X6RLA8_HUMAN Loading...

Neuralized E3 ubiquitin protein ligase 1

AlphaFold DB , UniProt , Accession X6RLA8, Species HUMAN (Homo sapiens, Human), Gene NEURL1, Length 199 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	43.5	Very low	35.8	Very low	249 Å²	249	152.5 Å²	152.5	100%	1.227	85%	0.853	S	S	*	*				0	80.6	0	-66.4	-167.4	-97.6	0	0	106.3
2	G	37.9	Very low	35.6	Very low	88 Å²	88	152.6 Å²	152.6	91%	0.907	85%	0.85	S	S	*	*				72.2	115.2	94.7	0	0	0	0	0	109.2
3	G	34.8	Very low	35.6	Very low	77 Å²	77	148.4 Å²	148.4	79%	0.794	84%	0.838	S	S	*	*			cis	150.5	118.5	15.4	0	0	0	0	0	104.7
4	Q	36.4	Very low	36.3	Very low	189 Å²	189	150.3 Å²	150.3	88%	0.883	84%	0.842	S	S	*	*			trans	-58.8	151.8	174.9	-102.8	169.7	-28.8	0	0	111.1
5	I	34.6	Very low	36	Very low	159 Å²	159	145.5 Å²	145.5	82%	0.815	84%	0.84	S	S	*	*				174.7	138.4	129.6	-86.6	152.4	0	0	0	110.8
6	T	41.1	Very low	36.1	Very low	126 Å²	126	139.9 Å²	139.9	77%	0.773	82%	0.823	S	S	*	*			trans	-54.6	147.8	168	33	0	0	0	0	114.8
7	R	33.9	Very low	36.3	Very low	235 Å²	235	139.6 Å²	139.6	89%	0.887	83%	0.827	S	S	*	*			trans	-174.3	116.1	154.5	-110.1	171.3	174.2	-167.2	-3.4	109.4
8	S	32.3	Very low	36.5	Very low	101 Å²	101	142.9 Å²	142.9	71%	0.706	83%	0.829	S	S	*	*				92.4	124.8	86.3	69.2	0	0	0	0	112.9
9	T	32.6	Very low	36.7	Very low	130 Å²	130	140.8 Å²	140.8	80%	0.798	82%	0.821	S	S	*	*			trans	-51.7	146.1	160.4	23.1	0	0	0	0	113.2
10	L	34.9	Very low	36.9	Very low	159 Å²	159	141.3 Å²	141.3	83%	0.832	83%	0.825	S	S	*	*			trans	171.7	103.9	142.7	-89.7	163.9	0	0	0	107.4
11	H	32	Very low	37	Very low	165 Å²	165	139 Å²	139	76%	0.764	81%	0.813	S	S	*	*				64.5	111.9	103.4	-78.4	-134.4	0	0	0	115.6
12	D	33.7	Very low	36.9	Very low	153 Å²	153	132.5 Å²	132.5	82%	0.818	79%	0.792	S	S	*	*				-163.4	109.7	120.7	-113.9	-35.1	0	0	0	114.9
13	S	35.5	Very low	37	Very low	98 Å²	98	136.1 Å²	136.1	69%	0.685	79%	0.785	S	S	*	*				25.1	103.3	129.7	-41.1	0	0	0	0	121.7
14	I	44.6	Very low	37.2	Very low	175 Å²	175	142 Å²	142	90%	0.897	78%	0.783	S	S	*	*			trans	-152.9	108	135.7	-49.3	-178	0	0	0	105
15	G	32.3	Very low	37	Very low	79 Å²	79	138.7 Å²	138.7	81%	0.814	78%	0.779	S	S	*	*				94.6	86.6	59	0	0	0	0	0	109.9
16	G	37.9	Very low	37.3	Very low	55 Å²	55	138.7 Å²	138.7	57%	0.567	78%	0.776	S	S	*	*			trans	148.3	127.2	164.9	0	0	0	0	0	115.7	F18	G16-F18 PolarHBondContact O-N 3.49Å
17	P	39.1	Very low	37.2	Very low	136 Å²	136	141 Å²	141	88%	0.883	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-76.1	122.7	177.2	29.4	-30.1	0	0	0	110.9
18	F	39.3	Very low	37.4	Very low	199 Å²	199	139 Å²	139	87%	0.873	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-86.1	132.2	170.4	-74.7	-83	0	0	0	110.4	G16	G16-F18 PolarHBondContact O-N 3.49Å
19	P	41.8	Very low	37.7	Very low	103 Å²	103	141.7 Å²	141.7	67%	0.669	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-72.2	139.3	-179	28.1	-32.1	0	0	0	111.5	T21	P19-T21 PolarHBondContact O-N 3.05Å
20	V	39.6	Very low	38.2	Very low	149 Å²	149	145 Å²	145	90%	0.903	78%	0.78	S	S	*	*			trans	-68.5	97.9	167.7	179.2	0	0	0	0	108.1
21	T	39.4	Very low	38.4	Very low	94 Å²	94	145.5 Å²	145.5	58%	0.577	78%	0.777	S	S	*	*			trans	-95.7	106.6	168.2	53.8	0	0	0	0	109.5	P19 H23	P19-T21 PolarHBondContact O-N 3.05Å; T21-H23 PolarHBondContact O-N 2.94Å
22	S	41.1	Very low	38.7	Very low	112 Å²	112	143 Å²	143	78%	0.783	78%	0.777	S	S	*	*			trans	-56.5	106.6	166.1	-177.5	0	0	0	0	109.3	R24	S22-R24 VanDerWaalsContact C-N 3.27Å; S22-R24 PolarHBondContact O-N 3.39Å
23	H	39.6	Very low	39	Very low	164 Å²	164	141.8 Å²	141.8	76%	0.759	78%	0.778	S	S	*	*			trans	-72.8	88.5	170.5	-74.7	-76.1	0	0	0	108.8	T21 C25	T21-H23 PolarHBondContact O-N 2.94Å; H23-C25 PolarHBondContact O-N 2.93Å
24	R	39.3	Very low	39.3	Very low	202 Å²	202	141.3 Å²	141.3	76%	0.762	78%	0.78	S	S	*	*			trans	-62.8	100.3	164.9	-169.4	176.7	-166.2	174.4	3.7	108	S22 H26	S22-R24 VanDerWaalsContact C-N 3.27Å; S22-R24 PolarHBondContact O-N 3.39Å; R24-H26 PolarHBondContact O-CD2 3.06Å; R24-H26 PolarHBondContact O-N 3.02Å
25	C	32.8	Very low	39.5	Very low	118 Å²	118	139.8 Å²	139.8	80%	0.797	78%	0.778	S	S	*	*			trans	-58.8	102.4	169.3	-71.3	0	0	0	0	109.2	H23 H27	H23-C25 PolarHBondContact O-N 2.93Å; C25-H27 VanDerWaalsContact C-N 3.27Å; C25-H27 PolarHBondContact O-N 2.96Å
26	H	40.7	Very low	40.4	Very low	160 Å²	160	142.8 Å²	142.8	74%	0.741	78%	0.775	S	S	*	*			trans	-71.7	87.3	167.8	-75.1	-81.5	0	0	0	108.6	R24 K28	R24-H26 PolarHBondContact O-CD2 3.06Å; R24-H26 PolarHBondContact O-N 3.02Å; H26-K28 VanDerWaalsContact C-N 3.3Å; H26-K28 PolarHBondContact O-N 2.92Å
27	H	39.2	Very low	40.8	Very low	173 Å²	173	145.8 Å²	145.8	80%	0.801	79%	0.785	S	S	*	*			trans	-66.7	94.6	165.1	-148.8	81.3	0	0	0	107.3	C25 Q29	C25-H27 VanDerWaalsContact C-N 3.27Å; C25-H27 PolarHBondContact O-N 2.96Å; H27-Q29 VanDerWaalsContact C-N 3.31Å; H27-Q29 PolarHBondContact O-N 3.13Å
28	K	38.2	Very low	41.3	Very low	195 Å²	195	144.7 Å²	144.7	85%	0.848	78%	0.78	S	S	*	*			trans	-62.6	97.4	168.2	-118	-166.7	177.8	-174.6	0	106.8	H26 K30	H26-K28 VanDerWaalsContact C-N 3.3Å; H26-K28 PolarHBondContact O-N 2.92Å; K28-K30 VanDerWaalsContact C-N 3.33Å; K28-K30 PolarHBondContact O-N 3.1Å
29	Q	38.7	Very low	41.6	Very low	157 Å²	157	138.3 Å²	138.3	73%	0.734	77%	0.771	S	S	*	*			trans	-56.6	99.8	164.9	-86.9	176.7	-29	0	0	107.7	H27 H31	H27-Q29 VanDerWaalsContact C-N 3.31Å; H27-Q29 PolarHBondContact O-N 3.13Å; Q29-H31 VanDerWaalsContact C-N 3.32Å; Q29-H31 PolarHBondContact O-N 2.9Å; Q29-H31 PolarHBondContact O-ND1 2.94Å; Q29-H31 VanDerWaalsContact O-ND1 3.1Å
30	K	42.5	Very low	42.1	Very low	199 Å²	199	136.4 Å²	136.4	87%	0.865	77%	0.77	S	S	*	*			trans	-64.1	102.2	163.8	-69.6	-175	-178.5	178.4	0	105.5	K28 C32	K28-K30 VanDerWaalsContact C-N 3.33Å; K28-K30 PolarHBondContact O-N 3.1Å; K30-C32 PolarHBondContact O-N 2.87Å; K30-C32 VanDerWaalsContact O-N 3.13Å
31	H	38.4	Very low	43.1	Very low	169 Å²	169	137 Å²	137	78%	0.782	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-53	117.8	176.9	-78.8	52.6	0	0	0	108.6	Q29	Q29-H31 VanDerWaalsContact C-N 3.32Å; Q29-H31 PolarHBondContact O-N 2.9Å; Q29-H31 PolarHBondContact O-ND1 2.94Å; Q29-H31 VanDerWaalsContact O-ND1 3.1Å
32	C	39.7	Very low	44.1	Very low	112 Å²	112	134.3 Å²	134.3	76%	0.757	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-57.6	129.1	161.5	-59.6	0	0	0	0	107.1	K30 A34	K30-C32 PolarHBondContact O-N 2.87Å; K30-C32 VanDerWaalsContact O-N 3.13Å; C32-A34 PolarHBondContact O-N 3Å
33	P	38.8	Very low	45.4	Very low	128 Å²	128	134.2 Å²	134.2	83%	0.831	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-61.5	130.3	173.8	23.2	-29.4	0	0	0	108.7
34	A	43.2	Very low	47.7	Very low	89 Å²	89	130 Å²	130	74%	0.736	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-51.1	140.1	-179.6	0	0	0	0	0	111.3	C32 L36	C32-A34 PolarHBondContact O-N 3Å; A34-L36 PolarHBondContact O-N 3.45Å
35	V	49	Very low	50.2	Low	142 Å²	142	124.3 Å²	124.3	86%	0.861	73%	0.732	S	S	*	*			trans	-49.1	113.4	165.9	176.9	0	0	0	0	107.5
36	L	50.2	Low	53.3	Low	143 Å²	143	119.9 Å²	119.9	75%	0.749	70%	0.701	S	S	*	*			trans	-57.8	138.4	174.5	-76.6	163.8	0	0	0	108.7	A34 S38	A34-L36 PolarHBondContact O-N 3.45Å; L36-S38 PolarHBondContact O-N 3.14Å
37	P	46.1	Very low	56	Low	118 Å²	118	113.8 Å²	113.8	77%	0.766	67%	0.673	S	S	*	*			trans	-60.6	128.5	178.4	25.1	-32.4	0	0	0	109.1	G39	P37-G39 PolarHBondContact O-N 3.49Å
38	S	49.1	Very low	58.8	Low	112 Å²	112	105.6 Å²	105.6	78%	0.783	64%	0.635	S	S	*	*			trans	-49.5	102	173.8	-60	0	0	0	0	109.8	L36 G40	L36-S38 PolarHBondContact O-N 3.14Å; S38-G40 PolarHBondContact O-N 3.05Å
39	G	45.7	Very low	61.7	Low	66 Å²	66	96.8 Å²	96.8	68%	0.68	60%	0.597	S	S	*	*			trans	-54.7	131.8	159.8	0	0	0	0	0	107.4	P37 L41	P37-G39 PolarHBondContact O-N 3.49Å; G39-L41 PolarHBondContact O-N 3.49Å
40	G	53.9	Low	64.4	Low	63 Å²	63	91 Å²	91	65%	0.649	57%	0.573	S	S	*	*			trans	-40.4	126.5	-167.8	0	0	0	0	0	112.5	S38	S38-G40 PolarHBondContact O-N 3.05Å
41	L	58.8	Low	66.9	Low	161 Å²	161	88 Å²	88	84%	0.843	56%	0.562	S	S	*	*			trans	-51.7	134.9	173	-73	168.7	0	0	0	108.1	G39 A43	G39-L41 PolarHBondContact O-N 3.49Å; L41-A43 PolarHBondContact O-N 2.83Å
42	P	61.7	Low	69.7	Low	37 Å²	37	80.1 Å²	80.1	24%	0.24	53%	0.525	C	S	.	.			trans	-54.6	138.7	180	-24.1	33.2	0	0	0	110.3	T44 R81 L84 E87	P42-T44 PolarHBondContact O-N 3.46Å; P42-R81 VanDerWaalsContact CB-CZ 3.4Å; P42-L84 HydrophobicContact CG-CD1 4.07Å; P42-L84 HydrophobicContact CG-CG 4.45Å; P42-E87 WeakPolarHBondContact CG-OE2 3.23Å
43	A	68.3	Low	72.5	Confident	111 Å²	111	77.6 Å²	77.6	92%	0.917	50%	0.502	S	S	*	.	S	Bend	trans	-59.3	-13.5	-175.9	0	0	0	0	0	114.2	L41	L41-A43 PolarHBondContact O-N 2.83Å
44	T	86.5	Confident	75.3	Confident	76 Å²	76	71.9 Å²	71.9	47%	0.466	47%	0.466	S	S	.	.	S	Bend	trans	-125.9	139.6	179.3	52	0	0	0	0	112.2	P42 R81	P42-T44 PolarHBondContact O-N 3.46Å; T44-R81 PolarHBondContact O-NE 2.83Å; T44-R81 PolarHBondContact O-NH2 2.87Å; T44-R81 WeakPolarHBondContact OG1-CD 3.44Å
45	P	92.8	Very high	77.8	Confident	82 Å²	82	71.7 Å²	71.7	53%	0.532	46%	0.46	S	S	.	.			trans	-62	146	178.9	27.2	-34.7	0	0	0	110.9	L47	P45-L47 HydrophobicContact CB-CD2 4.38Å; P45-L47 HydrophobicContact CG-CD2 4.49Å; P45-L47 HydrophobicContact CG-CG 4.43Å; P45-L47 PolarHBondContact O-N 3.13Å
46	L	97.1	Very high	80.2	Confident	25 Å²	25	66.6 Å²	66.6	13%	0.131	43%	0.426	C	S	.	.			trans	-77.3	117.7	173.7	-163.8	69.8	0	0	0	108.9	R81 V83 V89 L198	L46-R81 HydrophobicContact CD1-CG 3.99Å; L46-V83 HydrophobicContact CD1-CG1 3.74Å; L46-V83 HydrophobicContact CD2-CG1 4.1Å; L46-V89 HydrophobicContact CD2-CB 4.2Å; L46-V89 HydrophobicContact CD2-CG1 3.78Å; L46-V89 HydrophobicContact CD2-CG2 3.88Å; L46-L198 HydrophobicContact CD2-CD2 4.17Å
47	L	98	Very high	82.4	Confident	31 Å²	31	60.3 Å²	60.3	16%	0.162	39%	0.393	C	S	.	.			trans	-124.2	170.4	179.7	-53.7	177.4	0	0	0	109.2	P45 H63 K64 S79 N80	P45-L47 HydrophobicContact CB-CD2 4.38Å; P45-L47 HydrophobicContact CG-CD2 4.49Å; P45-L47 HydrophobicContact CG-CG 4.43Å; P45-L47 PolarHBondContact O-N 3.13Å; L47-H63 HydrophobicContact CB-CB 4.25Å; L47-K64 HydrophobicContact CD2-CD 4.27Å; L47-K64 HydrophobicContact CD2-CG 3.4Å; L47-K64 VanDerWaalsContact CD2-CG 3.4Å; L47-S79 CarbonylContact O-C 3.54Å; L47-S79 WeakPolarHBondContact O-CA 3.44Å; L47-N80 HydrophobicContact CB-CB 4.21Å; L47-N80 PolarHBondContact N-OD1 2.94Å; L47-N80 PolarHBondContact O-N 3.05Å; L47-N80 PolarHBondContact O-OD1 3.01Å; L47-N80 VanDerWaalsContact O-OD1 3.08Å
48	F	98.6	Very high	84.9	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.009	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	144.2	168.2	-67.2	-72	0	0	0	110.4	M59 H63 K64 V66 T77 F78 L91 V187 V196 L198	F48-M59 HydrophobicContact CB-CE 3.39Å; F48-M59 HydrophobicContact CB-SD 4.09Å; F48-M59 HydrophobicContact CG-CE 4.37Å; F48-H63 WeakPolarHBondContact CD2-O 3.41Å; F48-H63 PolarHBondContact N-O 2.87Å; F48-K64 VanDerWaalsContact CE2-O 3.24Å; F48-K64 WeakPolarHBondContact CE2-O 3.1Å; F48-V66 HydrophobicContact CB-CG1 4.16Å; F48-V66 HydrophobicContact CD1-CG1 4.36Å; F48-V66 HydrophobicContact CD1-CG2 4.44Å; F48-V66 HydrophobicContact CD2-CB 4.43Å; F48-V66 HydrophobicContact CD2-CG1 3.62Å; F48-V66 HydrophobicContact CD2-CG2 4.17Å; F48-V66 HydrophobicContact CE1-CG2 4.05Å; F48-V66 HydrophobicContact CE2-CB 4.39Å; F48-V66 HydrophobicContact CE2-CG1 4.05Å; F48-V66 HydrophobicContact CE2-CG2 3.75Å; F48-V66 HydrophobicContact CG-CG1 3.79Å; F48-V66 HydrophobicContact CG-CG2 4.5Å; F48-V66 HydrophobicContact CZ-CG2 3.69Å; F48-T77 WeakPolarHBondContact CD1-OG1 3.3Å; F48-T77 WeakPolarHBondContact CE1-OG1 3.2Å; F48-F78 CarbonylContact C-O 3.45Å; F48-F78 WeakPolarHBondContact CA-O 3.18Å; F48-L91 HydrophobicContact CE1-CD2 4.33Å; F48-L91 HydrophobicContact CZ-CD2 3.79Å; F48-V187 HydrophobicContact CE1-CG2 4.47Å; F48-V196 HydrophobicContact CZ-CG2 3.83Å; F48-L198 HydrophobicContact CD1-CD1 3.93Å; F48-L198 HydrophobicContact CD2-CD1 3.81Å; F48-L198 HydrophobicContact CD2-CG 4.28Å; F48-L198 HydrophobicContact CE1-CD1 3.94Å; F48-L198 HydrophobicContact CE1-CG 4.13Å; F48-L198 HydrophobicContact CE2-CB 4.4Å; F48-L198 HydrophobicContact CE2-CD1 3.82Å; F48-L198 HydrophobicContact CE2-CG 3.78Å; F48-L198 HydrophobicContact CG-CD1 3.87Å; F48-L198 HydrophobicContact CZ-CD1 3.88Å; F48-L198 HydrophobicContact CZ-CG 3.69Å
49	H	98.1	Very high	87.2	Confident	10 Å²	10	56 Å²	56	5%	0.046	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	125.8	176.6	-171.6	-89.4	0	0	0	110.1	H51 T52 M59 F78 P113	H49-H51 PolarHBondContact ND1-N 2.7Å; H49-H51 PolarHBondContact O-N 3.31Å; H49-T52 PolarHBondContact CE1-OG1 2.98Å; H49-T52 PolarHBondContact ND1-N 3.25Å; H49-T52 VanDerWaalsContact ND1-N 3.13Å; H49-M59 WeakPolarHBondContact O-CE 3.46Å; H49-F78 HydrophobicContact CB-CB 4.29Å; H49-F78 PolarHBondContact N-O 3.04Å; H49-P113 HydrophobicContact CB-CB 4.36Å
50	P	96.3	Very high	89.6	Confident	34 Å²	34	55.6 Å²	55.6	22%	0.221	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	-31.1	-166.8	24.5	-33	0	0	0	114.1	K53	P50-K53 PolarHBondContact O-NZ 3.46Å
51	H	95.4	Very high	91.5	Very high	136 Å²	136	61 Å²	61	63%	0.63	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	-59.7	-171.5	-54.8	111.2	0	0	0	112	H49 K53	H49-H51 PolarHBondContact ND1-N 2.7Å; H49-H51 PolarHBondContact O-N 3.31Å; H51-K53 PolarHBondContact O-N 2.76Å; H51-K53 VanDerWaalsContact O-N 3.12Å
52	T	97.4	Very high	93.3	Very high	4 Å²	4	56 Å²	56	3%	0.025	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	95.3	-178.2	-46.3	0	0	0	0	112.2	H49 F78 P113 I116 L121	H49-T52 PolarHBondContact CE1-OG1 2.98Å; H49-T52 PolarHBondContact ND1-N 3.25Å; H49-T52 VanDerWaalsContact ND1-N 3.13Å; T52-F78 HydrophobicContact CG2-CD2 3.97Å; T52-F78 HydrophobicContact CG2-CE2 3.87Å; T52-P113 WeakPolarHBondContact CB-O 3.4Å; T52-P113 HydrophobicContact CG2-CB 4.44Å; T52-P113 PolarHBondContact OG1-O 3.38Å; T52-I116 HydrophobicContact CG2-CB 3.76Å; T52-I116 HydrophobicContact CG2-CG2 3.89Å; T52-I116 PolarHBondContact OG1-O 3.46Å; T52-L121 HydrophobicContact CG2-CD1 4.2Å; T52-L121 HydrophobicContact CG2-CD2 4.45Å
53	K	97.5	Very high	95	Very high	59 Å²	59	57.5 Å²	57.5	26%	0.257	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	156.7	179	63.6	-166.8	-179.1	-68.9	0	110.3	P50 H51 I57 M59 I76 T77 L121	P50-K53 PolarHBondContact O-NZ 3.46Å; H51-K53 PolarHBondContact O-N 2.76Å; H51-K53 VanDerWaalsContact O-N 3.12Å; K53-I57 HydrophobicContact CB-CB 4.25Å; K53-I57 HydrophobicContact CB-CG1 4.47Å; K53-I57 HydrophobicContact CB-CG2 4.34Å; K53-I57 HydrophobicContact CD-CB 4.21Å; K53-I57 HydrophobicContact CD-CG2 3.86Å; K53-I57 HydrophobicContact CG-CB 4.26Å; K53-I57 HydrophobicContact CG-CG2 4.39Å; K53-M59 HydrophobicContact CD-CE 3.92Å; K53-I76 CarbonylContact C-O 3.59Å; K53-I76 VanDerWaalsContact CA-O 3.31Å; K53-I76 WeakPolarHBondContact CA-O 3.49Å; K53-T77 HydrophobicContact CB-CG2 4.32Å; K53-L121 VanDerWaalsContact C-CD1 3.45Å
54	G	97.6	Very high	96.4	Very high	8 Å²	8	55.9 Å²	55.9	8%	0.082	30%	0.303	C	S	.	.			trans	-63.8	152.1	177.3	0	0	0	0	0	112.6	Q56 I57 N74 I76	G54-Q56 PolarHBondContact O-N 2.9Å; G54-Q56 VanDerWaalsContact O-N 3.07Å; G54-I57 WeakPolarHBondContact O-CB 3.32Å; G54-I57 PolarHBondContact O-N 2.92Å; G54-N74 CarbonylContact C-O 3.4Å; G54-N74 VanDerWaalsContact CA-O 3.28Å; G54-N74 WeakPolarHBondContact CA-O 3.38Å; G54-I76 PolarHBondContact N-O 3.02Å
55	S	96.8	Very high	97	Very high	86 Å²	86	53.1 Å²	53.1	60%	0.601	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-14.9	-174.7	58.4	0	0	0	0	114.9	N74	S55-N74 PolarHBondContact N-O 3.48Å
56	Q	97.6	Very high	97.2	Very high	35 Å²	35	49.2 Å²	49.2	16%	0.164	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	3.2	175.9	-61.8	-60.3	-53.7	0	0	113.6	G54 R68 Q69 A70 N74	G54-Q56 PolarHBondContact O-N 2.9Å; G54-Q56 VanDerWaalsContact O-N 3.07Å; Q56-R68 HydrophobicContact CB-CG 3.79Å; Q56-R68 CarbonylContact O-C 3.51Å; Q56-R68 VanDerWaalsContact O-CA 3.28Å; Q56-R68 WeakPolarHBondContact O-CA 3.17Å; Q56-Q69 HydrophobicContact CB-CG 4.47Å; Q56-Q69 PolarHBondContact O-N 3.32Å; Q56-Q69 VanDerWaalsContact OE1-CG 3.22Å; Q56-A70 PolarHBondContact OE1-O 3.4Å; Q56-N74 HydrophobicContact CB-CB 4.39Å; Q56-N74 WeakPolarHBondContact CB-O 3.42Å; Q56-N74 HydrophobicContact CG-CB 3.8Å; Q56-N74 PolarHBondContact N-O 3.05Å
57	I	97.9	Very high	97.3	Very high	10 Å²	10	53.7 Å²	53.7	5%	0.051	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	118.7	-179.6	-63.8	-64.5	0	0	0	111.5	K53 G54 V66 A75 T77 V189	K53-I57 HydrophobicContact CB-CB 4.25Å; K53-I57 HydrophobicContact CB-CG1 4.47Å; K53-I57 HydrophobicContact CB-CG2 4.34Å; K53-I57 HydrophobicContact CD-CB 4.21Å; K53-I57 HydrophobicContact CD-CG2 3.86Å; K53-I57 HydrophobicContact CG-CB 4.26Å; K53-I57 HydrophobicContact CG-CG2 4.39Å; G54-I57 WeakPolarHBondContact O-CB 3.32Å; G54-I57 PolarHBondContact O-N 2.92Å; I57-V66 HydrophobicContact CG2-CB 3.88Å; I57-V66 HydrophobicContact CG2-CG1 3.74Å; I57-A75 HydrophobicContact CD1-CB 3.7Å; I57-A75 HydrophobicContact CG1-CB 4.28Å; I57-T77 HydrophobicContact CB-CG2 4.41Å; I57-T77 HydrophobicContact CD1-CG2 3.74Å; I57-T77 HydrophobicContact CG1-CG2 3.65Å; I57-T77 HydrophobicContact CG2-CG2 4.01Å; I57-V189 HydrophobicContact CD1-CB 4.27Å; I57-V189 HydrophobicContact CD1-CG2 4.18Å
58	L	97.7	Very high	97.2	Very high	95 Å²	95	52.3 Å²	52.3	50%	0.497	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	135.6	158.5	-64.2	175.5	0	0	0	109.1	V66 K67 Q69	L58-V66 CarbonylContact O-C 3.48Å; L58-V66 VanDerWaalsContact O-CA 3.24Å; L58-V66 WeakPolarHBondContact O-CA 3.42Å; L58-K67 PolarHBondContact N-O 2.84Å; L58-K67 PolarHBondContact O-N 3.22Å; L58-Q69 HydrophobicContact CD1-CB 3.65Å; L58-Q69 HydrophobicContact CG-CB 3.91Å
59	M	97.1	Very high	97.1	Very high	44 Å²	44	56.4 Å²	56.4	22%	0.217	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	143.5	-178.6	-170	174.2	-67.4	0	0	109.4	F48 H49 K53 H63 A65 V66	F48-M59 HydrophobicContact CB-CE 3.39Å; F48-M59 HydrophobicContact CB-SD 4.09Å; F48-M59 HydrophobicContact CG-CE 4.37Å; H49-M59 WeakPolarHBondContact O-CE 3.46Å; K53-M59 HydrophobicContact CD-CE 3.92Å; M59-H63 HydrophobicContact CG-CB 4.3Å; M59-H63 HydrophobicContact SD-CB 3.62Å; M59-H63 PolarHBondContact SD-CD2 3.39Å; M59-A65 WeakPolarHBondContact CA-O 3.3Å; M59-V66 HydrophobicContact CB-CG1 4.13Å; M59-V66 HydrophobicContact CE-CG1 3.62Å; M59-V66 HydrophobicContact CG-CG1 3.92Å
60	D	96.1	Very high	96.8	Very high	58 Å²	58	58.2 Å²	58.2	31%	0.31	31%	0.31	S	S	.	.			trans	-75.1	164.8	173.3	79.3	-43.6	0	0	0	111.8	S62 H63 K64 A65	D60-S62 PolarHBondContact O-N 2.9Å; D60-S62 WeakPolarHBondContact OD2-CB 3.48Å; D60-S62 PolarHBondContact OD2-N 2.76Å; D60-S62 PolarHBondContact OD2-OG 3.43Å; D60-H63 PolarHBondContact O-CD2 2.87Å; D60-H63 VanDerWaalsContact O-CD2 3.29Å; D60-H63 PolarHBondContact O-N 3.39Å; D60-H63 WeakPolarHBondContact OD1-CA 3.46Å; D60-H63 PolarHBondContact OD1-N 2.91Å; D60-K64 PolarHBondContact OD1-N 2.83Å; D60-A65 HydrophobicContact CB-CB 4.34Å; D60-A65 PolarHBondContact N-O 3.3Å; D60-A65 PolarHBondContact OD1-N 3.32Å
61	L	95.1	Very high	96.6	Very high	178 Å²	178	59 Å²	59	93%	0.932	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-25.1	-178.4	-64.8	175.9	0	0	0	113.5	H63	L61-H63 VanDerWaalsContact C-N 3.3Å
62	S	95.9	Very high	96.3	Very high	56 Å²	56	55.2 Å²	55.2	39%	0.392	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-4.8	177.9	81.4	0	0	0	0	113.5	D60 K64	D60-S62 PolarHBondContact O-N 2.9Å; D60-S62 WeakPolarHBondContact OD2-CB 3.48Å; D60-S62 PolarHBondContact OD2-N 2.76Å; D60-S62 PolarHBondContact OD2-OG 3.43Å; S62-K64 PolarHBondContact O-N 2.93Å; S62-K64 VanDerWaalsContact O-N 3.09Å; S62-K64 WeakPolarHBondContact OG-CB 3.04Å; S62-K64 PolarHBondContact OG-N 3.37Å
63	H	97.6	Very high	96.1	Very high	67 Å²	67	55.2 Å²	55.2	31%	0.31	30%	0.299	S	S	.	.	S	Bend	trans	54.8	20.8	-173.2	-49.3	153.1	0	0	0	113.9	L47 F48 M59 D60 L61	L47-H63 HydrophobicContact CB-CB 4.25Å; F48-H63 WeakPolarHBondContact CD2-O 3.41Å; F48-H63 PolarHBondContact N-O 2.87Å; M59-H63 HydrophobicContact CG-CB 4.3Å; M59-H63 HydrophobicContact SD-CB 3.62Å; M59-H63 PolarHBondContact SD-CD2 3.39Å; D60-H63 PolarHBondContact O-CD2 2.87Å; D60-H63 VanDerWaalsContact O-CD2 3.29Å; D60-H63 PolarHBondContact O-N 3.39Å; D60-H63 WeakPolarHBondContact OD1-CA 3.46Å; D60-H63 PolarHBondContact OD1-N 2.91Å; L61-H63 VanDerWaalsContact C-N 3.3Å
64	K	97.6	Very high	96	Very high	77 Å²	77	54.3 Å²	54.3	34%	0.335	30%	0.296	S	S	.	.	S	Bend	trans	-90.4	-24	176.8	-73.7	-167.4	173.6	-164.9	0	112.6	L47 F48 D60 S62 Q197 L198	L47-K64 HydrophobicContact CD2-CD 4.27Å; L47-K64 HydrophobicContact CD2-CG 3.4Å; L47-K64 VanDerWaalsContact CD2-CG 3.4Å; F48-K64 VanDerWaalsContact CE2-O 3.24Å; F48-K64 WeakPolarHBondContact CE2-O 3.1Å; D60-K64 PolarHBondContact OD1-N 2.83Å; S62-K64 PolarHBondContact O-N 2.93Å; S62-K64 VanDerWaalsContact O-N 3.09Å; S62-K64 WeakPolarHBondContact OG-CB 3.04Å; S62-K64 PolarHBondContact OG-N 3.37Å; K64-Q197 HydrophobicContact CB-CG 4.49Å; K64-Q197 CarbonylContact O-C 3.56Å; K64-Q197 VanDerWaalsContact O-CA 3.23Å; K64-Q197 WeakPolarHBondContact O-CA 3.45Å; K64-Q197 WeakPolarHBondContact O-CG 3.41Å; K64-L198 PolarHBondContact O-N 3.46Å
65	A	98.3	Very high	96	Very high	18 Å²	18	53.9 Å²	53.9	15%	0.149	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	136.5	-174.6	0	0	0	0	0	111	M59 D60 V196 Q197	M59-A65 WeakPolarHBondContact CA-O 3.3Å; D60-A65 HydrophobicContact CB-CB 4.34Å; D60-A65 PolarHBondContact N-O 3.3Å; D60-A65 PolarHBondContact OD1-N 3.32Å; A65-V196 WeakPolarHBondContact CA-O 3.47Å; A65-Q197 HydrophobicContact CB-CB 4.16Å; A65-Q197 HydrophobicContact CB-CG 4.23Å
66	V	98.4	Very high	96.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	146.7	174.2	-66.7	0	0	0	0	110.8	F48 I57 L58 M59 T77 V189 G195 V196	F48-V66 HydrophobicContact CB-CG1 4.16Å; F48-V66 HydrophobicContact CD1-CG1 4.36Å; F48-V66 HydrophobicContact CD1-CG2 4.44Å; F48-V66 HydrophobicContact CD2-CB 4.43Å; F48-V66 HydrophobicContact CD2-CG1 3.62Å; F48-V66 HydrophobicContact CD2-CG2 4.17Å; F48-V66 HydrophobicContact CE1-CG2 4.05Å; F48-V66 HydrophobicContact CE2-CB 4.39Å; F48-V66 HydrophobicContact CE2-CG1 4.05Å; F48-V66 HydrophobicContact CE2-CG2 3.75Å; F48-V66 HydrophobicContact CG-CG1 3.79Å; F48-V66 HydrophobicContact CG-CG2 4.5Å; F48-V66 HydrophobicContact CZ-CG2 3.69Å; I57-V66 HydrophobicContact CG2-CB 3.88Å; I57-V66 HydrophobicContact CG2-CG1 3.74Å; L58-V66 CarbonylContact O-C 3.48Å; L58-V66 VanDerWaalsContact O-CA 3.24Å; L58-V66 WeakPolarHBondContact O-CA 3.42Å; M59-V66 HydrophobicContact CB-CG1 4.13Å; M59-V66 HydrophobicContact CE-CG1 3.62Å; M59-V66 HydrophobicContact CG-CG1 3.92Å; V66-T77 HydrophobicContact CG1-CG2 4.41Å; V66-T77 HydrophobicContact CG2-CG2 4.37Å; V66-V189 HydrophobicContact CG2-CG2 4.02Å; V66-G195 WeakPolarHBondContact O-CA 3.39Å; V66-V196 HydrophobicContact CG2-CG2 3.47Å; V66-V196 VanDerWaalsContact CG2-CG2 3.47Å; V66-V196 PolarHBondContact N-O 3.06Å; V66-V196 PolarHBondContact O-N 3.29Å
67	K	97.8	Very high	96.1	Very high	120 Å²	120	48.2 Å²	48.2	52%	0.522	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	138.8	176.4	-65.8	178.6	-176.9	172.3	0	109.7	L58 R194	L58-K67 PolarHBondContact N-O 2.84Å; L58-K67 PolarHBondContact O-N 3.22Å; K67-R194 CarbonylContact C-O 3.49Å; K67-R194 VanDerWaalsContact CA-O 3.3Å; K67-R194 WeakPolarHBondContact CA-O 3.45Å
68	R	97.1	Very high	96.2	Very high	1 Å²	1	47.8 Å²	47.8	0%	0.004	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	118.7	169	-166.5	180	66.5	-123.1	-0.4	109.4	Q56 A70 S71 F72 A75 V189 G191 T193 R194	Q56-R68 HydrophobicContact CB-CG 3.79Å; Q56-R68 CarbonylContact O-C 3.51Å; Q56-R68 VanDerWaalsContact O-CA 3.28Å; Q56-R68 WeakPolarHBondContact O-CA 3.17Å; R68-A70 WeakPolarHBondContact CD-O 3.35Å; R68-A70 WeakPolarHBondContact CG-O 3.34Å; R68-S71 PolarHBondContact NE-O 2.87Å; R68-S71 PolarHBondContact NH2-O 3.05Å; R68-F72 PolarHBondContact NH1-O 2.89Å; R68-A75 HydrophobicContact CB-CB 4.4Å; R68-A75 HydrophobicContact CG-CB 3.95Å; R68-V189 HydrophobicContact CB-CG1 4.28Å; R68-V189 PolarHBondContact NH1-O 3.32Å; R68-G191 PolarHBondContact NH1-O 2.95Å; R68-G191 PolarHBondContact NH2-O 2.82Å; R68-T193 PolarHBondContact NH1-O 2.75Å; R68-R194 HydrophobicContact CB-CG 4.43Å; R68-R194 PolarHBondContact N-O 3.21Å; R68-R194 WeakPolarHBondContact O-CG 3.23Å; R68-R194 PolarHBondContact O-NE 2.76Å; R68-R194 VanDerWaalsContact O-NE 3.14Å
69	Q	96.1	Very high	96.2	Very high	88 Å²	88	43.3 Å²	43.3	41%	0.411	23%	0.231	S	C	.	.			trans	-71.8	-47.3	-176.1	70.2	-176.4	40.5	0	0	112.3	Q56 L58 R194	Q56-Q69 HydrophobicContact CB-CG 4.47Å; Q56-Q69 PolarHBondContact O-N 3.32Å; Q56-Q69 VanDerWaalsContact OE1-CG 3.22Å; L58-Q69 HydrophobicContact CD1-CB 3.65Å; L58-Q69 HydrophobicContact CG-CB 3.91Å; Q69-R194 PolarHBondContact O-NH2 3.36Å
70	A	91.3	Very high	96.3	Very high	49 Å²	49	43.7 Å²	43.7	41%	0.405	23%	0.234	S	C	.	.	S	Bend	trans	-145.7	176.6	-179.3	0	0	0	0	0	111.6	Q56 R68	Q56-A70 PolarHBondContact OE1-O 3.4Å; R68-A70 WeakPolarHBondContact CD-O 3.35Å; R68-A70 WeakPolarHBondContact CG-O 3.34Å
71	S	92	Very high	96.3	Very high	51 Å²	51	42.3 Å²	42.3	36%	0.357	22%	0.224	S	C	.	.	S	Bend	trans	59	-164.5	-176.9	-164.9	0	0	0	0	113.4	R68	R68-S71 PolarHBondContact NE-O 2.87Å; R68-S71 PolarHBondContact NH2-O 3.05Å
72	F	89.5	Confident	96.5	Very high	55 Å²	55	36.3 Å²	36.3	24%	0.241	20%	0.196	C	C	.	.	S	Bend	trans	-118.5	-2.7	177	64.6	-88.2	0	0	0	113.7	R68 W100 Y124 Y190 G191	R68-F72 PolarHBondContact NH1-O 2.89Å; F72-W100 HydrophobicContact CB-CB 4.39Å; F72-W100 HydrophobicContact CB-CD2 3.56Å; F72-W100 HydrophobicContact CB-CE3 3.86Å; F72-W100 HydrophobicContact CB-CG 3.78Å; F72-W100 HydrophobicContact CB-CZ2 4.37Å; F72-W100 HydrophobicContact CB-CZ3 4.39Å; F72-W100 HydrophobicContact CD1-CD2 4.32Å; F72-W100 AromaticContact CD1-CE3 3.84Å; F72-W100 HydrophobicContact CD1-CE3 3.84Å; F72-W100 AromaticContact CD1-CH2 3.84Å; F72-W100 HydrophobicContact CD1-CH2 3.84Å; F72-W100 HydrophobicContact CD1-CZ2 4.3Å; F72-W100 AromaticContact CD1-CZ3 3.58Å; F72-W100 HydrophobicContact CD1-CZ3 3.58Å; F72-W100 HydrophobicContact CE1-CZ3 4.21Å; F72-W100 HydrophobicContact CG-CD2 4.24Å; F72-W100 HydrophobicContact CG-CE3 4.03Å; F72-W100 HydrophobicContact CG-CZ3 4.24Å; F72-Y124 AromaticContact CE2-CE1 3.92Å; F72-Y124 HydrophobicContact CE2-CE1 3.92Å; F72-Y190 HydrophobicContact CD2-CD2 4.37Å; F72-Y190 AromaticContact CD2-CE2 3.54Å; F72-Y190 HydrophobicContact CD2-CE2 3.54Å; F72-Y190 AromaticContact CD2-CZ 3.84Å; F72-Y190 HydrophobicContact CE2-CE2 4.01Å; F72-Y190 WeakPolarHBondContact O-CD2 3.32Å; F72-G191 PolarHBondContact O-N 2.87Å
73	C	92.9	Very high	96.6	Very high	5 Å²	5	34 Å²	34	3%	0.034	18%	0.179	C	C	.	.			trans	-144	-163.2	-173.2	67.3	0	0	0	0	112.5	A75 Y124 Y190	C73-A75 VanDerWaalsContact C-N 3.28Å; C73-A75 PolarHBondContact O-N 3.11Å; C73-Y124 HydrophobicContact CB-CD1 3.7Å; C73-Y124 HydrophobicContact CB-CE1 3.28Å; C73-Y190 HydrophobicContact CB-CD2 4.26Å; C73-Y190 HydrophobicContact CB-CE2 4.31Å
74	N	96.1	Very high	96.5	Very high	39 Å²	39	35.4 Å²	35.4	21%	0.209	19%	0.189	C	C	.	.			trans	57.8	40.4	-174.8	-67.3	-56.7	0	0	0	112.5	G54 S55 Q56 K123	G54-N74 CarbonylContact C-O 3.4Å; G54-N74 VanDerWaalsContact CA-O 3.28Å; G54-N74 WeakPolarHBondContact CA-O 3.38Å; S55-N74 PolarHBondContact N-O 3.48Å; Q56-N74 HydrophobicContact CB-CB 4.39Å; Q56-N74 WeakPolarHBondContact CB-O 3.42Å; Q56-N74 HydrophobicContact CG-CB 3.8Å; Q56-N74 PolarHBondContact N-O 3.05Å; N74-K123 PolarHBondContact N-O 2.99Å; N74-K123 WeakPolarHBondContact OD1-CA 3.18Å; N74-K123 WeakPolarHBondContact OD1-CG 3.32Å
75	A	97.6	Very high	96.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.185	C	C	.	.			trans	-133.4	32.7	-167	0	0	0	0	0	112.7	I57 R68 C73 V189	I57-A75 HydrophobicContact CD1-CB 3.7Å; I57-A75 HydrophobicContact CG1-CB 4.28Å; R68-A75 HydrophobicContact CB-CB 4.4Å; R68-A75 HydrophobicContact CG-CB 3.95Å; C73-A75 VanDerWaalsContact C-N 3.28Å; C73-A75 PolarHBondContact O-N 3.11Å; A75-V189 HydrophobicContact CB-CB 4Å; A75-V189 WeakPolarHBondContact CB-O 3.42Å; A75-V189 PolarHBondContact O-N 2.98Å
76	I	98.5	Very high	96.5	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	135.4	176.2	-62.2	157.7	0	0	0	109.6	K53 G54 F78 P122 A125 L129 V187 D188	K53-I76 CarbonylContact C-O 3.59Å; K53-I76 VanDerWaalsContact CA-O 3.31Å; K53-I76 WeakPolarHBondContact CA-O 3.49Å; G54-I76 PolarHBondContact N-O 3.02Å; I76-F78 HydrophobicContact CG2-CE1 4.3Å; I76-F78 HydrophobicContact CG2-CE2 3.83Å; I76-F78 HydrophobicContact CG2-CZ 3.64Å; I76-P122 HydrophobicContact CD1-CG 4.29Å; I76-P122 WeakPolarHBondContact CD1-O 3.22Å; I76-A125 HydrophobicContact CG1-CB 4.45Å; I76-L129 HydrophobicContact CD1-CD1 3.75Å; I76-L129 HydrophobicContact CD1-CG 4.21Å; I76-L129 HydrophobicContact CG1-CD1 4.39Å; I76-L129 HydrophobicContact CG2-CD1 3.84Å; I76-V187 CarbonylContact C-O 3.51Å; I76-D188 HydrophobicContact CG1-CB 4.16Å
77	T	98.6	Very high	96.5	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	161.6	174.1	68.3	0	0	0	0	110.4	F48 K53 I57 V66 V187	F48-T77 WeakPolarHBondContact CD1-OG1 3.3Å; F48-T77 WeakPolarHBondContact CE1-OG1 3.2Å; K53-T77 HydrophobicContact CB-CG2 4.32Å; I57-T77 HydrophobicContact CB-CG2 4.41Å; I57-T77 HydrophobicContact CD1-CG2 3.74Å; I57-T77 HydrophobicContact CG1-CG2 3.65Å; I57-T77 HydrophobicContact CG2-CG2 4.01Å; V66-T77 HydrophobicContact CG1-CG2 4.41Å; V66-T77 HydrophobicContact CG2-CG2 4.37Å; T77-V187 PolarHBondContact N-O 2.84Å; T77-V187 PolarHBondContact O-N 2.85Å; T77-V187 PolarHBondContact OG1-O 2.82Å
78	F	98.8	Very high	96.5	Very high	1 Å²	1	38.3 Å²	38.3	0%	0.004	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	163.1	178.4	-55.3	-84.7	0	0	0	110.8	F48 H49 T52 I76 T109 P113 I116 L121 L129 F135 A185 L186	F48-F78 CarbonylContact C-O 3.45Å; F48-F78 WeakPolarHBondContact CA-O 3.18Å; H49-F78 HydrophobicContact CB-CB 4.29Å; H49-F78 PolarHBondContact N-O 3.04Å; T52-F78 HydrophobicContact CG2-CD2 3.97Å; T52-F78 HydrophobicContact CG2-CE2 3.87Å; I76-F78 HydrophobicContact CG2-CE1 4.3Å; I76-F78 HydrophobicContact CG2-CE2 3.83Å; I76-F78 HydrophobicContact CG2-CZ 3.64Å; F78-T109 HydrophobicContact CD1-CG2 3.75Å; F78-T109 HydrophobicContact CE1-CG2 3.89Å; F78-P113 HydrophobicContact CB-CB 3.89Å; F78-P113 HydrophobicContact CB-CG 3.49Å; F78-P113 VanDerWaalsContact CB-CG 3.49Å; F78-P113 HydrophobicContact CD1-CG 4.33Å; F78-P113 HydrophobicContact CD2-CB 4.22Å; F78-P113 HydrophobicContact CD2-CG 4.47Å; F78-P113 HydrophobicContact CG-CB 4.1Å; F78-P113 HydrophobicContact CG-CG 3.86Å; F78-I116 HydrophobicContact CZ-CD1 4.44Å; F78-L121 HydrophobicContact CE2-CD1 4.31Å; F78-L121 HydrophobicContact CE2-CD2 3.8Å; F78-L121 HydrophobicContact CZ-CD2 3.97Å; F78-L129 HydrophobicContact CZ-CD1 4.27Å; F78-F135 HydrophobicContact CE1-CE1 4.16Å; F78-F135 HydrophobicContact CZ-CE1 4.38Å; F78-A185 CarbonylContact C-O 3.46Å; F78-A185 WeakPolarHBondContact CA-O 3.38Å; F78-L186 HydrophobicContact CD1-CB 4.26Å; F78-L186 HydrophobicContact CD1-CG 4.26Å; F78-L186 HydrophobicContact CE1-CB 4.33Å; F78-L186 HydrophobicContact CE1-CD1 3.95Å; F78-L186 HydrophobicContact CE1-CG 3.89Å
79	S	98.6	Very high	96.5	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.014	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	151.4	167.1	55.4	0	0	0	0	111.8	L47 R81 W184 A185	L47-S79 CarbonylContact O-C 3.54Å; L47-S79 WeakPolarHBondContact O-CA 3.44Å; S79-R81 WeakPolarHBondContact CB-O 3.24Å; S79-R81 PolarHBondContact O-N 3.01Å; S79-R81 PolarHBondContact OG-O 3.48Å; S79-W184 WeakPolarHBondContact OG-CA 3.41Å; S79-A185 PolarHBondContact N-O 3.21Å; S79-A185 PolarHBondContact OG-N 2.74Å
80	N	97.7	Very high	96.6	Very high	51 Å²	51	39.3 Å²	39.3	27%	0.273	20%	0.199	S	C	.	.	S	Bend	trans	-69.7	-19.4	176.9	69.4	-43	0	0	0	113.8	L47	L47-N80 HydrophobicContact CB-CB 4.21Å; L47-N80 PolarHBondContact N-OD1 2.94Å; L47-N80 PolarHBondContact O-N 3.05Å; L47-N80 PolarHBondContact O-OD1 3.01Å; L47-N80 VanDerWaalsContact O-OD1 3.08Å
81	R	97.6	Very high	97	Very high	30 Å²	30	37 Å²	37	11%	0.113	18%	0.18	C	C	.	.	S	Bend	trans	-141	165.4	179.7	64.9	158.3	173.5	77	5.9	111.5	P42 T44 L46 S79 E87 W184	P42-R81 VanDerWaalsContact CB-CZ 3.4Å; T44-R81 PolarHBondContact O-NE 2.83Å; T44-R81 PolarHBondContact O-NH2 2.87Å; T44-R81 WeakPolarHBondContact OG1-CD 3.44Å; L46-R81 HydrophobicContact CD1-CG 3.99Å; S79-R81 WeakPolarHBondContact CB-O 3.24Å; S79-R81 PolarHBondContact O-N 3.01Å; S79-R81 PolarHBondContact OG-O 3.48Å; R81-E87 IonicContact CZ-OE1 3.91Å; R81-E87 VanDerWaalsContact CZ-OE1 3.28Å; R81-E87 IonicContact CZ-OE2 3.63Å; R81-E87 IonicContact NH1-OE1 3.95Å; R81-E87 PolarHBondContact NH1-OE1 2.82Å; R81-E87 IonicContact NH1-OE2 2.88Å; R81-E87 PolarHBondContact NH1-OE2 2.86Å; R81-E87 IonicContact NH2-OE1 3.75Å; R81-E87 PolarHBondContact NH2-OE1 2.95Å; R81-E87 IonicContact NH2-OE2 3.18Å; R81-W184 VanDerWaalsContact O-CD1 3.26Å
82	P	98.1	Very high	97.3	Very high	52 Å²	52	38.5 Å²	38.5	34%	0.338	18%	0.18	S	C	.	.	P	Polyproline II helix	trans	-58.4	144.7	167.2	-21.1	31	0	0	0	111.9	P182 L183 W184	P82-P182 HydrophobicContact CB-CB 4.07Å; P82-P182 HydrophobicContact CG-CB 4.12Å; P82-L183 CarbonylContact C-O 3.56Å; P82-L183 WeakPolarHBondContact CA-O 3.34Å; P82-W184 HydrophobicContact CG-CD2 4.33Å; P82-W184 HydrophobicContact CG-CH2 4.05Å; P82-W184 HydrophobicContact CG-CZ2 3.56Å
83	V	98	Very high	97.7	Very high	7 Å²	7	35.9 Å²	35.9	4%	0.042	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-97.3	140.9	170	-63	0	0	0	0	109.5	L46 E87 V89 F108 L183 A185	L46-V83 HydrophobicContact CD1-CG1 3.74Å; L46-V83 HydrophobicContact CD2-CG1 4.1Å; V83-E87 WeakPolarHBondContact CA-OE2 3.48Å; V83-V89 HydrophobicContact CB-CG2 4.46Å; V83-V89 HydrophobicContact CG1-CG2 3.8Å; V83-F108 HydrophobicContact CG2-CD1 3.88Å; V83-F108 HydrophobicContact CG2-CE1 3.77Å; V83-L183 HydrophobicContact CG2-CB 4.28Å; V83-L183 WeakPolarHBondContact CG2-O 3.22Å; V83-L183 PolarHBondContact N-O 3.07Å; V83-A185 HydrophobicContact CG1-CB 4.32Å
84	L	97.1	Very high	97.9	Very high	97 Å²	97	37.7 Å²	37.7	51%	0.508	18%	0.18	S	C	.	.	P	Polyproline II helix	trans	-75.1	154.9	175.9	-56.2	175.2	0	0	0	110.5	P42 Y86 E87	P42-L84 HydrophobicContact CG-CD1 4.07Å; P42-L84 HydrophobicContact CG-CG 4.45Å; L84-Y86 PolarHBondContact O-N 2.99Å; L84-E87 HydrophobicContact CB-CB 4.02Å; L84-E87 PolarHBondContact N-OE2 2.73Å; L84-E87 WeakPolarHBondContact O-CB 3.45Å; L84-E87 PolarHBondContact O-N 2.98Å
85	I	97.7	Very high	98	Very high	51 Å²	51	40.1 Å²	40.1	26%	0.262	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	134.9	167.3	-53.3	-57.8	0	0	0	108.4	E87 V155 K157 T179 L183	I85-E87 PolarHBondContact O-N 2.82Å; I85-V155 HydrophobicContact CD1-CG1 3.74Å; I85-V155 WeakPolarHBondContact CG2-O 3.36Å; I85-K157 HydrophobicContact CG2-CG 3.89Å; I85-T179 HydrophobicContact CD1-CG2 3.72Å; I85-L183 HydrophobicContact CD1-CD1 4.15Å
86	Y	97.8	Very high	97.9	Very high	110 Å²	110	42.5 Å²	42.5	43%	0.431	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.8	0	-170.2	-48.7	-73.6	0	0	0	116.4	L84 Q88 V155 D156 K157	L84-Y86 PolarHBondContact O-N 2.99Å; Y86-Q88 PolarHBondContact O-N 3.37Å; Y86-V155 PolarHBondContact N-O 3.4Å; Y86-D156 HydrophobicContact CD1-CB 4.11Å; Y86-D156 HydrophobicContact CE1-CB 3.33Å; Y86-K157 HydrophobicContact CE2-CD 4Å; Y86-K157 HydrophobicContact CE2-CG 3.69Å; Y86-K157 PolarHBondContact OH-N 2.92Å
87	E	97.5	Very high	97.6	Very high	31 Å²	31	44.4 Å²	44.4	15%	0.145	21%	0.208	C	C	.	.			trans	-68.5	124	170.5	-172.6	-179.7	161.3	0	0	109.8	P42 R81 V83 L84 I85 V89 W154	P42-E87 WeakPolarHBondContact CG-OE2 3.23Å; R81-E87 IonicContact CZ-OE1 3.91Å; R81-E87 VanDerWaalsContact CZ-OE1 3.28Å; R81-E87 IonicContact CZ-OE2 3.63Å; R81-E87 IonicContact NH1-OE1 3.95Å; R81-E87 PolarHBondContact NH1-OE1 2.82Å; R81-E87 IonicContact NH1-OE2 2.88Å; R81-E87 PolarHBondContact NH1-OE2 2.86Å; R81-E87 IonicContact NH2-OE1 3.75Å; R81-E87 PolarHBondContact NH2-OE1 2.95Å; R81-E87 IonicContact NH2-OE2 3.18Å; V83-E87 WeakPolarHBondContact CA-OE2 3.48Å; L84-E87 HydrophobicContact CB-CB 4.02Å; L84-E87 PolarHBondContact N-OE2 2.73Å; L84-E87 WeakPolarHBondContact O-CB 3.45Å; L84-E87 PolarHBondContact O-N 2.98Å; I85-E87 PolarHBondContact O-N 2.82Å; E87-V89 PolarHBondContact O-N 3.39Å; E87-W154 WeakPolarHBondContact O-CB 3.28Å
88	Q	97.7	Very high	97.1	Very high	83 Å²	83	49.4 Å²	49.4	39%	0.388	24%	0.241	S	C	.	.			trans	-82.3	111.2	177.9	-64.7	-173.9	38.4	0	0	110.5	Y86 R90 W154	Y86-Q88 PolarHBondContact O-N 3.37Å; Q88-R90 HydrophobicContact CB-CG 4.33Å; Q88-R90 PolarHBondContact O-N 2.88Å; Q88-W154 HydrophobicContact CB-CE3 4.45Å; Q88-W154 HydrophobicContact CG-CB 4.42Å; Q88-W154 HydrophobicContact CG-CD2 3.99Å; Q88-W154 HydrophobicContact CG-CE3 3.67Å; Q88-W154 HydrophobicContact CG-CG 4.34Å; Q88-W154 HydrophobicContact CG-CZ3 4.25Å
89	V	98.4	Very high	96.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	112.7	167.6	-176.4	0	0	0	0	107.9	L46 V83 E87 F108 A152 F153 A185 L198	L46-V89 HydrophobicContact CD2-CB 4.2Å; L46-V89 HydrophobicContact CD2-CG1 3.78Å; L46-V89 HydrophobicContact CD2-CG2 3.88Å; V83-V89 HydrophobicContact CB-CG2 4.46Å; V83-V89 HydrophobicContact CG1-CG2 3.8Å; E87-V89 PolarHBondContact O-N 3.39Å; V89-F108 HydrophobicContact CG2-CE1 4.48Å; V89-A152 CarbonylContact O-C 3.51Å; V89-A152 WeakPolarHBondContact O-CA 3.39Å; V89-F153 HydrophobicContact CB-CD1 3.98Å; V89-F153 HydrophobicContact CB-CE1 3.54Å; V89-F153 HydrophobicContact CB-CE2 4.13Å; V89-F153 HydrophobicContact CB-CG 4.46Å; V89-F153 HydrophobicContact CB-CZ 3.64Å; V89-F153 HydrophobicContact CG1-CD1 4.27Å; V89-F153 HydrophobicContact CG1-CE1 3.39Å; V89-F153 HydrophobicContact CG1-CE2 4.44Å; V89-F153 HydrophobicContact CG1-CZ 3.52Å; V89-F153 HydrophobicContact CG2-CE2 4.31Å; V89-F153 HydrophobicContact CG2-CZ 4.16Å; V89-F153 PolarHBondContact N-O 3.08Å; V89-F153 WeakPolarHBondContact O-CD1 3.34Å; V89-F153 PolarHBondContact O-N 2.83Å; V89-A185 HydrophobicContact CG1-CB 4.06Å; V89-A185 HydrophobicContact CG2-CB 3.96Å; V89-L198 HydrophobicContact CG1-CD2 3.86Å
90	R	98.3	Very high	96.3	Very high	110 Å²	110	57.9 Å²	57.9	42%	0.415	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	123.8	-176.6	-64.7	176.9	70.3	-147	5.6	110.4	Q88 I151 A152 L198 L199	Q88-R90 HydrophobicContact CB-CG 4.33Å; Q88-R90 PolarHBondContact O-N 2.88Å; R90-I151 CarbonylContact C-O 3.53Å; R90-I151 WeakPolarHBondContact CA-O 3.33Å; R90-A152 HydrophobicContact CG-CB 4.05Å; R90-L198 WeakPolarHBondContact O-CA 3.39Å; R90-L199 HydrophobicContact CB-CB 3.99Å; R90-L199 HydrophobicContact CB-CD1 4.45Å; R90-L199 PolarHBondContact O-N 2.56Å
91	L	97.8	Very high	95.9	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	127.2	-178.3	-71.1	166.8	0	0	0	110.3	F48 L106 I150 I151 F153 V187 Q197 L198	F48-L91 HydrophobicContact CE1-CD2 4.33Å; F48-L91 HydrophobicContact CZ-CD2 3.79Å; L91-L106 HydrophobicContact CD1-CD2 3.57Å; L91-I150 CarbonylContact O-C 3.21Å; L91-I150 WeakPolarHBondContact O-CA 3.47Å; L91-I151 PolarHBondContact N-O 3.49Å; L91-I151 PolarHBondContact O-N 2.97Å; L91-F153 HydrophobicContact CD1-CE1 3.68Å; L91-F153 HydrophobicContact CG-CE1 4.43Å; L91-V187 HydrophobicContact CD1-CG1 4.12Å; L91-V187 HydrophobicContact CD1-CG2 3.63Å; L91-Q197 CarbonylContact C-O 3.57Å; L91-Q197 WeakPolarHBondContact CA-O 3.42Å; L91-L198 HydrophobicContact CD2-CD2 3.37Å; L91-L198 HydrophobicContact CD2-CG 3.7Å; L91-L198 HydrophobicContact CG-CD2 4.04Å
92	K	98.6	Very high	95.6	Very high	83 Å²	83	59.2 Å²	59.2	36%	0.361	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	130.6	167.5	-174.7	175.3	-178.1	177.9	0	110	T94 N149 I150 V196 Q197 L199	K92-T94 PolarHBondContact O-N 2.78Å; K92-N149 WeakPolarHBondContact CA-O 3.31Å; K92-I150 HydrophobicContact CB-CG1 4.35Å; K92-I150 HydrophobicContact CG-CG1 4.32Å; K92-V196 CarbonylContact O-C 3.47Å; K92-V196 VanDerWaalsContact O-CA 3.22Å; K92-V196 WeakPolarHBondContact O-CA 3.47Å; K92-Q197 PolarHBondContact N-O 3.17Å; K92-Q197 PolarHBondContact O-N 3.36Å; K92-L199 HydrophobicContact CB-CD1 4.25Å; K92-L199 HydrophobicContact CB-CD2 4.06Å; K92-L199 HydrophobicContact CB-CG 4.3Å
93	I	98.4	Very high	95.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	115.2	168	-61.8	177.7	0	0	0	108.1	L104 A145 N146 G148 N149 I151 T193	I93-L104 HydrophobicContact CD1-CD2 4.09Å; I93-A145 VanDerWaalsContact CD1-CA 3.49Å; I93-A145 HydrophobicContact CD1-CB 4.41Å; I93-N146 WeakPolarHBondContact CB-O 3.44Å; I93-G148 PolarHBondContact O-N 3.44Å; I93-N149 PolarHBondContact N-O 3.27Å; I93-I151 HydrophobicContact CD1-CD1 3.85Å; I93-I151 HydrophobicContact CG1-CD1 4.01Å; I93-T193 HydrophobicContact CG1-CG2 4.49Å; I93-T193 HydrophobicContact CG2-CG2 4.26Å
94	T	98.2	Very high	95.2	Very high	43 Å²	43	56.5 Å²	56.5	26%	0.264	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	-22.9	-177.6	59.4	0	0	0	0	112.6	K92 G195 V196 Q197	K92-T94 PolarHBondContact O-N 2.78Å; T94-G195 PolarHBondContact N-O 2.93Å; T94-G195 WeakPolarHBondContact OG1-CA 3.43Å; T94-G195 PolarHBondContact OG1-O 3.01Å; T94-V196 PolarHBondContact OG1-N 3Å; T94-Q197 HydrophobicContact CG2-CB 3.68Å
95	K	97.1	Very high	95.3	Very high	90 Å²	90	53 Å²	53	39%	0.391	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	135.3	178.7	-164.3	73.1	-158.9	142.8	0	112.4	E147 R194 G195	K95-E147 WeakPolarHBondContact CA-OE1 3.34Å; K95-E147 WeakPolarHBondContact CD-OE1 3.32Å; K95-E147 WeakPolarHBondContact CE-OE1 3.23Å; K95-E147 IonicContact NZ-OE1 2.93Å; K95-E147 PolarHBondContact NZ-OE1 3.13Å; K95-E147 IonicContact NZ-OE2 3.81Å; K95-R194 HydrophobicContact CB-CB 4.16Å; K95-R194 HydrophobicContact CG-CB 4.04Å; K95-R194 HydrophobicContact CG-CG 4.44Å; K95-R194 PolarHBondContact O-N 3.21Å; K95-G195 PolarHBondContact N-O 3.01Å; K95-G195 PolarHBondContact O-N 2.87Å
96	K	94.7	Very high	95.3	Very high	51 Å²	51	50.5 Å²	50.5	22%	0.222	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	152.2	172.3	-169.8	-179.4	-173.7	177	0	109.7	A145 N146 E147 L192	K96-A145 WeakPolarHBondContact CD-O 3.42Å; K96-N146 PolarHBondContact NZ-OD1 3.36Å; K96-E147 HydrophobicContact CB-CG 3.5Å; K96-E147 VanDerWaalsContact CB-CG 3.5Å; K96-E147 VanDerWaalsContact N-CG 3.32Å; K96-E147 PolarHBondContact N-OE1 3.14Å; K96-L192 CarbonylContact C-O 3.57Å; K96-L192 WeakPolarHBondContact CA-O 3.41Å; K96-L192 VanDerWaalsContact CG-O 3.32Å; K96-L192 WeakPolarHBondContact CG-O 3.33Å
97	Q	92.8	Very high	95.4	Very high	40 Å²	40	45.3 Å²	45.3	19%	0.187	24%	0.236	C	C	.	.			trans	-135.3	104.5	176.3	178.4	169.4	-10.5	0	0	108.8	C99 L192 R194	Q97-C99 VanDerWaalsContact C-N 3.27Å; Q97-C99 VanDerWaalsContact CG-SG 3.51Å; Q97-C99 PolarHBondContact NE2-SG 3.12Å; Q97-C99 PolarHBondContact O-N 3.28Å; Q97-L192 PolarHBondContact N-O 2.87Å; Q97-L192 WeakPolarHBondContact O-CA 3.35Å; Q97-R194 HydrophobicContact CB-CB 4.13Å
98	C	87.9	Confident	95.4	Very high	105 Å²	105	43.9 Å²	43.9	71%	0.709	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-1.2	-168.5	-55.5	0	0	0	0	115.3	W100	C98-W100 VanDerWaalsContact C-N 3.28Å; C98-W100 PolarHBondContact O-N 3.42Å
99	C	89.9	Confident	95.5	Very high	91 Å²	91	39.9 Å²	39.9	62%	0.615	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.6	9.3	179.6	60.9	0	0	0	0	114.3	Q97	Q97-C99 VanDerWaalsContact C-N 3.27Å; Q97-C99 VanDerWaalsContact CG-SG 3.51Å; Q97-C99 PolarHBondContact NE2-SG 3.12Å; Q97-C99 PolarHBondContact O-N 3.28Å
100	W	90.2	Very high	95.5	Very high	91 Å²	91	41.2 Å²	41.2	35%	0.345	22%	0.22	S	C	.	.	S	Bend	trans	-128.1	161.5	177.6	-57.4	115.9	0	0	0	110.4	F72 C98 L192	F72-W100 HydrophobicContact CB-CB 4.39Å; F72-W100 HydrophobicContact CB-CD2 3.56Å; F72-W100 HydrophobicContact CB-CE3 3.86Å; F72-W100 HydrophobicContact CB-CG 3.78Å; F72-W100 HydrophobicContact CB-CZ2 4.37Å; F72-W100 HydrophobicContact CB-CZ3 4.39Å; F72-W100 HydrophobicContact CD1-CD2 4.32Å; F72-W100 AromaticContact CD1-CE3 3.84Å; F72-W100 HydrophobicContact CD1-CE3 3.84Å; F72-W100 AromaticContact CD1-CH2 3.84Å; F72-W100 HydrophobicContact CD1-CH2 3.84Å; F72-W100 HydrophobicContact CD1-CZ2 4.3Å; F72-W100 AromaticContact CD1-CZ3 3.58Å; F72-W100 HydrophobicContact CD1-CZ3 3.58Å; F72-W100 HydrophobicContact CE1-CZ3 4.21Å; F72-W100 HydrophobicContact CG-CD2 4.24Å; F72-W100 HydrophobicContact CG-CE3 4.03Å; F72-W100 HydrophobicContact CG-CZ3 4.24Å; C98-W100 VanDerWaalsContact C-N 3.28Å; C98-W100 PolarHBondContact O-N 3.42Å; W100-L192 WeakPolarHBondContact O-CD2 3.3Å; W100-L192 WeakPolarHBondContact O-CG 3.48Å
101	S	89.4	Confident	95.4	Very high	92 Å²	92	40.1 Å²	40.1	64%	0.643	22%	0.219	S	C	*	.			trans	-107.3	162.3	169.9	-55.1	0	0	0	0	110.8	Y190	S101-Y190 VanDerWaalsContact O-CE1 3.3Å; S101-Y190 WeakPolarHBondContact O-CE1 3.28Å
102	G	91.3	Very high	95.5	Very high	17 Å²	17	42 Å²	42	18%	0.175	23%	0.229	C	C	.	.			trans	77.7	148.8	-176.1	0	0	0	0	0	112.9	E142 G191 L192	G102-E142 WeakPolarHBondContact CA-OE1 3.14Å; G102-E142 PolarHBondContact N-OE1 3.25Å; G102-G191 CarbonylContact O-C 3.51Å; G102-G191 WeakPolarHBondContact O-CA 3.24Å; G102-L192 WeakPolarHBondContact O-CB 3.2Å; G102-L192 WeakPolarHBondContact O-CG 3.44Å; G102-L192 PolarHBondContact O-N 2.59Å
103	A	93.1	Very high	95.4	Very high	2 Å²	2	38.1 Å²	38.1	2%	0.017	21%	0.212	C	C	.	.			trans	-106	179.2	179.4	0	0	0	0	0	112.6	R105 L140 E142 A145 Y190	A103-R105 WeakPolarHBondContact O-CD 3.34Å; A103-R105 PolarHBondContact O-NE 2.62Å; A103-L140 HydrophobicContact CB-CB 4.46Å; A103-L140 WeakPolarHBondContact CB-O 3.44Å; A103-E142 HydrophobicContact CB-CG 4.39Å; A103-A145 HydrophobicContact CB-CB 3.46Å; A103-A145 VanDerWaalsContact CB-CB 3.46Å; A103-Y190 WeakPolarHBondContact O-CD1 3.41Å
104	L	96.3	Very high	95.4	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.239	C	C	.	.			trans	-53.6	153.2	173.5	74	164.2	0	0	0	112.9	I93 L106 L140 A145 I151 D188 T193 V196	I93-L104 HydrophobicContact CD1-CD2 4.09Å; L104-L106 HydrophobicContact CD1-CD1 4.43Å; L104-L106 HydrophobicContact CD1-CD2 3.81Å; L104-L106 HydrophobicContact CD1-CG 4.22Å; L104-L106 HydrophobicContact CG-CD2 4.45Å; L104-L106 HydrophobicContact CG-CG 4.42Å; L104-L140 HydrophobicContact CD2-CB 4.12Å; L104-L140 HydrophobicContact CD2-CD2 3.57Å; L104-L140 HydrophobicContact CG-CB 4.46Å; L104-L140 HydrophobicContact CG-CD2 4.43Å; L104-L140 WeakPolarHBondContact O-CB 3.38Å; L104-L140 PolarHBondContact O-N 3.23Å; L104-A145 HydrophobicContact CD2-CB 4.47Å; L104-I151 HydrophobicContact CD1-CD1 3.96Å; L104-I151 HydrophobicContact CD2-CD1 4.01Å; L104-D188 VanDerWaalsContact CA-O 3.27Å; L104-D188 WeakPolarHBondContact CA-O 3.36Å; L104-D188 WeakPolarHBondContact CB-O 3.36Å; L104-T193 HydrophobicContact CB-CG2 4.2Å; L104-T193 HydrophobicContact CD2-CG2 4.41Å; L104-T193 WeakPolarHBondContact CD2-OG1 3.32Å; L104-T193 PolarHBondContact N-OG1 2.99Å; L104-V196 HydrophobicContact CD1-CG1 4.28Å
105	R	98.3	Very high	95.3	Very high	22 Å²	22	50.1 Å²	50.1	8%	0.083	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	138.9	176.9	-55.3	70.1	-174.8	-115.7	-4.4	108.2	A103 A125 K138 A139 V187 D188 Y190	A103-R105 WeakPolarHBondContact O-CD 3.34Å; A103-R105 PolarHBondContact O-NE 2.62Å; R105-A125 HydrophobicContact CB-CB 4.46Å; R105-K138 VanDerWaalsContact CA-O 3.32Å; R105-K138 WeakPolarHBondContact CA-O 3.27Å; R105-A139 HydrophobicContact CG-CB 4.12Å; R105-V187 WeakPolarHBondContact O-CA 3.49Å; R105-D188 HydrophobicContact CB-CB 4.02Å; R105-D188 IonicContact CZ-OD2 3.99Å; R105-D188 PolarHBondContact N-O 3.09Å; R105-D188 VanDerWaalsContact N-O 3.08Å; R105-D188 IonicContact NH1-OD2 2.73Å; R105-D188 PolarHBondContact NH1-OD2 3.14Å; R105-D188 PolarHBondContact O-N 3.45Å; R105-Y190 VanDerWaalsContact NH2-CE2 3.35Å
106	L	98.6	Very high	95.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	146.4	-174.4	-59.6	172.3	0	0	0	109.8	L91 L104 A137 K138 I151 F153 F173 V187	L91-L106 HydrophobicContact CD1-CD2 3.57Å; L104-L106 HydrophobicContact CD1-CD1 4.43Å; L104-L106 HydrophobicContact CD1-CD2 3.81Å; L104-L106 HydrophobicContact CD1-CG 4.22Å; L104-L106 HydrophobicContact CG-CD2 4.45Å; L104-L106 HydrophobicContact CG-CG 4.42Å; L106-A137 WeakPolarHBondContact O-CA 3.4Å; L106-K138 PolarHBondContact N-O 2.75Å; L106-K138 PolarHBondContact O-N 3.17Å; L106-I151 HydrophobicContact CD1-CG2 3.57Å; L106-F153 HydrophobicContact CB-CD1 4.49Å; L106-F153 HydrophobicContact CB-CE1 4.48Å; L106-F153 HydrophobicContact CB-CZ 4.47Å; L106-F153 HydrophobicContact CD1-CD1 4.04Å; L106-F153 HydrophobicContact CD1-CE1 4.4Å; L106-F153 HydrophobicContact CD2-CD1 4.36Å; L106-F153 HydrophobicContact CD2-CE1 3.89Å; L106-F153 HydrophobicContact CD2-CZ 4.27Å; L106-F153 HydrophobicContact CG-CE1 4.49Å; L106-F173 HydrophobicContact CB-CE1 4.05Å; L106-V187 HydrophobicContact CD2-CB 4.42Å; L106-V187 HydrophobicContact CD2-CG1 4.03Å; L106-V187 HydrophobicContact CD2-CG2 4.04Å
107	G	98.4	Very high	95.2	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.9	-145.5	171.3	0	0	0	0	0	112.7	W136 F153 L186	G107-W136 CarbonylContact C-O 3.59Å; G107-W136 VanDerWaalsContact CA-O 3.23Å; G107-W136 WeakPolarHBondContact CA-O 3.3Å; G107-F153 WeakPolarHBondContact O-CE2 3.42Å; G107-L186 PolarHBondContact N-O 2.81Å; G107-L186 PolarHBondContact O-N 3.13Å
108	F	98.8	Very high	95.2	Very high	1 Å²	1	50.7 Å²	50.7	0%	0.004	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	158.6	-172	-57.4	-81	0	0	0	111.7	V83 V89 W136 F153 V155 V161 V177 L183 W184	V83-F108 HydrophobicContact CG2-CD1 3.88Å; V83-F108 HydrophobicContact CG2-CE1 3.77Å; V89-F108 HydrophobicContact CG2-CE1 4.48Å; F108-W136 PolarHBondContact N-O 3Å; F108-W136 PolarHBondContact O-N 3.36Å; F108-W136 VanDerWaalsContact O-O 3.1Å; F108-F153 HydrophobicContact CE1-CD2 4.2Å; F108-F153 AromaticContact CE1-CE2 3.84Å; F108-F153 HydrophobicContact CE1-CE2 3.84Å; F108-F153 AromaticContact CE2-CD2 3.95Å; F108-F153 HydrophobicContact CE2-CD2 3.95Å; F108-F153 HydrophobicContact CE2-CE2 4.17Å; F108-F153 AromaticContact CZ-CD2 3.51Å; F108-F153 HydrophobicContact CZ-CD2 3.51Å; F108-F153 AromaticContact CZ-CE2 3.61Å; F108-F153 HydrophobicContact CZ-CE2 3.61Å; F108-V155 HydrophobicContact CD2-CB 4.33Å; F108-V155 HydrophobicContact CE2-CB 3.9Å; F108-V155 HydrophobicContact CE2-CG1 4.42Å; F108-V155 HydrophobicContact CZ-CB 4.2Å; F108-V155 HydrophobicContact CZ-CG1 4.35Å; F108-V161 HydrophobicContact CD2-CG2 3.88Å; F108-V161 HydrophobicContact CE2-CB 4.37Å; F108-V161 HydrophobicContact CE2-CG1 3.79Å; F108-V161 HydrophobicContact CE2-CG2 3.67Å; F108-V177 HydrophobicContact CB-CG1 4.4Å; F108-V177 HydrophobicContact CD2-CG2 4.38Å; F108-L183 HydrophobicContact CB-CB 4.49Å; F108-L183 HydrophobicContact CB-CD2 4.36Å; F108-W184 CarbonylContact C-O 3.42Å; F108-W184 WeakPolarHBondContact CA-O 3.16Å
109	T	98.6	Very high	95.5	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	147.4	166.9	-177.8	0	0	0	0	110.7	F78 K111 G134 F135 L183 W184	F78-T109 HydrophobicContact CD1-CG2 3.75Å; F78-T109 HydrophobicContact CE1-CG2 3.89Å; T109-K111 WeakPolarHBondContact CG2-O 3.14Å; T109-K111 WeakPolarHBondContact OG1-CB 3.43Å; T109-K111 PolarHBondContact OG1-N 2.96Å; T109-G134 CarbonylContact C-O 3.6Å; T109-G134 WeakPolarHBondContact CA-O 3.02Å; T109-G134 WeakPolarHBondContact CB-O 3.48Å; T109-G134 PolarHBondContact OG1-O 2.87Å; T109-F135 HydrophobicContact CG2-CD1 4.5Å; T109-F135 HydrophobicContact CG2-CE1 4.35Å; T109-F135 VanDerWaalsContact OG1-CD1 3.23Å; T109-F135 WeakPolarHBondContact OG1-CD1 3.34Å; T109-F135 WeakPolarHBondContact OG1-CE1 3.37Å; T109-L183 CarbonylContact O-C 3.57Å; T109-L183 VanDerWaalsContact O-CA 3.31Å; T109-L183 WeakPolarHBondContact O-CA 3.33Å; T109-W184 HydrophobicContact CG2-CB 3.95Å; T109-W184 PolarHBondContact N-O 3.13Å; T109-W184 PolarHBondContact O-N 3Å
110	S	98.3	Very high	95.7	Very high	28 Å²	28	51.6 Å²	51.6	20%	0.196	27%	0.271	C	S	.	.	S	Bend	trans	-94.8	3.7	168.2	66.6	0	0	0	0	112.8	G134 P182	S110-G134 PolarHBondContact N-O 2.81Å; S110-G134 WeakPolarHBondContact OG-CA 3.11Å; S110-P182 WeakPolarHBondContact CA-O 3.16Å
111	K	97.9	Very high	96	Very high	87 Å²	87	48.3 Å²	48.3	38%	0.378	26%	0.261	S	S	.	.	S	Bend	trans	-89.1	125	173.7	-56.9	-63	-176.5	175.6	0	108.6	T109 P113 I116 S133 F135	T109-K111 WeakPolarHBondContact CG2-O 3.14Å; T109-K111 WeakPolarHBondContact OG1-CB 3.43Å; T109-K111 PolarHBondContact OG1-N 2.96Å; K111-P113 VanDerWaalsContact O-CD 3.24Å; K111-P113 WeakPolarHBondContact O-CD 3.07Å; K111-I116 HydrophobicContact CB-CD1 3.91Å; K111-I116 HydrophobicContact CB-CG1 4.38Å; K111-S133 WeakPolarHBondContact CE-O 3.15Å; K111-F135 HydrophobicContact CB-CE1 4.44Å; K111-F135 HydrophobicContact CB-CZ 3.97Å; K111-F135 HydrophobicContact CG-CD2 4.47Å; K111-F135 HydrophobicContact CG-CE1 4.38Å; K111-F135 HydrophobicContact CG-CE2 3.7Å; K111-F135 HydrophobicContact CG-CZ 3.65Å
112	D	97.9	Very high	96.3	Very high	40 Å²	40	45.3 Å²	45.3	21%	0.214	24%	0.239	C	C	.	.			trans	-61.6	116.5	174	179.5	-5.7	0	0	0	109.8	S114 R115 W184	D112-S114 PolarHBondContact O-N 2.93Å; D112-S114 VanDerWaalsContact O-N 3.12Å; D112-S114 VanDerWaalsContact OD1-CB 3.24Å; D112-S114 WeakPolarHBondContact OD1-CB 3.25Å; D112-S114 PolarHBondContact OD1-N 3.12Å; D112-S114 PolarHBondContact OD1-OG 3.12Å; D112-R115 HydrophobicContact CB-CG 4.12Å; D112-R115 PolarHBondContact O-N 2.83Å; D112-R115 IonicContact OD2-NE 2.76Å; D112-W184 HydrophobicContact CB-CH2 3.76Å; D112-W184 HydrophobicContact CB-CZ2 3.86Å; D112-W184 HydrophobicContact CB-CZ3 4.36Å
113	P	97.9	Very high	96.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-56.2	-29.6	179.8	-25.7	35.6	0	0	0	113	H49 T52 F78 K111 R115 I116 W184	H49-P113 HydrophobicContact CB-CB 4.36Å; T52-P113 WeakPolarHBondContact CB-O 3.4Å; T52-P113 HydrophobicContact CG2-CB 4.44Å; T52-P113 PolarHBondContact OG1-O 3.38Å; F78-P113 HydrophobicContact CB-CB 3.89Å; F78-P113 HydrophobicContact CB-CG 3.49Å; F78-P113 VanDerWaalsContact CB-CG 3.49Å; F78-P113 HydrophobicContact CD1-CG 4.33Å; F78-P113 HydrophobicContact CD2-CB 4.22Å; F78-P113 HydrophobicContact CD2-CG 4.47Å; F78-P113 HydrophobicContact CG-CB 4.1Å; F78-P113 HydrophobicContact CG-CG 3.86Å; K111-P113 VanDerWaalsContact O-CD 3.24Å; K111-P113 WeakPolarHBondContact O-CD 3.07Å; P113-R115 PolarHBondContact O-N 3.18Å; P113-R115 VanDerWaalsContact O-N 3.13Å; P113-I116 PolarHBondContact O-N 3.11Å; P113-I116 VanDerWaalsContact O-N 3.13Å; P113-W184 VanDerWaalsContact CD-CG 3.47Å; P113-W184 HydrophobicContact CG-CB 4.07Å; P113-W184 HydrophobicContact CG-CD2 4.39Å; P113-W184 HydrophobicContact CG-CG 3.78Å
114	S	97.5	Very high	96.6	Very high	81 Å²	81	53 Å²	53	57%	0.566	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-63.2	-18.7	178.1	-39	0	0	0	0	113	D112	D112-S114 PolarHBondContact O-N 2.93Å; D112-S114 VanDerWaalsContact O-N 3.12Å; D112-S114 VanDerWaalsContact OD1-CB 3.24Å; D112-S114 WeakPolarHBondContact OD1-CB 3.25Å; D112-S114 PolarHBondContact OD1-N 3.12Å; D112-S114 PolarHBondContact OD1-OG 3.12Å
115	R	96.4	Very high	96.5	Very high	215 Å²	215	53 Å²	53	81%	0.811	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-104.3	-3.7	-179.3	-56.7	-177	-176.6	-152.6	-4.2	113.3	D112 P113	D112-R115 HydrophobicContact CB-CG 4.12Å; D112-R115 PolarHBondContact O-N 2.83Å; D112-R115 IonicContact OD2-NE 2.76Å; P113-R115 PolarHBondContact O-N 3.18Å; P113-R115 VanDerWaalsContact O-N 3.13Å
116	I	95.9	Very high	96.3	Very high	27 Å²	27	53.8 Å²	53.8	14%	0.138	27%	0.274	C	S	.	.	S	Bend	trans	-92.7	127.3	177.7	-59	172.6	0	0	0	108.1	T52 F78 K111 P113 L121 F135	T52-I116 HydrophobicContact CG2-CB 3.76Å; T52-I116 HydrophobicContact CG2-CG2 3.89Å; T52-I116 PolarHBondContact OG1-O 3.46Å; F78-I116 HydrophobicContact CZ-CD1 4.44Å; K111-I116 HydrophobicContact CB-CD1 3.91Å; K111-I116 HydrophobicContact CB-CG1 4.38Å; P113-I116 PolarHBondContact O-N 3.11Å; P113-I116 VanDerWaalsContact O-N 3.13Å; I116-L121 HydrophobicContact CG2-CD2 3.87Å; I116-F135 HydrophobicContact CD1-CE1 4.21Å; I116-F135 HydrophobicContact CD1-CZ 4.01Å
117	H	94.4	Very high	96.1	Very high	117 Å²	117	58 Å²	58	54%	0.542	30%	0.301	S	S	.	.			trans	-72.3	128.4	175.1	-163.8	-95.9	0	0	0	109.9	D119 S120	H117-D119 IonicContact CE1-OD2 3.28Å; H117-D119 PolarHBondContact CE1-OD2 3.03Å; H117-D119 PolarHBondContact ND1-N 2.88Å; H117-D119 IonicContact ND1-OD2 3Å; H117-D119 PolarHBondContact O-N 3.38Å; H117-S120 WeakPolarHBondContact O-CB 3.5Å; H117-S120 PolarHBondContact O-N 2.91Å; H117-S120 PolarHBondContact O-OG 3.24Å
118	P	92.9	Very high	95.9	Very high	48 Å²	48	60.4 Å²	60.4	31%	0.312	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-54.3	-39.6	-178.5	-26.2	34	0	0	0	113.4	S120 L121	P118-S120 PolarHBondContact O-N 2.75Å; P118-L121 WeakPolarHBondContact O-CB 3.47Å; P118-L121 WeakPolarHBondContact O-CG 3.41Å; P118-L121 PolarHBondContact O-N 2.93Å; P118-L121 VanDerWaalsContact O-N 3.12Å
119	D	92.7	Very high	95.7	Very high	141 Å²	141	60.5 Å²	60.5	75%	0.754	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-72.4	-11.9	-179.7	-57.7	-32.7	0	0	0	114	H117 L121	H117-D119 IonicContact CE1-OD2 3.28Å; H117-D119 PolarHBondContact CE1-OD2 3.03Å; H117-D119 PolarHBondContact ND1-N 2.88Å; H117-D119 IonicContact ND1-OD2 3Å; H117-D119 PolarHBondContact O-N 3.38Å; D119-L121 VanDerWaalsContact C-N 3.31Å
120	S	93.9	Very high	95.6	Very high	74 Å²	74	63.1 Å²	63.1	52%	0.517	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-84.1	-7.5	172.8	71.3	0	0	0	0	113.2	H117 P118	H117-S120 WeakPolarHBondContact O-CB 3.5Å; H117-S120 PolarHBondContact O-N 2.91Å; H117-S120 PolarHBondContact O-OG 3.24Å; P118-S120 PolarHBondContact O-N 2.75Å
121	L	96.8	Very high	95.4	Very high	23 Å²	23	66.4 Å²	66.4	12%	0.12	35%	0.354	C	S	.	.			trans	-68.3	129.1	178.5	-66.6	177.4	0	0	0	110.1	T52 K53 F78 I116 P118 D119	T52-L121 HydrophobicContact CG2-CD1 4.2Å; T52-L121 HydrophobicContact CG2-CD2 4.45Å; K53-L121 VanDerWaalsContact C-CD1 3.45Å; F78-L121 HydrophobicContact CE2-CD1 4.31Å; F78-L121 HydrophobicContact CE2-CD2 3.8Å; F78-L121 HydrophobicContact CZ-CD2 3.97Å; I116-L121 HydrophobicContact CG2-CD2 3.87Å; P118-L121 WeakPolarHBondContact O-CB 3.47Å; P118-L121 WeakPolarHBondContact O-CG 3.41Å; P118-L121 PolarHBondContact O-N 2.93Å; P118-L121 VanDerWaalsContact O-N 3.12Å; D119-L121 VanDerWaalsContact C-N 3.31Å
122	P	96.4	Very high	95.3	Very high	29 Å²	29	66.6 Å²	66.6	19%	0.188	36%	0.356	C	S	.	.			trans	-75.9	177.7	177.9	34.6	-37.3	0	0	0	111.3	I76 Y124 D128 L129	I76-P122 HydrophobicContact CD1-CG 4.29Å; I76-P122 WeakPolarHBondContact CD1-O 3.22Å; P122-Y124 VanDerWaalsContact C-N 3.34Å; P122-Y124 PolarHBondContact O-N 2.95Å; P122-D128 HydrophobicContact CB-CB 3.45Å; P122-D128 VanDerWaalsContact CB-CB 3.45Å; P122-D128 HydrophobicContact CG-CB 3.62Å; P122-L129 HydrophobicContact CG-CD2 3.73Å; P122-L129 HydrophobicContact CG-CG 3.64Å
123	K	94.6	Very high	95.2	Very high	121 Å²	121	69.1 Å²	69.1	53%	0.526	38%	0.377	S	S	.	.	S	Bend	trans	-68.5	-33.2	-178.3	-65.9	-176.8	179.5	174.2	0	112.8	N74	N74-K123 PolarHBondContact N-O 2.99Å; N74-K123 WeakPolarHBondContact OD1-CA 3.18Å; N74-K123 WeakPolarHBondContact OD1-CG 3.32Å
124	Y	95.6	Very high	95.2	Very high	59 Å²	59	69.7 Å²	69.7	23%	0.231	38%	0.383	C	S	.	.			trans	-133	145.8	-172.5	-47.4	-71.1	0	0	0	111.9	F72 C73 P122 C126 D128 L129 Y190	F72-Y124 AromaticContact CE2-CE1 3.92Å; F72-Y124 HydrophobicContact CE2-CE1 3.92Å; C73-Y124 HydrophobicContact CB-CD1 3.7Å; C73-Y124 HydrophobicContact CB-CE1 3.28Å; P122-Y124 VanDerWaalsContact C-N 3.34Å; P122-Y124 PolarHBondContact O-N 2.95Å; Y124-C126 WeakPolarHBondContact CB-O 3.25Å; Y124-D128 WeakPolarHBondContact CD2-OD2 3.4Å; Y124-D128 PolarHBondContact N-OD2 3.39Å; Y124-D128 WeakPolarHBondContact O-CB 3.33Å; Y124-L129 PolarHBondContact O-N 3.21Å; Y124-Y190 HydrophobicContact CD1-CD2 4.22Å; Y124-Y190 AromaticContact CD1-CE2 3.83Å; Y124-Y190 HydrophobicContact CD1-CE2 3.83Å; Y124-Y190 HydrophobicContact CE1-CD2 4.49Å; Y124-Y190 AromaticContact CE1-CE2 3.8Å; Y124-Y190 HydrophobicContact CE1-CE2 3.8Å
125	A	95.5	Very high	95.2	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	36%	0.358	C	S	.	.	I	π-helix	trans	-69	-43	168.6	0	0	0	0	0	111.5	I76 R105 L129 V130 A137 L186 D188	I76-A125 HydrophobicContact CG1-CB 4.45Å; R105-A125 HydrophobicContact CB-CB 4.46Å; A125-L129 WeakPolarHBondContact O-CB 3.44Å; A125-L129 PolarHBondContact O-N 3.47Å; A125-V130 WeakPolarHBondContact O-CG2 3.24Å; A125-V130 PolarHBondContact O-N 2.72Å; A125-A137 HydrophobicContact CB-CB 4.33Å; A125-L186 HydrophobicContact CB-CD2 3.93Å; A125-D188 HydrophobicContact CB-CB 3.72Å; A125-D188 PolarHBondContact N-OD2 2.9Å; A125-D188 VanDerWaalsContact N-OD2 3.11Å
126	C	92.8	Very high	95.3	Very high	38 Å²	38	58.6 Å²	58.6	26%	0.257	33%	0.329	S	S	.	.	I	π-helix	trans	-111.7	124.9	175.4	-57.9	0	0	0	0	109.3	Y124 A137	Y124-C126 WeakPolarHBondContact CB-O 3.25Å; C126-A137 PolarHBondContact SG-O 3.39Å
127	P	94.1	Very high	95.4	Very high	88 Å²	88	58 Å²	58	57%	0.571	33%	0.327	S	S	*	.	I	π-helix	cis	-87.3	-12.2	-0.7	35	-34.2	0	0	0	114.4	L129 V130 S131	P127-L129 PolarHBondContact O-N 3Å; P127-V130 PolarHBondContact O-N 2.92Å; P127-S131 WeakPolarHBondContact O-CB 3.36Å; P127-S131 PolarHBondContact O-N 3.08Å; P127-S131 PolarHBondContact O-OG 2.92Å
128	D	95.5	Very high	95.6	Very high	51 Å²	51	57 Å²	57	27%	0.273	32%	0.322	S	S	.	.	I	π-helix	trans	-65	-40.7	-159.5	-42.8	-24.8	0	0	0	115.3	P122 Y124 S131 Q132	P122-D128 HydrophobicContact CB-CB 3.45Å; P122-D128 VanDerWaalsContact CB-CB 3.45Å; P122-D128 HydrophobicContact CG-CB 3.62Å; Y124-D128 WeakPolarHBondContact CD2-OD2 3.4Å; Y124-D128 PolarHBondContact N-OD2 3.39Å; Y124-D128 WeakPolarHBondContact O-CB 3.33Å; D128-S131 PolarHBondContact O-OG 2.73Å; D128-Q132 PolarHBondContact O-NE2 2.94Å; D128-Q132 VanDerWaalsContact O-NE2 3.11Å
129	L	93.4	Very high	95.8	Very high	4 Å²	4	57 Å²	57	2%	0.021	33%	0.325	C	S	.	.	I	π-helix	trans	-79	-43	174	-78.6	-177.3	0	0	0	111.5	I76 F78 P122 Y124 A125 P127 S131 Q132 F135 L186	I76-L129 HydrophobicContact CD1-CD1 3.75Å; I76-L129 HydrophobicContact CD1-CG 4.21Å; I76-L129 HydrophobicContact CG1-CD1 4.39Å; I76-L129 HydrophobicContact CG2-CD1 3.84Å; F78-L129 HydrophobicContact CZ-CD1 4.27Å; P122-L129 HydrophobicContact CG-CD2 3.73Å; P122-L129 HydrophobicContact CG-CG 3.64Å; Y124-L129 PolarHBondContact O-N 3.21Å; A125-L129 WeakPolarHBondContact O-CB 3.44Å; A125-L129 PolarHBondContact O-N 3.47Å; P127-L129 PolarHBondContact O-N 3Å; L129-S131 PolarHBondContact O-N 2.93Å; L129-Q132 WeakPolarHBondContact O-CA 3.36Å; L129-Q132 VanDerWaalsContact O-CB 3.3Å; L129-Q132 WeakPolarHBondContact O-CB 3.35Å; L129-Q132 PolarHBondContact O-N 3.27Å; L129-F135 HydrophobicContact CB-CB 4.27Å; L129-F135 HydrophobicContact CB-CD1 4.31Å; L129-F135 HydrophobicContact CB-CG 4.24Å; L129-F135 HydrophobicContact CD1-CD1 4.24Å; L129-F135 HydrophobicContact CD1-CE1 4.4Å; L129-F135 HydrophobicContact CD2-CD1 4.24Å; L129-F135 HydrophobicContact CD2-CE1 4.09Å; L129-F135 HydrophobicContact CD2-CE2 4.41Å; L129-F135 HydrophobicContact CD2-CG 4.49Å; L129-F135 HydrophobicContact CD2-CZ 4.17Å; L129-F135 VanDerWaalsContact O-CB 3.28Å; L129-F135 WeakPolarHBondContact O-CB 3.44Å; L129-L186 HydrophobicContact CD1-CD1 4.03Å
130	V	96.1	Very high	96	Very high	55 Å²	55	50.4 Å²	50.4	33%	0.333	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-23.8	-176.5	175.3	0	0	0	0	112.6	A125 P127 Q132 A137	A125-V130 WeakPolarHBondContact O-CG2 3.24Å; A125-V130 PolarHBondContact O-N 2.72Å; P127-V130 PolarHBondContact O-N 2.92Å; V130-Q132 PolarHBondContact O-N 2.68Å; V130-A137 HydrophobicContact CG2-CB 3.79Å; V130-A137 VanDerWaalsContact CG2-N 3.35Å
131	S	95.8	Very high	96.1	Very high	97 Å²	97	49.1 Å²	49.1	68%	0.678	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-16.4	171.7	67.9	0	0	0	0	113.4	P127 D128 L129	P127-S131 WeakPolarHBondContact O-CB 3.36Å; P127-S131 PolarHBondContact O-N 3.08Å; P127-S131 PolarHBondContact O-OG 2.92Å; D128-S131 PolarHBondContact O-OG 2.73Å; L129-S131 PolarHBondContact O-N 2.93Å
132	Q	95.6	Very high	96.1	Very high	91 Å²	91	52.2 Å²	52.2	43%	0.425	29%	0.294	S	S	.	.	S	Bend	trans	-91.4	149.6	178.1	-55.7	176	38	0	0	111.1	D128 L129 V130 G134 F135	D128-Q132 PolarHBondContact O-NE2 2.94Å; D128-Q132 VanDerWaalsContact O-NE2 3.11Å; L129-Q132 WeakPolarHBondContact O-CA 3.36Å; L129-Q132 VanDerWaalsContact O-CB 3.3Å; L129-Q132 WeakPolarHBondContact O-CB 3.35Å; L129-Q132 PolarHBondContact O-N 3.27Å; V130-Q132 PolarHBondContact O-N 2.68Å; Q132-G134 PolarHBondContact O-N 2.8Å; Q132-F135 HydrophobicContact CB-CD2 3.86Å; Q132-F135 HydrophobicContact CB-CE2 4.23Å
133	S	95.5	Very high	96	Very high	93 Å²	93	56.6 Å²	56.6	65%	0.65	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	135.1	178	65.8	0	0	0	0	112.1	K111	K111-S133 WeakPolarHBondContact CE-O 3.15Å
134	G	97.1	Very high	96.1	Very high	12 Å²	12	54 Å²	54	12%	0.124	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.3	15.9	176.4	0	0	0	0	0	114.8	T109 S110 Q132 W136	T109-G134 CarbonylContact C-O 3.6Å; T109-G134 WeakPolarHBondContact CA-O 3.02Å; T109-G134 WeakPolarHBondContact CB-O 3.48Å; T109-G134 PolarHBondContact OG1-O 2.87Å; S110-G134 PolarHBondContact N-O 2.81Å; S110-G134 WeakPolarHBondContact OG-CA 3.11Å; Q132-G134 PolarHBondContact O-N 2.8Å; G134-W136 WeakPolarHBondContact O-CZ3 3.47Å
135	F	98.3	Very high	96.1	Very high	12 Å²	12	51.1 Å²	51.1	5%	0.053	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	136.2	174	-63.3	-87.2	0	0	0	110.5	F78 T109 K111 I116 L129 Q132 L186	F78-F135 HydrophobicContact CE1-CE1 4.16Å; F78-F135 HydrophobicContact CZ-CE1 4.38Å; T109-F135 HydrophobicContact CG2-CD1 4.5Å; T109-F135 HydrophobicContact CG2-CE1 4.35Å; T109-F135 VanDerWaalsContact OG1-CD1 3.23Å; T109-F135 WeakPolarHBondContact OG1-CD1 3.34Å; T109-F135 WeakPolarHBondContact OG1-CE1 3.37Å; K111-F135 HydrophobicContact CB-CE1 4.44Å; K111-F135 HydrophobicContact CB-CZ 3.97Å; K111-F135 HydrophobicContact CG-CD2 4.47Å; K111-F135 HydrophobicContact CG-CE1 4.38Å; K111-F135 HydrophobicContact CG-CE2 3.7Å; K111-F135 HydrophobicContact CG-CZ 3.65Å; I116-F135 HydrophobicContact CD1-CE1 4.21Å; I116-F135 HydrophobicContact CD1-CZ 4.01Å; L129-F135 HydrophobicContact CB-CB 4.27Å; L129-F135 HydrophobicContact CB-CD1 4.31Å; L129-F135 HydrophobicContact CB-CG 4.24Å; L129-F135 HydrophobicContact CD1-CD1 4.24Å; L129-F135 HydrophobicContact CD1-CE1 4.4Å; L129-F135 HydrophobicContact CD2-CD1 4.24Å; L129-F135 HydrophobicContact CD2-CE1 4.09Å; L129-F135 HydrophobicContact CD2-CE2 4.41Å; L129-F135 HydrophobicContact CD2-CG 4.49Å; L129-F135 HydrophobicContact CD2-CZ 4.17Å; L129-F135 VanDerWaalsContact O-CB 3.28Å; L129-F135 WeakPolarHBondContact O-CB 3.44Å; Q132-F135 HydrophobicContact CB-CD2 3.86Å; Q132-F135 HydrophobicContact CB-CE2 4.23Å; F135-L186 HydrophobicContact CD1-CD1 3.94Å
136	W	98.6	Very high	96.1	Very high	51 Å²	51	54 Å²	54	19%	0.193	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	124.1	176.6	-55.7	-93.6	0	0	0	108.8	G107 F108 G134 F174 G176 V177 R178 L183	G107-W136 CarbonylContact C-O 3.59Å; G107-W136 VanDerWaalsContact CA-O 3.23Å; G107-W136 WeakPolarHBondContact CA-O 3.3Å; F108-W136 PolarHBondContact N-O 3Å; F108-W136 PolarHBondContact O-N 3.36Å; F108-W136 VanDerWaalsContact O-O 3.1Å; G134-W136 WeakPolarHBondContact O-CZ3 3.47Å; W136-F174 HydrophobicContact CB-CE2 3.79Å; W136-F174 HydrophobicContact CB-CZ 4.34Å; W136-G176 PolarHBondContact NE1-O 3.16Å; W136-V177 HydrophobicContact CB-CG2 3.93Å; W136-V177 HydrophobicContact CD2-CB 4.45Å; W136-V177 HydrophobicContact CD2-CG1 4.32Å; W136-V177 HydrophobicContact CD2-CG2 4.3Å; W136-V177 HydrophobicContact CE3-CG1 4.09Å; W136-V177 HydrophobicContact CG-CG2 3.96Å; W136-V177 HydrophobicContact CZ3-CG1 4.4Å; W136-R178 HydrophobicContact CH2-CB 3.84Å; W136-R178 HydrophobicContact CZ2-CB 3.83Å; W136-L183 HydrophobicContact CZ3-CD2 4.16Å
137	A	98.4	Very high	96.3	Very high	13 Å²	13	56.6 Å²	56.6	11%	0.107	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	154.7	177.7	0	0	0	0	0	110.5	L106 A125 C126 V130 L186	L106-A137 WeakPolarHBondContact O-CA 3.4Å; A125-A137 HydrophobicContact CB-CB 4.33Å; C126-A137 PolarHBondContact SG-O 3.39Å; V130-A137 HydrophobicContact CG2-CB 3.79Å; V130-A137 VanDerWaalsContact CG2-N 3.35Å; A137-L186 HydrophobicContact CB-CD2 4.02Å
138	K	98	Very high	96.5	Very high	97 Å²	97	54.2 Å²	54.2	42%	0.422	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	146.7	174.3	-175.7	172.3	173.2	-179.7	0	109.9	R105 L106 F173 F174	R105-K138 VanDerWaalsContact CA-O 3.32Å; R105-K138 WeakPolarHBondContact CA-O 3.27Å; L106-K138 PolarHBondContact N-O 2.75Å; L106-K138 PolarHBondContact O-N 3.17Å; K138-F173 HydrophobicContact CB-CD1 4.5Å; K138-F173 HydrophobicContact CB-CE1 3.89Å; K138-F173 HydrophobicContact CB-CE2 4.22Å; K138-F173 HydrophobicContact CB-CZ 3.74Å; K138-F173 HydrophobicContact CD-CD2 4.15Å; K138-F173 HydrophobicContact CD-CE2 4Å; K138-F173 HydrophobicContact CD-CZ 4.37Å; K138-F173 WeakPolarHBondContact CD-O 3.39Å; K138-F173 HydrophobicContact CG-CE2 3.98Å; K138-F173 HydrophobicContact CG-CZ 3.96Å; K138-F173 PolarHBondContact NZ-O 3.42Å; K138-F173 WeakPolarHBondContact O-CZ 3.43Å; K138-F174 HydrophobicContact CB-CD1 3.57Å; K138-F174 HydrophobicContact CB-CE1 3.95Å; K138-F174 HydrophobicContact CB-CG 4.33Å; K138-F174 HydrophobicContact CD-CB 4.02Å; K138-F174 HydrophobicContact CD-CD1 4.15Å
139	A	97.8	Very high	96.6	Very high	47 Å²	47	53.2 Å²	53.2	39%	0.388	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	133.8	173.3	0	0	0	0	0	110.9	R105	R105-A139 HydrophobicContact CG-CB 4.12Å
140	L	97	Very high	96.9	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.021	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-70.7	141.8	167.9	-167.8	71.7	0	0	0	108.8	A103 L104 F144 I151 I165 F173	A103-L140 HydrophobicContact CB-CB 4.46Å; A103-L140 WeakPolarHBondContact CB-O 3.44Å; L104-L140 HydrophobicContact CD2-CB 4.12Å; L104-L140 HydrophobicContact CD2-CD2 3.57Å; L104-L140 HydrophobicContact CG-CB 4.46Å; L104-L140 HydrophobicContact CG-CD2 4.43Å; L104-L140 WeakPolarHBondContact O-CB 3.38Å; L104-L140 PolarHBondContact O-N 3.23Å; L140-F144 HydrophobicContact CD1-CB 4.5Å; L140-F144 HydrophobicContact CD1-CD2 4.29Å; L140-F144 HydrophobicContact CD2-CB 3.76Å; L140-F144 HydrophobicContact CG-CB 4.04Å; L140-F144 HydrophobicContact CG-CD2 4.37Å; L140-I151 HydrophobicContact CD2-CD1 3.51Å; L140-I151 HydrophobicContact CD2-CG1 4.01Å; L140-I165 HydrophobicContact CD1-CD1 4.22Å; L140-I165 HydrophobicContact CD2-CD1 4.47Å; L140-F173 HydrophobicContact CD1-CE2 4.49Å
141	P	95.9	Very high	97	Very high	46 Å²	46	52.6 Å²	52.6	30%	0.299	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-56.4	139.9	168.4	-25.3	34.4	0	0	0	112	E143 F144	P141-E143 HydrophobicContact CB-CG 4.2Å; P141-E143 VanDerWaalsContact CB-OE1 3.25Å; P141-E143 WeakPolarHBondContact CB-OE1 3.49Å; P141-E143 WeakPolarHBondContact CB-OE2 3.44Å; P141-E143 PolarHBondContact O-N 2.88Å; P141-F144 HydrophobicContact CB-CD2 3.78Å; P141-F144 HydrophobicContact CB-CE2 3.91Å; P141-F144 HydrophobicContact CG-CD2 3.91Å; P141-F144 HydrophobicContact CG-CE2 3.85Å; P141-F144 PolarHBondContact O-N 2.95Å; P141-F144 VanDerWaalsContact O-N 3.14Å
142	E	95.8	Very high	97.1	Very high	88 Å²	88	48.2 Å²	48.2	41%	0.411	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-64	-29.6	-172.3	-67.2	-172.3	-171.4	0	0	113.2	G102 A103 F144 A145 L192	G102-E142 WeakPolarHBondContact CA-OE1 3.14Å; G102-E142 PolarHBondContact N-OE1 3.25Å; A103-E142 HydrophobicContact CB-CG 4.39Å; E142-F144 PolarHBondContact O-N 3.36Å; E142-F144 VanDerWaalsContact O-N 3.16Å; E142-A145 WeakPolarHBondContact O-CB 3.35Å; E142-A145 PolarHBondContact O-N 3.32Å; E142-L192 HydrophobicContact CB-CD1 3.9Å; E142-L192 HydrophobicContact CG-CD1 3.84Å
143	E	95.1	Very high	97.3	Very high	121 Å²	121	43.9 Å²	43.9	57%	0.565	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-60.5	-22.1	176.9	63.4	-91.7	-147.1	0	0	113.1	P141 N146	P141-E143 HydrophobicContact CB-CG 4.2Å; P141-E143 VanDerWaalsContact CB-OE1 3.25Å; P141-E143 WeakPolarHBondContact CB-OE1 3.49Å; P141-E143 WeakPolarHBondContact CB-OE2 3.44Å; P141-E143 PolarHBondContact O-N 2.88Å; E143-N146 PolarHBondContact O-ND2 2.61Å
144	F	95.9	Very high	97.4	Very high	66 Å²	66	40.7 Å²	40.7	29%	0.289	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-96.1	-2.4	177.6	-53.9	-43.7	0	0	0	113.1	L140 P141 E142 N146 N149 I165	L140-F144 HydrophobicContact CD1-CB 4.5Å; L140-F144 HydrophobicContact CD1-CD2 4.29Å; L140-F144 HydrophobicContact CD2-CB 3.76Å; L140-F144 HydrophobicContact CG-CB 4.04Å; L140-F144 HydrophobicContact CG-CD2 4.37Å; P141-F144 HydrophobicContact CB-CD2 3.78Å; P141-F144 HydrophobicContact CB-CE2 3.91Å; P141-F144 HydrophobicContact CG-CD2 3.91Å; P141-F144 HydrophobicContact CG-CE2 3.85Å; P141-F144 PolarHBondContact O-N 2.95Å; P141-F144 VanDerWaalsContact O-N 3.14Å; E142-F144 PolarHBondContact O-N 3.36Å; E142-F144 VanDerWaalsContact O-N 3.16Å; F144-N146 PolarHBondContact O-N 3.19Å; F144-N146 VanDerWaalsContact O-N 3.17Å; F144-N149 PolarHBondContact O-OD1 3.18Å; F144-I165 HydrophobicContact CB-CD1 3.88Å; F144-I165 HydrophobicContact CB-CG1 4.01Å; F144-I165 HydrophobicContact CB-CG2 4.46Å; F144-I165 HydrophobicContact CD1-CB 4.49Å; F144-I165 HydrophobicContact CD1-CG1 3.91Å; F144-I165 HydrophobicContact CD1-CG2 4.35Å; F144-I165 HydrophobicContact CD2-CD1 4.38Å; F144-I165 HydrophobicContact CD2-CG1 4.09Å; F144-I165 HydrophobicContact CE1-CG1 4.43Å; F144-I165 HydrophobicContact CG-CD1 4.09Å; F144-I165 HydrophobicContact CG-CG1 3.74Å
145	A	95.4	Very high	97.5	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.211	C	C	.	.			trans	-89.4	39.3	-175.3	0	0	0	0	0	113.4	I93 K96 A103 L104 E142	I93-A145 VanDerWaalsContact CD1-CA 3.49Å; I93-A145 HydrophobicContact CD1-CB 4.41Å; K96-A145 WeakPolarHBondContact CD-O 3.42Å; A103-A145 HydrophobicContact CB-CB 3.46Å; A103-A145 VanDerWaalsContact CB-CB 3.46Å; L104-A145 HydrophobicContact CD2-CB 4.47Å; E142-A145 WeakPolarHBondContact O-CB 3.35Å; E142-A145 PolarHBondContact O-N 3.32Å
146	N	96.4	Very high	97.5	Very high	60 Å²	60	39.8 Å²	39.8	32%	0.321	21%	0.21	S	C	.	.			trans	-95.4	145	-176.1	-68	-49.3	0	0	0	112.6	I93 K96 E143 F144 G148 N149	I93-N146 WeakPolarHBondContact CB-O 3.44Å; K96-N146 PolarHBondContact NZ-OD1 3.36Å; E143-N146 PolarHBondContact O-ND2 2.61Å; F144-N146 PolarHBondContact O-N 3.19Å; F144-N146 VanDerWaalsContact O-N 3.17Å; N146-G148 PolarHBondContact O-N 3Å; N146-N149 WeakPolarHBondContact O-CB 3.39Å; N146-N149 PolarHBondContact O-N 3.29Å; N146-N149 VanDerWaalsContact O-N 3.13Å
147	E	97.6	Very high	97.5	Very high	93 Å²	93	44.7 Å²	44.7	44%	0.435	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	136	174.6	-62.8	-168.2	174.4	0	0	110.1	K95 K96 N149	K95-E147 WeakPolarHBondContact CA-OE1 3.34Å; K95-E147 WeakPolarHBondContact CD-OE1 3.32Å; K95-E147 WeakPolarHBondContact CE-OE1 3.23Å; K95-E147 IonicContact NZ-OE1 2.93Å; K95-E147 PolarHBondContact NZ-OE1 3.13Å; K95-E147 IonicContact NZ-OE2 3.81Å; K96-E147 HydrophobicContact CB-CG 3.5Å; K96-E147 VanDerWaalsContact CB-CG 3.5Å; K96-E147 VanDerWaalsContact N-CG 3.32Å; K96-E147 PolarHBondContact N-OE1 3.14Å; E147-N149 VanDerWaalsContact C-N 3.31Å; E147-N149 PolarHBondContact O-N 2.78Å
148	G	97.9	Very high	97.5	Very high	37 Å²	37	52 Å²	52	38%	0.381	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.8	-18.7	-178.2	0	0	0	0	0	115.1	I93 N146	I93-G148 PolarHBondContact O-N 3.44Å; N146-G148 PolarHBondContact O-N 3Å
149	N	98.1	Very high	97.5	Very high	31 Å²	31	47.4 Å²	47.4	17%	0.166	24%	0.242	C	C	.	.			trans	-63.1	140.1	175.8	-79.9	-157	0	0	0	111	K92 I93 F144 N146 E147 I165	K92-N149 WeakPolarHBondContact CA-O 3.31Å; I93-N149 PolarHBondContact N-O 3.27Å; F144-N149 PolarHBondContact O-OD1 3.18Å; N146-N149 WeakPolarHBondContact O-CB 3.39Å; N146-N149 PolarHBondContact O-N 3.29Å; N146-N149 VanDerWaalsContact O-N 3.13Å; E147-N149 VanDerWaalsContact C-N 3.31Å; E147-N149 PolarHBondContact O-N 2.78Å; N149-I165 HydrophobicContact CB-CG2 4.46Å
150	I	98.5	Very high	97.5	Very high	45 Å²	45	49.8 Å²	49.8	23%	0.231	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.8	174.1	-60.4	174.9	0	0	0	107.7	L91 K92 I165 N166 L199	L91-I150 CarbonylContact O-C 3.21Å; L91-I150 WeakPolarHBondContact O-CA 3.47Å; K92-I150 HydrophobicContact CB-CG1 4.35Å; K92-I150 HydrophobicContact CG-CG1 4.32Å; I150-I165 CarbonylContact O-C 3.39Å; I150-I165 WeakPolarHBondContact O-CA 3.42Å; I150-N166 PolarHBondContact N-OD1 2.78Å; I150-N166 PolarHBondContact O-N 2.98Å; I150-L199 HydrophobicContact CB-CD1 4.48Å; I150-L199 HydrophobicContact CD1-CD1 3.83Å; I150-L199 HydrophobicContact CG1-CD1 4Å; I150-L199 HydrophobicContact CG2-CD1 3.69Å
151	I	98.3	Very high	97.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	123.5	175.4	-57.5	145.7	0	0	0	107.4	R90 L91 I93 L104 L106 L140 R164 I165	R90-I151 CarbonylContact C-O 3.53Å; R90-I151 WeakPolarHBondContact CA-O 3.33Å; L91-I151 PolarHBondContact N-O 3.49Å; L91-I151 PolarHBondContact O-N 2.97Å; I93-I151 HydrophobicContact CD1-CD1 3.85Å; I93-I151 HydrophobicContact CG1-CD1 4.01Å; L104-I151 HydrophobicContact CD1-CD1 3.96Å; L104-I151 HydrophobicContact CD2-CD1 4.01Å; L106-I151 HydrophobicContact CD1-CG2 3.57Å; L140-I151 HydrophobicContact CD2-CD1 3.51Å; L140-I151 HydrophobicContact CD2-CG1 4.01Å; I151-R164 WeakPolarHBondContact CA-O 3.43Å; I151-I165 HydrophobicContact CB-CD1 4.23Å; I151-I165 HydrophobicContact CG1-CD1 3.63Å; I151-I165 HydrophobicContact CG2-CD1 4.02Å
152	A	98.5	Very high	97.8	Very high	6 Å²	6	49.1 Å²	49.1	5%	0.05	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.4	167	0	0	0	0	0	108.6	V89 R90 W154 H163 R164	V89-A152 CarbonylContact O-C 3.51Å; V89-A152 WeakPolarHBondContact O-CA 3.39Å; R90-A152 HydrophobicContact CG-CB 4.05Å; A152-W154 HydrophobicContact CB-CZ3 4.25Å; A152-H163 CarbonylContact O-C 3.52Å; A152-H163 WeakPolarHBondContact O-CA 3.42Å; A152-R164 HydrophobicContact CB-CB 4.43Å; A152-R164 PolarHBondContact N-O 2.92Å; A152-R164 PolarHBondContact O-N 2.83Å
153	F	98.7	Very high	97.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	147.9	172.6	69.8	-78.4	0	0	0	111.2	V89 L91 L106 G107 F108 F162 H163 A185	V89-F153 HydrophobicContact CB-CD1 3.98Å; V89-F153 HydrophobicContact CB-CE1 3.54Å; V89-F153 HydrophobicContact CB-CE2 4.13Å; V89-F153 HydrophobicContact CB-CG 4.46Å; V89-F153 HydrophobicContact CB-CZ 3.64Å; V89-F153 HydrophobicContact CG1-CD1 4.27Å; V89-F153 HydrophobicContact CG1-CE1 3.39Å; V89-F153 HydrophobicContact CG1-CE2 4.44Å; V89-F153 HydrophobicContact CG1-CZ 3.52Å; V89-F153 HydrophobicContact CG2-CE2 4.31Å; V89-F153 HydrophobicContact CG2-CZ 4.16Å; V89-F153 PolarHBondContact N-O 3.08Å; V89-F153 WeakPolarHBondContact O-CD1 3.34Å; V89-F153 PolarHBondContact O-N 2.83Å; L91-F153 HydrophobicContact CD1-CE1 3.68Å; L91-F153 HydrophobicContact CG-CE1 4.43Å; L106-F153 HydrophobicContact CB-CD1 4.49Å; L106-F153 HydrophobicContact CB-CE1 4.48Å; L106-F153 HydrophobicContact CB-CZ 4.47Å; L106-F153 HydrophobicContact CD1-CD1 4.04Å; L106-F153 HydrophobicContact CD1-CE1 4.4Å; L106-F153 HydrophobicContact CD2-CD1 4.36Å; L106-F153 HydrophobicContact CD2-CE1 3.89Å; L106-F153 HydrophobicContact CD2-CZ 4.27Å; L106-F153 HydrophobicContact CG-CE1 4.49Å; G107-F153 WeakPolarHBondContact O-CE2 3.42Å; F108-F153 HydrophobicContact CE1-CD2 4.2Å; F108-F153 AromaticContact CE1-CE2 3.84Å; F108-F153 HydrophobicContact CE1-CE2 3.84Å; F108-F153 AromaticContact CE2-CD2 3.95Å; F108-F153 HydrophobicContact CE2-CD2 3.95Å; F108-F153 HydrophobicContact CE2-CE2 4.17Å; F108-F153 AromaticContact CZ-CD2 3.51Å; F108-F153 HydrophobicContact CZ-CD2 3.51Å; F108-F153 AromaticContact CZ-CE2 3.61Å; F108-F153 HydrophobicContact CZ-CE2 3.61Å; F153-F162 WeakPolarHBondContact CA-O 3.44Å; F153-F162 WeakPolarHBondContact CB-O 3.42Å; F153-H163 HydrophobicContact CB-CB 4.12Å; F153-A185 HydrophobicContact CZ-CB 4.19Å
154	W	98.8	Very high	98	Very high	26 Å²	26	43.4 Å²	43.4	10%	0.098	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	162.1	-177.6	63.5	97.5	0	0	0	110.6	E87 Q88 A152 V161 F162 R164 V170	E87-W154 WeakPolarHBondContact O-CB 3.28Å; Q88-W154 HydrophobicContact CB-CE3 4.45Å; Q88-W154 HydrophobicContact CG-CB 4.42Å; Q88-W154 HydrophobicContact CG-CD2 3.99Å; Q88-W154 HydrophobicContact CG-CE3 3.67Å; Q88-W154 HydrophobicContact CG-CG 4.34Å; Q88-W154 HydrophobicContact CG-CZ3 4.25Å; A152-W154 HydrophobicContact CB-CZ3 4.25Å; W154-V161 CarbonylContact O-C 3.59Å; W154-V161 WeakPolarHBondContact O-CA 3.16Å; W154-F162 HydrophobicContact CD2-CB 4.18Å; W154-F162 HydrophobicContact CH2-CB 4.26Å; W154-F162 HydrophobicContact CZ2-CB 3.76Å; W154-F162 HydrophobicContact CZ2-CG 4.49Å; W154-F162 PolarHBondContact N-O 3.48Å; W154-F162 AromaticContact NE1-CD2 3.9Å; W154-F162 PolarHBondContact O-N 2.88Å; W154-R164 HydrophobicContact CH2-CB 4.35Å; W154-R164 HydrophobicContact CZ3-CB 4.22Å; W154-V170 HydrophobicContact CH2-CB 4.27Å; W154-V170 HydrophobicContact CH2-CG1 3.58Å; W154-V170 HydrophobicContact CH2-CG2 3.76Å; W154-V170 HydrophobicContact CZ2-CB 4.42Å; W154-V170 HydrophobicContact CZ2-CG1 3.46Å; W154-V170 VanDerWaalsContact CZ2-CG1 3.46Å; W154-V170 HydrophobicContact CZ2-CG2 4.06Å
155	V	98.8	Very high	98.1	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	144.2	176	64.1	0	0	0	0	110.3	I85 Y86 F108 R160 V161 V177 T179 L183	I85-V155 HydrophobicContact CD1-CG1 3.74Å; I85-V155 WeakPolarHBondContact CG2-O 3.36Å; Y86-V155 PolarHBondContact N-O 3.4Å; F108-V155 HydrophobicContact CD2-CB 4.33Å; F108-V155 HydrophobicContact CE2-CB 3.9Å; F108-V155 HydrophobicContact CE2-CG1 4.42Å; F108-V155 HydrophobicContact CZ-CB 4.2Å; F108-V155 HydrophobicContact CZ-CG1 4.35Å; V155-R160 CarbonylContact C-O 3.52Å; V155-R160 WeakPolarHBondContact CA-O 3.47Å; V155-V161 HydrophobicContact CB-CG2 4.25Å; V155-V161 HydrophobicContact CG2-CG2 4.16Å; V155-V177 HydrophobicContact CG2-CB 4.05Å; V155-V177 HydrophobicContact CG2-CG1 4.14Å; V155-T179 HydrophobicContact CG2-CG2 3.96Å; V155-L183 HydrophobicContact CG1-CD1 3.85Å
156	D	98.5	Very high	98.2	Very high	4 Å²	4	44 Å²	44	2%	0.021	21%	0.21	C	C	.	.			trans	-95.9	173.7	171.9	78.4	1.4	0	0	0	113.1	Y86 K158 G159 R160 F162	Y86-D156 HydrophobicContact CD1-CB 4.11Å; Y86-D156 HydrophobicContact CE1-CB 3.33Å; D156-K158 PolarHBondContact O-N 2.79Å; D156-K158 VanDerWaalsContact OD1-CA 3.32Å; D156-K158 WeakPolarHBondContact OD1-CA 3.46Å; D156-K158 WeakPolarHBondContact OD1-CB 3.28Å; D156-K158 PolarHBondContact OD1-N 3.22Å; D156-G159 PolarHBondContact O-N 3.26Å; D156-G159 PolarHBondContact OD1-N 3.34Å; D156-G159 VanDerWaalsContact OD1-N 3.13Å; D156-R160 PolarHBondContact N-O 3.24Å; D156-R160 WeakPolarHBondContact OD1-CB 3.31Å; D156-R160 PolarHBondContact OD1-N 2.87Å; D156-R160 IonicContact OD1-NE 2.92Å; D156-R160 IonicContact OD2-CZ 3.15Å; D156-R160 IonicContact OD2-NE 2.7Å; D156-R160 PolarHBondContact OD2-NE 2.8Å; D156-R160 IonicContact OD2-NH2 3.85Å; D156-R160 PolarHBondContact OD2-NH2 2.82Å; D156-F162 HydrophobicContact CB-CE2 4.04Å
157	K	97.9	Very high	98.1	Very high	153 Å²	153	48.9 Å²	48.9	67%	0.665	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-14.7	178.2	-73	175.4	176.7	-177.5	0	114.7	I85 Y86 T179	I85-K157 HydrophobicContact CG2-CG 3.89Å; Y86-K157 HydrophobicContact CE2-CD 4Å; Y86-K157 HydrophobicContact CE2-CG 3.69Å; Y86-K157 PolarHBondContact OH-N 2.92Å; K157-T179 PolarHBondContact O-OG1 3.29Å
158	K	98.3	Very high	98	Very high	166 Å²	166	47.2 Å²	47.2	72%	0.722	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.8	5.6	178.7	-61.7	-175.1	178.1	-175.3	0	111.9	D156 R160	D156-K158 PolarHBondContact O-N 2.79Å; D156-K158 VanDerWaalsContact OD1-CA 3.32Å; D156-K158 WeakPolarHBondContact OD1-CA 3.46Å; D156-K158 WeakPolarHBondContact OD1-CB 3.28Å; D156-K158 PolarHBondContact OD1-N 3.22Å; K158-R160 VanDerWaalsContact C-N 3.28Å; K158-R160 HydrophobicContact CB-CG 4.29Å; K158-R160 PolarHBondContact O-N 2.99Å
159	G	98.4	Very high	98	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.01	24%	0.244	C	C	.	.	S	Bend	trans	74	19.2	-177.9	0	0	0	0	0	113.9	D156 S175 G176 V177	D156-G159 PolarHBondContact O-N 3.26Å; D156-G159 PolarHBondContact OD1-N 3.34Å; D156-G159 VanDerWaalsContact OD1-N 3.13Å; G159-S175 CarbonylContact O-C 3.51Å; G159-S175 WeakPolarHBondContact O-CA 3.32Å; G159-G176 PolarHBondContact O-N 2.82Å; G159-V177 WeakPolarHBondContact CA-O 3.4Å; G159-V177 PolarHBondContact O-N 3.12Å; G159-V177 VanDerWaalsContact O-N 3.14Å
160	R	98.8	Very high	98	Very high	98 Å²	98	50.2 Å²	50.2	37%	0.37	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	129.2	173.9	-56.5	-178.3	-63.3	171.8	5.5	108.9	V155 D156 K158 F162 L172	V155-R160 CarbonylContact C-O 3.52Å; V155-R160 WeakPolarHBondContact CA-O 3.47Å; D156-R160 PolarHBondContact N-O 3.24Å; D156-R160 WeakPolarHBondContact OD1-CB 3.31Å; D156-R160 PolarHBondContact OD1-N 2.87Å; D156-R160 IonicContact OD1-NE 2.92Å; D156-R160 IonicContact OD2-CZ 3.15Å; D156-R160 IonicContact OD2-NE 2.7Å; D156-R160 PolarHBondContact OD2-NE 2.8Å; D156-R160 IonicContact OD2-NH2 3.85Å; D156-R160 PolarHBondContact OD2-NH2 2.82Å; K158-R160 VanDerWaalsContact C-N 3.28Å; K158-R160 HydrophobicContact CB-CG 4.29Å; K158-R160 PolarHBondContact O-N 2.99Å; R160-F162 HydrophobicContact CB-CE2 3.77Å; R160-F162 HydrophobicContact CB-CZ 3.98Å; R160-L172 HydrophobicContact CB-CD1 3.89Å
161	V	98.8	Very high	98	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	128.9	177.4	179.4	0	0	0	0	108.8	F108 W154 V155 F173 F174 V177	F108-V161 HydrophobicContact CD2-CG2 3.88Å; F108-V161 HydrophobicContact CE2-CB 4.37Å; F108-V161 HydrophobicContact CE2-CG1 3.79Å; F108-V161 HydrophobicContact CE2-CG2 3.67Å; W154-V161 CarbonylContact O-C 3.59Å; W154-V161 WeakPolarHBondContact O-CA 3.16Å; V155-V161 HydrophobicContact CB-CG2 4.25Å; V155-V161 HydrophobicContact CG2-CG2 4.16Å; V161-F173 HydrophobicContact CG1-CB 4.19Å; V161-F173 HydrophobicContact CG1-CD1 4.17Å; V161-F173 WeakPolarHBondContact O-CA 3.47Å; V161-F173 WeakPolarHBondContact O-CB 3.19Å; V161-F173 PolarHBondContact O-N 2.85Å; V161-F174 HydrophobicContact CB-CD1 4.14Å; V161-F174 HydrophobicContact CB-CD2 4.26Å; V161-F174 HydrophobicContact CB-CE1 3.99Å; V161-F174 HydrophobicContact CB-CE2 4.1Å; V161-F174 HydrophobicContact CB-CG 4.28Å; V161-F174 HydrophobicContact CB-CZ 3.97Å; V161-F174 HydrophobicContact CG1-CD1 4.31Å; V161-F174 HydrophobicContact CG1-CE1 3.86Å; V161-F174 HydrophobicContact CG1-CZ 4.08Å; V161-F174 HydrophobicContact CG2-CD2 4.03Å; V161-F174 HydrophobicContact CG2-CE1 4.19Å; V161-F174 HydrophobicContact CG2-CE2 3.54Å; V161-F174 HydrophobicContact CG2-CZ 3.64Å; V161-F174 PolarHBondContact N-O 2.84Å; V161-F174 PolarHBondContact O-N 3.39Å; V161-V177 HydrophobicContact CG2-CG2 3.51Å
162	F	98.7	Very high	98	Very high	35 Å²	35	57.8 Å²	57.8	15%	0.154	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	154.7	175.1	-60.2	-87.6	0	0	0	109.7	F153 W154 D156 R160 V170 M171 L172	F153-F162 WeakPolarHBondContact CA-O 3.44Å; F153-F162 WeakPolarHBondContact CB-O 3.42Å; W154-F162 HydrophobicContact CD2-CB 4.18Å; W154-F162 HydrophobicContact CH2-CB 4.26Å; W154-F162 HydrophobicContact CZ2-CB 3.76Å; W154-F162 HydrophobicContact CZ2-CG 4.49Å; W154-F162 PolarHBondContact N-O 3.48Å; W154-F162 AromaticContact NE1-CD2 3.9Å; W154-F162 PolarHBondContact O-N 2.88Å; D156-F162 HydrophobicContact CB-CE2 4.04Å; R160-F162 HydrophobicContact CB-CE2 3.77Å; R160-F162 HydrophobicContact CB-CZ 3.98Å; F162-V170 HydrophobicContact CB-CG1 3.79Å; F162-V170 HydrophobicContact CD1-CG1 3.92Å; F162-V170 HydrophobicContact CG-CG1 4.13Å; F162-M171 CarbonylContact C-O 3.56Å; F162-M171 VanDerWaalsContact CA-O 3.3Å; F162-M171 WeakPolarHBondContact CA-O 3.49Å; F162-L172 HydrophobicContact CD1-CB 4.35Å; F162-L172 HydrophobicContact CD1-CD1 4.23Å; F162-L172 HydrophobicContact CE1-CB 4.25Å; F162-L172 HydrophobicContact CE1-CD1 3.82Å; F162-L172 HydrophobicContact CZ-CD1 4.09Å
163	H	98.3	Very high	97.9	Very high	14 Å²	14	57.9 Å²	57.9	7%	0.065	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	161.1	168.6	75.7	-69.8	0	0	0	111.2	A152 F153 M171 F173	A152-H163 CarbonylContact O-C 3.52Å; A152-H163 WeakPolarHBondContact O-CA 3.42Å; F153-H163 HydrophobicContact CB-CB 4.12Å; H163-M171 PolarHBondContact N-O 3.25Å; H163-M171 PolarHBondContact ND1-O 2.83Å; H163-M171 PolarHBondContact O-N 2.77Å; H163-F173 HydrophobicContact CB-CB 4.43Å; H163-F173 AromaticContact CE1-CD2 3.93Å; H163-F173 AromaticContact ND1-CD2 3.71Å; H163-F173 AromaticContact ND1-CG 3.75Å
164	R	98.2	Very high	97.9	Very high	76 Å²	76	59.3 Å²	59.3	29%	0.287	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	137.6	173.3	-177	-174.3	-65.8	153.7	-0.8	108.6	I151 A152 W154 N166 S168	I151-R164 WeakPolarHBondContact CA-O 3.43Å; A152-R164 HydrophobicContact CB-CB 4.43Å; A152-R164 PolarHBondContact N-O 2.92Å; A152-R164 PolarHBondContact O-N 2.83Å; W154-R164 HydrophobicContact CH2-CB 4.35Å; W154-R164 HydrophobicContact CZ3-CB 4.22Å; R164-N166 VanDerWaalsContact CD-O 3.25Å; R164-N166 WeakPolarHBondContact CD-O 3.24Å; R164-N166 WeakPolarHBondContact CG-O 3.4Å; R164-S168 WeakPolarHBondContact CD-O 3.4Å; R164-S168 WeakPolarHBondContact CG-O 3.42Å; R164-S168 PolarHBondContact NE-O 2.75Å
165	I	98.1	Very high	97.9	Very high	11 Å²	11	61.3 Å²	61.3	6%	0.056	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	118.3	173.6	-49.7	-59.7	0	0	0	108.7	L140 F144 N149 I150 I151 D167 S168	L140-I165 HydrophobicContact CD1-CD1 4.22Å; L140-I165 HydrophobicContact CD2-CD1 4.47Å; F144-I165 HydrophobicContact CB-CD1 3.88Å; F144-I165 HydrophobicContact CB-CG1 4.01Å; F144-I165 HydrophobicContact CB-CG2 4.46Å; F144-I165 HydrophobicContact CD1-CB 4.49Å; F144-I165 HydrophobicContact CD1-CG1 3.91Å; F144-I165 HydrophobicContact CD1-CG2 4.35Å; F144-I165 HydrophobicContact CD2-CD1 4.38Å; F144-I165 HydrophobicContact CD2-CG1 4.09Å; F144-I165 HydrophobicContact CE1-CG1 4.43Å; F144-I165 HydrophobicContact CG-CD1 4.09Å; F144-I165 HydrophobicContact CG-CG1 3.74Å; N149-I165 HydrophobicContact CB-CG2 4.46Å; I150-I165 CarbonylContact O-C 3.39Å; I150-I165 WeakPolarHBondContact O-CA 3.42Å; I151-I165 HydrophobicContact CB-CD1 4.23Å; I151-I165 HydrophobicContact CG1-CD1 3.63Å; I151-I165 HydrophobicContact CG2-CD1 4.02Å; I165-D167 PolarHBondContact O-N 2.89Å; I165-S168 PolarHBondContact N-OG 2.79Å; I165-S168 VanDerWaalsContact N-OG 3.12Å; I165-S168 WeakPolarHBondContact O-CB 2.93Å; I165-S168 PolarHBondContact O-N 2.89Å; I165-S168 PolarHBondContact O-OG 3.32Å
166	N	97	Very high	97.8	Very high	68 Å²	68	63.8 Å²	63.8	36%	0.364	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	-123.9	-173.1	-51.9	-41.4	0	0	0	110	I150 R164	I150-N166 PolarHBondContact N-OD1 2.78Å; I150-N166 PolarHBondContact O-N 2.98Å; R164-N166 VanDerWaalsContact CD-O 3.25Å; R164-N166 WeakPolarHBondContact CD-O 3.24Å; R164-N166 WeakPolarHBondContact CG-O 3.4Å
167	D	93.9	Very high	97.8	Very high	162 Å²	162	63.9 Å²	63.9	87%	0.866	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	21.5	179.4	-55.1	-58.8	0	0	0	113.1	I165	I165-D167 PolarHBondContact O-N 2.89Å
168	S	96.7	Very high	97.8	Very high	58 Å²	58	63.9 Å²	63.9	41%	0.406	34%	0.338	S	S	.	.	S	Bend	trans	-70.6	175.1	177	64.3	0	0	0	0	113.2	R164 I165	R164-S168 WeakPolarHBondContact CD-O 3.4Å; R164-S168 WeakPolarHBondContact CG-O 3.42Å; R164-S168 PolarHBondContact NE-O 2.75Å; I165-S168 PolarHBondContact N-OG 2.79Å; I165-S168 VanDerWaalsContact N-OG 3.12Å; I165-S168 WeakPolarHBondContact O-CB 2.93Å; I165-S168 PolarHBondContact O-N 2.89Å; I165-S168 PolarHBondContact O-OG 3.32Å
169	A	97.1	Very high	97.7	Very high	71 Å²	71	58.1 Å²	58.1	59%	0.587	32%	0.316	S	S	*	.			trans	-59.4	148.8	173.3	0	0	0	0	0	111.6	M171	A169-M171 PolarHBondContact O-N 3.01Å
170	V	97.9	Very high	97.6	Very high	60 Å²	60	61.8 Å²	61.8	36%	0.364	35%	0.347	S	S	.	.			trans	-72.6	127.1	171.1	-179.9	0	0	0	0	109	W154 F162	W154-V170 HydrophobicContact CH2-CB 4.27Å; W154-V170 HydrophobicContact CH2-CG1 3.58Å; W154-V170 HydrophobicContact CH2-CG2 3.76Å; W154-V170 HydrophobicContact CZ2-CB 4.42Å; W154-V170 HydrophobicContact CZ2-CG1 3.46Å; W154-V170 VanDerWaalsContact CZ2-CG1 3.46Å; W154-V170 HydrophobicContact CZ2-CG2 4.06Å; F162-V170 HydrophobicContact CB-CG1 3.79Å; F162-V170 HydrophobicContact CD1-CG1 3.92Å; F162-V170 HydrophobicContact CG-CG1 4.13Å
171	M	97.9	Very high	97.5	Very high	107 Å²	107	60.1 Å²	60.1	53%	0.527	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	136.6	-179.7	-64.2	-57.6	-69.4	0	0	110.8	F162 H163 A169 F173	F162-M171 CarbonylContact C-O 3.56Å; F162-M171 VanDerWaalsContact CA-O 3.3Å; F162-M171 WeakPolarHBondContact CA-O 3.49Å; H163-M171 PolarHBondContact N-O 3.25Å; H163-M171 PolarHBondContact ND1-O 2.83Å; H163-M171 PolarHBondContact O-N 2.77Å; A169-M171 PolarHBondContact O-N 3.01Å; M171-F173 PolarHBondContact O-N 3.13Å
172	L	98.3	Very high	97.4	Very high	96 Å²	96	63.9 Å²	63.9	50%	0.503	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	124.6	168.5	-179.4	69.9	0	0	0	108.6	R160 F162	R160-L172 HydrophobicContact CB-CD1 3.89Å; F162-L172 HydrophobicContact CD1-CB 4.35Å; F162-L172 HydrophobicContact CD1-CD1 4.23Å; F162-L172 HydrophobicContact CE1-CB 4.25Å; F162-L172 HydrophobicContact CE1-CD1 3.82Å; F162-L172 HydrophobicContact CZ-CD1 4.09Å
173	F	97.9	Very high	97.4	Very high	8 Å²	8	62.3 Å²	62.3	4%	0.035	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	-55.4	-177.6	-165.6	-146.2	0	0	0	111.8	L106 K138 L140 V161 H163 M171	L106-F173 HydrophobicContact CB-CE1 4.05Å; K138-F173 HydrophobicContact CB-CD1 4.5Å; K138-F173 HydrophobicContact CB-CE1 3.89Å; K138-F173 HydrophobicContact CB-CE2 4.22Å; K138-F173 HydrophobicContact CB-CZ 3.74Å; K138-F173 HydrophobicContact CD-CD2 4.15Å; K138-F173 HydrophobicContact CD-CE2 4Å; K138-F173 HydrophobicContact CD-CZ 4.37Å; K138-F173 WeakPolarHBondContact CD-O 3.39Å; K138-F173 HydrophobicContact CG-CE2 3.98Å; K138-F173 HydrophobicContact CG-CZ 3.96Å; K138-F173 PolarHBondContact NZ-O 3.42Å; K138-F173 WeakPolarHBondContact O-CZ 3.43Å; L140-F173 HydrophobicContact CD1-CE2 4.49Å; V161-F173 HydrophobicContact CG1-CB 4.19Å; V161-F173 HydrophobicContact CG1-CD1 4.17Å; V161-F173 WeakPolarHBondContact O-CA 3.47Å; V161-F173 WeakPolarHBondContact O-CB 3.19Å; V161-F173 PolarHBondContact O-N 2.85Å; H163-F173 HydrophobicContact CB-CB 4.43Å; H163-F173 AromaticContact CE1-CD2 3.93Å; H163-F173 AromaticContact ND1-CD2 3.71Å; H163-F173 AromaticContact ND1-CG 3.75Å; M171-F173 PolarHBondContact O-N 3.13Å
174	F	98.4	Very high	97.5	Very high	30 Å²	30	62.8 Å²	62.8	13%	0.132	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	-180	172.4	60.9	-90	0	0	0	110.5	W136 K138 V161 V177	W136-F174 HydrophobicContact CB-CE2 3.79Å; W136-F174 HydrophobicContact CB-CZ 4.34Å; K138-F174 HydrophobicContact CB-CD1 3.57Å; K138-F174 HydrophobicContact CB-CE1 3.95Å; K138-F174 HydrophobicContact CB-CG 4.33Å; K138-F174 HydrophobicContact CD-CB 4.02Å; K138-F174 HydrophobicContact CD-CD1 4.15Å; V161-F174 HydrophobicContact CB-CD1 4.14Å; V161-F174 HydrophobicContact CB-CD2 4.26Å; V161-F174 HydrophobicContact CB-CE1 3.99Å; V161-F174 HydrophobicContact CB-CE2 4.1Å; V161-F174 HydrophobicContact CB-CG 4.28Å; V161-F174 HydrophobicContact CB-CZ 3.97Å; V161-F174 HydrophobicContact CG1-CD1 4.31Å; V161-F174 HydrophobicContact CG1-CE1 3.86Å; V161-F174 HydrophobicContact CG1-CZ 4.08Å; V161-F174 HydrophobicContact CG2-CD2 4.03Å; V161-F174 HydrophobicContact CG2-CE1 4.19Å; V161-F174 HydrophobicContact CG2-CE2 3.54Å; V161-F174 HydrophobicContact CG2-CZ 3.64Å; V161-F174 PolarHBondContact N-O 2.84Å; V161-F174 PolarHBondContact O-N 3.39Å; F174-V177 HydrophobicContact CD2-CG2 4.38Å; F174-V177 HydrophobicContact CE2-CG2 3.63Å; F174-V177 HydrophobicContact CZ-CG2 4.45Å
175	S	98.2	Very high	97.5	Very high	68 Å²	68	59.3 Å²	59.3	48%	0.476	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	169	-179.8	-61.9	0	0	0	0	110.9	G159	G159-S175 CarbonylContact O-C 3.51Å; G159-S175 WeakPolarHBondContact O-CA 3.32Å
176	G	97.2	Very high	97.5	Very high	54 Å²	54	58.8 Å²	58.8	56%	0.557	35%	0.349	S	S	*	.			trans	101.6	10.1	177.5	0	0	0	0	0	114.6	W136 G159 R178	W136-G176 PolarHBondContact NE1-O 3.16Å; G159-G176 PolarHBondContact O-N 2.82Å; G176-R178 PolarHBondContact O-N 3.45Å
177	V	98.3	Very high	97.6	Very high	6 Å²	6	55.7 Å²	55.7	4%	0.036	33%	0.332	C	S	.	.			trans	-70.5	128	172.8	-179.5	0	0	0	0	109.3	F108 W136 V155 G159 V161 F174 T179 L183	F108-V177 HydrophobicContact CB-CG1 4.4Å; F108-V177 HydrophobicContact CD2-CG2 4.38Å; W136-V177 HydrophobicContact CB-CG2 3.93Å; W136-V177 HydrophobicContact CD2-CB 4.45Å; W136-V177 HydrophobicContact CD2-CG1 4.32Å; W136-V177 HydrophobicContact CD2-CG2 4.3Å; W136-V177 HydrophobicContact CE3-CG1 4.09Å; W136-V177 HydrophobicContact CG-CG2 3.96Å; W136-V177 HydrophobicContact CZ3-CG1 4.4Å; V155-V177 HydrophobicContact CG2-CB 4.05Å; V155-V177 HydrophobicContact CG2-CG1 4.14Å; G159-V177 WeakPolarHBondContact CA-O 3.4Å; G159-V177 PolarHBondContact O-N 3.12Å; G159-V177 VanDerWaalsContact O-N 3.14Å; V161-V177 HydrophobicContact CG2-CG2 3.51Å; F174-V177 HydrophobicContact CD2-CG2 4.38Å; F174-V177 HydrophobicContact CE2-CG2 3.63Å; F174-V177 HydrophobicContact CZ-CG2 4.45Å; V177-T179 PolarHBondContact O-N 3.44Å; V177-L183 HydrophobicContact CG1-CD1 3.68Å; V177-L183 HydrophobicContact CG1-CD2 4.04Å
178	R	97.6	Very high	97.8	Very high	153 Å²	153	48 Å²	48	58%	0.577	29%	0.291	S	S	*	.			trans	-79.2	118.5	175.4	-172.5	-176.8	-176.5	-170.7	-0.2	109.8	W136 G176 A180 D181	W136-R178 HydrophobicContact CH2-CB 3.84Å; W136-R178 HydrophobicContact CZ2-CB 3.83Å; G176-R178 PolarHBondContact O-N 3.45Å; R178-A180 HydrophobicContact CG-CB 4.3Å; R178-D181 IonicContact CZ-OD2 3.78Å; R178-D181 IonicContact NE-OD2 3.78Å; R178-D181 IonicContact NH1-OD2 3.7Å
179	T	97.1	Very high	97.9	Very high	45 Å²	45	45.2 Å²	45.2	28%	0.276	27%	0.272	S	S	.	.			trans	-103.6	15.2	-175.3	59.8	0	0	0	0	113.9	I85 V155 K157 V177 L183	I85-T179 HydrophobicContact CD1-CG2 3.72Å; V155-T179 HydrophobicContact CG2-CG2 3.96Å; K157-T179 PolarHBondContact O-OG1 3.29Å; V177-T179 PolarHBondContact O-N 3.44Å; T179-L183 HydrophobicContact CG2-CD1 4.3Å
180	A	95.7	Very high	97.9	Very high	78 Å²	78	43.5 Å²	43.5	65%	0.645	25%	0.25	S	S	*	.	S	Bend	trans	-78.9	-26.8	176.3	0	0	0	0	0	112.2	R178	R178-A180 HydrophobicContact CG-CB 4.3Å
181	D	95.9	Very high	97.7	Very high	63 Å²	63	40.6 Å²	40.6	34%	0.337	23%	0.233	S	C	.	.	S	Bend	trans	-106.4	157.1	-178.8	-55.5	-57.1	0	0	0	110	R178	R178-D181 IonicContact CZ-OD2 3.78Å; R178-D181 IonicContact NE-OD2 3.78Å; R178-D181 IonicContact NH1-OD2 3.7Å
182	P	97.8	Very high	97.6	Very high	79 Å²	79	36.2 Å²	36.2	51%	0.513	21%	0.211	S	C	.	.			trans	-55.2	141.9	169.6	-23.2	33.8	0	0	0	111.4	P82 S110 W184	P82-P182 HydrophobicContact CB-CB 4.07Å; P82-P182 HydrophobicContact CG-CB 4.12Å; S110-P182 WeakPolarHBondContact CA-O 3.16Å; P182-W184 HydrophobicContact CB-CH2 3.96Å; P182-W184 HydrophobicContact CB-CZ3 3.83Å; P182-W184 WeakPolarHBondContact O-CZ3 3.33Å
183	L	98.6	Very high	97.5	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.01	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-117.5	137.9	-177.9	-67.3	174.2	0	0	0	110.5	P82 V83 I85 F108 T109 W136 V155 V177 T179	P82-L183 CarbonylContact C-O 3.56Å; P82-L183 WeakPolarHBondContact CA-O 3.34Å; V83-L183 HydrophobicContact CG2-CB 4.28Å; V83-L183 WeakPolarHBondContact CG2-O 3.22Å; V83-L183 PolarHBondContact N-O 3.07Å; I85-L183 HydrophobicContact CD1-CD1 4.15Å; F108-L183 HydrophobicContact CB-CB 4.49Å; F108-L183 HydrophobicContact CB-CD2 4.36Å; T109-L183 CarbonylContact O-C 3.57Å; T109-L183 VanDerWaalsContact O-CA 3.31Å; T109-L183 WeakPolarHBondContact O-CA 3.33Å; W136-L183 HydrophobicContact CZ3-CD2 4.16Å; V155-L183 HydrophobicContact CG1-CD1 3.85Å; V177-L183 HydrophobicContact CG1-CD1 3.68Å; V177-L183 HydrophobicContact CG1-CD2 4.04Å; T179-L183 HydrophobicContact CG2-CD1 4.3Å
184	W	98.8	Very high	97.5	Very high	24 Å²	24	35.8 Å²	35.8	9%	0.091	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	145.3	169.2	-70.7	-106.6	0	0	0	109.3	S79 R81 P82 F108 T109 D112 P113 P182	S79-W184 WeakPolarHBondContact OG-CA 3.41Å; R81-W184 VanDerWaalsContact O-CD1 3.26Å; P82-W184 HydrophobicContact CG-CD2 4.33Å; P82-W184 HydrophobicContact CG-CH2 4.05Å; P82-W184 HydrophobicContact CG-CZ2 3.56Å; F108-W184 CarbonylContact C-O 3.42Å; F108-W184 WeakPolarHBondContact CA-O 3.16Å; T109-W184 HydrophobicContact CG2-CB 3.95Å; T109-W184 PolarHBondContact N-O 3.13Å; T109-W184 PolarHBondContact O-N 3Å; D112-W184 HydrophobicContact CB-CH2 3.76Å; D112-W184 HydrophobicContact CB-CZ2 3.86Å; D112-W184 HydrophobicContact CB-CZ3 4.36Å; P113-W184 VanDerWaalsContact CD-CG 3.47Å; P113-W184 HydrophobicContact CG-CB 4.07Å; P113-W184 HydrophobicContact CG-CD2 4.39Å; P113-W184 HydrophobicContact CG-CG 3.78Å; P182-W184 HydrophobicContact CB-CH2 3.96Å; P182-W184 HydrophobicContact CB-CZ3 3.83Å; P182-W184 WeakPolarHBondContact O-CZ3 3.33Å
185	A	98.6	Very high	97.5	Very high	3 Å²	3	34.3 Å²	34.3	3%	0.025	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	138.4	172.2	0	0	0	0	0	109.4	F78 S79 V83 V89 F153	F78-A185 CarbonylContact C-O 3.46Å; F78-A185 WeakPolarHBondContact CA-O 3.38Å; S79-A185 PolarHBondContact N-O 3.21Å; S79-A185 PolarHBondContact OG-N 2.74Å; V83-A185 HydrophobicContact CG1-CB 4.32Å; V89-A185 HydrophobicContact CG1-CB 4.06Å; V89-A185 HydrophobicContact CG2-CB 3.96Å; F153-A185 HydrophobicContact CZ-CB 4.19Å
186	L	98.7	Very high	97.5	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	126.7	175.4	-177	167	0	0	0	108.4	F78 G107 A125 L129 F135 A137	F78-L186 HydrophobicContact CD1-CB 4.26Å; F78-L186 HydrophobicContact CD1-CG 4.26Å; F78-L186 HydrophobicContact CE1-CB 4.33Å; F78-L186 HydrophobicContact CE1-CD1 3.95Å; F78-L186 HydrophobicContact CE1-CG 3.89Å; G107-L186 PolarHBondContact N-O 2.81Å; G107-L186 PolarHBondContact O-N 3.13Å; A125-L186 HydrophobicContact CB-CD2 3.93Å; L129-L186 HydrophobicContact CD1-CD1 4.03Å; F135-L186 HydrophobicContact CD1-CD1 3.94Å; A137-L186 HydrophobicContact CB-CD2 4.02Å
187	V	98.6	Very high	97.5	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.012	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	120.1	179	-176.1	0	0	0	0	109.2	F48 I76 T77 L91 R105 L106 V189 V196	F48-V187 HydrophobicContact CE1-CG2 4.47Å; I76-V187 CarbonylContact C-O 3.51Å; T77-V187 PolarHBondContact N-O 2.84Å; T77-V187 PolarHBondContact O-N 2.85Å; T77-V187 PolarHBondContact OG1-O 2.82Å; L91-V187 HydrophobicContact CD1-CG1 4.12Å; L91-V187 HydrophobicContact CD1-CG2 3.63Å; R105-V187 WeakPolarHBondContact O-CA 3.49Å; L106-V187 HydrophobicContact CD2-CB 4.42Å; L106-V187 HydrophobicContact CD2-CG1 4.03Å; L106-V187 HydrophobicContact CD2-CG2 4.04Å; V187-V189 HydrophobicContact CG1-CG2 4.33Å; V187-V196 HydrophobicContact CG1-CG2 4.45Å
188	D	98.4	Very high	97.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	108.9	171.7	-178.9	11.9	0	0	0	109.3	I76 L104 R105 A125 Y190	I76-D188 HydrophobicContact CG1-CB 4.16Å; L104-D188 VanDerWaalsContact CA-O 3.27Å; L104-D188 WeakPolarHBondContact CA-O 3.36Å; L104-D188 WeakPolarHBondContact CB-O 3.36Å; R105-D188 HydrophobicContact CB-CB 4.02Å; R105-D188 IonicContact CZ-OD2 3.99Å; R105-D188 PolarHBondContact N-O 3.09Å; R105-D188 VanDerWaalsContact N-O 3.08Å; R105-D188 IonicContact NH1-OD2 2.73Å; R105-D188 PolarHBondContact NH1-OD2 3.14Å; R105-D188 PolarHBondContact O-N 3.45Å; A125-D188 HydrophobicContact CB-CB 3.72Å; A125-D188 PolarHBondContact N-OD2 2.9Å; A125-D188 VanDerWaalsContact N-OD2 3.11Å; D188-Y190 VanDerWaalsContact C-N 3.27Å; D188-Y190 PolarHBondContact O-N 3.21Å
189	V	98	Very high	97.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.16	C	C	.	.			trans	-77.8	78.5	-178.7	-173.7	0	0	0	0	109.5	I57 V66 R68 A75 V187 T193 V196	I57-V189 HydrophobicContact CD1-CB 4.27Å; I57-V189 HydrophobicContact CD1-CG2 4.18Å; V66-V189 HydrophobicContact CG2-CG2 4.02Å; R68-V189 HydrophobicContact CB-CG1 4.28Å; R68-V189 PolarHBondContact NH1-O 3.32Å; A75-V189 HydrophobicContact CB-CB 4Å; A75-V189 WeakPolarHBondContact CB-O 3.42Å; A75-V189 PolarHBondContact O-N 2.98Å; V187-V189 HydrophobicContact CG1-CG2 4.33Å; V189-T193 HydrophobicContact CG1-CG2 4.32Å; V189-T193 WeakPolarHBondContact CG1-O 3.43Å; V189-V196 HydrophobicContact CG2-CG2 3.8Å
190	Y	97.2	Very high	97.5	Very high	35 Å²	35	28.5 Å²	28.5	14%	0.137	15%	0.154	C	C	.	.			trans	-106.7	151.5	-168.6	178.6	-93.1	0	0	0	114.6	F72 C73 S101 A103 R105 Y124 D188 L192 T193	F72-Y190 HydrophobicContact CD2-CD2 4.37Å; F72-Y190 AromaticContact CD2-CE2 3.54Å; F72-Y190 HydrophobicContact CD2-CE2 3.54Å; F72-Y190 AromaticContact CD2-CZ 3.84Å; F72-Y190 HydrophobicContact CE2-CE2 4.01Å; F72-Y190 WeakPolarHBondContact O-CD2 3.32Å; C73-Y190 HydrophobicContact CB-CD2 4.26Å; C73-Y190 HydrophobicContact CB-CE2 4.31Å; S101-Y190 VanDerWaalsContact O-CE1 3.3Å; S101-Y190 WeakPolarHBondContact O-CE1 3.28Å; A103-Y190 WeakPolarHBondContact O-CD1 3.41Å; R105-Y190 VanDerWaalsContact NH2-CE2 3.35Å; Y124-Y190 HydrophobicContact CD1-CD2 4.22Å; Y124-Y190 AromaticContact CD1-CE2 3.83Å; Y124-Y190 HydrophobicContact CD1-CE2 3.83Å; Y124-Y190 HydrophobicContact CE1-CD2 4.49Å; Y124-Y190 AromaticContact CE1-CE2 3.8Å; Y124-Y190 HydrophobicContact CE1-CE2 3.8Å; D188-Y190 VanDerWaalsContact C-N 3.27Å; D188-Y190 PolarHBondContact O-N 3.21Å; Y190-L192 PolarHBondContact O-N 3.01Å; Y190-T193 PolarHBondContact O-N 2.76Å
191	G	95	Very high	97.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	-119.7	163.4	0	0	0	0	0	112.6	R68 F72 G102 T193	R68-G191 PolarHBondContact NH1-O 2.95Å; R68-G191 PolarHBondContact NH2-O 2.82Å; F72-G191 PolarHBondContact O-N 2.87Å; G102-G191 CarbonylContact O-C 3.51Å; G102-G191 WeakPolarHBondContact O-CA 3.24Å; G191-T193 PolarHBondContact O-N 3.46Å
192	L	95.5	Very high	97.7	Very high	14 Å²	14	23.8 Å²	23.8	7%	0.073	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-33	177.8	-70.5	172.6	0	0	0	113	K96 Q97 W100 G102 E142 Y190	K96-L192 CarbonylContact C-O 3.57Å; K96-L192 WeakPolarHBondContact CA-O 3.41Å; K96-L192 VanDerWaalsContact CG-O 3.32Å; K96-L192 WeakPolarHBondContact CG-O 3.33Å; Q97-L192 PolarHBondContact N-O 2.87Å; Q97-L192 WeakPolarHBondContact O-CA 3.35Å; W100-L192 WeakPolarHBondContact O-CD2 3.3Å; W100-L192 WeakPolarHBondContact O-CG 3.48Å; G102-L192 WeakPolarHBondContact O-CB 3.2Å; G102-L192 WeakPolarHBondContact O-CG 3.44Å; G102-L192 PolarHBondContact O-N 2.59Å; E142-L192 HydrophobicContact CB-CD1 3.9Å; E142-L192 HydrophobicContact CG-CD1 3.84Å; Y190-L192 PolarHBondContact O-N 3.01Å
193	T	96.6	Very high	97.6	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	118.9	-178.8	-51.9	0	0	0	0	109.5	R68 I93 L104 V189 Y190 G191 V196	R68-T193 PolarHBondContact NH1-O 2.75Å; I93-T193 HydrophobicContact CG1-CG2 4.49Å; I93-T193 HydrophobicContact CG2-CG2 4.26Å; L104-T193 HydrophobicContact CB-CG2 4.2Å; L104-T193 HydrophobicContact CD2-CG2 4.41Å; L104-T193 WeakPolarHBondContact CD2-OG1 3.32Å; L104-T193 PolarHBondContact N-OG1 2.99Å; V189-T193 HydrophobicContact CG1-CG2 4.32Å; V189-T193 WeakPolarHBondContact CG1-O 3.43Å; Y190-T193 PolarHBondContact O-N 2.76Å; G191-T193 PolarHBondContact O-N 3.46Å; T193-V196 HydrophobicContact CG2-CG1 3.62Å
194	R	97.1	Very high	97.6	Very high	95 Å²	95	21.7 Å²	21.7	36%	0.358	10%	0.098	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-28	178	-170.1	178.8	-174.6	176.4	0.7	112.7	K67 R68 Q69 K95 Q97	K67-R194 CarbonylContact C-O 3.49Å; K67-R194 VanDerWaalsContact CA-O 3.3Å; K67-R194 WeakPolarHBondContact CA-O 3.45Å; R68-R194 HydrophobicContact CB-CG 4.43Å; R68-R194 PolarHBondContact N-O 3.21Å; R68-R194 WeakPolarHBondContact O-CG 3.23Å; R68-R194 PolarHBondContact O-NE 2.76Å; R68-R194 VanDerWaalsContact O-NE 3.14Å; Q69-R194 PolarHBondContact O-NH2 3.36Å; K95-R194 HydrophobicContact CB-CB 4.16Å; K95-R194 HydrophobicContact CG-CB 4.04Å; K95-R194 HydrophobicContact CG-CG 4.44Å; K95-R194 PolarHBondContact O-N 3.21Å; Q97-R194 HydrophobicContact CB-CB 4.13Å
195	G	97.9	Very high	97.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	141.5	-177.7	0	0	0	0	0	112.3	V66 T94 K95	V66-G195 WeakPolarHBondContact O-CA 3.39Å; T94-G195 PolarHBondContact N-O 2.93Å; T94-G195 WeakPolarHBondContact OG1-CA 3.43Å; T94-G195 PolarHBondContact OG1-O 3.01Å; K95-G195 PolarHBondContact N-O 3.01Å; K95-G195 PolarHBondContact O-N 2.87Å
196	V	98.6	Very high	97.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	157.8	176.6	-63.1	0	0	0	0	111	F48 A65 V66 K92 T94 L104 V187 V189 T193	F48-V196 HydrophobicContact CZ-CG2 3.83Å; A65-V196 WeakPolarHBondContact CA-O 3.47Å; V66-V196 HydrophobicContact CG2-CG2 3.47Å; V66-V196 VanDerWaalsContact CG2-CG2 3.47Å; V66-V196 PolarHBondContact N-O 3.06Å; V66-V196 PolarHBondContact O-N 3.29Å; K92-V196 CarbonylContact O-C 3.47Å; K92-V196 VanDerWaalsContact O-CA 3.22Å; K92-V196 WeakPolarHBondContact O-CA 3.47Å; T94-V196 PolarHBondContact OG1-N 3Å; L104-V196 HydrophobicContact CD1-CG1 4.28Å; V187-V196 HydrophobicContact CG1-CG2 4.45Å; V189-V196 HydrophobicContact CG2-CG2 3.8Å; T193-V196 HydrophobicContact CG2-CG1 3.62Å
197	Q	98.6	Very high	97.3	Very high	70 Å²	70	24.6 Å²	24.6	33%	0.327	11%	0.112	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	132.7	177.3	176.5	-179.3	-9.6	0	0	110.6	K64 A65 L91 K92 T94	K64-Q197 HydrophobicContact CB-CG 4.49Å; K64-Q197 CarbonylContact O-C 3.56Å; K64-Q197 VanDerWaalsContact O-CA 3.23Å; K64-Q197 WeakPolarHBondContact O-CA 3.45Å; K64-Q197 WeakPolarHBondContact O-CG 3.41Å; A65-Q197 HydrophobicContact CB-CB 4.16Å; A65-Q197 HydrophobicContact CB-CG 4.23Å; L91-Q197 CarbonylContact C-O 3.57Å; L91-Q197 WeakPolarHBondContact CA-O 3.42Å; K92-Q197 PolarHBondContact N-O 3.17Å; K92-Q197 PolarHBondContact O-N 3.36Å; T94-Q197 HydrophobicContact CG2-CB 3.68Å
198	L	98.3	Very high	97.2	Very high	6 Å²	6	26.5 Å²	26.5	3%	0.031	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	139.2	170.1	-74.6	164.1	0	0	0	110.6	L46 F48 K64 V89 R90 L91	L46-L198 HydrophobicContact CD2-CD2 4.17Å; F48-L198 HydrophobicContact CD1-CD1 3.93Å; F48-L198 HydrophobicContact CD2-CD1 3.81Å; F48-L198 HydrophobicContact CD2-CG 4.28Å; F48-L198 HydrophobicContact CE1-CD1 3.94Å; F48-L198 HydrophobicContact CE1-CG 4.13Å; F48-L198 HydrophobicContact CE2-CB 4.4Å; F48-L198 HydrophobicContact CE2-CD1 3.82Å; F48-L198 HydrophobicContact CE2-CG 3.78Å; F48-L198 HydrophobicContact CG-CD1 3.87Å; F48-L198 HydrophobicContact CZ-CD1 3.88Å; F48-L198 HydrophobicContact CZ-CG 3.69Å; K64-L198 PolarHBondContact O-N 3.46Å; V89-L198 HydrophobicContact CG1-CD2 3.86Å; R90-L198 WeakPolarHBondContact O-CA 3.39Å; L91-L198 HydrophobicContact CD2-CD2 3.37Å; L91-L198 HydrophobicContact CD2-CG 3.7Å; L91-L198 HydrophobicContact CG-CD2 4.04Å
199	L	95.5	Very high	97.1	Very high	98 Å²	98	28.9 Å²	28.9	51%	0.513	13%	0.131	S	C	.	.			trans	-107.5	0	-176.5	-57.6	-177.5	0	0	0	112.6	R90 K92 I150	R90-L199 HydrophobicContact CB-CB 3.99Å; R90-L199 HydrophobicContact CB-CD1 4.45Å; R90-L199 PolarHBondContact O-N 2.56Å; K92-L199 HydrophobicContact CB-CD1 4.25Å; K92-L199 HydrophobicContact CB-CD2 4.06Å; K92-L199 HydrophobicContact CB-CG 4.3Å; I150-L199 HydrophobicContact CB-CD1 4.48Å; I150-L199 HydrophobicContact CD1-CD1 3.83Å; I150-L199 HydrophobicContact CG1-CD1 4Å; I150-L199 HydrophobicContact CG2-CD1 3.69Å

Retrieved 199 of 199 residues in 58.2 ms (Link to these results)

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