A0A096NIS1_PAPAN Loading...

Calcipressin-2

Inhibits calcineurin-dependent transcriptional responses by binding to the catalytic domain of calcineurin A. Could play a role during central nervous system development.

AlphaFold DB (A0A2K6DES2), UniProt , Accession A0A096NIS1, Species PAPAN (Papio anubis, Olive baboon), Gene RCAN2, Length 243 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.4	Very low	37.4	Very low	217 Å²	217	164.9 Å²	164.9	100%	1.069	82%	0.818	S	S	*	*				0	128.2	0	-76.8	166.8	109.9	0	0	107.9
2	R	40.3	Very low	37.7	Very low	228 Å²	228	160.8 Å²	160.8	86%	0.86	82%	0.818	S	S	*	*			trans	42.5	109.5	158.2	-67.1	-174.5	-93.6	-123.9	1.9	116.4
3	G	36.6	Very low	38	Very low	72 Å²	72	158.4 Å²	158.4	74%	0.742	82%	0.819	S	S	*	*			cis	87.8	111	42.7	0	0	0	0	0	108.7
4	E	38.6	Very low	37.8	Very low	189 Å²	189	151.8 Å²	151.8	88%	0.883	81%	0.809	S	S	*	*			trans	-157	148.1	146.5	-80	-141.2	153.3	0	0	109.8
5	S	37.8	Very low	37.8	Very low	95 Å²	95	153.7 Å²	153.7	66%	0.664	81%	0.811	S	S	*	*			trans	-131	140.7	-160.2	38.6	0	0	0	0	108.5
6	Y	45.2	Very low	37.4	Very low	224 Å²	224	154.9 Å²	154.9	88%	0.878	81%	0.811	S	S	*	*			trans	-120.5	119.2	165.4	4.4	-85	0	0	0	108.8
7	F	36	Very low	37.1	Very low	189 Å²	189	150.1 Å²	150.1	83%	0.829	81%	0.808	S	S	*	*			trans	-83	154.2	173.5	-95.5	-97.7	0	0	0	111.4
8	I	38.1	Very low	36.7	Very low	169 Å²	169	151.1 Å²	151.1	87%	0.867	81%	0.807	S	S	*	*			trans	157.7	112.4	144.3	-85	153	0	0	0	104.6
9	G	34.7	Very low	37	Very low	61 Å²	61	150.2 Å²	150.2	63%	0.629	80%	0.8	S	S	*	*			cis	102.3	104.7	33.5	0	0	0	0	0	108.4
10	M	31.7	Very low	37	Very low	157 Å²	157	148 Å²	148	77%	0.773	79%	0.794	S	S	*	*			trans	168.9	128.8	133.4	-89.9	175.9	86.7	0	0	114.5
11	R	36.5	Very low	37.3	Very low	213 Å²	213	148.9 Å²	148.9	80%	0.804	79%	0.794	S	S	*	*			trans	73.7	101.8	148.3	-68.7	-172.9	-167.3	-173.2	7.3	121.1
12	S	40.9	Very low	37.3	Very low	116 Å²	116	146.2 Å²	146.2	81%	0.811	78%	0.784	S	S	*	*			trans	-68	157.7	134.8	-50.9	0	0	0	0	111.3
13	P	40.9	Very low	37.3	Very low	129 Å²	129	138.5 Å²	138.5	84%	0.838	78%	0.775	S	S	*	*				-122.5	138.6	125.8	23.9	-9.3	0	0	0	110.7
14	G	35.3	Very low	37.7	Very low	66 Å²	66	138.7 Å²	138.7	68%	0.68	78%	0.777	S	S	*	*			trans	-99	174.2	168	0	0	0	0	0	112.2
15	Q	38.7	Very low	37.8	Very low	180 Å²	180	137.3 Å²	137.3	84%	0.841	78%	0.775	S	S	*	*			trans	75.1	140.8	172.3	-58.9	-173.7	-33.5	0	0	114.5
16	Q	30.3	Very low	37.7	Very low	173 Å²	173	141.7 Å²	141.7	81%	0.808	78%	0.783	S	S	*	*			cis	-159.6	155.5	15.2	-151.6	151.2	-0.4	0	0	108.3
17	G	32.8	Very low	37.6	Very low	74 Å²	74	138 Å²	138	76%	0.763	78%	0.777	S	S	*	*			trans	-67.1	151.9	-176.3	0	0	0	0	0	114.8
18	H	30.1	Very low	37.9	Very low	168 Å²	168	135.7 Å²	135.7	78%	0.778	77%	0.773	S	S	*	*			trans	-146.2	112.5	148.9	-162	-88.5	0	0	0	108.1	P20	H18-P20 WeakPolarHBondContact O-CD 3.37Å
19	I	43	Very low	37.9	Very low	134 Å²	134	132.3 Å²	132.3	69%	0.687	76%	0.763	S	S	*	*			trans	-81.1	124.2	162.6	-65.9	169.3	0	0	0	105.8	E21	I19-E21 HydrophobicContact CG2-CG 4.08Å
20	P	35.4	Very low	38.2	Very low	105 Å²	105	135.4 Å²	135.4	68%	0.682	77%	0.773	S	S	*	*			trans	-104.9	112	142.7	29.3	-17.8	0	0	0	107.6	H18 D22	H18-P20 WeakPolarHBondContact O-CD 3.37Å; P20-D22 PolarHBondContact O-N 3.37Å
21	E	43.4	Very low	39.1	Very low	167 Å²	167	133.4 Å²	133.4	78%	0.78	77%	0.765	S	S	*	*			trans	-51.5	121.7	150.8	-55.9	-87	122.4	0	0	106.7	I19	I19-E21 HydrophobicContact CG2-CG 4.08Å
22	D	36.4	Very low	39.6	Very low	162 Å²	162	129.8 Å²	129.8	87%	0.866	76%	0.762	S	S	*	*				169.1	129.9	127.6	-153.4	-119	0	0	0	111.6	P20	P20-D22 PolarHBondContact O-N 3.37Å
23	G	40.1	Very low	39.8	Very low	66 Å²	66	135.4 Å²	135.4	68%	0.68	77%	0.765	S	S	*	*			trans	49.1	96.7	138.7	0	0	0	0	0	120.8
24	G	45.1	Very low	40.2	Very low	76 Å²	76	134.8 Å²	134.8	78%	0.784	75%	0.754	S	S	*	*				69.2	69.4	125.8	0	0	0	0	0	118.9
25	L	41.3	Very low	41	Very low	160 Å²	160	137.3 Å²	137.3	84%	0.838	74%	0.744	S	S	*	*			trans	-161.7	54.6	154.1	-148.1	78.4	0	0	0	113.1
26	F	35.1	Very low	41.5	Very low	187 Å²	187	131.9 Å²	131.9	82%	0.82	73%	0.73	S	S	*	*			trans	-119.6	19.1	179.8	-97.1	-80.5	0	0	0	115.2
27	L	43.5	Very low	42.6	Very low	146 Å²	146	127.1 Å²	127.1	76%	0.764	71%	0.712	S	S	*	*	S	Bend	trans	-123.8	26	177.6	-134.5	85.5	0	0	0	115.2
28	L	43.5	Very low	43.7	Very low	141 Å²	141	127 Å²	127	74%	0.738	70%	0.696	S	S	*	*	S	Bend	trans	-117.5	-6.3	170.3	-121.9	83.4	0	0	0	114.8	C30	L28-C30 PolarHBondContact O-N 3.3Å
29	C	37.9	Very low	45	Very low	97 Å²	97	125.9 Å²	125.9	66%	0.655	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	26.6	-166.3	82.7	0	0	0	0	117
30	C	40.3	Very low	45.7	Very low	126 Å²	126	123.1 Å²	123.1	85%	0.851	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.1	8.7	169.6	-62.7	0	0	0	0	114.8	L28	L28-C30 PolarHBondContact O-N 3.3Å
31	I	50.2	Low	46.8	Very low	116 Å²	116	124.3 Å²	124.3	60%	0.595	67%	0.672	S	S	*	*	S	Bend	trans	-129.9	59.6	176.6	-44.5	178.1	0	0	0	109.2	W35	I31-W35 HydrophobicContact CG2-CB 4.22Å; I31-W35 HydrophobicContact CG2-CD2 4.39Å; I31-W35 HydrophobicContact CG2-CE3 3.79Å
32	D	46.8	Very low	47.8	Very low	137 Å²	137	117.1 Å²	117.1	73%	0.733	64%	0.641	S	S	*	*	S	Bend	trans	-140.5	32.9	-171.9	-143.2	-98.3	0	0	0	115.8
33	R	44.9	Very low	49.3	Very low	234 Å²	234	114.5 Å²	114.5	88%	0.883	62%	0.623	S	S	*	*	S	Bend	trans	-147.9	-22.5	162.4	-123.2	169.4	76.1	-160.7	3.6	116.7
34	D	50.5	Low	50.7	Low	115 Å²	115	117.2 Å²	117.2	62%	0.615	62%	0.618	S	S	*	*	S	Bend	trans	-105.3	-7.8	179.6	-69.4	-56	0	0	0	114.1	A36 V37 T38	D34-A36 PolarHBondContact O-N 2.85Å; D34-V37 PolarHBondContact O-N 3.32Å; D34-V37 VanDerWaalsContact O-N 3.14Å; D34-T38 PolarHBondContact O-N 3.24Å; D34-T38 PolarHBondContact O-OG1 3.14Å
35	W	51.3	Low	51.9	Low	120 Å²	120	115.8 Å²	115.8	46%	0.455	60%	0.599	S	S	.	*	H	α-helix	trans	-58.1	-43.4	-176.1	175.9	-97.9	0	0	0	113.5	I31 V37 T38 R39 E116	I31-W35 HydrophobicContact CG2-CB 4.22Å; I31-W35 HydrophobicContact CG2-CD2 4.39Å; I31-W35 HydrophobicContact CG2-CE3 3.79Å; W35-V37 VanDerWaalsContact C-N 3.31Å; W35-V37 PolarHBondContact O-N 3.49Å; W35-T38 PolarHBondContact O-N 3.09Å; W35-R39 WeakPolarHBondContact O-CB 3.25Å; W35-R39 PolarHBondContact O-N 3.02Å; W35-E116 WeakPolarHBondContact CH2-OE1 3.01Å
36	A	49.1	Very low	53.3	Low	66 Å²	66	109.8 Å²	109.8	55%	0.545	57%	0.566	S	S	.	*	H	α-helix	trans	-64.5	-38.4	179.5	0	0	0	0	0	111.9	D34 R39 C40	D34-A36 PolarHBondContact O-N 2.85Å; A36-R39 PolarHBondContact O-N 3.45Å; A36-C40 PolarHBondContact O-N 3.44Å; A36-C40 VanDerWaalsContact O-N 3.09Å; A36-C40 PolarHBondContact O-SG 3.1Å
37	V	53.7	Low	54.9	Low	73 Å²	73	107.6 Å²	107.6	44%	0.442	56%	0.558	S	S	.	*	H	α-helix	trans	-71.5	-46	178.6	176.5	0	0	0	0	110.4	D34 W35 R39 C40 F41	D34-V37 PolarHBondContact O-N 3.32Å; D34-V37 VanDerWaalsContact O-N 3.14Å; W35-V37 VanDerWaalsContact C-N 3.31Å; W35-V37 PolarHBondContact O-N 3.49Å; V37-R39 VanDerWaalsContact C-N 3.27Å; V37-R39 PolarHBondContact O-N 2.94Å; V37-C40 PolarHBondContact O-N 3.47Å; V37-F41 HydrophobicContact CG1-CD2 3.72Å; V37-F41 HydrophobicContact CG1-CE2 3.35Å; V37-F41 HydrophobicContact CG1-CZ 4.48Å; V37-F41 WeakPolarHBondContact O-CD2 3.21Å; V37-F41 PolarHBondContact O-N 3.26Å; V37-F41 VanDerWaalsContact O-N 3.1Å
38	T	56.2	Low	56	Low	70 Å²	70	104.1 Å²	104.1	43%	0.429	55%	0.551	S	S	.	*	H	α-helix	trans	-59.6	-37.5	174.1	-54.2	0	0	0	0	111.9	D34 W35 F41 A42	D34-T38 PolarHBondContact O-N 3.24Å; D34-T38 PolarHBondContact O-OG1 3.14Å; W35-T38 PolarHBondContact O-N 3.09Å; T38-F41 PolarHBondContact O-N 3.31Å; T38-A42 VanDerWaalsContact O-CB 3.25Å; T38-A42 WeakPolarHBondContact O-CB 3.39Å; T38-A42 PolarHBondContact O-N 2.86Å
39	R	58.3	Low	57.1	Low	146 Å²	146	99.8 Å²	99.8	55%	0.551	53%	0.528	S	S	*	.	H	α-helix	trans	-66.1	-43.5	176.5	-172.7	175.6	179.6	160.2	4.2	112.2	W35 A36 V37 A42 E43	W35-R39 WeakPolarHBondContact O-CB 3.25Å; W35-R39 PolarHBondContact O-N 3.02Å; A36-R39 PolarHBondContact O-N 3.45Å; V37-R39 VanDerWaalsContact C-N 3.27Å; V37-R39 PolarHBondContact O-N 2.94Å; R39-A42 PolarHBondContact O-N 3.28Å; R39-E43 WeakPolarHBondContact O-CB 3.1Å; R39-E43 PolarHBondContact O-N 3.07Å
40	C	55.8	Low	58.4	Low	75 Å²	75	102 Å²	102	51%	0.507	54%	0.538	S	S	.	.	H	α-helix	trans	-59.9	-47.2	174.8	-67.2	0	0	0	0	111.7	A36 V37 A42 E43 E44	A36-C40 PolarHBondContact O-N 3.44Å; A36-C40 VanDerWaalsContact O-N 3.09Å; A36-C40 PolarHBondContact O-SG 3.1Å; V37-C40 PolarHBondContact O-N 3.47Å; C40-A42 VanDerWaalsContact C-N 3.34Å; C40-A42 PolarHBondContact O-N 3.37Å; C40-E43 PolarHBondContact O-N 3.04Å; C40-E44 PolarHBondContact O-N 3.25Å; C40-E44 VanDerWaalsContact O-N 3.07Å
41	F	59.3	Low	59.7	Low	131 Å²	131	99.4 Å²	99.4	58%	0.575	52%	0.516	S	S	*	.	H	α-helix	trans	-65.8	-35.3	177.5	-72.3	-60.9	0	0	0	113	V37 T38 A45	V37-F41 HydrophobicContact CG1-CD2 3.72Å; V37-F41 HydrophobicContact CG1-CE2 3.35Å; V37-F41 HydrophobicContact CG1-CZ 4.48Å; V37-F41 WeakPolarHBondContact O-CD2 3.21Å; V37-F41 PolarHBondContact O-N 3.26Å; V37-F41 VanDerWaalsContact O-N 3.1Å; T38-F41 PolarHBondContact O-N 3.31Å; F41-A45 VanDerWaalsContact O-CB 3.27Å; F41-A45 WeakPolarHBondContact O-CB 3.3Å; F41-A45 PolarHBondContact O-N 3.4Å
42	A	63.8	Low	60.6	Low	15 Å²	15	95.9 Å²	95.9	12%	0.124	50%	0.497	C	S	.	.	H	α-helix	trans	-67.3	-37.5	175.7	0	0	0	0	0	111.8	T38 R39 C40 F46 I115	T38-A42 VanDerWaalsContact O-CB 3.25Å; T38-A42 WeakPolarHBondContact O-CB 3.39Å; T38-A42 PolarHBondContact O-N 2.86Å; R39-A42 PolarHBondContact O-N 3.28Å; C40-A42 VanDerWaalsContact C-N 3.34Å; C40-A42 PolarHBondContact O-N 3.37Å; A42-F46 WeakPolarHBondContact O-CB 3.39Å; A42-F46 PolarHBondContact O-N 2.88Å; A42-I115 HydrophobicContact CB-CG2 3.97Å
43	E	68.8	Low	61.6	Low	108 Å²	108	96.2 Å²	96.2	51%	0.505	50%	0.499	S	S	.	.	H	α-helix	trans	-70.9	-39.4	179.5	-162.4	150.9	-162.9	0	0	111.8	R39 C40 F46 Q47	R39-E43 WeakPolarHBondContact O-CB 3.1Å; R39-E43 PolarHBondContact O-N 3.07Å; C40-E43 PolarHBondContact O-N 3.04Å; E43-F46 PolarHBondContact O-N 3.13Å; E43-Q47 VanDerWaalsContact O-CG 3.28Å; E43-Q47 WeakPolarHBondContact O-CG 3.48Å; E43-Q47 PolarHBondContact O-N 3.38Å
44	E	69.3	Low	63.1	Low	123 Å²	123	91.9 Å²	91.9	58%	0.575	49%	0.493	S	S	*	.	H	α-helix	trans	-64	-47.6	170.7	-71.4	177.3	173	0	0	112.2	C40 F46 Q47 A48	C40-E44 PolarHBondContact O-N 3.25Å; C40-E44 VanDerWaalsContact O-N 3.07Å; E44-F46 PolarHBondContact O-N 3.23Å; E44-Q47 PolarHBondContact O-N 3.48Å; E44-A48 PolarHBondContact O-N 3.15Å
45	A	69.5	Low	64.7	Low	46 Å²	46	88.5 Å²	88.5	38%	0.38	48%	0.475	S	S	.	.	H	α-helix	trans	-62.6	-32.5	177.8	0	0	0	0	0	112.2	F41 I115	F41-A45 VanDerWaalsContact O-CB 3.27Å; F41-A45 WeakPolarHBondContact O-CB 3.3Å; F41-A45 PolarHBondContact O-N 3.4Å; A45-I115 HydrophobicContact CB-CG2 3.94Å
46	F	72	Confident	66.6	Low	33 Å²	33	83.8 Å²	83.8	15%	0.145	46%	0.459	C	S	.	.	H	α-helix	trans	-72.6	-40.1	175.5	-176.6	-105.6	0	0	0	112.5	A42 E43 E44 A48 I49 F52 K108 A111 R112 I115	A42-F46 WeakPolarHBondContact O-CB 3.39Å; A42-F46 PolarHBondContact O-N 2.88Å; E43-F46 PolarHBondContact O-N 3.13Å; E44-F46 PolarHBondContact O-N 3.23Å; F46-A48 VanDerWaalsContact C-N 3.27Å; F46-A48 PolarHBondContact O-N 3.29Å; F46-I49 PolarHBondContact O-N 3.14Å; F46-F52 HydrophobicContact CD2-CE1 4.15Å; F46-F52 AromaticContact CD2-CZ 3.98Å; F46-F52 HydrophobicContact CD2-CZ 3.98Å; F46-F52 HydrophobicContact CE1-CZ 4.31Å; F46-F52 AromaticContact CE2-CE1 3.48Å; F46-F52 HydrophobicContact CE2-CE1 3.48Å; F46-F52 VanDerWaalsContact CE2-CE1 3.48Å; F46-F52 AromaticContact CE2-CZ 3.41Å; F46-F52 HydrophobicContact CE2-CZ 3.41Å; F46-F52 VanDerWaalsContact CE2-CZ 3.41Å; F46-F52 HydrophobicContact CZ-CE1 4.04Å; F46-F52 HydrophobicContact CZ-CE2 4.42Å; F46-F52 AromaticContact CZ-CZ 3.63Å; F46-F52 HydrophobicContact CZ-CZ 3.63Å; F46-K108 HydrophobicContact CE2-CG 4.06Å; F46-K108 HydrophobicContact CZ-CD 4.07Å; F46-K108 HydrophobicContact CZ-CG 3.49Å; F46-K108 VanDerWaalsContact CZ-CG 3.49Å; F46-A111 HydrophobicContact CE2-CB 4.44Å; F46-R112 HydrophobicContact CD1-CG 4.48Å; F46-R112 HydrophobicContact CD2-CG 3.42Å; F46-R112 VanDerWaalsContact CD2-CG 3.42Å; F46-R112 HydrophobicContact CE1-CG 4.25Å; F46-R112 HydrophobicContact CE2-CB 4.36Å; F46-R112 HydrophobicContact CE2-CG 3.14Å; F46-R112 HydrophobicContact CG-CG 4.09Å; F46-R112 HydrophobicContact CZ-CG 3.57Å; F46-I115 HydrophobicContact CB-CD1 3.91Å; F46-I115 HydrophobicContact CD2-CD1 3.9Å; F46-I115 HydrophobicContact CG-CD1 4.44Å
47	Q	67.8	Low	68.7	Low	141 Å²	141	83.8 Å²	83.8	66%	0.659	45%	0.45	S	S	*	.	H	α-helix	trans	-68.2	-25.9	175.3	-72.9	174.5	23.5	0	0	112.9	E43 E44 I49	E43-Q47 VanDerWaalsContact O-CG 3.28Å; E43-Q47 WeakPolarHBondContact O-CG 3.48Å; E43-Q47 PolarHBondContact O-N 3.38Å; E44-Q47 PolarHBondContact O-N 3.48Å; Q47-I49 PolarHBondContact O-N 2.91Å
48	A	66.2	Low	70.7	Confident	74 Å²	74	80.5 Å²	80.5	61%	0.612	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-15.9	174.6	0	0	0	0	0	113.7	E44 F46 T50	E44-A48 PolarHBondContact O-N 3.15Å; F46-A48 VanDerWaalsContact C-N 3.27Å; F46-A48 PolarHBondContact O-N 3.29Å; A48-T50 PolarHBondContact O-N 3.45Å
49	I	67.1	Low	72.6	Confident	50 Å²	50	77.1 Å²	77.1	26%	0.256	41%	0.41	S	S	.	.			trans	-83.3	100.6	175.2	-57.5	172.9	0	0	0	108.2	F46 Q47 F52 L55 A111 I115	F46-I49 PolarHBondContact O-N 3.14Å; Q47-I49 PolarHBondContact O-N 2.91Å; I49-F52 HydrophobicContact CB-CE1 3.93Å; I49-F52 HydrophobicContact CB-CE2 4.19Å; I49-F52 HydrophobicContact CB-CZ 3.65Å; I49-F52 HydrophobicContact CD1-CE1 4.09Å; I49-F52 HydrophobicContact CD1-CZ 4.44Å; I49-F52 HydrophobicContact CG2-CD1 3.89Å; I49-F52 HydrophobicContact CG2-CD2 4.29Å; I49-F52 HydrophobicContact CG2-CE1 3.6Å; I49-F52 HydrophobicContact CG2-CE2 4.03Å; I49-F52 HydrophobicContact CG2-CG 4.22Å; I49-F52 HydrophobicContact CG2-CZ 3.68Å; I49-F52 VanDerWaalsContact O-CE2 3.27Å; I49-F52 WeakPolarHBondContact O-CE2 3.22Å; I49-L55 HydrophobicContact CG2-CD1 4.1Å; I49-A111 HydrophobicContact CD1-CB 4.38Å; I49-I115 HydrophobicContact CD1-CD1 3.77Å
50	T	64.6	Low	74.5	Confident	142 Å²	142	73.3 Å²	73.3	87%	0.871	40%	0.397	S	S	*	.			trans	-83	-16.8	-176.6	53.4	0	0	0	0	113.7	A48	A48-T50 PolarHBondContact O-N 3.45Å
51	D	68.3	Low	76.4	Confident	73 Å²	73	69.7 Å²	69.7	39%	0.39	37%	0.373	S	S	.	.			trans	-139	115.2	178.1	-158.2	-13.8	0	0	0	111.9	N53	D51-N53 VanDerWaalsContact OD1-CB 3.29Å; D51-N53 WeakPolarHBondContact OD1-CB 3.41Å; D51-N53 PolarHBondContact OD1-N 3.19Å; D51-N53 PolarHBondContact OD1-ND2 2.98Å
52	F	69.4	Low	78.1	Confident	41 Å²	41	64.4 Å²	64.4	18%	0.18	35%	0.352	C	S	.	.			trans	-98.2	-5.3	176.6	-67	-86.4	0	0	0	112.3	F46 I49 D54 L55 K108 A111	F46-F52 HydrophobicContact CD2-CE1 4.15Å; F46-F52 AromaticContact CD2-CZ 3.98Å; F46-F52 HydrophobicContact CD2-CZ 3.98Å; F46-F52 HydrophobicContact CE1-CZ 4.31Å; F46-F52 AromaticContact CE2-CE1 3.48Å; F46-F52 HydrophobicContact CE2-CE1 3.48Å; F46-F52 VanDerWaalsContact CE2-CE1 3.48Å; F46-F52 AromaticContact CE2-CZ 3.41Å; F46-F52 HydrophobicContact CE2-CZ 3.41Å; F46-F52 VanDerWaalsContact CE2-CZ 3.41Å; F46-F52 HydrophobicContact CZ-CE1 4.04Å; F46-F52 HydrophobicContact CZ-CE2 4.42Å; F46-F52 AromaticContact CZ-CZ 3.63Å; F46-F52 HydrophobicContact CZ-CZ 3.63Å; I49-F52 HydrophobicContact CB-CE1 3.93Å; I49-F52 HydrophobicContact CB-CE2 4.19Å; I49-F52 HydrophobicContact CB-CZ 3.65Å; I49-F52 HydrophobicContact CD1-CE1 4.09Å; I49-F52 HydrophobicContact CD1-CZ 4.44Å; I49-F52 HydrophobicContact CG2-CD1 3.89Å; I49-F52 HydrophobicContact CG2-CD2 4.29Å; I49-F52 HydrophobicContact CG2-CE1 3.6Å; I49-F52 HydrophobicContact CG2-CE2 4.03Å; I49-F52 HydrophobicContact CG2-CG 4.22Å; I49-F52 HydrophobicContact CG2-CZ 3.68Å; I49-F52 VanDerWaalsContact O-CE2 3.27Å; I49-F52 WeakPolarHBondContact O-CE2 3.22Å; F52-D54 VanDerWaalsContact C-N 3.3Å; F52-D54 PolarHBondContact O-N 2.99Å; F52-L55 HydrophobicContact CD1-CD1 3.88Å; F52-L55 HydrophobicContact CE1-CD1 4.47Å; F52-L55 PolarHBondContact O-N 3.45Å; F52-K108 HydrophobicContact CE1-CG 4.46Å; F52-A111 HydrophobicContact CD1-CB 4.03Å; F52-A111 HydrophobicContact CE1-CB 3.72Å
53	N	67.5	Low	79.5	Confident	145 Å²	145	67.1 Å²	67.1	78%	0.775	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-30.1	-176	-62.8	-57.8	0	0	0	112	D51 L55	D51-N53 VanDerWaalsContact OD1-CB 3.29Å; D51-N53 WeakPolarHBondContact OD1-CB 3.41Å; D51-N53 PolarHBondContact OD1-N 3.19Å; D51-N53 PolarHBondContact OD1-ND2 2.98Å; N53-L55 VanDerWaalsContact C-N 3.31Å
54	D	76.3	Confident	80.8	Confident	142 Å²	142	62 Å²	62	76%	0.759	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-7	178	-65.5	-20.9	0	0	0	113.3	F52	F52-D54 VanDerWaalsContact C-N 3.3Å; F52-D54 PolarHBondContact O-N 2.99Å
55	L	84.9	Confident	82	Confident	44 Å²	44	58.8 Å²	58.8	23%	0.23	33%	0.325	C	S	.	.	S	Bend	trans	-86.8	135.6	-176.9	-70.7	177.7	0	0	0	111.3	I49 F52 N53 P107 A111 F131	I49-L55 HydrophobicContact CG2-CD1 4.1Å; F52-L55 HydrophobicContact CD1-CD1 3.88Å; F52-L55 HydrophobicContact CE1-CD1 4.47Å; F52-L55 PolarHBondContact O-N 3.45Å; N53-L55 VanDerWaalsContact C-N 3.31Å; L55-P107 HydrophobicContact CB-CB 4.26Å; L55-P107 VanDerWaalsContact O-CB 3.26Å; L55-P107 WeakPolarHBondContact O-CB 3.26Å; L55-A111 HydrophobicContact CD1-CB 4.12Å; L55-F131 HydrophobicContact CD1-CE2 4.4Å; L55-F131 HydrophobicContact CD1-CZ 4.17Å; L55-F131 HydrophobicContact CD2-CD2 3.96Å; L55-F131 HydrophobicContact CD2-CE2 3.63Å; L55-F131 HydrophobicContact CD2-CZ 4.03Å
56	P	90.8	Very high	83.2	Confident	21 Å²	21	58.6 Å²	58.6	14%	0.136	32%	0.317	C	S	.	.			trans	-73.8	147.3	175.6	31.9	-34.5	0	0	0	110.4	S58 F131 A132 V134	P56-S58 PolarHBondContact O-N 3.31Å; P56-S58 VanDerWaalsContact O-N 3.15Å; P56-F131 HydrophobicContact CG-CB 3.53Å; P56-F131 HydrophobicContact CG-CD1 3.64Å; P56-F131 HydrophobicContact CG-CG 3.76Å; P56-A132 WeakPolarHBondContact CB-O 3.47Å; P56-A132 WeakPolarHBondContact CG-O 3.21Å; P56-V134 HydrophobicContact CB-CG2 3.41Å; P56-V134 VanDerWaalsContact CB-CG2 3.41Å
57	N	93.6	Very high	84.2	Confident	66 Å²	66	57.9 Å²	57.9	35%	0.353	32%	0.316	S	S	.	.	S	Bend	trans	-75.4	4.9	177.8	68.6	0.6	0	0	0	114.1	F104	N57-F104 WeakPolarHBondContact O-CB 3.39Å; N57-F104 WeakPolarHBondContact O-CD2 3.47Å; N57-F104 PolarHBondContact O-N 2.99Å
58	S	95.3	Very high	85.5	Confident	4 Å²	4	51.2 Å²	51.2	3%	0.028	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	141.1	-168.4	-63.2	0	0	0	0	111.5	P56 I102 N103 A132	P56-S58 PolarHBondContact O-N 3.31Å; P56-S58 VanDerWaalsContact O-N 3.15Å; S58-I102 CarbonylContact C-O 3.56Å; S58-I102 VanDerWaalsContact CA-O 3.27Å; S58-I102 WeakPolarHBondContact CA-O 3.32Å; S58-N103 PolarHBondContact OG-OD1 3.15Å; S58-A132 PolarHBondContact O-N 3.43Å
59	L	96.7	Very high	86.9	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	150.5	176.2	-64.1	179.1	0	0	0	111.7	R101 I102 F104 A110 A113 R114 L129 Y130 F131	L59-R101 CarbonylContact O-C 3.5Å; L59-R101 WeakPolarHBondContact O-CA 3.42Å; L59-I102 HydrophobicContact CB-CB 4.47Å; L59-I102 PolarHBondContact N-O 3.11Å; L59-I102 PolarHBondContact O-N 3.08Å; L59-F104 HydrophobicContact CB-CE2 4.3Å; L59-F104 HydrophobicContact CD1-CE2 3.78Å; L59-F104 HydrophobicContact CD1-CZ 4.17Å; L59-F104 HydrophobicContact CG-CE2 3.92Å; L59-A110 HydrophobicContact CG-CB 4.38Å; L59-A113 HydrophobicContact CD1-CB 4.44Å; L59-R114 HydrophobicContact CD1-CB 4.07Å; L59-R114 HydrophobicContact CD2-CB 4.16Å; L59-L129 HydrophobicContact CD1-CD1 4.49Å; L59-Y130 CarbonylContact C-O 3.57Å; L59-Y130 VanDerWaalsContact CA-O 3.24Å; L59-Y130 WeakPolarHBondContact CA-O 3.17Å; L59-F131 HydrophobicContact CD2-CD1 3.38Å; L59-F131 HydrophobicContact CD2-CE1 3.6Å; L59-F131 HydrophobicContact CD2-CG 4.06Å; L59-F131 HydrophobicContact CD2-CZ 4.41Å
60	F	96.8	Very high	88.1	Confident	65 Å²	65	52.4 Å²	52.4	29%	0.285	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	119.4	160.4	-78	-74.5	0	0	0	109.9	F94 V100 R101 L129 Y130 A132	F60-F94 HydrophobicContact CE1-CE2 4.13Å; F60-V100 WeakPolarHBondContact CA-O 3.4Å; F60-R101 HydrophobicContact CD1-CB 4.01Å; F60-R101 HydrophobicContact CE1-CB 3.72Å; F60-R101 HydrophobicContact CE1-CG 4.26Å; F60-R101 HydrophobicContact CZ-CB 4.39Å; F60-R101 HydrophobicContact CZ-CG 4.46Å; F60-L129 WeakPolarHBondContact O-CA 3.28Å; F60-Y130 PolarHBondContact N-O 2.98Å; F60-Y130 PolarHBondContact O-N 2.81Å; F60-A132 HydrophobicContact CD2-CB 3.71Å; F60-A132 HydrophobicContact CE2-CB 3.53Å
61	A	97	Very high	89.4	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	114.8	163.6	0	0	0	0	0	109.8	V64 F78 R99 V100 I102 L129	A61-V64 HydrophobicContact CB-CG2 3.89Å; A61-V64 WeakPolarHBondContact O-CG2 3.27Å; A61-F78 HydrophobicContact CB-CZ 3.9Å; A61-R99 CarbonylContact O-C 3.59Å; A61-R99 WeakPolarHBondContact O-CA 3.27Å; A61-V100 HydrophobicContact CB-CB 4.4Å; A61-V100 PolarHBondContact N-O 2.89Å; A61-V100 PolarHBondContact O-N 2.81Å; A61-I102 HydrophobicContact CB-CD1 3.95Å; A61-L129 HydrophobicContact CB-CD2 3.62Å
62	C	95.1	Very high	90.7	Very high	20 Å²	20	49.3 Å²	49.3	14%	0.135	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	159.8	175.6	-70.3	0	0	0	0	110.5	V64 K128 Y130	C62-V64 VanDerWaalsContact C-N 3.26Å; C62-V64 PolarHBondContact O-N 3.03Å; C62-K128 HydrophobicContact CB-CB 4.01Å; C62-K128 PolarHBondContact N-O 2.8Å; C62-K128 PolarHBondContact O-N 3.46Å; C62-K128 VanDerWaalsContact O-N 3.16Å; C62-Y130 HydrophobicContact CB-CD2 4.34Å; C62-Y130 HydrophobicContact CB-CE2 3.97Å
63	N	92.8	Very high	91.9	Very high	71 Å²	71	52.8 Å²	52.8	38%	0.38	28%	0.278	S	S	.	.	S	Bend	trans	62.4	31.6	-179.8	-165.2	42.6	0	0	0	113.6	R98 K126	N63-R98 PolarHBondContact N-O 3.26Å; N63-K126 PolarHBondContact ND2-O 3.15Å
64	V	95.3	Very high	93.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.244	C	C	.	.			trans	-69	140.7	-179.6	-176.8	0	0	0	0	110.2	A61 C62 V68 F69 F78 R98 V100 L127	A61-V64 HydrophobicContact CB-CG2 3.89Å; A61-V64 WeakPolarHBondContact O-CG2 3.27Å; C62-V64 VanDerWaalsContact C-N 3.26Å; C62-V64 PolarHBondContact O-N 3.03Å; V64-V68 HydrophobicContact CG1-CB 3.7Å; V64-V68 HydrophobicContact CG1-CG1 3.83Å; V64-V68 HydrophobicContact CG1-CG2 3.7Å; V64-F69 HydrophobicContact CB-CE2 3.87Å; V64-F69 HydrophobicContact CB-CZ 3.99Å; V64-F69 HydrophobicContact CG1-CE2 3.84Å; V64-F69 HydrophobicContact CG1-CZ 4.08Å; V64-F78 HydrophobicContact CG1-CD2 4.36Å; V64-F78 HydrophobicContact CG1-CE2 4.05Å; V64-F78 HydrophobicContact CG1-CZ 4.3Å; V64-F78 HydrophobicContact CG2-CE2 4.24Å; V64-F78 HydrophobicContact CG2-CZ 4.12Å; V64-R98 PolarHBondContact N-O 3.33Å; V64-V100 HydrophobicContact CG1-CG2 4.42Å; V64-V100 HydrophobicContact CG2-CG2 4.17Å; V64-L127 HydrophobicContact CG2-CD2 4.37Å
65	H	95.4	Very high	94.1	Very high	56 Å²	56	42 Å²	42	26%	0.259	22%	0.219	S	C	.	.			trans	-64.3	141.7	-179.9	-169.6	-93.4	0	0	0	111.4	S67 V68 R123 K125	H65-S67 WeakPolarHBondContact ND1-CB 3.42Å; H65-S67 PolarHBondContact ND1-N 3.14Å; H65-S67 PolarHBondContact ND1-OG 3.46Å; H65-S67 PolarHBondContact O-N 3.09Å; H65-S67 VanDerWaalsContact O-N 3.15Å; H65-V68 WeakPolarHBondContact O-CB 3.25Å; H65-V68 PolarHBondContact O-N 2.89Å; H65-V68 VanDerWaalsContact O-N 3.08Å; H65-R123 HydrophobicContact CB-CB 4.1Å; H65-K125 HydrophobicContact CB-CD 4.42Å
66	Q	93.9	Very high	94.6	Very high	42 Å²	42	46.2 Å²	46.2	20%	0.196	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-57.2	-35.9	-173.8	-174.6	68.7	34.2	0	0	112.3	V68 F69 E70	Q66-V68 PolarHBondContact O-N 2.95Å; Q66-V68 VanDerWaalsContact O-N 3.11Å; Q66-F69 PolarHBondContact O-N 3.06Å; Q66-E70 VanDerWaalsContact CG-OE1 3.29Å; Q66-E70 WeakPolarHBondContact CG-OE1 3.44Å; Q66-E70 PolarHBondContact NE2-OE1 3.01Å
67	S	93.8	Very high	94.8	Very high	19 Å²	19	50.4 Å²	50.4	13%	0.133	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-59	-25.7	-179.3	68.4	0	0	0	0	113.8	H65 F69 E70 G71 S74 R123	H65-S67 WeakPolarHBondContact ND1-CB 3.42Å; H65-S67 PolarHBondContact ND1-N 3.14Å; H65-S67 PolarHBondContact ND1-OG 3.46Å; H65-S67 PolarHBondContact O-N 3.09Å; H65-S67 VanDerWaalsContact O-N 3.15Å; S67-F69 PolarHBondContact O-N 3.14Å; S67-E70 PolarHBondContact O-N 3.23Å; S67-G71 PolarHBondContact O-N 2.83Å; S67-S74 VanDerWaalsContact O-CB 3.25Å; S67-S74 WeakPolarHBondContact O-CB 3.41Å; S67-S74 PolarHBondContact OG-OG 3.05Å; S67-R123 VanDerWaalsContact OG-CD 3.27Å; S67-R123 WeakPolarHBondContact OG-CD 3.43Å; S67-R123 PolarHBondContact OG-NH1 2.74Å
68	V	95.3	Very high	95	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.006	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-64.1	-24.4	175.7	177.7	0	0	0	0	111.7	V64 H65 Q66 F78 F122	V64-V68 HydrophobicContact CG1-CB 3.7Å; V64-V68 HydrophobicContact CG1-CG1 3.83Å; V64-V68 HydrophobicContact CG1-CG2 3.7Å; H65-V68 WeakPolarHBondContact O-CB 3.25Å; H65-V68 PolarHBondContact O-N 2.89Å; H65-V68 VanDerWaalsContact O-N 3.08Å; Q66-V68 PolarHBondContact O-N 2.95Å; Q66-V68 VanDerWaalsContact O-N 3.11Å; V68-F78 HydrophobicContact CG1-CB 3.99Å; V68-F78 HydrophobicContact CG1-CD1 3.89Å; V68-F78 HydrophobicContact CG1-CG 3.88Å; V68-F78 HydrophobicContact CG2-CB 4Å; V68-F78 HydrophobicContact CG2-CD2 4.31Å; V68-F78 HydrophobicContact CG2-CG 4.19Å; V68-F122 HydrophobicContact CG2-CD1 4.45Å; V68-F122 HydrophobicContact CG2-CE1 3.57Å; V68-F122 HydrophobicContact CG2-CZ 4.33Å
69	F	95.1	Very high	95.1	Very high	23 Å²	23	48.2 Å²	48.2	10%	0.101	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-99.6	3.9	-179.5	-54.7	-84.9	0	0	0	113.6	V64 Q66 S67 L93 K95 R98 V100	V64-F69 HydrophobicContact CB-CE2 3.87Å; V64-F69 HydrophobicContact CB-CZ 3.99Å; V64-F69 HydrophobicContact CG1-CE2 3.84Å; V64-F69 HydrophobicContact CG1-CZ 4.08Å; Q66-F69 PolarHBondContact O-N 3.06Å; S67-F69 PolarHBondContact O-N 3.14Å; F69-L93 HydrophobicContact CD1-CB 4.02Å; F69-L93 HydrophobicContact CD1-CD2 3.89Å; F69-L93 HydrophobicContact CD1-CG 4.43Å; F69-L93 HydrophobicContact CE1-CB 3.97Å; F69-L93 HydrophobicContact CE1-CD2 4.21Å; F69-L93 HydrophobicContact CE1-CG 4.36Å; F69-K95 HydrophobicContact CB-CB 4.24Å; F69-K95 HydrophobicContact CB-CD 3.98Å; F69-K95 HydrophobicContact CB-CG 3.78Å; F69-K95 HydrophobicContact CD1-CB 3.93Å; F69-K95 HydrophobicContact CD1-CG 4.34Å; F69-K95 HydrophobicContact CG-CB 4.25Å; F69-K95 HydrophobicContact CG-CG 4.15Å; F69-K95 PolarHBondContact O-NZ 3.44Å; F69-K95 VanDerWaalsContact O-NZ 3.17Å; F69-R98 HydrophobicContact CE2-CB 4.33Å; F69-R98 HydrophobicContact CE2-CG 4.5Å; F69-V100 HydrophobicContact CE1-CG2 3.93Å; F69-V100 HydrophobicContact CZ-CG2 3.9Å
70	E	93	Very high	95	Very high	126 Å²	126	49.8 Å²	49.8	59%	0.589	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.1	-37.3	-171.2	-73.2	171.5	-174.2	0	0	112.9	Q66 S67 K95	Q66-E70 VanDerWaalsContact CG-OE1 3.29Å; Q66-E70 WeakPolarHBondContact CG-OE1 3.44Å; Q66-E70 PolarHBondContact NE2-OE1 3.01Å; S67-E70 PolarHBondContact O-N 3.23Å; E70-K95 IonicContact OE1-NZ 2.81Å
71	G	91.9	Very high	95	Very high	28 Å²	28	49.3 Å²	49.3	29%	0.289	26%	0.256	S	S	.	.			trans	-116.5	130.9	-179	0	0	0	0	0	112.4	S67 D73 S74 K75	S67-G71 PolarHBondContact O-N 2.83Å; G71-D73 PolarHBondContact O-N 3.32Å; G71-S74 WeakPolarHBondContact O-CB 3.49Å; G71-S74 PolarHBondContact O-N 3.41Å; G71-S74 VanDerWaalsContact O-N 3.14Å; G71-K75 PolarHBondContact O-N 3.14Å; G71-K75 VanDerWaalsContact O-N 3.09Å
72	E	94.6	Very high	95	Very high	121 Å²	121	49.3 Å²	49.3	57%	0.565	26%	0.256	S	S	*	.	H	α-helix	trans	-61.1	-44.4	-178.5	-160.8	60.8	-145.2	0	0	111.7	S74 K75 E76	E72-S74 PolarHBondContact O-N 3.34Å; E72-S74 VanDerWaalsContact O-N 3.14Å; E72-K75 CarbonylContact O-C 3.59Å; E72-K75 WeakPolarHBondContact O-CA 3.21Å; E72-K75 WeakPolarHBondContact O-CB 3.41Å; E72-K75 PolarHBondContact O-N 3.46Å; E72-K75 IonicContact OE1-NZ 3.47Å; E72-K75 PolarHBondContact OE1-NZ 3.42Å; E72-K75 IonicContact OE2-NZ 3.9Å; E72-K75 PolarHBondContact OE2-NZ 3.44Å; E72-E76 PolarHBondContact O-N 2.99Å
73	D	94.9	Very high	95	Very high	114 Å²	114	54.3 Å²	54.3	61%	0.61	27%	0.272	S	S	*	.	H	α-helix	trans	-58.6	-33.4	177.1	-50.9	-16.5	0	0	0	113.1	G71 K77	G71-D73 PolarHBondContact O-N 3.32Å; D73-K77 WeakPolarHBondContact O-CB 3.38Å; D73-K77 WeakPolarHBondContact O-CD 3.44Å; D73-K77 WeakPolarHBondContact O-CG 3.49Å; D73-K77 PolarHBondContact O-N 2.81Å
74	S	93.6	Very high	95.2	Very high	11 Å²	11	56.6 Å²	56.6	8%	0.077	29%	0.289	C	S	.	.	H	α-helix	trans	-75.2	-36.7	179.5	-55.1	0	0	0	0	111.4	S67 G71 E72 F78 R123	S67-S74 VanDerWaalsContact O-CB 3.25Å; S67-S74 WeakPolarHBondContact O-CB 3.41Å; S67-S74 PolarHBondContact OG-OG 3.05Å; G71-S74 WeakPolarHBondContact O-CB 3.49Å; G71-S74 PolarHBondContact O-N 3.41Å; G71-S74 VanDerWaalsContact O-N 3.14Å; E72-S74 PolarHBondContact O-N 3.34Å; E72-S74 VanDerWaalsContact O-N 3.14Å; S74-F78 WeakPolarHBondContact O-CB 3.37Å; S74-F78 PolarHBondContact O-N 3.23Å; S74-F78 VanDerWaalsContact O-N 3.14Å; S74-R123 VanDerWaalsContact CB-CZ 3.49Å; S74-R123 PolarHBondContact OG-NH1 2.77Å; S74-R123 PolarHBondContact OG-NH2 2.95Å
75	K	95.5	Very high	95.1	Very high	51 Å²	51	58 Å²	58	22%	0.222	29%	0.294	C	S	.	.	H	α-helix	trans	-69.1	-48.8	177	178.5	179	153	-129.7	0	110.6	G71 E72 K77 F78 E79 L93	G71-K75 PolarHBondContact O-N 3.14Å; G71-K75 VanDerWaalsContact O-N 3.09Å; E72-K75 CarbonylContact O-C 3.59Å; E72-K75 WeakPolarHBondContact O-CA 3.21Å; E72-K75 WeakPolarHBondContact O-CB 3.41Å; E72-K75 PolarHBondContact O-N 3.46Å; E72-K75 IonicContact OE1-NZ 3.47Å; E72-K75 PolarHBondContact OE1-NZ 3.42Å; E72-K75 IonicContact OE2-NZ 3.9Å; E72-K75 PolarHBondContact OE2-NZ 3.44Å; K75-K77 PolarHBondContact O-N 3Å; K75-F78 CarbonylContact O-C 3.59Å; K75-F78 WeakPolarHBondContact O-CA 3.38Å; K75-F78 WeakPolarHBondContact O-CB 3.27Å; K75-F78 PolarHBondContact O-N 2.93Å; K75-E79 WeakPolarHBondContact CE-OE1 3.34Å; K75-E79 HydrophobicContact CG-CG 4.43Å; K75-E79 WeakPolarHBondContact O-CG 3.13Å; K75-E79 PolarHBondContact O-N 3.3Å; K75-L93 HydrophobicContact CD-CD2 4.32Å
76	E	96.3	Very high	95.1	Very high	132 Å²	132	56.1 Å²	56.1	62%	0.617	29%	0.287	S	S	*	.	H	α-helix	trans	-58.4	-46.5	177.6	-173.2	180	-160	0	0	111.5	E72 F78 E79 G80	E72-E76 PolarHBondContact O-N 2.99Å; E76-F78 VanDerWaalsContact C-N 3.28Å; E76-F78 PolarHBondContact O-N 3.11Å; E76-E79 PolarHBondContact O-N 3.05Å; E76-G80 PolarHBondContact O-N 3.28Å
77	K	95.8	Very high	95.1	Very high	108 Å²	108	61.2 Å²	61.2	47%	0.47	32%	0.315	S	S	.	.	H	α-helix	trans	-61.1	-36.2	174.9	-73.2	173.6	-176.1	178.3	0	112.9	D73 K75	D73-K77 WeakPolarHBondContact O-CB 3.38Å; D73-K77 WeakPolarHBondContact O-CD 3.44Å; D73-K77 WeakPolarHBondContact O-CG 3.49Å; D73-K77 PolarHBondContact O-N 2.81Å; K75-K77 PolarHBondContact O-N 3Å
78	F	96.8	Very high	95.1	Very high	2 Å²	2	64.8 Å²	64.8	1%	0.009	34%	0.339	C	S	.	.	H	α-helix	trans	-70.6	-47.3	176.7	175.8	-94.3	0	0	0	111.5	A61 V64 V68 S74 K75 E76 G80 L81 F82 V100 F122 L127	A61-F78 HydrophobicContact CB-CZ 3.9Å; V64-F78 HydrophobicContact CG1-CD2 4.36Å; V64-F78 HydrophobicContact CG1-CE2 4.05Å; V64-F78 HydrophobicContact CG1-CZ 4.3Å; V64-F78 HydrophobicContact CG2-CE2 4.24Å; V64-F78 HydrophobicContact CG2-CZ 4.12Å; V68-F78 HydrophobicContact CG1-CB 3.99Å; V68-F78 HydrophobicContact CG1-CD1 3.89Å; V68-F78 HydrophobicContact CG1-CG 3.88Å; V68-F78 HydrophobicContact CG2-CB 4Å; V68-F78 HydrophobicContact CG2-CD2 4.31Å; V68-F78 HydrophobicContact CG2-CG 4.19Å; S74-F78 WeakPolarHBondContact O-CB 3.37Å; S74-F78 PolarHBondContact O-N 3.23Å; S74-F78 VanDerWaalsContact O-N 3.14Å; K75-F78 CarbonylContact O-C 3.59Å; K75-F78 WeakPolarHBondContact O-CA 3.38Å; K75-F78 WeakPolarHBondContact O-CB 3.27Å; K75-F78 PolarHBondContact O-N 2.93Å; E76-F78 VanDerWaalsContact C-N 3.28Å; E76-F78 PolarHBondContact O-N 3.11Å; F78-G80 VanDerWaalsContact C-N 3.3Å; F78-G80 PolarHBondContact O-N 2.83Å; F78-L81 WeakPolarHBondContact O-CB 3.15Å; F78-L81 PolarHBondContact O-N 3.21Å; F78-F82 HydrophobicContact CD1-CE2 4.35Å; F78-F82 HydrophobicContact CD2-CE2 4.35Å; F78-F82 HydrophobicContact CE1-CD2 4.31Å; F78-F82 AromaticContact CE1-CE2 3.8Å; F78-F82 HydrophobicContact CE1-CE2 3.8Å; F78-F82 AromaticContact CE2-CE2 3.81Å; F78-F82 HydrophobicContact CE2-CE2 3.81Å; F78-F82 HydrophobicContact CE2-CZ 4.41Å; F78-F82 HydrophobicContact CZ-CD2 4.43Å; F78-F82 AromaticContact CZ-CE2 3.5Å; F78-F82 HydrophobicContact CZ-CE2 3.5Å; F78-F82 HydrophobicContact CZ-CZ 4.14Å; F78-F82 WeakPolarHBondContact O-CD2 3.45Å; F78-V100 HydrophobicContact CE1-CB 4.18Å; F78-V100 HydrophobicContact CE1-CG1 4.16Å; F78-V100 HydrophobicContact CE1-CG2 4.1Å; F78-V100 HydrophobicContact CZ-CB 4.45Å; F78-V100 HydrophobicContact CZ-CG2 4.4Å; F78-F122 HydrophobicContact CB-CE1 4.07Å; F78-F122 HydrophobicContact CB-CE2 4.37Å; F78-F122 HydrophobicContact CB-CZ 3.69Å; F78-F122 HydrophobicContact CD2-CD1 4.15Å; F78-F122 AromaticContact CD2-CE1 3.97Å; F78-F122 HydrophobicContact CD2-CE1 3.97Å; F78-F122 HydrophobicContact CD2-CZ 4.21Å; F78-F122 HydrophobicContact CG-CE1 4.49Å; F78-F122 HydrophobicContact CG-CZ 4.47Å; F78-L127 HydrophobicContact CE2-CD1 4.25Å; F78-L127 HydrophobicContact CE2-CD2 3.92Å
79	E	96.8	Very high	95.2	Very high	23 Å²	23	65.4 Å²	65.4	11%	0.107	34%	0.343	C	S	.	.	H	α-helix	trans	-62.1	-38.6	177.2	-69.9	-173	-169.3	0	0	111.6	K75 E76 L81 F82 R83 F91	K75-E79 WeakPolarHBondContact CE-OE1 3.34Å; K75-E79 HydrophobicContact CG-CG 4.43Å; K75-E79 WeakPolarHBondContact O-CG 3.13Å; K75-E79 PolarHBondContact O-N 3.3Å; E76-E79 PolarHBondContact O-N 3.05Å; E79-L81 PolarHBondContact O-N 2.75Å; E79-F82 PolarHBondContact O-N 2.68Å; E79-R83 PolarHBondContact O-N 3.13Å; E79-R83 IonicContact OE2-CZ 3.92Å; E79-R83 IonicContact OE2-NE 4Å; E79-R83 IonicContact OE2-NH2 3.01Å; E79-R83 PolarHBondContact OE2-NH2 3.49Å; E79-F91 HydrophobicContact CB-CD2 4.29Å; E79-F91 HydrophobicContact CB-CE1 4.22Å; E79-F91 HydrophobicContact CB-CE2 3.75Å; E79-F91 HydrophobicContact CB-CZ 3.69Å; E79-F91 HydrophobicContact CG-CD1 4.01Å; E79-F91 HydrophobicContact CG-CD2 3.7Å; E79-F91 HydrophobicContact CG-CE1 3.99Å; E79-F91 HydrophobicContact CG-CE2 3.68Å; E79-F91 HydrophobicContact CG-CG 3.87Å; E79-F91 HydrophobicContact CG-CZ 3.82Å
80	G	95.9	Very high	95.3	Very high	32 Å²	32	67.7 Å²	67.7	33%	0.33	36%	0.359	S	S	.	.	H	α-helix	trans	-57.5	-31.9	177.8	0	0	0	0	0	113.9	E76 F78 F82 R83 T84	E76-G80 PolarHBondContact O-N 3.28Å; F78-G80 VanDerWaalsContact C-N 3.3Å; F78-G80 PolarHBondContact O-N 2.83Å; G80-F82 VanDerWaalsContact C-N 3.29Å; G80-F82 PolarHBondContact O-N 3.29Å; G80-R83 PolarHBondContact O-N 3.3Å; G80-T84 PolarHBondContact O-N 2.94Å; G80-T84 PolarHBondContact O-OG1 3.02Å; G80-T84 VanDerWaalsContact O-OG1 3.04Å
81	L	95.6	Very high	95.5	Very high	55 Å²	55	63.4 Å²	63.4	29%	0.288	34%	0.338	S	S	.	.	H	α-helix	trans	-57.9	-44.2	173.7	-64.8	173.7	0	0	0	111.2	F78 E79 Y85 L117 F122 L127	F78-L81 WeakPolarHBondContact O-CB 3.15Å; F78-L81 PolarHBondContact O-N 3.21Å; E79-L81 PolarHBondContact O-N 2.75Å; L81-Y85 VanDerWaalsContact O-CD2 3.31Å; L81-Y85 WeakPolarHBondContact O-CD2 3.31Å; L81-Y85 WeakPolarHBondContact O-CE2 3.39Å; L81-L117 HydrophobicContact CB-CD1 4.15Å; L81-F122 HydrophobicContact CD1-CD2 3.69Å; L81-F122 HydrophobicContact CD1-CE2 3.98Å; L81-F122 HydrophobicContact CD1-CG 4.48Å; L81-L127 HydrophobicContact CD1-CD1 4.49Å
82	F	97	Very high	95.7	Very high	0 Å²	0	66 Å²	66	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-84.9	-30.1	-175.9	-59.8	-81.6	0	0	0	112.6	F78 E79 G80 T84 Y85 V89 F91 I102 F104 A113 L117 L129	F78-F82 HydrophobicContact CD1-CE2 4.35Å; F78-F82 HydrophobicContact CD2-CE2 4.35Å; F78-F82 HydrophobicContact CE1-CD2 4.31Å; F78-F82 AromaticContact CE1-CE2 3.8Å; F78-F82 HydrophobicContact CE1-CE2 3.8Å; F78-F82 AromaticContact CE2-CE2 3.81Å; F78-F82 HydrophobicContact CE2-CE2 3.81Å; F78-F82 HydrophobicContact CE2-CZ 4.41Å; F78-F82 HydrophobicContact CZ-CD2 4.43Å; F78-F82 AromaticContact CZ-CE2 3.5Å; F78-F82 HydrophobicContact CZ-CE2 3.5Å; F78-F82 HydrophobicContact CZ-CZ 4.14Å; F78-F82 WeakPolarHBondContact O-CD2 3.45Å; E79-F82 PolarHBondContact O-N 2.68Å; G80-F82 VanDerWaalsContact C-N 3.29Å; G80-F82 PolarHBondContact O-N 3.29Å; F82-T84 PolarHBondContact O-N 3.38Å; F82-Y85 PolarHBondContact O-N 2.95Å; F82-Y85 VanDerWaalsContact O-N 3.11Å; F82-V89 HydrophobicContact CB-CG1 4.49Å; F82-F91 HydrophobicContact CB-CE1 4.01Å; F82-F91 HydrophobicContact CB-CZ 3.98Å; F82-F91 AromaticContact CD2-CE1 3.97Å; F82-F91 HydrophobicContact CD2-CE1 3.97Å; F82-F91 HydrophobicContact CG-CE1 4.24Å; F82-I102 HydrophobicContact CB-CG2 4.32Å; F82-I102 HydrophobicContact CD1-CD1 3.78Å; F82-I102 HydrophobicContact CD1-CG2 4.39Å; F82-I102 HydrophobicContact CD2-CD1 3.85Å; F82-I102 HydrophobicContact CE1-CD1 3.52Å; F82-I102 HydrophobicContact CE2-CD1 3.62Å; F82-I102 HydrophobicContact CG-CD1 3.92Å; F82-I102 HydrophobicContact CG-CG2 4.3Å; F82-I102 HydrophobicContact CZ-CD1 3.44Å; F82-I102 VanDerWaalsContact CZ-CD1 3.44Å; F82-F104 HydrophobicContact CB-CE1 4.48Å; F82-F104 HydrophobicContact CB-CZ 4.38Å; F82-F104 AromaticContact CD1-CZ 3.95Å; F82-F104 HydrophobicContact CD1-CZ 3.95Å; F82-A113 HydrophobicContact CD1-CB 4.31Å; F82-L117 HydrophobicContact CD1-CD1 3.72Å; F82-L117 HydrophobicContact CE1-CD1 3.53Å; F82-L117 HydrophobicContact CG-CD1 4.39Å; F82-L117 HydrophobicContact CZ-CD1 4.02Å; F82-L129 HydrophobicContact CE1-CD1 4.05Å; F82-L129 HydrophobicContact CE1-CD2 3.96Å; F82-L129 HydrophobicContact CZ-CD1 4.47Å; F82-L129 HydrophobicContact CZ-CD2 3.94Å
83	R	96.2	Very high	95.7	Very high	126 Å²	126	63.3 Å²	63.3	48%	0.475	33%	0.332	S	S	.	.	H	α-helix	trans	-62.1	-25.6	175.7	-70.4	-169.6	-166.6	-163.1	7.2	113.3	E79 G80 Y85 D86	E79-R83 PolarHBondContact O-N 3.13Å; E79-R83 IonicContact OE2-CZ 3.92Å; E79-R83 IonicContact OE2-NE 4Å; E79-R83 IonicContact OE2-NH2 3.01Å; E79-R83 PolarHBondContact OE2-NH2 3.49Å; G80-R83 PolarHBondContact O-N 3.3Å; R83-Y85 PolarHBondContact O-N 2.74Å; R83-Y85 VanDerWaalsContact O-N 3.13Å; R83-D86 WeakPolarHBondContact CA-O 3.36Å; R83-D86 CarbonylContact O-C 3.35Å; R83-D86 PolarHBondContact O-N 3.34Å; R83-D86 VanDerWaalsContact O-O 3.13Å
84	T	95.6	Very high	95.7	Very high	118 Å²	118	61.7 Å²	61.7	72%	0.724	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-25.7	174.6	-52.3	0	0	0	0	113.1	G80 F82	G80-T84 PolarHBondContact O-N 2.94Å; G80-T84 PolarHBondContact O-OG1 3.02Å; G80-T84 VanDerWaalsContact O-OG1 3.04Å; F82-T84 PolarHBondContact O-N 3.38Å
85	Y	94.7	Very high	95.7	Very high	29 Å²	29	65.9 Å²	65.9	11%	0.114	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-20.5	-177.8	-58	-90.7	0	0	0	113.3	L81 F82 R83 S109 R112 A113 E116 L117	L81-Y85 VanDerWaalsContact O-CD2 3.31Å; L81-Y85 WeakPolarHBondContact O-CD2 3.31Å; L81-Y85 WeakPolarHBondContact O-CE2 3.39Å; F82-Y85 PolarHBondContact O-N 2.95Å; F82-Y85 VanDerWaalsContact O-N 3.11Å; R83-Y85 PolarHBondContact O-N 2.74Å; R83-Y85 VanDerWaalsContact O-N 3.13Å; Y85-S109 WeakPolarHBondContact O-CB 3.34Å; Y85-S109 PolarHBondContact O-OG 3.46Å; Y85-R112 HydrophobicContact CD1-CB 3.95Å; Y85-R112 HydrophobicContact CE1-CB 4.3Å; Y85-A113 HydrophobicContact CD1-CB 4.26Å; Y85-A113 HydrophobicContact CD2-CB 3.88Å; Y85-A113 HydrophobicContact CE2-CB 4.23Å; Y85-A113 HydrophobicContact CG-CB 3.9Å; Y85-E116 HydrophobicContact CE1-CB 4.39Å; Y85-E116 WeakPolarHBondContact CE1-OE2 3.42Å; Y85-E116 WeakPolarHBondContact OH-CB 3.45Å; Y85-E116 VanDerWaalsContact OH-CG 3.3Å; Y85-E116 WeakPolarHBondContact OH-CG 3.16Å; Y85-E116 PolarHBondContact OH-OE1 3.41Å; Y85-E116 PolarHBondContact OH-OE2 3.38Å; Y85-L117 HydrophobicContact CE2-CD1 3.74Å; Y85-L117 HydrophobicContact CE2-CD2 4.48Å; Y85-L117 HydrophobicContact CE2-CG 4.08Å
86	D	95.1	Very high	95.6	Very high	18 Å²	18	69 Å²	69	10%	0.096	36%	0.364	C	S	.	.			trans	-166.2	125.1	-175.9	-177.5	-3.3	0	0	0	109.8	R83 C88 V89 F104 S105	R83-D86 WeakPolarHBondContact CA-O 3.36Å; R83-D86 CarbonylContact O-C 3.35Å; R83-D86 PolarHBondContact O-N 3.34Å; R83-D86 VanDerWaalsContact O-O 3.13Å; D86-C88 VanDerWaalsContact C-N 3.28Å; D86-C88 PolarHBondContact O-N 2.94Å; D86-C88 PolarHBondContact OD1-N 3.03Å; D86-V89 HydrophobicContact CB-CG2 3.6Å; D86-V89 WeakPolarHBondContact O-CG2 3.28Å; D86-F104 HydrophobicContact CB-CD1 3.92Å; D86-S105 PolarHBondContact OD1-OG 3.02Å; D86-S105 VanDerWaalsContact OD2-CB 3.32Å; D86-S105 WeakPolarHBondContact OD2-CB 3.38Å; D86-S105 PolarHBondContact OD2-N 2.63Å; D86-S105 PolarHBondContact OD2-OG 3.5Å
87	D	93.8	Very high	95.4	Very high	148 Å²	148	69.5 Å²	69.5	79%	0.791	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-23.4	-179.5	-63.6	-48.2	0	0	0	112.5	V89	D87-V89 VanDerWaalsContact C-N 3.35Å; D87-V89 PolarHBondContact O-N 3.14Å
88	C	93.8	Very high	95.3	Very high	94 Å²	94	69.3 Å²	69.3	64%	0.635	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	31.3	-174.6	-68.4	0	0	0	0	112.9	D86	D86-C88 VanDerWaalsContact C-N 3.28Å; D86-C88 PolarHBondContact O-N 2.94Å; D86-C88 PolarHBondContact OD1-N 3.03Å
89	V	96.9	Very high	95.3	Very high	14 Å²	14	75.1 Å²	75.1	9%	0.085	38%	0.383	C	S	.	.			trans	-78.4	136.7	-178.7	179.2	0	0	0	0	111.3	F82 D86 D87 F91 I102 N103 F104	F82-V89 HydrophobicContact CB-CG1 4.49Å; D86-V89 HydrophobicContact CB-CG2 3.6Å; D86-V89 WeakPolarHBondContact O-CG2 3.28Å; D87-V89 VanDerWaalsContact C-N 3.35Å; D87-V89 PolarHBondContact O-N 3.14Å; V89-F91 HydrophobicContact CB-CE2 4.1Å; V89-F91 HydrophobicContact CB-CZ 4.1Å; V89-F91 HydrophobicContact CG1-CD1 4.44Å; V89-F91 HydrophobicContact CG1-CD2 4.28Å; V89-F91 HydrophobicContact CG1-CE1 3.82Å; V89-F91 HydrophobicContact CG1-CE2 3.63Å; V89-F91 HydrophobicContact CG1-CZ 3.37Å; V89-I102 HydrophobicContact CG1-CG2 3.37Å; V89-N103 WeakPolarHBondContact CA-O 3.33Å; V89-F104 HydrophobicContact CG2-CD1 3.64Å; V89-F104 HydrophobicContact CG2-CE1 3.87Å; V89-F104 HydrophobicContact CG2-CG 4.35Å
90	T	96.9	Very high	95.3	Very high	72 Å²	72	74 Å²	74	44%	0.442	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	143.9	173.2	62	0	0	0	0	111.5	I102 N103	T90-I102 WeakPolarHBondContact O-CA 3.47Å; T90-N103 PolarHBondContact N-O 2.85Å; T90-N103 PolarHBondContact O-N 3.24Å; T90-N103 WeakPolarHBondContact OG1-CB 3.45Å; T90-N103 PolarHBondContact OG1-ND2 2.97Å
91	F	97.2	Very high	95.4	Very high	35 Å²	35	76.7 Å²	76.7	15%	0.154	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.4	-176	-57.8	-89.7	0	0	0	110.8	E79 F82 V89 L93 V100 R101 I102	E79-F91 HydrophobicContact CB-CD2 4.29Å; E79-F91 HydrophobicContact CB-CE1 4.22Å; E79-F91 HydrophobicContact CB-CE2 3.75Å; E79-F91 HydrophobicContact CB-CZ 3.69Å; E79-F91 HydrophobicContact CG-CD1 4.01Å; E79-F91 HydrophobicContact CG-CD2 3.7Å; E79-F91 HydrophobicContact CG-CE1 3.99Å; E79-F91 HydrophobicContact CG-CE2 3.68Å; E79-F91 HydrophobicContact CG-CG 3.87Å; E79-F91 HydrophobicContact CG-CZ 3.82Å; F82-F91 HydrophobicContact CB-CE1 4.01Å; F82-F91 HydrophobicContact CB-CZ 3.98Å; F82-F91 AromaticContact CD2-CE1 3.97Å; F82-F91 HydrophobicContact CD2-CE1 3.97Å; F82-F91 HydrophobicContact CG-CE1 4.24Å; V89-F91 HydrophobicContact CB-CE2 4.1Å; V89-F91 HydrophobicContact CB-CZ 4.1Å; V89-F91 HydrophobicContact CG1-CD1 4.44Å; V89-F91 HydrophobicContact CG1-CD2 4.28Å; V89-F91 HydrophobicContact CG1-CE1 3.82Å; V89-F91 HydrophobicContact CG1-CE2 3.63Å; V89-F91 HydrophobicContact CG1-CZ 3.37Å; F91-L93 HydrophobicContact CB-CD1 4.16Å; F91-V100 HydrophobicContact CB-CG1 4.29Å; F91-V100 HydrophobicContact CD1-CG1 4.18Å; F91-R101 CarbonylContact C-O 3.52Å; F91-R101 WeakPolarHBondContact CA-O 2.98Å; F91-I102 HydrophobicContact CD1-CG1 4.01Å; F91-I102 HydrophobicContact CD1-CG2 4.21Å; F91-I102 HydrophobicContact CE1-CG1 4.2Å; F91-I102 HydrophobicContact CE1-CG2 3.88Å
92	Q	96.4	Very high	95.5	Very high	84 Å²	84	74.1 Å²	74.1	39%	0.393	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	114.6	170.5	-57.8	172.2	9.7	0	0	108.9	F94 V100 R101	Q92-F94 HydrophobicContact CB-CE2 4.25Å; Q92-F94 HydrophobicContact CB-CZ 4.23Å; Q92-V100 CarbonylContact O-C 3.45Å; Q92-V100 WeakPolarHBondContact O-CA 3.41Å; Q92-R101 HydrophobicContact CB-CB 4.2Å; Q92-R101 PolarHBondContact N-O 3.29Å; Q92-R101 PolarHBondContact O-N 3.25Å
93	L	95.7	Very high	95.5	Very high	64 Å²	64	75.2 Å²	75.2	34%	0.335	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	124.1	-173.3	-69.4	82.8	0	0	0	110.7	F69 K75 F91 V100	F69-L93 HydrophobicContact CD1-CB 4.02Å; F69-L93 HydrophobicContact CD1-CD2 3.89Å; F69-L93 HydrophobicContact CD1-CG 4.43Å; F69-L93 HydrophobicContact CE1-CB 3.97Å; F69-L93 HydrophobicContact CE1-CD2 4.21Å; F69-L93 HydrophobicContact CE1-CG 4.36Å; K75-L93 HydrophobicContact CD-CD2 4.32Å; F91-L93 HydrophobicContact CB-CD1 4.16Å; L93-V100 HydrophobicContact CG-CG1 4.32Å; L93-V100 HydrophobicContact CG-CG2 4.14Å
94	F	95.1	Very high	95.5	Very high	80 Å²	80	69.5 Å²	69.5	35%	0.351	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	80.7	175.1	-56.4	-75.5	0	0	0	109.6	F60 Q92 S96 F97 R98 R99 R101	F60-F94 HydrophobicContact CE1-CE2 4.13Å; Q92-F94 HydrophobicContact CB-CE2 4.25Å; Q92-F94 HydrophobicContact CB-CZ 4.23Å; F94-S96 PolarHBondContact O-N 2.87Å; F94-F97 HydrophobicContact CB-CB 4.24Å; F94-F97 HydrophobicContact CB-CD2 4.17Å; F94-F97 PolarHBondContact O-N 2.95Å; F94-R98 PolarHBondContact O-N 3.05Å; F94-R99 WeakPolarHBondContact CA-O 3.3Å; F94-R99 HydrophobicContact CB-CB 4.29Å; F94-R99 WeakPolarHBondContact CB-O 3.15Å; F94-R99 HydrophobicContact CD2-CB 4.43Å; F94-R99 PolarHBondContact N-O 3.22Å; F94-R99 PolarHBondContact O-N 3.26Å; F94-R101 HydrophobicContact CE2-CB 3.81Å
95	K	93.3	Very high	95.5	Very high	98 Å²	98	67.3 Å²	67.3	43%	0.426	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-51.7	-51	-172.3	-178.7	167.5	-175.4	158.4	0	113.4	F69 E70 F97 R98	F69-K95 HydrophobicContact CB-CB 4.24Å; F69-K95 HydrophobicContact CB-CD 3.98Å; F69-K95 HydrophobicContact CB-CG 3.78Å; F69-K95 HydrophobicContact CD1-CB 3.93Å; F69-K95 HydrophobicContact CD1-CG 4.34Å; F69-K95 HydrophobicContact CG-CB 4.25Å; F69-K95 HydrophobicContact CG-CG 4.15Å; F69-K95 PolarHBondContact O-NZ 3.44Å; F69-K95 VanDerWaalsContact O-NZ 3.17Å; E70-K95 IonicContact OE1-NZ 2.81Å; K95-F97 PolarHBondContact O-N 3.3Å; K95-R98 PolarHBondContact O-N 3.48Å; K95-R98 VanDerWaalsContact O-N 3.1Å
96	S	93.5	Very high	95.3	Very high	116 Å²	116	68.3 Å²	68.3	81%	0.811	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-60.9	-32	-178.7	-51.8	0	0	0	0	113	F94	F94-S96 PolarHBondContact O-N 2.87Å
97	F	91.5	Very high	95.2	Very high	144 Å²	144	69.4 Å²	69.4	63%	0.632	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-91.4	-5.9	-178.8	-62.8	-77.4	0	0	0	113.2	F94 K95 R99	F94-F97 HydrophobicContact CB-CB 4.24Å; F94-F97 HydrophobicContact CB-CD2 4.17Å; F94-F97 PolarHBondContact O-N 2.95Å; K95-F97 PolarHBondContact O-N 3.3Å; F97-R99 HydrophobicContact CB-CB 4.22Å; F97-R99 HydrophobicContact CB-CG 4.15Å; F97-R99 WeakPolarHBondContact O-CG 3.33Å; F97-R99 PolarHBondContact O-N 3.47Å
98	R	93.9	Very high	95.2	Very high	103 Å²	103	67.5 Å²	67.5	39%	0.389	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	43	-170	-63.5	-175.5	171	173.1	-0.5	112.2	N63 V64 F69 F94 K95	N63-R98 PolarHBondContact N-O 3.26Å; V64-R98 PolarHBondContact N-O 3.33Å; F69-R98 HydrophobicContact CE2-CB 4.33Å; F69-R98 HydrophobicContact CE2-CG 4.5Å; F94-R98 PolarHBondContact O-N 3.05Å; K95-R98 PolarHBondContact O-N 3.48Å; K95-R98 VanDerWaalsContact O-N 3.1Å
99	R	96.3	Very high	95.2	Very high	124 Å²	124	63.1 Å²	63.1	47%	0.468	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	147.2	-178.1	-71.7	174.7	-165.3	-173.5	0.6	110.8	A61 F94 F97	A61-R99 CarbonylContact O-C 3.59Å; A61-R99 WeakPolarHBondContact O-CA 3.27Å; F94-R99 WeakPolarHBondContact CA-O 3.3Å; F94-R99 HydrophobicContact CB-CB 4.29Å; F94-R99 WeakPolarHBondContact CB-O 3.15Å; F94-R99 HydrophobicContact CD2-CB 4.43Å; F94-R99 PolarHBondContact N-O 3.22Å; F94-R99 PolarHBondContact O-N 3.26Å; F97-R99 HydrophobicContact CB-CB 4.22Å; F97-R99 HydrophobicContact CB-CG 4.15Å; F97-R99 WeakPolarHBondContact O-CG 3.33Å; F97-R99 PolarHBondContact O-N 3.47Å
100	V	97.5	Very high	95.1	Very high	1 Å²	1	62.5 Å²	62.5	1%	0.006	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	126.6	172.3	-175.7	0	0	0	0	108.1	F60 A61 V64 F69 F78 F91 Q92 L93 I102	F60-V100 WeakPolarHBondContact CA-O 3.4Å; A61-V100 HydrophobicContact CB-CB 4.4Å; A61-V100 PolarHBondContact N-O 2.89Å; A61-V100 PolarHBondContact O-N 2.81Å; V64-V100 HydrophobicContact CG1-CG2 4.42Å; V64-V100 HydrophobicContact CG2-CG2 4.17Å; F69-V100 HydrophobicContact CE1-CG2 3.93Å; F69-V100 HydrophobicContact CZ-CG2 3.9Å; F78-V100 HydrophobicContact CE1-CB 4.18Å; F78-V100 HydrophobicContact CE1-CG1 4.16Å; F78-V100 HydrophobicContact CE1-CG2 4.1Å; F78-V100 HydrophobicContact CZ-CB 4.45Å; F78-V100 HydrophobicContact CZ-CG2 4.4Å; F91-V100 HydrophobicContact CB-CG1 4.29Å; F91-V100 HydrophobicContact CD1-CG1 4.18Å; Q92-V100 CarbonylContact O-C 3.45Å; Q92-V100 WeakPolarHBondContact O-CA 3.41Å; L93-V100 HydrophobicContact CG-CG1 4.32Å; L93-V100 HydrophobicContact CG-CG2 4.14Å; V100-I102 HydrophobicContact CG1-CG1 4.1Å
101	R	97.3	Very high	94.9	Very high	88 Å²	88	59.1 Å²	59.1	33%	0.332	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	132.4	167.2	174.7	177.6	179.6	168.4	6	108.6	L59 F60 F91 Q92 F94 N103	L59-R101 CarbonylContact O-C 3.5Å; L59-R101 WeakPolarHBondContact O-CA 3.42Å; F60-R101 HydrophobicContact CD1-CB 4.01Å; F60-R101 HydrophobicContact CE1-CB 3.72Å; F60-R101 HydrophobicContact CE1-CG 4.26Å; F60-R101 HydrophobicContact CZ-CB 4.39Å; F60-R101 HydrophobicContact CZ-CG 4.46Å; F91-R101 CarbonylContact C-O 3.52Å; F91-R101 WeakPolarHBondContact CA-O 2.98Å; Q92-R101 HydrophobicContact CB-CB 4.2Å; Q92-R101 PolarHBondContact N-O 3.29Å; Q92-R101 PolarHBondContact O-N 3.25Å; F94-R101 HydrophobicContact CE2-CB 3.81Å; R101-N103 PolarHBondContact NE-OD1 3.25Å
102	I	97.8	Very high	94.8	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	111.8	-174.3	-52	172.1	0	0	0	105.7	S58 L59 A61 F82 V89 T90 F91 V100 F104	S58-I102 CarbonylContact C-O 3.56Å; S58-I102 VanDerWaalsContact CA-O 3.27Å; S58-I102 WeakPolarHBondContact CA-O 3.32Å; L59-I102 HydrophobicContact CB-CB 4.47Å; L59-I102 PolarHBondContact N-O 3.11Å; L59-I102 PolarHBondContact O-N 3.08Å; A61-I102 HydrophobicContact CB-CD1 3.95Å; F82-I102 HydrophobicContact CB-CG2 4.32Å; F82-I102 HydrophobicContact CD1-CD1 3.78Å; F82-I102 HydrophobicContact CD1-CG2 4.39Å; F82-I102 HydrophobicContact CD2-CD1 3.85Å; F82-I102 HydrophobicContact CE1-CD1 3.52Å; F82-I102 HydrophobicContact CE2-CD1 3.62Å; F82-I102 HydrophobicContact CG-CD1 3.92Å; F82-I102 HydrophobicContact CG-CG2 4.3Å; F82-I102 HydrophobicContact CZ-CD1 3.44Å; F82-I102 VanDerWaalsContact CZ-CD1 3.44Å; V89-I102 HydrophobicContact CG1-CG2 3.37Å; T90-I102 WeakPolarHBondContact O-CA 3.47Å; F91-I102 HydrophobicContact CD1-CG1 4.01Å; F91-I102 HydrophobicContact CD1-CG2 4.21Å; F91-I102 HydrophobicContact CE1-CG1 4.2Å; F91-I102 HydrophobicContact CE1-CG2 3.88Å; V100-I102 HydrophobicContact CG1-CG1 4.1Å; I102-F104 HydrophobicContact CB-CE2 4.1Å; I102-F104 HydrophobicContact CG2-CD2 4.19Å; I102-F104 HydrophobicContact CG2-CE1 4.47Å; I102-F104 HydrophobicContact CG2-CE2 3.47Å; I102-F104 VanDerWaalsContact CG2-CE2 3.47Å; I102-F104 HydrophobicContact CG2-CZ 3.65Å
103	N	96.9	Very high	94.7	Very high	24 Å²	24	58.2 Å²	58.2	13%	0.128	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	126.5	176.3	-39.7	-72.4	0	0	0	109	S58 V89 T90 R101	S58-N103 PolarHBondContact OG-OD1 3.15Å; V89-N103 WeakPolarHBondContact CA-O 3.33Å; T90-N103 PolarHBondContact N-O 2.85Å; T90-N103 PolarHBondContact O-N 3.24Å; T90-N103 WeakPolarHBondContact OG1-CB 3.45Å; T90-N103 PolarHBondContact OG1-ND2 2.97Å; R101-N103 PolarHBondContact NE-OD1 3.25Å
104	F	96.1	Very high	94.7	Very high	6 Å²	6	58.9 Å²	58.9	3%	0.026	28%	0.275	C	S	.	.			trans	-97.6	157.7	175.5	-60.7	-100.1	0	0	0	109.5	N57 L59 F82 D86 V89 I102 N106 A110 A113	N57-F104 WeakPolarHBondContact O-CB 3.39Å; N57-F104 WeakPolarHBondContact O-CD2 3.47Å; N57-F104 PolarHBondContact O-N 2.99Å; L59-F104 HydrophobicContact CB-CE2 4.3Å; L59-F104 HydrophobicContact CD1-CE2 3.78Å; L59-F104 HydrophobicContact CD1-CZ 4.17Å; L59-F104 HydrophobicContact CG-CE2 3.92Å; F82-F104 HydrophobicContact CB-CE1 4.48Å; F82-F104 HydrophobicContact CB-CZ 4.38Å; F82-F104 AromaticContact CD1-CZ 3.95Å; F82-F104 HydrophobicContact CD1-CZ 3.95Å; D86-F104 HydrophobicContact CB-CD1 3.92Å; V89-F104 HydrophobicContact CG2-CD1 3.64Å; V89-F104 HydrophobicContact CG2-CE1 3.87Å; V89-F104 HydrophobicContact CG2-CG 4.35Å; I102-F104 HydrophobicContact CB-CE2 4.1Å; I102-F104 HydrophobicContact CG2-CD2 4.19Å; I102-F104 HydrophobicContact CG2-CE1 4.47Å; I102-F104 HydrophobicContact CG2-CE2 3.47Å; I102-F104 VanDerWaalsContact CG2-CE2 3.47Å; I102-F104 HydrophobicContact CG2-CZ 3.65Å; F104-N106 VanDerWaalsContact C-N 3.27Å; F104-N106 PolarHBondContact O-N 2.73Å; F104-A110 HydrophobicContact CB-CB 4.24Å; F104-A110 HydrophobicContact CD2-CB 3.52Å; F104-A110 HydrophobicContact CE2-CB 4.02Å; F104-A110 HydrophobicContact CG-CB 3.91Å; F104-A113 HydrophobicContact CE1-CB 3.95Å; F104-A113 HydrophobicContact CZ-CB 3.73Å
105	S	94.9	Very high	94.6	Very high	72 Å²	72	57.6 Å²	57.6	50%	0.503	27%	0.271	S	S	.	.	S	Bend	trans	-65.1	-33.2	171.7	62.8	0	0	0	0	112	D86	D86-S105 PolarHBondContact OD1-OG 3.02Å; D86-S105 VanDerWaalsContact OD2-CB 3.32Å; D86-S105 WeakPolarHBondContact OD2-CB 3.38Å; D86-S105 PolarHBondContact OD2-N 2.63Å; D86-S105 PolarHBondContact OD2-OG 3.5Å
106	N	92.2	Very high	94.6	Very high	50 Å²	50	55.1 Å²	55.1	27%	0.267	26%	0.261	S	S	.	.	S	Bend	trans	-137.5	143.7	-174	67.4	86.7	0	0	0	112.2	F104 K108 S109 A110	F104-N106 VanDerWaalsContact C-N 3.27Å; F104-N106 PolarHBondContact O-N 2.73Å; N106-K108 PolarHBondContact O-N 3.33Å; N106-K108 WeakPolarHBondContact OD1-CB 3.49Å; N106-K108 PolarHBondContact OD1-N 2.97Å; N106-S109 PolarHBondContact ND2-OG 3.16Å; N106-S109 PolarHBondContact O-N 3.19Å; N106-S109 VanDerWaalsContact OD1-CB 3.28Å; N106-S109 WeakPolarHBondContact OD1-CB 3.29Å; N106-S109 PolarHBondContact OD1-N 2.92Å; N106-S109 PolarHBondContact OD1-OG 2.98Å; N106-S109 VanDerWaalsContact OD1-OG 3.13Å; N106-A110 PolarHBondContact O-N 2.86Å
107	P	93	Very high	94.7	Very high	41 Å²	41	50.3 Å²	50.3	27%	0.266	23%	0.226	S	C	.	.	H	α-helix	trans	-66.2	-26.2	-178.5	27.2	-35	0	0	0	112.9	L55 A110 A111	L55-P107 HydrophobicContact CB-CB 4.26Å; L55-P107 VanDerWaalsContact O-CB 3.26Å; L55-P107 WeakPolarHBondContact O-CB 3.26Å; P107-A110 PolarHBondContact O-N 3.3Å; P107-A111 WeakPolarHBondContact O-CB 3.29Å; P107-A111 PolarHBondContact O-N 2.9Å
108	K	92.4	Very high	94.9	Very high	107 Å²	107	46.3 Å²	46.3	47%	0.465	21%	0.209	S	C	.	.	H	α-helix	trans	-63.2	-43.7	177.1	-167	176.7	-176.4	176.1	0	112.1	F46 F52 N106 A111 R112	F46-K108 HydrophobicContact CE2-CG 4.06Å; F46-K108 HydrophobicContact CZ-CD 4.07Å; F46-K108 HydrophobicContact CZ-CG 3.49Å; F46-K108 VanDerWaalsContact CZ-CG 3.49Å; F52-K108 HydrophobicContact CE1-CG 4.46Å; N106-K108 PolarHBondContact O-N 3.33Å; N106-K108 WeakPolarHBondContact OD1-CB 3.49Å; N106-K108 PolarHBondContact OD1-N 2.97Å; K108-A111 PolarHBondContact O-N 3.37Å; K108-R112 WeakPolarHBondContact O-CG 3.4Å; K108-R112 PolarHBondContact O-N 3.29Å
109	S	94.6	Very high	94.9	Very high	3 Å²	3	47 Å²	47	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-68.3	-39.1	175.3	-76.5	0	0	0	0	111.7	Y85 N106 A111 R112 A113	Y85-S109 WeakPolarHBondContact O-CB 3.34Å; Y85-S109 PolarHBondContact O-OG 3.46Å; N106-S109 PolarHBondContact ND2-OG 3.16Å; N106-S109 PolarHBondContact O-N 3.19Å; N106-S109 VanDerWaalsContact OD1-CB 3.28Å; N106-S109 WeakPolarHBondContact OD1-CB 3.29Å; N106-S109 PolarHBondContact OD1-N 2.92Å; N106-S109 PolarHBondContact OD1-OG 2.98Å; N106-S109 VanDerWaalsContact OD1-OG 3.13Å; S109-A111 VanDerWaalsContact C-N 3.33Å; S109-A111 PolarHBondContact O-N 3.47Å; S109-R112 PolarHBondContact O-N 3.47Å; S109-R112 PolarHBondContact OG-NH2 2.88Å; S109-R112 VanDerWaalsContact OG-NH2 3.14Å; S109-A113 WeakPolarHBondContact O-CB 3.4Å; S109-A113 PolarHBondContact O-N 2.95Å
110	A	94.6	Very high	94.8	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.3	-43.2	173	0	0	0	0	0	111.7	L59 F104 N106 P107 R114 F131	L59-A110 HydrophobicContact CG-CB 4.38Å; F104-A110 HydrophobicContact CB-CB 4.24Å; F104-A110 HydrophobicContact CD2-CB 3.52Å; F104-A110 HydrophobicContact CE2-CB 4.02Å; F104-A110 HydrophobicContact CG-CB 3.91Å; N106-A110 PolarHBondContact O-N 2.86Å; P107-A110 PolarHBondContact O-N 3.3Å; A110-R114 WeakPolarHBondContact O-CB 3.4Å; A110-R114 PolarHBondContact O-N 2.76Å; A110-F131 HydrophobicContact CB-CE1 4.1Å
111	A	93.9	Very high	94.7	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-63.6	-46.9	176.5	0	0	0	0	0	112.5	F46 I49 F52 L55 P107 K108 S109 R114 I115 F131	F46-A111 HydrophobicContact CE2-CB 4.44Å; I49-A111 HydrophobicContact CD1-CB 4.38Å; F52-A111 HydrophobicContact CD1-CB 4.03Å; F52-A111 HydrophobicContact CE1-CB 3.72Å; L55-A111 HydrophobicContact CD1-CB 4.12Å; P107-A111 WeakPolarHBondContact O-CB 3.29Å; P107-A111 PolarHBondContact O-N 2.9Å; K108-A111 PolarHBondContact O-N 3.37Å; S109-A111 VanDerWaalsContact C-N 3.33Å; S109-A111 PolarHBondContact O-N 3.47Å; A111-R114 WeakPolarHBondContact O-CB 3.46Å; A111-R114 PolarHBondContact O-N 2.94Å; A111-I115 WeakPolarHBondContact O-CG1 3.39Å; A111-I115 PolarHBondContact O-N 2.83Å; A111-F131 HydrophobicContact CB-CZ 4.15Å
112	R	93.4	Very high	94.5	Very high	100 Å²	100	47.6 Å²	47.6	38%	0.377	23%	0.232	S	C	.	.	H	α-helix	trans	-58.6	-51.5	176	-73	-172.2	-69.1	165.7	3.4	112	F46 Y85 K108 S109 R114 I115 E116	F46-R112 HydrophobicContact CD1-CG 4.48Å; F46-R112 HydrophobicContact CD2-CG 3.42Å; F46-R112 VanDerWaalsContact CD2-CG 3.42Å; F46-R112 HydrophobicContact CE1-CG 4.25Å; F46-R112 HydrophobicContact CE2-CB 4.36Å; F46-R112 HydrophobicContact CE2-CG 3.14Å; F46-R112 HydrophobicContact CG-CG 4.09Å; F46-R112 HydrophobicContact CZ-CG 3.57Å; Y85-R112 HydrophobicContact CD1-CB 3.95Å; Y85-R112 HydrophobicContact CE1-CB 4.3Å; K108-R112 WeakPolarHBondContact O-CG 3.4Å; K108-R112 PolarHBondContact O-N 3.29Å; S109-R112 PolarHBondContact O-N 3.47Å; S109-R112 PolarHBondContact OG-NH2 2.88Å; S109-R112 VanDerWaalsContact OG-NH2 3.14Å; R112-R114 PolarHBondContact O-N 3.01Å; R112-I115 PolarHBondContact O-N 2.85Å; R112-I115 VanDerWaalsContact O-N 3.14Å; R112-E116 PolarHBondContact O-N 2.81Å
113	A	95.4	Very high	94.1	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-57.4	-38.5	178.5	0	0	0	0	0	111.3	L59 F82 Y85 F104 S109 L117	L59-A113 HydrophobicContact CD1-CB 4.44Å; F82-A113 HydrophobicContact CD1-CB 4.31Å; Y85-A113 HydrophobicContact CD1-CB 4.26Å; Y85-A113 HydrophobicContact CD2-CB 3.88Å; Y85-A113 HydrophobicContact CE2-CB 4.23Å; Y85-A113 HydrophobicContact CG-CB 3.9Å; F104-A113 HydrophobicContact CE1-CB 3.95Å; F104-A113 HydrophobicContact CZ-CB 3.73Å; S109-A113 WeakPolarHBondContact O-CB 3.4Å; S109-A113 PolarHBondContact O-N 2.95Å; A113-L117 WeakPolarHBondContact O-CB 3.45Å; A113-L117 WeakPolarHBondContact O-CG 3.21Å; A113-L117 PolarHBondContact O-N 3.17Å
114	R	95.3	Very high	93.8	Very high	78 Å²	78	54.6 Å²	54.6	29%	0.294	28%	0.277	S	S	.	.	H	α-helix	trans	-65	-50.7	174.8	-179.2	179.4	173.1	160.3	-3.2	112.2	L59 A110 A111 R112 E116 H118 L129	L59-R114 HydrophobicContact CD1-CB 4.07Å; L59-R114 HydrophobicContact CD2-CB 4.16Å; A110-R114 WeakPolarHBondContact O-CB 3.4Å; A110-R114 PolarHBondContact O-N 2.76Å; A111-R114 WeakPolarHBondContact O-CB 3.46Å; A111-R114 PolarHBondContact O-N 2.94Å; R112-R114 PolarHBondContact O-N 3.01Å; R114-E116 VanDerWaalsContact C-N 3.28Å; R114-E116 PolarHBondContact O-N 2.91Å; R114-H118 WeakPolarHBondContact O-CB 3.35Å; R114-H118 PolarHBondContact O-N 2.93Å; R114-L129 HydrophobicContact CG-CB 4.3Å
115	I	93.3	Very high	93.6	Very high	54 Å²	54	56.6 Å²	56.6	28%	0.277	29%	0.286	S	S	.	.	H	α-helix	trans	-59.1	-43.3	-177.1	-67.8	166.9	0	0	0	110.8	A42 A45 F46 I49 A111 R112	A42-I115 HydrophobicContact CB-CG2 3.97Å; A45-I115 HydrophobicContact CB-CG2 3.94Å; F46-I115 HydrophobicContact CB-CD1 3.91Å; F46-I115 HydrophobicContact CD2-CD1 3.9Å; F46-I115 HydrophobicContact CG-CD1 4.44Å; I49-I115 HydrophobicContact CD1-CD1 3.77Å; A111-I115 WeakPolarHBondContact O-CG1 3.39Å; A111-I115 PolarHBondContact O-N 2.83Å; R112-I115 PolarHBondContact O-N 2.85Å; R112-I115 VanDerWaalsContact O-N 3.14Å
116	E	93.5	Very high	93.6	Very high	46 Å²	46	58.8 Å²	58.8	22%	0.215	29%	0.286	C	S	.	.	H	α-helix	trans	-84.4	-36.4	-172.6	-168.1	171.5	159.8	0	0	113.1	W35 Y85 R112 R114 T120	W35-E116 WeakPolarHBondContact CH2-OE1 3.01Å; Y85-E116 HydrophobicContact CE1-CB 4.39Å; Y85-E116 WeakPolarHBondContact CE1-OE2 3.42Å; Y85-E116 WeakPolarHBondContact OH-CB 3.45Å; Y85-E116 VanDerWaalsContact OH-CG 3.3Å; Y85-E116 WeakPolarHBondContact OH-CG 3.16Å; Y85-E116 PolarHBondContact OH-OE1 3.41Å; Y85-E116 PolarHBondContact OH-OE2 3.38Å; R112-E116 PolarHBondContact O-N 2.81Å; R114-E116 VanDerWaalsContact C-N 3.28Å; R114-E116 PolarHBondContact O-N 2.91Å; E116-T120 VanDerWaalsContact O-CG2 3.22Å; E116-T120 WeakPolarHBondContact O-CG2 3.36Å
117	L	95.3	Very high	93.8	Very high	15 Å²	15	56.5 Å²	56.5	8%	0.079	27%	0.274	C	S	.	.	H	α-helix	trans	-98.3	-12.2	-174.5	-57.4	176.1	0	0	0	114.2	L81 F82 Y85 A113 E119 T120 L129	L81-L117 HydrophobicContact CB-CD1 4.15Å; F82-L117 HydrophobicContact CD1-CD1 3.72Å; F82-L117 HydrophobicContact CE1-CD1 3.53Å; F82-L117 HydrophobicContact CG-CD1 4.39Å; F82-L117 HydrophobicContact CZ-CD1 4.02Å; Y85-L117 HydrophobicContact CE2-CD1 3.74Å; Y85-L117 HydrophobicContact CE2-CD2 4.48Å; Y85-L117 HydrophobicContact CE2-CG 4.08Å; A113-L117 WeakPolarHBondContact O-CB 3.45Å; A113-L117 WeakPolarHBondContact O-CG 3.21Å; A113-L117 PolarHBondContact O-N 3.17Å; L117-E119 PolarHBondContact O-N 3.28Å; L117-T120 WeakPolarHBondContact O-CB 3.24Å; L117-T120 WeakPolarHBondContact O-CG2 3.2Å; L117-T120 PolarHBondContact O-N 3.3Å; L117-T120 PolarHBondContact O-OG1 2.87Å; L117-L129 HydrophobicContact CB-CD1 3.67Å
118	H	95.9	Very high	93.9	Very high	59 Å²	59	59.1 Å²	59.1	27%	0.273	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	136.5	179.8	-170.6	88.4	0	0	0	110.8	R114 T120 L129	R114-H118 WeakPolarHBondContact O-CB 3.35Å; R114-H118 PolarHBondContact O-N 2.93Å; H118-T120 PolarHBondContact O-N 3.23Å; H118-L129 HydrophobicContact CB-CB 4.37Å; H118-L129 PolarHBondContact CE1-N 3.1Å; H118-L129 PolarHBondContact CE1-O 3.07Å; H118-L129 PolarHBondContact ND1-N 3.34Å; H118-L129 PolarHBondContact ND1-O 3.23Å
119	E	94.3	Very high	94.1	Very high	117 Å²	117	54 Å²	54	55%	0.547	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	3	-175	-66.7	-174.5	173.1	0	0	116.9	L117 L127	L117-E119 PolarHBondContact O-N 3.28Å; E119-L127 VanDerWaalsContact CA-O 3.3Å; E119-L127 WeakPolarHBondContact CA-O 3.27Å; E119-L127 PolarHBondContact N-O 3.41Å
120	T	93.9	Very high	94.1	Very high	49 Å²	49	58.8 Å²	58.8	30%	0.301	28%	0.277	S	S	.	.			trans	-65.3	151.1	171.8	64.8	0	0	0	0	111.6	E116 L117 H118 K126 L127	E116-T120 VanDerWaalsContact O-CG2 3.22Å; E116-T120 WeakPolarHBondContact O-CG2 3.36Å; L117-T120 WeakPolarHBondContact O-CB 3.24Å; L117-T120 WeakPolarHBondContact O-CG2 3.2Å; L117-T120 PolarHBondContact O-N 3.3Å; L117-T120 PolarHBondContact O-OG1 2.87Å; H118-T120 PolarHBondContact O-N 3.23Å; T120-K126 WeakPolarHBondContact O-CA 3.42Å; T120-L127 PolarHBondContact O-N 3.42Å
121	Q	93.9	Very high	94.2	Very high	152 Å²	152	61.2 Å²	61.2	71%	0.71	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	121.6	178.5	-68.6	-167	70.4	0	0	110.8	K126	Q121-K126 HydrophobicContact CG-CG 4.29Å
122	F	93.1	Very high	94	Very high	25 Å²	25	61.3 Å²	61.3	11%	0.11	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	117.4	169	-176.9	-97.8	0	0	0	109.4	V68 F78 L81 G124 K125 L127	V68-F122 HydrophobicContact CG2-CD1 4.45Å; V68-F122 HydrophobicContact CG2-CE1 3.57Å; V68-F122 HydrophobicContact CG2-CZ 4.33Å; F78-F122 HydrophobicContact CB-CE1 4.07Å; F78-F122 HydrophobicContact CB-CE2 4.37Å; F78-F122 HydrophobicContact CB-CZ 3.69Å; F78-F122 HydrophobicContact CD2-CD1 4.15Å; F78-F122 AromaticContact CD2-CE1 3.97Å; F78-F122 HydrophobicContact CD2-CE1 3.97Å; F78-F122 HydrophobicContact CD2-CZ 4.21Å; F78-F122 HydrophobicContact CG-CE1 4.49Å; F78-F122 HydrophobicContact CG-CZ 4.47Å; L81-F122 HydrophobicContact CD1-CD2 3.69Å; L81-F122 HydrophobicContact CD1-CE2 3.98Å; L81-F122 HydrophobicContact CD1-CG 4.48Å; F122-G124 VanDerWaalsContact C-N 3.28Å; F122-G124 PolarHBondContact O-N 2.8Å; F122-K125 PolarHBondContact N-O 2.81Å; F122-K125 PolarHBondContact O-N 2.8Å; F122-L127 HydrophobicContact CB-CD1 3.85Å; F122-L127 HydrophobicContact CB-CD2 4.28Å; F122-L127 HydrophobicContact CB-CG 3.92Å
123	R	90	Very high	93.4	Very high	105 Å²	105	65 Å²	65	40%	0.396	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	46.2	-178.5	-62.9	-174.7	168.4	-124.3	-3.8	113.1	H65 S67 S74 K125	H65-R123 HydrophobicContact CB-CB 4.1Å; S67-R123 VanDerWaalsContact OG-CD 3.27Å; S67-R123 WeakPolarHBondContact OG-CD 3.43Å; S67-R123 PolarHBondContact OG-NH1 2.74Å; S74-R123 VanDerWaalsContact CB-CZ 3.49Å; S74-R123 PolarHBondContact OG-NH1 2.77Å; S74-R123 PolarHBondContact OG-NH2 2.95Å; R123-K125 PolarHBondContact O-N 2.85Å
124	G	90.3	Very high	92.1	Very high	66 Å²	66	68.3 Å²	68.3	68%	0.68	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	7.2	178.4	0	0	0	0	0	115.3	F122	F122-G124 VanDerWaalsContact C-N 3.28Å; F122-G124 PolarHBondContact O-N 2.8Å
125	K	92.6	Very high	90.5	Very high	49 Å²	49	73.4 Å²	73.4	21%	0.213	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	139.7	173	-68	-169.3	-176.3	-174.2	0	111.1	H65 F122 R123	H65-K125 HydrophobicContact CB-CD 4.42Å; F122-K125 PolarHBondContact N-O 2.81Å; F122-K125 PolarHBondContact O-N 2.8Å; R123-K125 PolarHBondContact O-N 2.85Å
126	K	95.1	Very high	88.7	Confident	118 Å²	118	74.1 Å²	74.1	51%	0.513	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	124.3	170.8	-66.4	-170.2	175.8	-168.2	0	110.4	N63 T120 Q121	N63-K126 PolarHBondContact ND2-O 3.15Å; T120-K126 WeakPolarHBondContact O-CA 3.42Å; Q121-K126 HydrophobicContact CG-CG 4.29Å
127	L	95.4	Very high	86.8	Confident	1 Å²	1	77.8 Å²	77.8	1%	0.005	39%	0.393	C	S	.	.			trans	-73.2	136.5	175.1	-69.4	176.9	0	0	0	110.3	V64 F78 L81 E119 T120 F122	V64-L127 HydrophobicContact CG2-CD2 4.37Å; F78-L127 HydrophobicContact CE2-CD1 4.25Å; F78-L127 HydrophobicContact CE2-CD2 3.92Å; L81-L127 HydrophobicContact CD1-CD1 4.49Å; E119-L127 VanDerWaalsContact CA-O 3.3Å; E119-L127 WeakPolarHBondContact CA-O 3.27Å; E119-L127 PolarHBondContact N-O 3.41Å; T120-L127 PolarHBondContact O-N 3.42Å; F122-L127 HydrophobicContact CB-CD1 3.85Å; F122-L127 HydrophobicContact CB-CD2 4.28Å; F122-L127 HydrophobicContact CB-CG 3.92Å
128	K	96	Very high	84.7	Confident	96 Å²	96	83.8 Å²	83.8	42%	0.417	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	108.5	174.1	-65.6	-171.5	177.3	-169	0	109.3	C62 Y130	C62-K128 HydrophobicContact CB-CB 4.01Å; C62-K128 PolarHBondContact N-O 2.8Å; C62-K128 PolarHBondContact O-N 3.46Å; C62-K128 VanDerWaalsContact O-N 3.16Å; K128-Y130 HydrophobicContact CB-CE2 3.66Å
129	L	96.7	Very high	82.7	Confident	0 Å²	0	85.7 Å²	85.7	0%	0	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	126	-179.2	-61.8	174.9	0	0	0	111.7	L59 F60 A61 F82 R114 L117 H118	L59-L129 HydrophobicContact CD1-CD1 4.49Å; F60-L129 WeakPolarHBondContact O-CA 3.28Å; A61-L129 HydrophobicContact CB-CD2 3.62Å; F82-L129 HydrophobicContact CE1-CD1 4.05Å; F82-L129 HydrophobicContact CE1-CD2 3.96Å; F82-L129 HydrophobicContact CZ-CD1 4.47Å; F82-L129 HydrophobicContact CZ-CD2 3.94Å; R114-L129 HydrophobicContact CG-CB 4.3Å; L117-L129 HydrophobicContact CB-CD1 3.67Å; H118-L129 HydrophobicContact CB-CB 4.37Å; H118-L129 PolarHBondContact CE1-N 3.1Å; H118-L129 PolarHBondContact CE1-O 3.07Å; H118-L129 PolarHBondContact ND1-N 3.34Å; H118-L129 PolarHBondContact ND1-O 3.23Å
130	Y	95.3	Very high	80.4	Confident	103 Å²	103	88.1 Å²	88.1	40%	0.404	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	143.6	178.1	-56.7	-79.2	0	0	0	110.2	L59 F60 C62 K128 A132	L59-Y130 CarbonylContact C-O 3.57Å; L59-Y130 VanDerWaalsContact CA-O 3.24Å; L59-Y130 WeakPolarHBondContact CA-O 3.17Å; F60-Y130 PolarHBondContact N-O 2.98Å; F60-Y130 PolarHBondContact O-N 2.81Å; C62-Y130 HydrophobicContact CB-CD2 4.34Å; C62-Y130 HydrophobicContact CB-CE2 3.97Å; K128-Y130 HydrophobicContact CB-CE2 3.66Å; Y130-A132 PolarHBondContact O-N 3.06Å
131	F	94.6	Very high	78.4	Confident	51 Å²	51	87.6 Å²	87.6	22%	0.224	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	133.1	169.8	-82	-55.7	0	0	0	110.2	L55 P56 L59 A110 A111 Q133	L55-F131 HydrophobicContact CD1-CE2 4.4Å; L55-F131 HydrophobicContact CD1-CZ 4.17Å; L55-F131 HydrophobicContact CD2-CD2 3.96Å; L55-F131 HydrophobicContact CD2-CE2 3.63Å; L55-F131 HydrophobicContact CD2-CZ 4.03Å; P56-F131 HydrophobicContact CG-CB 3.53Å; P56-F131 HydrophobicContact CG-CD1 3.64Å; P56-F131 HydrophobicContact CG-CG 3.76Å; L59-F131 HydrophobicContact CD2-CD1 3.38Å; L59-F131 HydrophobicContact CD2-CE1 3.6Å; L59-F131 HydrophobicContact CD2-CG 4.06Å; L59-F131 HydrophobicContact CD2-CZ 4.41Å; A110-F131 HydrophobicContact CB-CE1 4.1Å; A111-F131 HydrophobicContact CB-CZ 4.15Å; F131-Q133 PolarHBondContact O-N 3.09Å
132	A	91	Very high	76.5	Confident	4 Å²	4	85.9 Å²	85.9	3%	0.033	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-73.5	123.4	173	0	0	0	0	0	108.2	P56 S58 F60 Y130 V134	P56-A132 WeakPolarHBondContact CB-O 3.47Å; P56-A132 WeakPolarHBondContact CG-O 3.21Å; S58-A132 PolarHBondContact O-N 3.43Å; F60-A132 HydrophobicContact CD2-CB 3.71Å; F60-A132 HydrophobicContact CE2-CB 3.53Å; Y130-A132 PolarHBondContact O-N 3.06Å; A132-V134 PolarHBondContact O-N 3.44Å; A132-V134 VanDerWaalsContact O-N 3.09Å
133	Q	81.2	Confident	74.7	Confident	177 Å²	177	94.2 Å²	94.2	83%	0.827	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-60.4	118	175.3	-171.6	174.2	-6.6	0	0	108.6	F131 Q135	F131-Q133 PolarHBondContact O-N 3.09Å; Q133-Q135 PolarHBondContact O-N 3.24Å
134	V	68.3	Low	73.6	Confident	70 Å²	70	96.5 Å²	96.5	42%	0.424	51%	0.509	S	S	.	.			trans	-70.3	115.5	170.5	168.7	0	0	0	0	105.6	P56 A132 T136	P56-V134 HydrophobicContact CB-CG2 3.41Å; P56-V134 VanDerWaalsContact CB-CG2 3.41Å; A132-V134 PolarHBondContact O-N 3.44Å; A132-V134 VanDerWaalsContact O-N 3.09Å; V134-T136 HydrophobicContact CG1-CG2 3.44Å; V134-T136 VanDerWaalsContact CG1-CG2 3.44Å; V134-T136 PolarHBondContact O-N 2.89Å
135	Q	61.5	Low	72.8	Confident	185 Å²	185	101.5 Å²	101.5	86%	0.864	51%	0.514	S	S	*	.			trans	-77.4	66.7	165.3	-64.9	-173	24.8	0	0	107	Q133 P137	Q133-Q135 PolarHBondContact O-N 3.24Å; Q135-P137 WeakPolarHBondContact O-CD 3.42Å
136	T	54.6	Low	72.1	Confident	69 Å²	69	107.4 Å²	107.4	42%	0.423	55%	0.547	S	S	.	.			trans	-75.1	122.2	156	34.6	0	0	0	0	104.4	V134 E138	V134-T136 HydrophobicContact CG1-CG2 3.44Å; V134-T136 VanDerWaalsContact CG1-CG2 3.44Å; V134-T136 PolarHBondContact O-N 2.89Å; T136-E138 WeakPolarHBondContact CB-OE1 3.26Å; T136-E138 HydrophobicContact CG2-CG 4.43Å; T136-E138 PolarHBondContact O-N 3.45Å; T136-E138 VanDerWaalsContact OG1-CG 3.26Å; T136-E138 WeakPolarHBondContact OG1-CG 3.14Å; T136-E138 PolarHBondContact OG1-OE1 2.76Å
137	P	53.3	Low	71.1	Confident	123 Å²	123	106 Å²	106	80%	0.799	56%	0.557	S	S	*	*			trans	-69.2	70.3	166.7	30.6	-32.7	0	0	0	107.2	Q135 T139	Q135-P137 WeakPolarHBondContact O-CD 3.42Å; P137-T139 PolarHBondContact O-N 2.67Å; P137-T139 VanDerWaalsContact O-N 3.13Å
138	E	52.7	Low	70.1	Confident	140 Å²	140	111.6 Å²	111.6	65%	0.654	59%	0.593	S	S	*	*			trans	-80.1	95.8	173.3	-50.4	-160.9	-169.8	0	0	106.3	T136 D140	T136-E138 WeakPolarHBondContact CB-OE1 3.26Å; T136-E138 HydrophobicContact CG2-CG 4.43Å; T136-E138 PolarHBondContact O-N 3.45Å; T136-E138 VanDerWaalsContact OG1-CG 3.26Å; T136-E138 WeakPolarHBondContact OG1-CG 3.14Å; T136-E138 PolarHBondContact OG1-OE1 2.76Å; E138-D140 PolarHBondContact O-N 2.96Å
139	T	52.2	Low	68.9	Low	99 Å²	99	111.4 Å²	111.4	61%	0.607	60%	0.602	S	S	*	*	S	Bend		36.7	38.6	118.3	-51	0	0	0	0	117.8	P137 D142	P137-T139 PolarHBondContact O-N 2.67Å; P137-T139 VanDerWaalsContact O-N 3.13Å; T139-D142 VanDerWaalsContact CB-OD2 3.25Å; T139-D142 WeakPolarHBondContact CB-OD2 2.89Å; T139-D142 HydrophobicContact CG2-CB 4.4Å; T139-D142 WeakPolarHBondContact CG2-OD2 2.99Å; T139-D142 PolarHBondContact OG1-OD2 3.13Å
140	D	47	Very low	67.8	Low	168 Å²	168	117.7 Å²	117.7	90%	0.898	63%	0.631	S	S	*	*	S	Bend	trans	-114.4	1.1	156.2	-154.1	19.1	0	0	0	111.5	E138	E138-D140 PolarHBondContact O-N 2.96Å
141	G	51	Low	66.5	Low	39 Å²	39	117.6 Å²	117.6	40%	0.402	64%	0.643	S	S	.	*	S	Bend	trans	-133.9	21.8	179	0	0	0	0	0	114.3	K143 L144	G141-K143 PolarHBondContact O-N 2.77Å; G141-L144 PolarHBondContact O-N 3.28Å
142	D	54.2	Low	65.1	Low	115 Å²	115	119.3 Å²	119.3	62%	0.615	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	18.9	-171.6	-94.1	1.7	0	0	0	116	T139	T139-D142 VanDerWaalsContact CB-OD2 3.25Å; T139-D142 WeakPolarHBondContact CB-OD2 2.89Å; T139-D142 HydrophobicContact CG2-CB 4.4Å; T139-D142 WeakPolarHBondContact CG2-OD2 2.99Å; T139-D142 PolarHBondContact OG1-OD2 3.13Å
143	K	55.5	Low	63.6	Low	200 Å²	200	125.9 Å²	125.9	87%	0.87	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.3	2.6	174.8	-69.3	-174.7	-179.4	178	0	115.4	G141	G141-K143 PolarHBondContact O-N 2.77Å
144	L	67.4	Low	62.6	Low	154 Å²	154	123.8 Å²	123.8	81%	0.806	69%	0.685	S	S	*	*	S	Bend	trans	-103.4	-8.3	-179.5	-62	-178.6	0	0	0	114.7	G141	G141-L144 PolarHBondContact O-N 3.28Å
145	H	73.4	Confident	62	Low	171 Å²	171	127.4 Å²	127.4	79%	0.792	70%	0.696	S	S	*	*	S	Bend	trans	-113.4	139.2	176.9	-63.7	-75	0	0	0	110.8	A147	H145-A147 PolarHBondContact O-N 2.75Å
146	L	77.2	Confident	61.8	Low	173 Å²	173	126.4 Å²	126.4	91%	0.906	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-60.9	136.2	172.9	-67.5	172.5	0	0	0	109.3
147	A	74.5	Confident	61.7	Low	87 Å²	87	129.1 Å²	129.1	72%	0.719	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-59.6	144.8	176	0	0	0	0	0	110.7	H145	H145-A147 PolarHBondContact O-N 2.75Å
148	P	74.4	Confident	61.4	Low	119 Å²	119	127.7 Å²	127.7	77%	0.773	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-51.2	137.9	170.3	-25.4	34	0	0	0	110.5
149	P	70.8	Confident	61.5	Low	93 Å²	93	127 Å²	127	60%	0.604	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-60.3	144.1	178.7	25.8	-33.4	0	0	0	109.8
150	Q	73.3	Confident	61.6	Low	131 Å²	131	127.3 Å²	127.3	61%	0.612	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-55.1	138.8	174.5	-68.4	178.1	-3.6	0	0	109.6	A152 K153	Q150-A152 PolarHBondContact O-N 3.45Å; Q150-K153 WeakPolarHBondContact O-CA 3.25Å; Q150-K153 PolarHBondContact O-N 3.05Å
151	P	68.6	Low	62	Low	101 Å²	101	124.7 Å²	124.7	66%	0.656	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-52.4	-32.7	-175.6	-29.3	34.7	0	0	0	114.5	K153 Q154	P151-K153 PolarHBondContact O-N 3.49Å; P151-Q154 WeakPolarHBondContact O-CB 3.41Å; P151-Q154 VanDerWaalsContact O-CG 3.25Å; P151-Q154 WeakPolarHBondContact O-CG 3.31Å; P151-Q154 PolarHBondContact O-N 3.26Å
152	A	65.8	Low	62.3	Low	88 Å²	88	127.8 Å²	127.8	73%	0.727	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-69.5	-5.7	175.9	0	0	0	0	0	114.7	Q150	Q150-A152 PolarHBondContact O-N 3.45Å
153	K	59.1	Low	62.7	Low	141 Å²	141	126.1 Å²	126.1	61%	0.613	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-113.8	23.5	177.3	-63.2	-176.8	178.7	178.6	0	112	Q150 P151 F155	Q150-K153 WeakPolarHBondContact O-CA 3.25Å; Q150-K153 PolarHBondContact O-N 3.05Å; P151-K153 PolarHBondContact O-N 3.49Å; K153-F155 PolarHBondContact O-N 3.05Å
154	Q	59.3	Low	63.3	Low	134 Å²	134	121.5 Å²	121.5	63%	0.626	71%	0.706	S	S	*	*			trans	-78	53.5	175.5	-72.6	178	-4.9	0	0	112.4	P151 L156	P151-Q154 WeakPolarHBondContact O-CB 3.41Å; P151-Q154 VanDerWaalsContact O-CG 3.25Å; P151-Q154 WeakPolarHBondContact O-CG 3.31Å; P151-Q154 PolarHBondContact O-N 3.26Å; Q154-L156 PolarHBondContact O-N 3.4Å
155	F	57.2	Low	63.7	Low	146 Å²	146	121.8 Å²	121.8	64%	0.64	71%	0.714	S	S	*	*			trans	-75.3	81.1	166.9	-66.8	-76.4	0	0	0	109	K153 I157	K153-F155 PolarHBondContact O-N 3.05Å; F155-I157 PolarHBondContact O-N 3.18Å; F155-I157 VanDerWaalsContact O-N 3.13Å
156	L	57.3	Low	63.8	Low	163 Å²	163	117.1 Å²	117.1	85%	0.853	71%	0.713	S	S	*	*			trans	-79.6	47.8	165.5	-68.3	176.2	0	0	0	110.6	Q154	Q154-L156 PolarHBondContact O-N 3.4Å
157	I	52.4	Low	63.8	Low	127 Å²	127	116.4 Å²	116.4	65%	0.651	70%	0.698	S	S	*	*	S	Bend	trans	-103	109.2	163.4	-24	-179.5	0	0	0	103.9	F155	F155-I157 PolarHBondContact O-N 3.18Å; F155-I157 VanDerWaalsContact O-N 3.13Å
158	S	46.6	Very low	63.7	Low	93 Å²	93	119.8 Å²	119.8	65%	0.65	70%	0.699	S	S	*	*			trans	-25.8	142.5	168.6	52.9	0	0	0	0	111.6	P160	S158-P160 WeakPolarHBondContact O-CD 3.47Å
159	P	54.2	Low	63.5	Low	126 Å²	126	119 Å²	119	82%	0.818	69%	0.693	S	S	*	*			trans	-57.4	112.5	-170.2	26.7	-33.1	0	0	0	109.6
160	P	55.2	Low	63.7	Low	104 Å²	104	121.6 Å²	121.6	68%	0.675	70%	0.701	S	S	*	*			trans	-68.4	153	140.6	32.1	-22.7	0	0	0	106	S158 S162	S158-P160 WeakPolarHBondContact O-CD 3.47Å; P160-S162 PolarHBondContact O-N 3.35Å
161	S	54.3	Low	63.7	Low	113 Å²	113	123 Å²	123	79%	0.79	71%	0.713	S	S	*	*	S	Bend	trans	-40.9	137.5	175.7	-54.5	0	0	0	0	110.9
162	S	57	Low	63.7	Low	105 Å²	105	124.3 Å²	124.3	73%	0.734	71%	0.714	S	S	*	*			trans	-29.2	133.1	177	41.6	0	0	0	0	112.6	P160	P160-S162 PolarHBondContact O-N 3.35Å
163	P	63.9	Low	64	Low	80 Å²	80	124.9 Å²	124.9	52%	0.519	72%	0.719	S	S	.	*	P	Polyproline II helix	trans	-49.8	146.3	179.3	-25	32.1	0	0	0	111.5	W167	P163-W167 HydrophobicContact CB-CB 3.57Å; P163-W167 HydrophobicContact CB-CD2 3.83Å; P163-W167 HydrophobicContact CB-CE3 3.86Å; P163-W167 HydrophobicContact CB-CG 3.72Å; P163-W167 HydrophobicContact CG-CD2 4.28Å; P163-W167 HydrophobicContact CG-CE3 3.92Å; P163-W167 HydrophobicContact CG-CZ3 4.42Å
164	P	68.4	Low	64.4	Low	102 Å²	102	123.5 Å²	123.5	66%	0.662	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-53.5	153.9	177.4	-24.3	32.7	0	0	0	112.2	G166 W167	P164-G166 PolarHBondContact O-N 3.26Å; P164-G166 VanDerWaalsContact O-N 3.1Å; P164-W167 WeakPolarHBondContact O-CB 3.49Å; P164-W167 PolarHBondContact O-N 3.02Å
165	V	74.8	Confident	64.9	Low	160 Å²	160	123.3 Å²	123.3	97%	0.97	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.1	120	173.6	177.7	0	0	0	0	109.2
166	G	76.6	Confident	65.6	Low	74 Å²	74	122.3 Å²	122.3	76%	0.763	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	99.4	-2.4	-179.2	0	0	0	0	0	115.9	P164 Q168	P164-G166 PolarHBondContact O-N 3.26Å; P164-G166 VanDerWaalsContact O-N 3.1Å; G166-Q168 PolarHBondContact O-N 3.39Å
167	W	75.5	Confident	66.6	Low	157 Å²	157	119.6 Å²	119.6	60%	0.595	72%	0.724	S	S	*	*			trans	-69.1	129.1	173.7	-170.5	91	0	0	0	111.2	P163 P164 P169	P163-W167 HydrophobicContact CB-CB 3.57Å; P163-W167 HydrophobicContact CB-CD2 3.83Å; P163-W167 HydrophobicContact CB-CE3 3.86Å; P163-W167 HydrophobicContact CB-CG 3.72Å; P163-W167 HydrophobicContact CG-CD2 4.28Å; P163-W167 HydrophobicContact CG-CE3 3.92Å; P163-W167 HydrophobicContact CG-CZ3 4.42Å; P164-W167 WeakPolarHBondContact O-CB 3.49Å; P164-W167 PolarHBondContact O-N 3.02Å; W167-P169 HydrophobicContact CH2-CB 4.12Å; W167-P169 HydrophobicContact CH2-CG 4.18Å; W167-P169 HydrophobicContact CZ3-CB 4.16Å; W167-P169 HydrophobicContact CZ3-CG 3.72Å
168	Q	73.3	Confident	68	Low	158 Å²	158	117 Å²	117	74%	0.738	71%	0.711	S	S	*	*			trans	-121.9	139.2	173.4	-67	-174	-15.3	0	0	109.3	G166 I170	G166-Q168 PolarHBondContact O-N 3.39Å; Q168-I170 PolarHBondContact O-N 2.9Å
169	P	69.4	Low	69.9	Low	102 Å²	102	120.6 Å²	120.6	66%	0.662	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-57.7	123.2	171.7	-15.5	25.6	0	0	0	109.5	W167	W167-P169 HydrophobicContact CH2-CB 4.12Å; W167-P169 HydrophobicContact CH2-CG 4.18Å; W167-P169 HydrophobicContact CZ3-CB 4.16Å; W167-P169 HydrophobicContact CZ3-CG 3.72Å
170	I	75.7	Confident	71.1	Confident	148 Å²	148	120.6 Å²	120.6	76%	0.759	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-86.2	144.3	167.4	55.2	172.3	0	0	0	108.5	Q168 D172	Q168-I170 PolarHBondContact O-N 2.9Å; I170-D172 PolarHBondContact O-N 2.74Å
171	N	72.8	Confident	72.3	Confident	162 Å²	162	120.9 Å²	120.9	87%	0.866	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-66.1	129.7	172.3	-72.8	-30.3	0	0	0	108.5	A173	N171-A173 PolarHBondContact O-N 3.19Å
172	D	69.4	Low	73.6	Confident	128 Å²	128	119.7 Å²	119.7	68%	0.684	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-54.1	138.1	169.6	-78.6	-19.2	0	0	0	109.1	I170 T174	I170-D172 PolarHBondContact O-N 2.74Å; D172-T174 PolarHBondContact O-N 3.14Å
173	A	72.6	Confident	74.8	Confident	99 Å²	99	121.6 Å²	121.6	82%	0.818	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-59.9	116.3	176.7	0	0	0	0	0	108.6	N171	N171-A173 PolarHBondContact O-N 3.19Å
174	T	66.7	Low	75.5	Confident	112 Å²	112	119.4 Å²	119.4	69%	0.687	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-63.3	136.2	167.4	37	0	0	0	0	108.1	D172 V176	D172-T174 PolarHBondContact O-N 3.14Å; T174-V176 PolarHBondContact O-N 2.98Å
175	P	68.7	Low	76.1	Confident	131 Å²	131	119.3 Å²	119.3	85%	0.851	66%	0.663	S	S	*	*			trans	-61.1	106.7	175.4	25.1	-32.3	0	0	0	107.8	L177	P175-L177 PolarHBondContact O-N 2.88Å
176	V	73.9	Confident	76.4	Confident	125 Å²	125	115.7 Å²	115.7	76%	0.758	65%	0.65	S	S	*	*			trans	-72.2	114.9	175.9	179.2	0	0	0	0	106.6	T174 N178	T174-V176 PolarHBondContact O-N 2.98Å; V176-N178 PolarHBondContact O-N 3.44Å
177	L	77.5	Confident	76.6	Confident	105 Å²	105	118 Å²	118	55%	0.55	64%	0.639	S	S	.	*			trans	-68	102.8	175	-167.4	73.1	0	0	0	108.6	P175 Y179 L182	P175-L177 PolarHBondContact O-N 2.88Å; L177-Y179 HydrophobicContact CD2-CE1 4.09Å; L177-Y179 PolarHBondContact O-N 3.39Å; L177-L182 HydrophobicContact CD1-CD1 3.98Å; L177-L182 HydrophobicContact CD2-CD1 3.92Å; L177-L182 HydrophobicContact CG-CD1 3.8Å
178	N	81.6	Confident	76.8	Confident	72 Å²	72	112.9 Å²	112.9	39%	0.385	62%	0.623	S	S	.	*			trans	-83.2	107.4	177.2	-174.5	-28.4	0	0	0	109.5	V176 D180 L181 L182	V176-N178 PolarHBondContact O-N 3.44Å; N178-D180 VanDerWaalsContact C-N 3.26Å; N178-D180 PolarHBondContact O-N 2.9Å; N178-D180 WeakPolarHBondContact OD1-CB 3.43Å; N178-D180 PolarHBondContact OD1-N 3.41Å; N178-L181 HydrophobicContact CB-CB 4.25Å; N178-L181 HydrophobicContact CB-CD1 3.88Å; N178-L181 HydrophobicContact CB-CG 3.94Å; N178-L181 PolarHBondContact O-N 2.85Å; N178-L181 PolarHBondContact OD1-N 3.34Å; N178-L182 PolarHBondContact O-N 3.2Å
179	Y	86.1	Confident	76.8	Confident	170 Å²	170	106.2 Å²	106.2	67%	0.667	60%	0.597	S	S	*	*	H	α-helix	trans	-63.9	-28.5	-179.1	-64.8	-79.2	0	0	0	113.4	L177 L182 Y183	L177-Y179 HydrophobicContact CD2-CE1 4.09Å; L177-Y179 PolarHBondContact O-N 3.39Å; Y179-L182 HydrophobicContact CD1-CD1 4.2Å; Y179-L182 PolarHBondContact O-N 2.93Å; Y179-Y183 WeakPolarHBondContact O-CB 2.99Å; Y179-Y183 PolarHBondContact O-N 3.23Å
180	D	79.9	Confident	76.9	Confident	125 Å²	125	105.7 Å²	105.7	67%	0.668	59%	0.593	S	S	*	*	H	α-helix	trans	-69.2	-37.8	177.3	-59	-28.9	0	0	0	110.8	N178 Y183 A184	N178-D180 VanDerWaalsContact C-N 3.26Å; N178-D180 PolarHBondContact O-N 2.9Å; N178-D180 WeakPolarHBondContact OD1-CB 3.43Å; N178-D180 PolarHBondContact OD1-N 3.41Å; D180-Y183 PolarHBondContact O-N 3.35Å; D180-A184 VanDerWaalsContact O-CB 3.29Å; D180-A184 WeakPolarHBondContact O-CB 3.46Å; D180-A184 PolarHBondContact O-N 3.03Å
181	L	79.8	Confident	76.4	Confident	111 Å²	111	101.1 Å²	101.1	58%	0.581	58%	0.583	S	S	*	*	H	α-helix	trans	-66.7	-40.2	173.8	-64.1	-178.4	0	0	0	111.3	N178 A184 V185	N178-L181 HydrophobicContact CB-CB 4.25Å; N178-L181 HydrophobicContact CB-CD1 3.88Å; N178-L181 HydrophobicContact CB-CG 3.94Å; N178-L181 PolarHBondContact O-N 2.85Å; N178-L181 PolarHBondContact OD1-N 3.34Å; L181-A184 PolarHBondContact O-N 3.3Å; L181-V185 WeakPolarHBondContact O-CB 3.5Å; L181-V185 WeakPolarHBondContact O-CG2 3.45Å; L181-V185 PolarHBondContact O-N 3.18Å
182	L	81.4	Confident	76.3	Confident	88 Å²	88	99.3 Å²	99.3	46%	0.461	57%	0.569	S	S	.	*	H	α-helix	trans	-61.1	-44.9	174.6	-69.4	174.4	0	0	0	111.5	L177 N178 Y179 V185 A186	L177-L182 HydrophobicContact CD1-CD1 3.98Å; L177-L182 HydrophobicContact CD2-CD1 3.92Å; L177-L182 HydrophobicContact CG-CD1 3.8Å; N178-L182 PolarHBondContact O-N 3.2Å; Y179-L182 HydrophobicContact CD1-CD1 4.2Å; Y179-L182 PolarHBondContact O-N 2.93Å; L182-V185 PolarHBondContact O-N 2.8Å; L182-A186 VanDerWaalsContact O-CB 3.31Å; L182-A186 WeakPolarHBondContact O-CB 3.29Å; L182-A186 PolarHBondContact O-N 3.49Å
183	Y	82.6	Confident	76.3	Confident	144 Å²	144	100.7 Å²	100.7	57%	0.565	57%	0.569	S	S	*	*	H	α-helix	trans	-65.9	-41.3	177.6	-178.7	-111.6	0	0	0	112.3	Y179 D180 A186 K187	Y179-Y183 WeakPolarHBondContact O-CB 2.99Å; Y179-Y183 PolarHBondContact O-N 3.23Å; D180-Y183 PolarHBondContact O-N 3.35Å; Y183-A186 PolarHBondContact O-N 3.11Å; Y183-K187 HydrophobicContact CD1-CD 4.1Å; Y183-K187 HydrophobicContact CE1-CD 3.65Å; Y183-K187 HydrophobicContact CE1-CG 4.49Å; Y183-K187 HydrophobicContact CE2-CD 4.45Å; Y183-K187 VanDerWaalsContact CZ-NZ 3.26Å; Y183-K187 WeakPolarHBondContact O-CB 3.22Å; Y183-K187 WeakPolarHBondContact O-CG 3.46Å; Y183-K187 PolarHBondContact O-N 3.05Å; Y183-K187 WeakPolarHBondContact OH-CE 3.25Å; Y183-K187 PolarHBondContact OH-NZ 3.26Å
184	A	78.8	Confident	76.5	Confident	34 Å²	34	101.3 Å²	101.3	28%	0.281	55%	0.551	S	S	.	*	H	α-helix	trans	-61.6	-46	175.3	0	0	0	0	0	111.1	D180 L181 K187 L188	D180-A184 VanDerWaalsContact O-CB 3.29Å; D180-A184 WeakPolarHBondContact O-CB 3.46Å; D180-A184 PolarHBondContact O-N 3.03Å; L181-A184 PolarHBondContact O-N 3.3Å; A184-K187 WeakPolarHBondContact O-CB 3.42Å; A184-K187 PolarHBondContact O-N 2.83Å; A184-L188 WeakPolarHBondContact O-CG 3.48Å; A184-L188 PolarHBondContact O-N 3.24Å
185	V	80.3	Confident	77.1	Confident	100 Å²	100	101 Å²	101	61%	0.606	54%	0.541	S	S	*	.	H	α-helix	trans	-64	-41.7	176.8	171.9	0	0	0	0	111.5	L181 L182 K187 L188	L181-V185 WeakPolarHBondContact O-CB 3.5Å; L181-V185 WeakPolarHBondContact O-CG2 3.45Å; L181-V185 PolarHBondContact O-N 3.18Å; L182-V185 PolarHBondContact O-N 2.8Å; V185-K187 PolarHBondContact O-N 2.81Å; V185-L188 WeakPolarHBondContact O-CB 3.42Å; V185-L188 PolarHBondContact O-N 2.95Å
186	A	81.9	Confident	77.4	Confident	85 Å²	85	99.7 Å²	99.7	70%	0.702	53%	0.527	S	S	*	.	H	α-helix	trans	-67.7	-23.2	177.7	0	0	0	0	0	113.6	L182 Y183	L182-A186 VanDerWaalsContact O-CB 3.31Å; L182-A186 WeakPolarHBondContact O-CB 3.29Å; L182-A186 PolarHBondContact O-N 3.49Å; Y183-A186 PolarHBondContact O-N 3.11Å
187	K	80.1	Confident	77.5	Confident	122 Å²	122	98.8 Å²	98.8	53%	0.53	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-13.6	174.4	-87	-175.3	159.4	176.2	0	114.1	Y183 A184 V185 G189	Y183-K187 HydrophobicContact CD1-CD 4.1Å; Y183-K187 HydrophobicContact CE1-CD 3.65Å; Y183-K187 HydrophobicContact CE1-CG 4.49Å; Y183-K187 HydrophobicContact CE2-CD 4.45Å; Y183-K187 VanDerWaalsContact CZ-NZ 3.26Å; Y183-K187 WeakPolarHBondContact O-CB 3.22Å; Y183-K187 WeakPolarHBondContact O-CG 3.46Å; Y183-K187 PolarHBondContact O-N 3.05Å; Y183-K187 WeakPolarHBondContact OH-CE 3.25Å; Y183-K187 PolarHBondContact OH-NZ 3.26Å; A184-K187 WeakPolarHBondContact O-CB 3.42Å; A184-K187 PolarHBondContact O-N 2.83Å; V185-K187 PolarHBondContact O-N 2.81Å; K187-G189 PolarHBondContact O-N 3.35Å
188	L	80.1	Confident	77.8	Confident	50 Å²	50	96.6 Å²	96.6	26%	0.262	51%	0.512	S	S	.	.			trans	-69.7	106.5	178.6	-62.8	179.2	0	0	0	108.6	A184 V185 Y194 V208 V210	A184-L188 WeakPolarHBondContact O-CG 3.48Å; A184-L188 PolarHBondContact O-N 3.24Å; V185-L188 WeakPolarHBondContact O-CB 3.42Å; V185-L188 PolarHBondContact O-N 2.95Å; L188-Y194 VanDerWaalsContact CD2-CB 3.42Å; L188-Y194 HydrophobicContact CD2-CD1 4.06Å; L188-Y194 HydrophobicContact CD2-CD2 3.89Å; L188-Y194 HydrophobicContact CD2-CG 3.52Å; L188-V208 HydrophobicContact CD1-CG1 4.31Å; L188-V210 HydrophobicContact CB-CG2 3.84Å
189	G	73.7	Confident	77.9	Confident	18 Å²	18	95.1 Å²	95.1	19%	0.186	51%	0.513	C	S	.	.			trans	-74.1	146.5	172.5	0	0	0	0	0	111.5	K187 G191 E192	K187-G189 PolarHBondContact O-N 3.35Å; G189-G191 PolarHBondContact O-N 3.13Å; G189-E192 PolarHBondContact O-N 3.39Å
190	P	71	Confident	77.9	Confident	90 Å²	90	90.8 Å²	90.8	58%	0.584	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	135.2	169.5	-11.2	24	0	0	0	110.5	E192 D212	P190-E192 VanDerWaalsContact C-N 3.26Å; P190-E192 PolarHBondContact O-N 3.03Å; P190-D212 WeakPolarHBondContact CB-OD1 3.43Å
191	G	65.7	Low	78.1	Confident	53 Å²	53	95 Å²	95	55%	0.546	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	-7.9	-178.3	0	0	0	0	0	116	G189 V210	G189-G191 PolarHBondContact O-N 3.13Å; G191-V210 PolarHBondContact N-O 2.77Å
192	E	69.4	Low	78.4	Confident	124 Å²	124	94.9 Å²	94.9	58%	0.579	53%	0.529	S	S	*	.			trans	-84.9	136.8	176.6	-70.5	-171.1	148.5	0	0	112.2	G189 P190	G189-E192 PolarHBondContact O-N 3.39Å; P190-E192 VanDerWaalsContact C-N 3.26Å; P190-E192 PolarHBondContact O-N 3.03Å
193	K	71.1	Confident	78	Confident	156 Å²	156	93.6 Å²	93.6	68%	0.678	52%	0.524	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	114.3	172.8	-61.5	-175.6	-177.3	-179.3	0	108.4	V207 H209	K193-V207 HydrophobicContact CB-CG1 3.96Å; K193-H209 VanDerWaalsContact CD-CE1 3.49Å; K193-H209 WeakPolarHBondContact CD-CE1 3.31Å; K193-H209 VanDerWaalsContact CE-CE1 3.47Å; K193-H209 WeakPolarHBondContact CE-CE1 3.46Å
194	Y	76.3	Confident	78.2	Confident	113 Å²	113	92 Å²	92	44%	0.443	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	108.5	178.1	-166.2	-94.4	0	0	0	110.4	L188 L196 V207 V208	L188-Y194 VanDerWaalsContact CD2-CB 3.42Å; L188-Y194 HydrophobicContact CD2-CD1 4.06Å; L188-Y194 HydrophobicContact CD2-CD2 3.89Å; L188-Y194 HydrophobicContact CD2-CG 3.52Å; Y194-L196 HydrophobicContact CD1-CD2 3.68Å; Y194-L196 HydrophobicContact CD1-CG 4.26Å; Y194-L196 HydrophobicContact CE1-CD2 3.75Å; Y194-L196 PolarHBondContact O-N 3.23Å; Y194-V207 WeakPolarHBondContact O-CA 2.96Å; Y194-V208 PolarHBondContact N-O 2.91Å; Y194-V208 PolarHBondContact O-N 3.45Å
195	E	79.1	Confident	78.6	Confident	104 Å²	104	93.2 Å²	93.2	49%	0.486	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	106.4	174.8	-173	168	-150.7	0	0	109.5	A198 S205 V206 V207	E195-A198 VanDerWaalsContact OE1-CA 3.31Å; E195-A198 WeakPolarHBondContact OE1-CA 3.34Å; E195-S205 WeakPolarHBondContact OE1-CB 3.31Å; E195-V206 CarbonylContact C-O 3.58Å; E195-V207 HydrophobicContact CB-CG2 4.25Å; E195-V207 HydrophobicContact CG-CG2 4.16Å
196	L	74.8	Confident	78.8	Confident	104 Å²	104	92.1 Å²	92.1	55%	0.545	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	-36.5	176.5	-69.1	175.7	0	0	0	111.4	Y194 V206 V208	Y194-L196 HydrophobicContact CD1-CD2 3.68Å; Y194-L196 HydrophobicContact CD1-CG 4.26Å; Y194-L196 HydrophobicContact CE1-CD2 3.75Å; Y194-L196 PolarHBondContact O-N 3.23Å; L196-V206 HydrophobicContact CB-CB 4.42Å; L196-V206 HydrophobicContact CB-CG1 4.26Å; L196-V206 HydrophobicContact CD1-CG1 4.08Å; L196-V206 PolarHBondContact N-O 3.42Å; L196-V208 HydrophobicContact CD1-CG2 3.36Å; L196-V208 HydrophobicContact CD2-CG2 4.35Å; L196-V208 HydrophobicContact CG-CG2 3.7Å
197	H	77.4	Confident	78.8	Confident	106 Å²	106	90.6 Å²	90.6	49%	0.491	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	123.7	-179.8	-160.6	77.1	0	0	0	110.3	S205 V206	H197-S205 CarbonylContact O-C 3.56Å; H197-S205 VanDerWaalsContact O-CA 3.28Å; H197-S205 WeakPolarHBondContact O-CA 3.28Å; H197-V206 HydrophobicContact CB-CB 4.23Å; H197-V206 HydrophobicContact CB-CG2 4.4Å; H197-V206 PolarHBondContact N-O 3.39Å; H197-V206 PolarHBondContact O-N 2.91Å
198	A	83.1	Confident	78.8	Confident	60 Å²	60	87 Å²	87	50%	0.496	50%	0.502	S	S	.	.			trans	-64.6	138.9	173.3	0	0	0	0	0	110.7	E195	E195-A198 VanDerWaalsContact OE1-CA 3.31Å; E195-A198 WeakPolarHBondContact OE1-CA 3.34Å
199	G	84.4	Confident	78.8	Confident	40 Å²	40	90.5 Å²	90.5	41%	0.412	52%	0.517	S	S	.	.			trans	-64.7	142	174	0	0	0	0	0	111	T203	G199-T203 CarbonylContact C-O 3.56Å; G199-T203 VanDerWaalsContact CA-O 3.31Å; G199-T203 WeakPolarHBondContact CA-O 3.44Å
200	T	84.2	Confident	78.9	Confident	80 Å²	80	91.9 Å²	91.9	49%	0.491	52%	0.521	S	S	.	.	B	Isolated β-bridge	trans	-111	173.5	167	71.9	0	0	0	0	109.6	S202 T203	T200-S202 PolarHBondContact O-N 2.86Å; T200-S202 PolarHBondContact OG1-N 2.99Å; T200-T203 PolarHBondContact N-O 3.13Å; T200-T203 PolarHBondContact O-N 2.85Å; T200-T203 PolarHBondContact OG1-N 3.05Å; T200-T203 PolarHBondContact OG1-OG1 3.13Å
201	E	85.8	Confident	79	Confident	212 Å²	212	93 Å²	93	99%	0.991	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-23.1	177.9	-62.8	-173.7	165.2	0	0	113.4
202	S	84.4	Confident	79.1	Confident	110 Å²	110	93.6 Å²	93.6	77%	0.769	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	-9.7	179.8	74.3	0	0	0	0	115	T200	T200-S202 PolarHBondContact O-N 2.86Å; T200-S202 PolarHBondContact OG1-N 2.99Å
203	T	75	Confident	78.5	Confident	60 Å²	60	93.2 Å²	93.2	37%	0.368	53%	0.532	S	S	.	.	B	Isolated β-bridge	trans	-135.6	133.7	-175.9	57.5	0	0	0	0	112.5	G199 T200	G199-T203 CarbonylContact C-O 3.56Å; G199-T203 VanDerWaalsContact CA-O 3.31Å; G199-T203 WeakPolarHBondContact CA-O 3.44Å; T200-T203 PolarHBondContact N-O 3.13Å; T200-T203 PolarHBondContact O-N 2.85Å; T200-T203 PolarHBondContact OG1-N 3.05Å; T200-T203 PolarHBondContact OG1-OG1 3.13Å
204	P	86.3	Confident	77.9	Confident	110 Å²	110	93.3 Å²	93.3	71%	0.714	54%	0.54	S	S	*	.			trans	-68.3	152.2	176.8	30.3	-35.2	0	0	0	111.7
205	S	86.8	Confident	76.7	Confident	61 Å²	61	94.1 Å²	94.1	43%	0.427	55%	0.55	S	S	.	*			trans	-67.2	145.5	173.1	57.4	0	0	0	0	111.6	E195 H197	E195-S205 WeakPolarHBondContact OE1-CB 3.31Å; H197-S205 CarbonylContact O-C 3.56Å; H197-S205 VanDerWaalsContact O-CA 3.28Å; H197-S205 WeakPolarHBondContact O-CA 3.28Å
206	V	84.9	Confident	75.1	Confident	76 Å²	76	97.7 Å²	97.7	46%	0.461	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.9	115.4	174.7	-177.3	0	0	0	0	108.8	E195 L196 H197	E195-V206 CarbonylContact C-O 3.58Å; L196-V206 HydrophobicContact CB-CB 4.42Å; L196-V206 HydrophobicContact CB-CG1 4.26Å; L196-V206 HydrophobicContact CD1-CG1 4.08Å; L196-V206 PolarHBondContact N-O 3.42Å; H197-V206 HydrophobicContact CB-CB 4.23Å; H197-V206 HydrophobicContact CB-CG2 4.4Å; H197-V206 PolarHBondContact N-O 3.39Å; H197-V206 PolarHBondContact O-N 2.91Å
207	V	80.8	Confident	74	Confident	53 Å²	53	102.4 Å²	102.4	32%	0.321	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-123.5	133.6	-177.9	-174.7	0	0	0	0	109.7	K193 Y194 E195	K193-V207 HydrophobicContact CB-CG1 3.96Å; Y194-V207 WeakPolarHBondContact O-CA 2.96Å; E195-V207 HydrophobicContact CB-CG2 4.25Å; E195-V207 HydrophobicContact CG-CG2 4.16Å
208	V	81.4	Confident	72.4	Confident	48 Å²	48	106.4 Å²	106.4	29%	0.291	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.4	128.1	173	178.7	0	0	0	0	108.6	L188 Y194 L196	L188-V208 HydrophobicContact CD1-CG1 4.31Å; Y194-V208 PolarHBondContact N-O 2.91Å; Y194-V208 PolarHBondContact O-N 3.45Å; L196-V208 HydrophobicContact CD1-CG2 3.36Å; L196-V208 HydrophobicContact CD2-CG2 4.35Å; L196-V208 HydrophobicContact CG-CG2 3.7Å
209	H	79.3	Confident	70.7	Confident	123 Å²	123	112.4 Å²	112.4	57%	0.569	62%	0.623	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-107.1	117.7	172.9	-67.4	-91.7	0	0	0	108.8	K193	K193-H209 VanDerWaalsContact CD-CE1 3.49Å; K193-H209 WeakPolarHBondContact CD-CE1 3.31Å; K193-H209 VanDerWaalsContact CE-CE1 3.47Å; K193-H209 WeakPolarHBondContact CE-CE1 3.46Å
210	V	76.5	Confident	68.7	Low	46 Å²	46	117.7 Å²	117.7	28%	0.279	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-83.4	117.5	171.7	-172.2	0	0	0	0	108.1	L188 G191	L188-V210 HydrophobicContact CB-CG2 3.84Å; G191-V210 PolarHBondContact N-O 2.77Å
211	C	72.3	Confident	66.9	Low	113 Å²	113	119.1 Å²	119.1	76%	0.764	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-82.9	119.5	179.4	-147.7	0	0	0	0	109.4	S213	C211-S213 PolarHBondContact O-N 3.37Å
212	D	67.6	Low	65.4	Low	67 Å²	67	118.6 Å²	118.6	36%	0.358	65%	0.646	S	S	.	*	P	Polyproline II helix	trans	-64.6	128.4	167.3	-88.2	-51.9	0	0	0	109.6	P190 D214 I215	P190-D212 WeakPolarHBondContact CB-OD1 3.43Å; D212-D214 VanDerWaalsContact C-N 3.34Å; D212-I215 HydrophobicContact CB-CD1 3.61Å; D212-I215 HydrophobicContact CB-CG1 3.86Å
213	S	57	Low	63.9	Low	116 Å²	116	119.7 Å²	119.7	81%	0.811	65%	0.649	S	S	*	*	S	Bend	trans	-88.8	-2.7	179.5	-52.9	0	0	0	0	113.1	C211	C211-S213 PolarHBondContact O-N 3.37Å
214	D	58.3	Low	62.9	Low	158 Å²	158	122.1 Å²	122.1	85%	0.845	67%	0.668	S	S	*	*			trans	-122.5	27.5	-172.1	-70.3	-27.1	0	0	0	113.7	D212	D212-D214 VanDerWaalsContact C-N 3.34Å
215	I	50.7	Low	61.8	Low	130 Å²	130	122.6 Å²	122.6	67%	0.667	67%	0.672	S	S	*	*			trans	-104.9	109.1	171.8	-54.9	173.1	0	0	0	108.1	D212	D212-I215 HydrophobicContact CB-CD1 3.61Å; D212-I215 HydrophobicContact CB-CG1 3.86Å
216	E	46.3	Very low	60.5	Low	179 Å²	179	128.9 Å²	128.9	84%	0.836	69%	0.691	S	S	*	*			trans	-48.3	144.2	169.2	-63	-178.6	162.9	0	0	110.9	E218	E216-E218 PolarHBondContact O-N 3.2Å
217	E	51.7	Low	59.6	Low	202 Å²	202	130.8 Å²	130.8	94%	0.944	71%	0.705	S	S	*	*			trans	-54.6	94.3	179.6	-60.3	176.5	154	0	0	111.5
218	E	43.1	Very low	59.2	Low	191 Å²	191	137.7 Å²	137.7	89%	0.893	73%	0.731	S	S	*	*			trans	-102.5	130.8	157.7	-76.2	-132.9	149.9	0	0	110.6	E216	E216-E218 PolarHBondContact O-N 3.2Å
219	E	48.8	Very low	58.9	Low	186 Å²	186	143 Å²	143	87%	0.869	76%	0.756	S	S	*	*			trans	-55.8	129.4	-172	-64.7	178.9	119.6	0	0	114.2
220	D	41.8	Very low	58.9	Low	151 Å²	151	144.2 Å²	144.2	81%	0.807	77%	0.765	S	S	*	*				157.8	161.5	120.5	-103.1	-42.8	0	0	0	112.4
221	P	46.1	Very low	59	Low	109 Å²	109	150.8 Å²	150.8	71%	0.708	79%	0.793	S	S	*	*				-109.3	148.6	-59.8	26.1	-8.5	0	0	0	110.7	T223	P221-T223 PolarHBondContact O-N 3.48Å
222	K	53.6	Low	59.3	Low	201 Å²	201	151.5 Å²	151.5	87%	0.874	79%	0.794	S	S	*	*			trans	-56.5	109.6	164.6	-66.5	166.6	-179.7	165.1	0	109.4
223	T	52.7	Low	60	Low	133 Å²	133	159.6 Å²	159.6	82%	0.816	82%	0.819	S	S	*	*			trans	166.3	85.8	133.4	40.5	0	0	0	0	111	P221	P221-T223 PolarHBondContact O-N 3.48Å
224	S	55.3	Low	60.8	Low	112 Å²	112	163.7 Å²	163.7	78%	0.783	82%	0.817	S	S	*	*			trans	-96.3	115.4	144.7	54.5	0	0	0	0	106.9	K226	S224-K226 PolarHBondContact O-N 3.03Å; S224-K226 VanDerWaalsContact O-N 3.14Å
225	P	62.1	Low	61.8	Low	120 Å²	120	161.6 Å²	161.6	78%	0.779	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-64.8	119.9	-179.8	24.4	-30.3	0	0	0	108.4
226	K	61.2	Low	63.3	Low	192 Å²	192	158.8 Å²	158.8	84%	0.835	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-49.6	124.8	175.4	-70.8	177.3	179.6	178.4	0	108.6	S224 K228	S224-K226 PolarHBondContact O-N 3.03Å; S224-K226 VanDerWaalsContact O-N 3.14Å; K226-K228 PolarHBondContact O-N 3.34Å; K226-K228 VanDerWaalsContact O-N 3.11Å
227	P	65.9	Low	64.8	Low	116 Å²	116	157.2 Å²	157.2	75%	0.753	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-58.1	122.9	177.5	22.3	-31.2	0	0	0	108.5	I229	P227-I229 PolarHBondContact O-N 3.22Å
228	K	71.1	Confident	66	Low	199 Å²	199	152.6 Å²	152.6	87%	0.865	80%	0.799	S	S	*	*			trans	-76.2	98.2	-178	-153.1	172.4	-172.3	176.9	0	107.6	K226 I230	K226-K228 PolarHBondContact O-N 3.34Å; K226-K228 VanDerWaalsContact O-N 3.11Å; K228-I230 PolarHBondContact O-N 3.46Å; K228-I230 VanDerWaalsContact O-N 3.13Å
229	I	75.9	Confident	67.6	Low	160 Å²	160	149.1 Å²	149.1	82%	0.821	79%	0.793	S	S	*	*			trans	-66.3	112.2	177.6	-59.5	173.8	0	0	0	107.8	P227	P227-I229 PolarHBondContact O-N 3.22Å
230	I	78.9	Confident	68.5	Low	147 Å²	147	145.7 Å²	145.7	75%	0.754	79%	0.79	S	S	*	*			trans	-79.9	123.1	175.7	-54.6	173.1	0	0	0	107.3	K228 T232	K228-I230 PolarHBondContact O-N 3.46Å; K228-I230 VanDerWaalsContact O-N 3.13Å; I230-T232 PolarHBondContact O-N 3Å; I230-T232 VanDerWaalsContact O-N 3.13Å
231	Q	78.9	Confident	69.6	Low	185 Å²	185	145.1 Å²	145.1	86%	0.864	79%	0.792	S	S	*	*			trans	-61.6	114.4	176.4	-176	177.8	-3.3	0	0	109.9	R233	Q231-R233 PolarHBondContact O-N 3.1Å
232	T	78.9	Confident	70.2	Confident	128 Å²	128	145 Å²	145	79%	0.785	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-70	128.8	175.6	54.1	0	0	0	0	109.7	I230	I230-T232 PolarHBondContact O-N 3Å; I230-T232 VanDerWaalsContact O-N 3.13Å
233	R	80.9	Confident	70.1	Confident	236 Å²	236	146.9 Å²	146.9	89%	0.891	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-62.6	140.2	173.2	-169.8	178.3	-179.2	-169.5	0.1	109.3	Q231	Q231-R233 PolarHBondContact O-N 3.1Å
234	R	75.5	Confident	71	Confident	203 Å²	203	147.6 Å²	147.6	77%	0.766	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-49.7	130.6	173.8	-173.8	-172.4	177.3	-160.6	-0.1	110.1
235	P	79.3	Confident	71.8	Confident	113 Å²	113	149.5 Å²	149.5	73%	0.734	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-53.1	144.7	170.8	-26.1	34.7	0	0	0	111.5
236	G	80.6	Confident	72.3	Confident	72 Å²	72	151.1 Å²	151.1	74%	0.742	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-58	152.8	177.5	0	0	0	0	0	111.8
237	L	78.8	Confident	73	Confident	145 Å²	145	148.7 Å²	148.7	76%	0.759	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-57.7	136.9	172.4	-80.8	151.3	0	0	0	109.4
238	P	77.4	Confident	73.4	Confident	105 Å²	105	150.8 Å²	150.8	68%	0.682	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-60.4	147.5	172.1	26.3	-32.6	0	0	0	109.6	S240	P238-S240 PolarHBondContact O-N 3.11Å
239	P	76	Confident	73.6	Confident	118 Å²	118	147.5 Å²	147.5	77%	0.766	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-59.5	140.2	179.3	24.8	-32.7	0	0	0	110.2	V241	P239-V241 PolarHBondContact O-N 3.49Å; P239-V241 VanDerWaalsContact O-N 3.11Å
240	S	67.5	Low	73.4	Confident	114 Å²	114	146.6 Å²	146.6	80%	0.797	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-59.6	116.6	175.1	53.4	0	0	0	0	109	P238 S242	P238-S240 PolarHBondContact O-N 3.11Å; S240-S242 PolarHBondContact O-N 3.06Å
241	V	64.2	Low	73	Confident	140 Å²	140	146.6 Å²	146.6	85%	0.848	82%	0.821	S	S	*	*			trans	-68.9	104.9	169	-159.4	0	0	0	0	106.1	P239 N243	P239-V241 PolarHBondContact O-N 3.49Å; P239-V241 VanDerWaalsContact O-N 3.11Å; V241-N243 PolarHBondContact O-N 3.47Å
242	S	59.3	Low	72.5	Confident	107 Å²	107	143.4 Å²	143.4	75%	0.748	82%	0.817	S	S	*	*			trans	-67.2	124.8	165.8	42.3	0	0	0	0	107.9	S240	S240-S242 PolarHBondContact O-N 3.06Å
243	N	51.7	Low	71.9	Confident	240 Å²	240	144.8 Å²	144.8	100%	1.283	82%	0.82	S	S	*	*			trans	-41.4	0	-176.7	-76	-42.9	0	0	0	115.1	V241	V241-N243 PolarHBondContact O-N 3.47Å

Retrieved 243 of 243 residues in 130.5 ms (Link to these results)

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