolarHBondContact O-N 2.95Å; V354-W358 VanDerWaalsContact O-N 3.16Å
355	S	97.7	Very high	97.8	Very high	21 Å²	21	30.2 Å²	30.2	15%	0.147	15%	0.147	C	C	.	.	H	α-helix	trans	-65.7	-41	-180	-52.3	0	0	0	0	111.4	Q116 M351 W358 E359	Q116-S355 PolarHBondContact OE1-OG 2.94Å; M351-S355 WeakPolarHBondContact O-CB 3.23Å; M351-S355 PolarHBondContact O-N 2.92Å; M351-S355 PolarHBondContact O-OG 3.11Å; S355-W358 WeakPolarHBondContact O-CB 3.49Å; S355-W358 PolarHBondContact O-N 3.01Å; S355-E359 PolarHBondContact O-N 3.46Å
356	C	96.8	Very high	97.8	Very high	32 Å²	32	30.7 Å²	30.7	22%	0.216	15%	0.151	C	C	.	.	H	α-helix	trans	-66.6	-37.5	178.4	-169.5	0	0	0	0	112.3	C53 E352 E359 R360	C53-C356 HydrophobicContact CB-CB 3.38Å; C53-C356 WeakPolarHBondContact CB-SG 3.48Å; C53-C356 WeakPolarHBondContact SG-CB 3.49Å; C53-C356 CovalentContact SG-SG 2.02Å; C53-C356 PolarHBondContact SG-SG 2.83Å; E352-C356 WeakPolarHBondContact O-CB 3.24Å; E352-C356 PolarHBondContact O-N 2.69Å; C356-E359 PolarHBondContact O-N 3.42Å; C356-R360 WeakPolarHBondContact O-CB 3.45Å; C356-R360 VanDerWaalsContact O-CG 3.27Å; C356-R360 WeakPolarHBondContact O-CG 3.24Å; C356-R360 PolarHBondContact O-N 3.41Å
357	Y	98	Very high	97.8	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-63.8	-42.7	173.5	-168.4	-81	0	0	0	111.6	H56 L60 P161 F299 D353 V354 R360 L361	H56-Y357 HydrophobicContact CB-CD2 3.81Å; H56-Y357 HydrophobicContact CB-CE2 3.81Å; L60-Y357 HydrophobicContact CB-CE2 4.21Å; P161-Y357 HydrophobicContact CG-CD1 3.61Å; P161-Y357 HydrophobicContact CG-CE1 4.43Å; P161-Y357 HydrophobicContact CG-CG 4.09Å; F299-Y357 HydrophobicContact CB-CE1 4.21Å; F299-Y357 HydrophobicContact CB-CE2 4.39Å; F299-Y357 HydrophobicContact CD2-CD1 4.12Å; F299-Y357 AromaticContact CD2-CD2 3.53Å; F299-Y357 HydrophobicContact CD2-CD2 3.53Å; F299-Y357 HydrophobicContact CD2-CE1 4.15Å; F299-Y357 AromaticContact CD2-CE2 3.57Å; F299-Y357 HydrophobicContact CD2-CE2 3.57Å; F299-Y357 AromaticContact CD2-CG 3.8Å; F299-Y357 HydrophobicContact CD2-CG 3.8Å; F299-Y357 AromaticContact CD2-CZ 3.88Å; F299-Y357 AromaticContact CE2-CD2 3.83Å; F299-Y357 HydrophobicContact CE2-CD2 3.83Å; F299-Y357 HydrophobicContact CE2-CE2 4.33Å; F299-Y357 AromaticContact CE2-CG 3.92Å; F299-Y357 HydrophobicContact CE2-CG 3.92Å; F299-Y357 HydrophobicContact CG-CE1 4.34Å; F299-Y357 HydrophobicContact CG-CE2 4.38Å; D353-Y357 WeakPolarHBondContact O-CB 3.31Å; D353-Y357 PolarHBondContact O-N 2.98Å; V354-Y357 PolarHBondContact O-N 3.28Å; Y357-R360 PolarHBondContact O-N 3.16Å; Y357-L361 HydrophobicContact CD1-CB 4.44Å; Y357-L361 HydrophobicContact CE1-CB 4.42Å; Y357-L361 HydrophobicContact CE1-CD2 4.38Å; Y357-L361 WeakPolarHBondContact O-CB 3.3Å; Y357-L361 PolarHBondContact O-N 3.42Å
358	W	98.5	Very high	97.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.2	-45.1	173.4	-89	115	0	0	0	112.7	V110 F113 L147 Y160 P161 V354 S355 R360 L361 L362	V110-W358 HydrophobicContact CG1-CH2 3.87Å; V110-W358 HydrophobicContact CG1-CZ2 4.07Å; V110-W358 HydrophobicContact CG2-CZ2 4.33Å; F113-W358 HydrophobicContact CB-CB 4.43Å; F113-W358 HydrophobicContact CB-CD2 4.47Å; F113-W358 HydrophobicContact CB-CG 3.89Å; F113-W358 AromaticContact CD2-NE1 3.75Å; F113-W358 AromaticContact CG-CD1 3.68Å; F113-W358 AromaticContact CG-NE1 3.82Å; L147-W358 HydrophobicContact CD2-CZ3 4.2Å; Y160-W358 HydrophobicContact CD1-CH2 4.47Å; Y160-W358 AromaticContact CD2-CH2 3.41Å; Y160-W358 HydrophobicContact CD2-CH2 3.41Å; Y160-W358 VanDerWaalsContact CD2-CH2 3.41Å; Y160-W358 AromaticContact CD2-CZ2 3.15Å; Y160-W358 HydrophobicContact CD2-CZ2 3.15Å; Y160-W358 HydrophobicContact CE2-CH2 4.12Å; Y160-W358 AromaticContact CE2-CZ2 3.86Å; Y160-W358 HydrophobicContact CE2-CZ2 3.86Å; Y160-W358 AromaticContact CG-CH2 3.59Å; Y160-W358 HydrophobicContact CG-CH2 3.59Å; Y160-W358 AromaticContact CG-CZ2 3.77Å; Y160-W358 HydrophobicContact CG-CZ2 3.77Å; Y160-W358 HydrophobicContact CG-CZ3 4.45Å; P161-W358 HydrophobicContact CG-CG 4.35Å; P161-W358 PolarHBondContact O-NE1 3Å; V354-W358 PolarHBondContact O-N 2.95Å; V354-W358 VanDerWaalsContact O-N 3.16Å; S355-W358 WeakPolarHBondContact O-CB 3.49Å; S355-W358 PolarHBondContact O-N 3.01Å; W358-R360 PolarHBondContact O-N 2.93Å; W358-L361 HydrophobicContact CE3-CD2 4.05Å; W358-L361 HydrophobicContact CZ3-CD2 4.08Å; W358-L361 PolarHBondContact O-N 2.89Å; W358-L362 HydrophobicContact CE3-CD1 4.09Å; W358-L362 HydrophobicContact CE3-CG 4.17Å; W358-L362 HydrophobicContact CZ3-CD2 4.45Å; W358-L362 WeakPolarHBondContact O-CG 3.4Å; W358-L362 PolarHBondContact O-N 3.47Å
359	E	98.3	Very high	97.9	Very high	41 Å²	41	31.3 Å²	31.3	19%	0.192	17%	0.17	C	C	.	.	H	α-helix	trans	-56.6	-49.5	176	-173	-179.6	140.7	0	0	111.1	V117 K120 S355 C356 T363	V117-E359 HydrophobicContact CB-CB 4.08Å; V117-E359 HydrophobicContact CB-CG 4.27Å; V117-E359 HydrophobicContact CG1-CB 4.09Å; V117-E359 HydrophobicContact CG2-CB 4.17Å; K120-E359 VanDerWaalsContact CD-CD 3.4Å; K120-E359 HydrophobicContact CD-CG 4.37Å; K120-E359 VanDerWaalsContact CD-OE1 3.3Å; K120-E359 WeakPolarHBondContact CD-OE1 3.48Å; K120-E359 VanDerWaalsContact CD-OE2 3.29Å; K120-E359 WeakPolarHBondContact CD-OE2 3.32Å; K120-E359 IonicContact NZ-OE1 2.74Å; K120-E359 IonicContact NZ-OE2 3.72Å; K120-E359 PolarHBondContact NZ-OE2 2.93Å; S355-E359 PolarHBondContact O-N 3.46Å; C356-E359 PolarHBondContact O-N 3.42Å; E359-T363 VanDerWaalsContact O-CB 3.25Å; E359-T363 WeakPolarHBondContact O-CB 3.21Å; E359-T363 PolarHBondContact O-N 3.43Å; E359-T363 PolarHBondContact O-OG1 3.26Å
360	R	97.8	Very high	98	Very high	112 Å²	112	38.1 Å²	38.1	42%	0.423	20%	0.2	S	C	.	.	H	α-helix	trans	-64.7	-47.8	179.8	-69.6	-73.7	-179.5	-171.8	-3	112	L57 L60 C356 Y357 W358 L362 T363 E364	L57-R360 HydrophobicContact CD2-CB 3.95Å; L57-R360 HydrophobicContact CD2-CG 3.98Å; L60-R360 HydrophobicContact CD2-CB 3.91Å; C356-R360 WeakPolarHBondContact O-CB 3.45Å; C356-R360 VanDerWaalsContact O-CG 3.27Å; C356-R360 WeakPolarHBondContact O-CG 3.24Å; C356-R360 PolarHBondContact O-N 3.41Å; Y357-R360 PolarHBondContact O-N 3.16Å; W358-R360 PolarHBondContact O-N 2.93Å; R360-L362 PolarHBondContact O-N 3.45Å; R360-T363 PolarHBondContact O-N 3.36Å; R360-E364 WeakPolarHBondContact O-CB 3.46Å; R360-E364 WeakPolarHBondContact O-CG 3.42Å; R360-E364 PolarHBondContact O-N 2.89Å
361	L	98.4	Very high	98	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-54.7	-52.1	178.5	167.9	58.9	0	0	0	111.5	L60 L147 I158 Y357 W358 F365	L60-L361 HydrophobicContact CD1-CB 3.96Å; L60-L361 HydrophobicContact CD1-CD1 3.42Å; L60-L361 VanDerWaalsContact CD1-CD1 3.42Å; L60-L361 HydrophobicContact CD1-CG 4.26Å; L60-L361 HydrophobicContact CD2-CB 4.48Å; L147-L361 HydrophobicContact CD2-CD2 3.88Å; L147-L361 HydrophobicContact CD2-CG 4.42Å; I158-L361 HydrophobicContact CG2-CD1 3.51Å; Y357-L361 HydrophobicContact CD1-CB 4.44Å; Y357-L361 HydrophobicContact CE1-CB 4.42Å; Y357-L361 HydrophobicContact CE1-CD2 4.38Å; Y357-L361 WeakPolarHBondContact O-CB 3.3Å; Y357-L361 PolarHBondContact O-N 3.42Å; W358-L361 HydrophobicContact CE3-CD2 4.05Å; W358-L361 HydrophobicContact CZ3-CD2 4.08Å; W358-L361 PolarHBondContact O-N 2.89Å; L361-F365 WeakPolarHBondContact O-CB 3.47Å; L361-F365 PolarHBondContact O-N 3.47Å
362	L	98.7	Very high	97.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-74.5	-31.2	-175.9	-64.5	178.7	0	0	0	112.7	I90 I114 L121 M126 W358 R360 G366	I90-L362 HydrophobicContact CD1-CD1 4.36Å; I114-L362 HydrophobicContact CG1-CD1 3.97Å; I114-L362 HydrophobicContact CG2-CD1 4.26Å; L121-L362 HydrophobicContact CD1-CB 3.98Å; L121-L362 HydrophobicContact CD1-CD1 3.61Å; L121-L362 HydrophobicContact CD1-CG 4.46Å; L121-L362 HydrophobicContact CD2-CB 3.75Å; L121-L362 HydrophobicContact CG-CB 4.49Å; M126-L362 HydrophobicContact CE-CD1 4.23Å; M126-L362 HydrophobicContact CE-CD2 3.96Å; M126-L362 HydrophobicContact CG-CD2 4.28Å; M126-L362 HydrophobicContact SD-CD2 3.96Å; W358-L362 HydrophobicContact CE3-CD1 4.09Å; W358-L362 HydrophobicContact CE3-CG 4.17Å; W358-L362 HydrophobicContact CZ3-CD2 4.45Å; W358-L362 WeakPolarHBondContact O-CG 3.4Å; W358-L362 PolarHBondContact O-N 3.47Å; R360-L362 PolarHBondContact O-N 3.45Å; L362-G366 PolarHBondContact O-N 2.83Å
363	T	98.4	Very high	97.9	Very high	54 Å²	54	39.6 Å²	39.6	33%	0.331	21%	0.205	S	C	.	.	H	α-helix	trans	-66.5	-50.4	173.6	-59.7	0	0	0	0	111.3	E359 R360 G366 G367	E359-T363 VanDerWaalsContact O-CB 3.25Å; E359-T363 WeakPolarHBondContact O-CB 3.21Å; E359-T363 PolarHBondContact O-N 3.43Å; E359-T363 PolarHBondContact O-OG1 3.26Å; R360-T363 PolarHBondContact O-N 3.36Å; T363-G366 PolarHBondContact O-N 3.19Å; T363-G367 PolarHBondContact O-N 2.7Å; T363-G367 VanDerWaalsContact O-N 3.12Å
364	E	98.1	Very high	97.8	Very high	62 Å²	62	45.6 Å²	45.6	29%	0.29	23%	0.233	S	C	.	.	H	α-helix	trans	-68.2	-43.8	-178.6	-69.7	179.9	-156.9	0	0	111.2	L60 L64 R360 G367	L60-E364 WeakPolarHBondContact CD2-OE2 3.34Å; L64-E364 HydrophobicContact CD1-CB 3.66Å; R360-E364 WeakPolarHBondContact O-CB 3.46Å; R360-E364 WeakPolarHBondContact O-CG 3.42Å; R360-E364 PolarHBondContact O-N 2.89Å; E364-G367 PolarHBondContact O-N 3.2Å
365	F	98.6	Very high	97.7	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.3	-41.4	176	-176.9	-106.2	0	0	0	112.4	L64 V71 M76 V124 E125 M126 P145 I158 L361 G367 L368 L369	L64-F365 HydrophobicContact CD2-CB 4.34Å; L64-F365 HydrophobicContact CD2-CD2 3.91Å; V71-F365 HydrophobicContact CG2-CE2 4.26Å; M76-F365 HydrophobicContact CE-CE1 4.45Å; M76-F365 HydrophobicContact CE-CZ 4.21Å; V124-F365 HydrophobicContact CG2-CD1 3.88Å; V124-F365 HydrophobicContact CG2-CE1 4.41Å; E125-F365 WeakPolarHBondContact O-CE1 3.32Å; M126-F365 HydrophobicContact CB-CD1 4.38Å; M126-F365 HydrophobicContact CB-CE1 3.96Å; P145-F365 HydrophobicContact CB-CE2 3.69Å; P145-F365 HydrophobicContact CB-CZ 3.68Å; P145-F365 HydrophobicContact CG-CZ 4.36Å; I158-F365 HydrophobicContact CD1-CD2 4.07Å; I158-F365 HydrophobicContact CD1-CE2 3.99Å; L361-F365 WeakPolarHBondContact O-CB 3.47Å; L361-F365 PolarHBondContact O-N 3.47Å; F365-G367 VanDerWaalsContact C-N 3.26Å; F365-G367 PolarHBondContact O-N 2.99Å; F365-L368 HydrophobicContact CD2-CD1 4.46Å; F365-L368 WeakPolarHBondContact O-CB 3.26Å; F365-L368 PolarHBondContact O-N 2.74Å; F365-L369 HydrophobicContact CE1-CD2 4.42Å; F365-L369 HydrophobicContact CZ-CD2 4.49Å
366	G	98.1	Very high	97.7	Very high	9 Å²	9	54.1 Å²	54.1	9%	0.093	26%	0.264	C	S	.	.	H	α-helix	trans	-59	-37.4	175	0	0	0	0	0	112.7	L362 T363 L368 L369	L362-G366 PolarHBondContact O-N 2.83Å; T363-G366 PolarHBondContact O-N 3.19Å; G366-L368 PolarHBondContact O-N 3.33Å; G366-L369 PolarHBondContact O-N 3.07Å
367	G	98	Very high	97.6	Very high	64 Å²	64	59.1 Å²	59.1	66%	0.66	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-14.5	174.2	0	0	0	0	0	115.1	T363 E364 F365	T363-G367 PolarHBondContact O-N 2.7Å; T363-G367 VanDerWaalsContact O-N 3.12Å; E364-G367 PolarHBondContact O-N 3.2Å; F365-G367 VanDerWaalsContact C-N 3.26Å; F365-G367 PolarHBondContact O-N 2.99Å
368	L	98.3	Very high	97.5	Very high	34 Å²	34	63.6 Å²	63.6	18%	0.178	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-13.4	177	-60	174.2	0	0	0	113	L64 F67 G70 V71 F365 G366 K370	L64-L368 HydrophobicContact CB-CD1 4.32Å; L64-L368 HydrophobicContact CD1-CD1 4.45Å; L64-L368 HydrophobicContact CD2-CD1 4.32Å; F67-L368 HydrophobicContact CB-CD1 3.94Å; G70-L368 CarbonylContact C-O 3.54Å; G70-L368 WeakPolarHBondContact CA-O 3.25Å; V71-L368 PolarHBondContact N-O 3.27Å; F365-L368 HydrophobicContact CD2-CD1 4.46Å; F365-L368 WeakPolarHBondContact O-CB 3.26Å; F365-L368 PolarHBondContact O-N 2.74Å; G366-L368 PolarHBondContact O-N 3.33Å; L368-K370 PolarHBondContact O-N 2.91Å
369	L	98.4	Very high	97.4	Very high	23 Å²	23	64.1 Å²	64.1	12%	0.12	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-71.4	125.7	-179.5	-58.4	-176.4	0	0	0	110.8	V71 M76 V124 E125 F365 G366 Y371 L373	V71-L369 HydrophobicContact CB-CD2 3.9Å; V71-L369 HydrophobicContact CG1-CD2 3.95Å; M76-L369 HydrophobicContact CE-CD2 4.35Å; V124-L369 HydrophobicContact CB-CD1 4.45Å; V124-L369 HydrophobicContact CG2-CD1 4.08Å; E125-L369 HydrophobicContact CG-CD1 4.46Å; F365-L369 HydrophobicContact CE1-CD2 4.42Å; F365-L369 HydrophobicContact CZ-CD2 4.49Å; G366-L369 PolarHBondContact O-N 3.07Å; L369-Y371 HydrophobicContact CB-CE1 4.19Å; L369-Y371 HydrophobicContact CD2-CE1 4.11Å; L369-L373 HydrophobicContact CD1-CD1 3.83Å; L369-L373 HydrophobicContact CD1-CD2 4.44Å
370	K	97.9	Very high	97.3	Very high	144 Å²	144	66.8 Å²	66.8	63%	0.626	34%	0.335	S	S	*	.			trans	-97.9	20.9	-175.4	-68.6	-167.4	163.2	179	0	114.7	E69 V71 L368	E69-K370 WeakPolarHBondContact O-CE 3.45Å; E69-K370 PolarHBondContact O-NZ 2.99Å; V71-K370 PolarHBondContact O-N 2.93Å; L368-K370 PolarHBondContact O-N 2.91Å
371	Y	98	Very high	97.3	Very high	36 Å²	36	65.8 Å²	65.8	14%	0.141	34%	0.336	C	S	.	.	S	Bend	trans	-147.2	161.4	-174.5	60.8	-79.7	0	0	0	110.8	E73 M76 E125 L369 L373	E73-Y371 HydrophobicContact CB-CD1 3.93Å; E73-Y371 HydrophobicContact CB-CD2 3.89Å; E73-Y371 HydrophobicContact CB-CE1 4.3Å; E73-Y371 HydrophobicContact CB-CE2 4.25Å; E73-Y371 HydrophobicContact CB-CG 3.72Å; E73-Y371 HydrophobicContact CG-CD2 4.02Å; E73-Y371 HydrophobicContact CG-CE2 4.2Å; E73-Y371 HydrophobicContact CG-CG 4.37Å; E73-Y371 VanDerWaalsContact N-CD1 3.29Å; M76-Y371 WeakPolarHBondContact CB-OH 3.33Å; M76-Y371 WeakPolarHBondContact CG-OH 3.38Å; E125-Y371 VanDerWaalsContact CG-OH 3.24Å; E125-Y371 WeakPolarHBondContact CG-OH 3.38Å; E125-Y371 WeakPolarHBondContact OE1-CE2 3.28Å; E125-Y371 PolarHBondContact OE1-OH 2.8Å; L369-Y371 HydrophobicContact CB-CE1 4.19Å; L369-Y371 HydrophobicContact CD2-CE1 4.11Å; Y371-L373 HydrophobicContact CE2-CG 4.44Å
372	K	95.7	Very high	97.2	Very high	175 Å²	175	66.8 Å²	66.8	76%	0.761	34%	0.341	S	S	*	.			trans	-86	121.5	176.7	-174.3	177	-177.7	177.2	0	109.6
373	L	96.4	Very high	96.9	Very high	17 Å²	17	72.1 Å²	72.1	9%	0.089	37%	0.369	C	S	.	.			trans	-64.6	142	179.7	-74.8	78	0	0	0	112	I91 E125 L369 Y371	I91-L373 HydrophobicContact CD1-CB 4.2Å; I91-L373 HydrophobicContact CG1-CB 4.32Å; I91-L373 HydrophobicContact CG1-CD2 4.42Å; E125-L373 HydrophobicContact CB-CD2 3.72Å; E125-L373 HydrophobicContact CG-CD2 4.08Å; E125-L373 HydrophobicContact CG-CG 4.46Å; L369-L373 HydrophobicContact CD1-CD1 3.83Å; L369-L373 HydrophobicContact CD1-CD2 4.44Å; Y371-L373 HydrophobicContact CE2-CG 4.44Å
374	Q	95.3	Very high	96	Very high	132 Å²	132	74 Å²	74	62%	0.617	37%	0.374	S	S	*	.			trans	-122.5	128.1	169.9	-62.7	-63.6	-23.5	0	0	108.7	Q89 K376	Q89-Q374 PolarHBondContact NE2-O 2.98Å; Q374-K376 PolarHBondContact O-N 2.95Å
375	R	96.5	Very high	94.5	Very high	118 Å²	118	80 Å²	80	45%	0.445	40%	0.399	S	S	.	.			trans	-61.8	127.8	177.3	-178.6	-172.9	161.3	-170.7	-2.4	109.3	I91 Y96 T377 Y379	I91-R375 VanDerWaalsContact CD1-CA 3.5Å; I91-R375 HydrophobicContact CD1-CB 3.7Å; Y96-R375 HydrophobicContact CD1-CG 4.46Å; Y96-R375 HydrophobicContact CD2-CG 4.48Å; Y96-R375 HydrophobicContact CG-CG 4.39Å; R375-T377 PolarHBondContact O-N 2.79Å; R375-Y379 PolarHBondContact NH2-O 3.28Å
376	K	96.8	Very high	92	Very high	81 Å²	81	89.1 Å²	89.1	35%	0.352	44%	0.441	S	S	.	.			trans	-70.9	126.9	169.9	-66.1	-169.5	-170.9	-73	0	110.1	Q374 N378 Y379	Q374-K376 PolarHBondContact O-N 2.95Å; K376-N378 VanDerWaalsContact C-N 3.27Å; K376-N378 PolarHBondContact O-N 3.27Å; K376-Y379 HydrophobicContact CB-CD1 3.71Å; K376-Y379 HydrophobicContact CB-CD2 4.18Å; K376-Y379 HydrophobicContact CB-CE1 3.93Å; K376-Y379 HydrophobicContact CB-CE2 4.37Å; K376-Y379 HydrophobicContact CB-CG 3.85Å; K376-Y379 HydrophobicContact CD-CD1 4.47Å; K376-Y379 HydrophobicContact CD-CE1 3.82Å; K376-Y379 HydrophobicContact CD-CE2 4.13Å; K376-Y379 HydrophobicContact CG-CE1 4.49Å; K376-Y379 WeakPolarHBondContact O-CB 3.45Å; K376-Y379 PolarHBondContact O-N 2.78Å; K376-Y379 VanDerWaalsContact O-N 3.12Å
377	T	94.9	Very high	89.6	Confident	138 Å²	138	91.2 Å²	91.2	85%	0.847	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-27.7	-171.6	50.5	0	0	0	0	113.5	R375 Y379	R375-T377 PolarHBondContact O-N 2.79Å; T377-Y379 VanDerWaalsContact C-N 3.29Å; T377-Y379 PolarHBondContact O-N 2.88Å
378	N	95.5	Very high	87	Confident	95 Å²	95	98.9 Å²	98.9	51%	0.508	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	3.1	178	65.2	-37.7	0	0	0	113.8	K376	K376-N378 VanDerWaalsContact C-N 3.27Å; K376-N378 PolarHBondContact O-N 3.27Å
379	Y	97.6	Very high	84.3	Confident	11 Å²	11	100.7 Å²	100.7	4%	0.043	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-91.6	133.7	-178.6	-75.8	22.6	0	0	0	110.8	H87 Q89 R97 E98 R375 K376 T377	H87-Y379 HydrophobicContact CB-CE2 4.18Å; H87-Y379 WeakPolarHBondContact CB-OH 3.22Å; H87-Y379 AromaticContact CE1-CE2 3.94Å; H87-Y379 AromaticContact CG-CE2 3.84Å; H87-Y379 AromaticContact ND1-CE2 3.27Å; H87-Y379 VanDerWaalsContact ND1-CE2 3.27Å; H87-Y379 WeakPolarHBondContact ND1-CE2 3.33Å; H87-Y379 AromaticContact ND1-CZ 3.38Å; H87-Y379 PolarHBondContact ND1-OH 3.07Å; Q89-Y379 HydrophobicContact CG-CD2 4.32Å; Q89-Y379 HydrophobicContact CG-CE2 4.31Å; R97-Y379 WeakPolarHBondContact O-CA 3.24Å; R97-Y379 WeakPolarHBondContact O-CB 3.35Å; E98-Y379 HydrophobicContact CB-CD1 4.15Å; E98-Y379 HydrophobicContact CB-CE1 3.55Å; E98-Y379 HydrophobicContact CB-CE2 4.13Å; R375-Y379 PolarHBondContact NH2-O 3.28Å; K376-Y379 HydrophobicContact CB-CD1 3.71Å; K376-Y379 HydrophobicContact CB-CD2 4.18Å; K376-Y379 HydrophobicContact CB-CE1 3.93Å; K376-Y379 HydrophobicContact CB-CE2 4.37Å; K376-Y379 HydrophobicContact CB-CG 3.85Å; K376-Y379 HydrophobicContact CD-CD1 4.47Å; K376-Y379 HydrophobicContact CD-CE1 3.82Å; K376-Y379 HydrophobicContact CD-CE2 4.13Å; K376-Y379 HydrophobicContact CG-CE1 4.49Å; K376-Y379 WeakPolarHBondContact O-CB 3.45Å; K376-Y379 PolarHBondContact O-N 2.78Å; K376-Y379 VanDerWaalsContact O-N 3.12Å; T377-Y379 VanDerWaalsContact C-N 3.29Å; T377-Y379 PolarHBondContact O-N 2.88Å
380	N	95.8	Very high	81.4	Confident	97 Å²	97	106.4 Å²	106.4	52%	0.519	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	140.4	177.8	-67.8	-34.3	0	0	0	109.3	Y96 R97 V382	Y96-N380 VanDerWaalsContact CA-O 3.3Å; Y96-N380 WeakPolarHBondContact CA-O 3.29Å; R97-N380 PolarHBondContact N-O 3.23Å; R97-N380 PolarHBondContact O-N 3.32Å; R97-N380 VanDerWaalsContact O-N 3.13Å; N380-V382 PolarHBondContact O-N 2.69Å
381	Q	97.6	Very high	78.6	Confident	92 Å²	92	106.9 Å²	106.9	43%	0.43	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	130	169.2	-170	-178.3	-18.4	0	0	108.8	L95 Y96 I383	L95-Q381 CarbonylContact O-C 3.57Å; L95-Q381 WeakPolarHBondContact O-CA 3.42Å; L95-Q381 WeakPolarHBondContact O-CG 3.42Å; Y96-Q381 HydrophobicContact CD1-CB 3.9Å; Y96-Q381 HydrophobicContact CD1-CG 4.31Å; Y96-Q381 HydrophobicContact CE1-CB 3.8Å; Y96-Q381 HydrophobicContact CE1-CG 4.02Å; Q381-I383 HydrophobicContact CG-CG2 4.2Å
382	V	97	Very high	77.6	Confident	20 Å²	20	110.5 Å²	110.5	12%	0.121	54%	0.538	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	130.7	170.3	-175.5	0	0	0	0	107.5	L95 R97 E111 L115 N380	L95-V382 HydrophobicContact CB-CB 4.29Å; L95-V382 HydrophobicContact CD2-CB 3.96Å; L95-V382 HydrophobicContact CD2-CG1 4.15Å; L95-V382 HydrophobicContact CD2-CG2 4.4Å; L95-V382 HydrophobicContact CG-CB 4.02Å; L95-V382 HydrophobicContact CG-CG2 4.29Å; L95-V382 PolarHBondContact O-N 3.13Å; R97-V382 HydrophobicContact CB-CG2 3.74Å; E111-V382 HydrophobicContact CB-CG1 4.09Å; E111-V382 HydrophobicContact CG-CG1 3.86Å; E111-V382 WeakPolarHBondContact OE2-CG1 3.47Å; L115-V382 HydrophobicContact CD1-CG1 4.25Å; N380-V382 PolarHBondContact O-N 2.69Å
383	I	93	Very high	76.7	Confident	112 Å²	112	107.1 Å²	107.1	57%	0.574	53%	0.526	S	S	*	.			trans	-126.8	155.1	179.1	58.5	172.3	0	0	0	109.4	Q381 K385	Q381-I383 HydrophobicContact CG-CG2 4.2Å; I383-K385 PolarHBondContact O-N 2.94Å
384	H	78.9	Confident	75.6	Confident	94 Å²	94	112.1 Å²	112.1	44%	0.435	55%	0.551	S	S	.	*			trans	-56.3	109.8	171.1	-85.9	-66.6	0	0	0	110.1	L115 H386	L115-H384 WeakPolarHBondContact CB-NE2 3.3Å; H384-H386 PolarHBondContact O-N 3.12Å; H384-H386 VanDerWaalsContact O-N 3.13Å
385	K	65.6	Low	74.4	Confident	188 Å²	188	110.9 Å²	110.9	82%	0.817	55%	0.547	S	S	*	.			trans	-72.1	107.4	166.1	-70.1	-174.2	-179.2	177.7	0	107.5	I383 G387	I383-K385 PolarHBondContact O-N 2.94Å; K385-G387 PolarHBondContact O-N 3.09Å
386	H	47.4	Very low	73	Confident	191 Å²	191	110.4 Å²	110.4	88%	0.884	55%	0.553	S	S	*	*			trans	-70.8	75.7	163.4	-75.5	50.6	0	0	0	107.8	H384	H384-H386 PolarHBondContact O-N 3.12Å; H384-H386 VanDerWaalsContact O-N 3.13Å
387	G	47.3	Very low	71.4	Confident	53 Å²	53	112.4 Å²	112.4	55%	0.546	57%	0.566	S	S	.	*			trans	-132.6	124.6	-176.4	0	0	0	0	0	111.1	K385 T389	K385-G387 PolarHBondContact O-N 3.09Å; G387-T389 PolarHBondContact O-N 3.25Å; G387-T389 VanDerWaalsContact O-N 3.16Å
388	R	42.6	Very low	69.8	Low	225 Å²	225	110.6 Å²	110.6	85%	0.849	55%	0.546	S	S	*	.			trans	-49.2	108.8	-175	-66.2	176.2	-177.1	179.5	0.3	112.8	E390	R388-E390 VanDerWaalsContact C-N 3.35Å; R388-E390 HydrophobicContact CB-CG 4.47Å; R388-E390 PolarHBondContact O-N 2.79Å
389	T	41.4	Very low	67.8	Low	72 Å²	72	111.8 Å²	111.8	44%	0.442	55%	0.549	S	S	.	.			trans	-90.1	78.5	157.2	35.9	0	0	0	0	107.9	G387	G387-T389 PolarHBondContact O-N 3.25Å; G387-T389 VanDerWaalsContact O-N 3.16Å
390	E	37.8	Very low	65.3	Low	143 Å²	143	120.2 Å²	120.2	67%	0.668	59%	0.591	S	S	*	*			trans	-75.2	132.3	162	-71.9	175.8	-161.7	0	0	107.5	R388	R388-E390 VanDerWaalsContact C-N 3.35Å; R388-E390 HydrophobicContact CB-CG 4.47Å; R388-E390 PolarHBondContact O-N 2.79Å
391	L	39.3	Very low	62.5	Low	155 Å²	155	122.3 Å²	122.3	81%	0.812	60%	0.598	S	S	*	*			trans	-52.3	0	-173.6	-77.5	158.7	0	0	0	113.4	T178 L185	T178-L391 PolarHBondContact OG1-OXT 2.87Å; L185-L391 HydrophobicContact CD1-CD1 4.16Å; L185-L391 HydrophobicContact CD1-CD2 3.95Å; L185-L391 HydrophobicContact CD1-CG 4.28Å

Retrieved 391 of 391 residues in 120 ms (Link to these results)

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