A0A087XJL3_POEFO Loading...

Biglycan

May be involved in collagen fiber assembly.

AlphaFold DB , UniProt , Accession A0A087XJL3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 372 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	39.3	Very low	36.6	Very low	244 Å²	244	149.5 Å²	149.5	100%	1.202	81%	0.807	S	S	*	*				0	136.5	0	-74.7	179.5	73.9	0	0	108
2	L	32.2	Very low	36.3	Very low	163 Å²	163	146.3 Å²	146.3	85%	0.853	80%	0.803	S	S	*	*			trans	-69.3	162.3	-150	-94	102.7	0	0	0	116.8
3	P	41.4	Very low	36	Very low	94 Å²	94	141.9 Å²	141.9	61%	0.61	80%	0.797	S	S	*	*			trans	-94.5	140.6	-177.2	36.7	-26.9	0	0	0	111.4
4	H	35.5	Very low	35.9	Very low	191 Å²	191	137.9 Å²	137.9	88%	0.884	79%	0.791	S	S	*	*			trans	-132.2	74.6	166.1	-82.9	21.5	0	0	0	109
5	C	39.9	Very low	35.7	Very low	126 Å²	126	140.3 Å²	140.3	85%	0.851	79%	0.792	S	S	*	*			trans	-139.3	34.1	173.5	-151.2	0	0	0	0	112.3
6	S	37.2	Very low	35.5	Very low	85 Å²	85	141.2 Å²	141.2	59%	0.594	79%	0.794	S	S	*	*	S	Bend	trans	-136.5	0.2	-176.2	-22.9	0	0	0	0	115.2
7	L	37.5	Very low	35.4	Very low	148 Å²	148	143.1 Å²	143.1	78%	0.775	80%	0.8	S	S	*	*	S	Bend	trans	-104.1	-6.2	-172.3	-128.8	83.8	0	0	0	116
8	L	35.9	Very low	35.2	Very low	164 Å²	164	141.2 Å²	141.2	86%	0.859	80%	0.798	S	S	*	*	S	Bend	trans	-96.6	-4.4	176.9	-102.5	108	0	0	0	114.9
9	L	36.4	Very low	35	Very low	157 Å²	157	139.7 Å²	139.7	82%	0.822	80%	0.798	S	S	*	*	S	Bend	trans	-94.5	-4.9	175.2	-98.2	141.8	0	0	0	113.7
10	L	34.9	Very low	34.8	Very low	136 Å²	136	137.8 Å²	137.8	71%	0.712	79%	0.793	S	S	*	*	S	Bend	trans	-103.7	-3	-179.3	-97.2	139.1	0	0	0	114.6
11	L	32.1	Very low	34.7	Very low	137 Å²	137	137.3 Å²	137.3	72%	0.717	80%	0.798	S	S	*	*	S	Bend	trans	-100.6	-5.2	174.9	-88.8	151	0	0	0	114.2
12	C	32.7	Very low	34.4	Very low	111 Å²	111	129 Å²	129	75%	0.75	77%	0.768	S	S	*	*	S	Bend	trans	-95.8	0.2	174.5	-86.8	0	0	0	0	114.6
13	A	32.9	Very low	34.3	Very low	89 Å²	89	129 Å²	129	74%	0.736	77%	0.768	S	S	*	*	S	Bend	trans	-99.6	-3.2	-179.5	0	0	0	0	0	114.1
14	A	35	Very low	34	Very low	86 Å²	86	129.7 Å²	129.7	71%	0.711	77%	0.773	S	S	*	*	S	Bend	trans	-113.2	8.3	-170.7	0	0	0	0	0	115.3
15	Q	32.7	Very low	34.2	Very low	173 Å²	173	127.7 Å²	127.7	81%	0.808	76%	0.762	S	S	*	*	S	Bend	trans	-126.4	17.4	-179.2	-74.3	-170.5	-24.9	0	0	115.4
16	L	32.8	Very low	33.9	Very low	155 Å²	155	130.3 Å²	130.3	81%	0.812	76%	0.762	S	S	*	*			trans	-102.7	52.5	169.2	-74.7	168.7	0	0	0	111.8
17	L	34.2	Very low	34.1	Very low	173 Å²	173	129.1 Å²	129.1	91%	0.906	75%	0.746	S	S	*	*			trans	-137.5	54.5	164.5	-81.8	164	0	0	0	108.7	S19	L17-S19 PolarHBondContact O-N 3.31Å
18	S	31	Very low	34.2	Very low	109 Å²	109	129.7 Å²	129.7	76%	0.762	74%	0.738	S	S	*	*			trans	-77.7	103.5	158.1	48.2	0	0	0	0	107.4	S20	S18-S20 PolarHBondContact O-N 2.83Å; S18-S20 VanDerWaalsContact O-N 3.07Å
19	S	31.9	Very low	34.4	Very low	113 Å²	113	123.8 Å²	123.8	79%	0.79	72%	0.717	S	S	*	*			trans	-44.4	105	175.8	38.9	0	0	0	0	112.5	L17 S21	L17-S19 PolarHBondContact O-N 3.31Å; S19-S21 PolarHBondContact O-N 3.35Å
20	S	30.5	Very low	34.9	Very low	101 Å²	101	117.2 Å²	117.2	71%	0.706	68%	0.682	S	S	*	*			trans	-60.8	110.9	155.6	178.9	0	0	0	0	107.5	S18 A22	S18-S20 PolarHBondContact O-N 2.83Å; S18-S20 VanDerWaalsContact O-N 3.07Å; S20-A22 PolarHBondContact O-N 2.91Å; S20-A22 VanDerWaalsContact O-N 3.12Å
21	S	33.3	Very low	35.6	Very low	128 Å²	128	115.8 Å²	115.8	90%	0.895	67%	0.667	S	S	*	*	S	Bend	trans	-84.4	49.9	170.6	56.6	0	0	0	0	110.7	S19	S19-S21 PolarHBondContact O-N 3.35Å
22	A	31.7	Very low	36.6	Very low	70 Å²	70	112.6 Å²	112.6	58%	0.579	65%	0.65	S	S	*	*			trans	-113.8	101.9	152.4	0	0	0	0	0	105.4	S20	S20-A22 PolarHBondContact O-N 2.91Å; S20-A22 VanDerWaalsContact O-N 3.12Å
23	L	30.9	Very low	37.3	Very low	163 Å²	163	109.7 Å²	109.7	85%	0.853	63%	0.625	S	S	*	*			trans	-54.5	133.6	170.1	-71.7	164	0	0	0	107.4	F25	L23-F25 PolarHBondContact O-N 3.25Å
24	P	34.6	Very low	38.1	Very low	109 Å²	109	105.7 Å²	105.7	71%	0.708	59%	0.592	S	S	*	*			trans	-53	136.5	163.1	23.2	-29.9	0	0	0	107	E26	P24-E26 PolarHBondContact O-N 3.27Å
25	F	39.4	Very low	38.6	Very low	149 Å²	149	106.5 Å²	106.5	65%	0.654	58%	0.584	S	S	*	*			trans	-52.8	105.4	174.9	171.2	-101.6	0	0	0	108.5	L23 Q27	L23-F25 PolarHBondContact O-N 3.25Å; F25-Q27 HydrophobicContact CD1-CB 4.25Å; F25-Q27 HydrophobicContact CE1-CB 3.88Å; F25-Q27 HydrophobicContact CE1-CG 4.37Å; F25-Q27 PolarHBondContact O-N 3.26Å
26	E	33.8	Very low	39.2	Very low	181 Å²	181	103 Å²	103	85%	0.846	57%	0.571	S	S	*	*			trans	-70.1	102.2	167.2	-98.7	-167.1	156.4	0	0	106.5	P24 R28	P24-E26 PolarHBondContact O-N 3.27Å; E26-R28 PolarHBondContact O-N 2.84Å
27	Q	42.9	Very low	39.8	Very low	59 Å²	59	99 Å²	99	28%	0.276	56%	0.556	S	S	.	*			trans	-60.1	108.8	168.3	-179.7	174.9	6	0	0	107.5	F25 G29 R169	F25-Q27 HydrophobicContact CD1-CB 4.25Å; F25-Q27 HydrophobicContact CE1-CB 3.88Å; F25-Q27 HydrophobicContact CE1-CG 4.37Å; F25-Q27 PolarHBondContact O-N 3.26Å; Q27-G29 PolarHBondContact O-N 2.02Å; Q27-R169 VanDerWaalsContact NE2-NH1 3.13Å
28	R	38.9	Very low	40.3	Very low	161 Å²	161	95.8 Å²	95.8	61%	0.608	54%	0.539	S	S	*	.			trans	-35.5	123	163.7	-75.1	-157.1	178.1	-174.7	-0	109.8	E26 D32	E26-R28 PolarHBondContact O-N 2.84Å; R28-D32 VanDerWaalsContact CA-OD2 3.26Å; R28-D32 WeakPolarHBondContact CA-OD2 3.34Å; R28-D32 HydrophobicContact CB-CB 3.96Å; R28-D32 WeakPolarHBondContact CB-OD2 3Å; R28-D32 WeakPolarHBondContact CD-OD2 3.24Å; R28-D32 HydrophobicContact CG-CB 4.35Å; R28-D32 WeakPolarHBondContact CG-OD2 3.29Å; R28-D32 IonicContact NE-OD2 3.75Å
29	G	39.7	Very low	40.7	Very low	39 Å²	39	98.2 Å²	98.2	40%	0.402	54%	0.538	S	S	.	.			trans	-58.2	156.5	179.3	0	0	0	0	0	109.8	Q27 W31 D32	Q27-G29 PolarHBondContact O-N 2.02Å; G29-W31 PolarHBondContact O-N 3.28Å; G29-D32 PolarHBondContact O-N 3.36Å
30	F	48	Very low	41	Very low	19 Å²	19	100.5 Å²	100.5	8%	0.083	54%	0.541	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.8	-28.4	171.8	179.1	-103.3	0	0	0	112.9	F98 D100 A122 Y148	F30-F98 HydrophobicContact CE1-CB 4.02Å; F30-F98 HydrophobicContact CE1-CD1 4.3Å; F30-F98 HydrophobicContact CZ-CB 3.82Å; F30-F98 AromaticContact CZ-CD1 3.84Å; F30-F98 HydrophobicContact CZ-CD1 3.84Å; F30-F98 HydrophobicContact CZ-CG 4.32Å; F30-D100 HydrophobicContact CD1-CB 4.26Å; F30-D100 HydrophobicContact CE1-CB 3.98Å; F30-D100 HydrophobicContact CZ-CB 4.39Å; F30-A122 HydrophobicContact CE2-CB 3.89Å; F30-A122 HydrophobicContact CZ-CB 4.28Å; F30-Y148 HydrophobicContact CD2-CD2 4.12Å; F30-Y148 AromaticContact CD2-CE2 3.95Å; F30-Y148 HydrophobicContact CD2-CE2 3.95Å; F30-Y148 HydrophobicContact CE2-CE2 4.43Å
31	W	49.6	Very low	41.5	Very low	107 Å²	107	98.5 Å²	98.5	41%	0.405	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-21.8	-179.1	-60.2	105.5	0	0	0	116.5	G29 F33 A34 L35 V77 Q79	G29-W31 PolarHBondContact O-N 3.28Å; W31-F33 PolarHBondContact O-N 2.68Å; W31-F33 VanDerWaalsContact O-N 3.09Å; W31-A34 HydrophobicContact CE3-CB 3.89Å; W31-A34 HydrophobicContact CZ3-CB 4.34Å; W31-A34 PolarHBondContact O-N 3.09Å; W31-A34 VanDerWaalsContact O-N 3.14Å; W31-L35 PolarHBondContact O-N 2.94Å; W31-V77 HydrophobicContact CH2-CG1 3.54Å; W31-V77 HydrophobicContact CZ3-CG1 3.85Å; W31-Q79 HydrophobicContact CZ2-CB 4.41Å; W31-Q79 HydrophobicContact CZ2-CG 4.25Å
32	D	52.4	Low	41.5	Very low	69 Å²	69	96.1 Å²	96.1	37%	0.369	53%	0.533	S	S	.	.	H	α-helix	trans	-64.6	-17.2	176.3	-76.5	-13.4	0	0	0	111.7	R28 G29	R28-D32 VanDerWaalsContact CA-OD2 3.26Å; R28-D32 WeakPolarHBondContact CA-OD2 3.34Å; R28-D32 HydrophobicContact CB-CB 3.96Å; R28-D32 WeakPolarHBondContact CB-OD2 3Å; R28-D32 WeakPolarHBondContact CD-OD2 3.24Å; R28-D32 HydrophobicContact CG-CB 4.35Å; R28-D32 WeakPolarHBondContact CG-OD2 3.29Å; R28-D32 IonicContact NE-OD2 3.75Å; G29-D32 PolarHBondContact O-N 3.36Å
33	F	47.6	Very low	41.6	Very low	51 Å²	51	101.6 Å²	101.6	22%	0.224	55%	0.549	C	S	.	.	H	α-helix	trans	-99.4	-22.4	176.2	-58.1	-71.2	0	0	0	113.9	W31 S37	W31-F33 PolarHBondContact O-N 2.68Å; W31-F33 VanDerWaalsContact O-N 3.09Å; F33-S37 PolarHBondContact O-N 3.42Å; F33-S37 PolarHBondContact O-OG 2.87Å
34	A	49.9	Very low	41.7	Very low	4 Å²	4	101.1 Å²	101.1	3%	0.033	54%	0.544	C	S	.	.	H	α-helix	trans	-72.2	-37	175.7	0	0	0	0	0	110.7	W31 S37 L38	W31-A34 HydrophobicContact CE3-CB 3.89Å; W31-A34 HydrophobicContact CZ3-CB 4.34Å; W31-A34 PolarHBondContact O-N 3.09Å; W31-A34 VanDerWaalsContact O-N 3.14Å; A34-S37 PolarHBondContact O-N 3.26Å; A34-L38 WeakPolarHBondContact O-CD1 3.45Å; A34-L38 VanDerWaalsContact O-CG 3.28Å; A34-L38 WeakPolarHBondContact O-CG 2.97Å; A34-L38 PolarHBondContact O-N 3.46Å
35	L	45.6	Very low	41.6	Very low	103 Å²	103	101.5 Å²	101.5	54%	0.539	55%	0.549	S	S	.	.	H	α-helix	trans	-69.3	-42.7	174.9	-101.2	104	0	0	0	113.1	W31 S37 L38 E39	W31-L35 PolarHBondContact O-N 2.94Å; L35-S37 PolarHBondContact O-N 2.92Å; L35-S37 VanDerWaalsContact O-N 3.08Å; L35-L38 PolarHBondContact O-N 2.94Å; L35-E39 PolarHBondContact O-N 3.22Å
36	D	43.8	Very low	41.2	Very low	101 Å²	101	102.2 Å²	102.2	54%	0.54	56%	0.556	S	S	.	*	H	α-helix	trans	-58.3	-25.6	175.4	-79	-4.1	0	0	0	112.5
37	S	45.4	Very low	41.3	Very low	70 Å²	70	102.3 Å²	102.3	49%	0.49	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.6	-14.1	177.3	-49.2	0	0	0	0	113.8	F33 A34 L35	F33-S37 PolarHBondContact O-N 3.42Å; F33-S37 PolarHBondContact O-OG 2.87Å; A34-S37 PolarHBondContact O-N 3.26Å; L35-S37 PolarHBondContact O-N 2.92Å; L35-S37 VanDerWaalsContact O-N 3.08Å
38	L	44.5	Very low	40.9	Very low	106 Å²	106	110 Å²	110	56%	0.555	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	-18.6	-177.3	-73.5	166.3	0	0	0	112.4	A34 L35 D40	A34-L38 WeakPolarHBondContact O-CD1 3.45Å; A34-L38 VanDerWaalsContact O-CG 3.28Å; A34-L38 WeakPolarHBondContact O-CG 2.97Å; A34-L38 PolarHBondContact O-N 3.46Å; L35-L38 PolarHBondContact O-N 2.94Å; L38-D40 VanDerWaalsContact C-N 3.31Å; L38-D40 PolarHBondContact O-N 2.88Å
39	E	40.8	Very low	40.7	Very low	160 Å²	160	107.5 Å²	107.5	75%	0.748	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-13.6	176.8	-71.7	-169.1	165.5	0	0	114.1	L35 G41	L35-E39 PolarHBondContact O-N 3.22Å; E39-G41 VanDerWaalsContact C-N 3.25Å; E39-G41 PolarHBondContact O-N 3.27Å
40	D	38.4	Very low	40.7	Very low	160 Å²	160	113.1 Å²	113.1	86%	0.856	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	14.6	174.9	-158.4	34	0	0	0	113.3	L38	L38-D40 VanDerWaalsContact C-N 3.31Å; L38-D40 PolarHBondContact O-N 2.88Å
41	G	39.4	Very low	40	Very low	59 Å²	59	118.9 Å²	118.9	61%	0.608	63%	0.632	S	S	*	*	S	Bend	trans	-130.1	77.1	-174.3	0	0	0	0	0	114.4	E39	E39-G41 VanDerWaalsContact C-N 3.25Å; E39-G41 PolarHBondContact O-N 3.27Å
42	G	33.5	Very low	39.2	Very low	79 Å²	79	122 Å²	122	81%	0.814	65%	0.651	S	S	*	*			trans	45.5	101.8	146.5	0	0	0	0	0	119.1
43	M	33.9	Very low	38.5	Very low	185 Å²	185	122.6 Å²	122.6	91%	0.911	67%	0.673	S	S	*	*			trans	-57.6	131.1	174	-163	170.1	176.2	0	0	114.6
44	M	33.3	Very low	37.8	Very low	152 Å²	152	125.2 Å²	125.2	75%	0.749	70%	0.698	S	S	*	*			trans	31.5	125.1	144.7	-68	-89.1	-166.3	0	0	120.7	M46	M44-M46 HydrophobicContact SD-CG 4.22Å
45	S	31.6	Very low	37.5	Very low	117 Å²	117	130.1 Å²	130.1	82%	0.818	74%	0.739	S	S	*	*			trans	-137.7	118.3	138.4	-173.1	0	0	0	0	109.3
46	M	32.9	Very low	37.1	Very low	164 Å²	164	130.3 Å²	130.3	81%	0.808	74%	0.744	S	S	*	*			trans	-95.4	130.5	171.1	-69.8	-146	-87.8	0	0	109.4	M44	M44-M46 HydrophobicContact SD-CG 4.22Å
47	M	34.3	Very low	37.2	Very low	184 Å²	184	135 Å²	135	91%	0.906	76%	0.763	S	S	*	*			trans	-140.2	122.7	154	-76.8	-147.4	-168.4	0	0	111
48	R	34.4	Very low	36.8	Very low	220 Å²	220	138.8 Å²	138.8	83%	0.83	77%	0.773	S	S	*	*			trans	-66.2	158.9	149.1	-96.7	-179.6	164.1	161.4	-2.6	108.6
49	D	35.4	Very low	36.7	Very low	109 Å²	109	141.6 Å²	141.6	58%	0.583	79%	0.786	S	S	*	*			cis	-164.6	158.4	11.4	-117.2	-23.9	0	0	0	108.5
50	Q	38.8	Very low	36.5	Very low	157 Å²	157	140.8 Å²	140.8	73%	0.734	79%	0.786	S	S	*	*			trans	56.3	115	144.7	-62.1	173.1	41.4	0	0	121.8
51	N	33.7	Very low	36.8	Very low	139 Å²	139	139 Å²	139	74%	0.743	78%	0.782	S	S	*	*				-166.2	133.6	115.2	-116.9	15.2	0	0	0	114.7
52	E	34.5	Very low	37.6	Very low	173 Å²	173	141.3 Å²	141.3	81%	0.808	79%	0.786	S	S	*	*			trans	35.6	113.3	141.5	-60.6	-176.2	156	0	0	122.5
53	G	36.1	Very low	38.1	Very low	82 Å²	82	144.9 Å²	144.9	85%	0.845	79%	0.786	S	S	*	*				63.5	108.9	117.6	0	0	0	0	0	121.1
54	S	33.6	Very low	39	Very low	106 Å²	106	141.9 Å²	141.9	74%	0.741	78%	0.778	S	S	*	*			trans	-167.1	124.6	131.8	-178.2	0	0	0	0	110	T56	S54-T56 PolarHBondContact O-N 2.6Å
55	A	43.2	Very low	40.2	Very low	107 Å²	107	137.9 Å²	137.9	88%	0.884	76%	0.763	S	S	*	*			trans	-78.1	103.5	170	0	0	0	0	0	108.9
56	T	38.4	Very low	42.3	Very low	106 Å²	106	138.8 Å²	138.8	65%	0.65	76%	0.756	S	S	*	*			trans	-118.8	118.7	159.6	36.1	0	0	0	0	107.3	S54 E58	S54-T56 PolarHBondContact O-N 2.6Å; T56-E58 PolarHBondContact O-N 3.38Å
57	E	45.5	Very low	44.9	Very low	200 Å²	200	133 Å²	133	94%	0.935	73%	0.732	S	S	*	*			trans	-59.9	88.7	166.8	-76.4	-179.2	145.8	0	0	108.5	I59	E57-I59 PolarHBondContact O-N 3.14Å
58	E	37.4	Very low	47.6	Very low	149 Å²	149	124.8 Å²	124.8	70%	0.696	69%	0.692	S	S	*	*			trans	-76.8	110.7	163.7	-79.9	-168.5	166.1	0	0	108.3	T56 L60	T56-E58 PolarHBondContact O-N 3.38Å; E58-L60 VanDerWaalsContact C-N 3.31Å; E58-L60 PolarHBondContact O-N 2.83Å
59	I	40.5	Very low	50.2	Low	165 Å²	165	124 Å²	124	85%	0.846	70%	0.695	S	S	*	*			trans	-62.7	93.7	166.6	-60.6	163.4	0	0	0	107.3	E57	E57-I59 PolarHBondContact O-N 3.14Å
60	L	37.4	Very low	52.7	Low	143 Å²	143	121.3 Å²	121.3	75%	0.749	69%	0.693	S	S	*	*			trans	-94.8	100.4	173.1	-77.3	168	0	0	0	110	E58	E58-L60 VanDerWaalsContact C-N 3.31Å; E58-L60 PolarHBondContact O-N 2.83Å
61	T	44.9	Very low	55.3	Low	123 Å²	123	114.7 Å²	114.7	76%	0.755	66%	0.664	S	S	*	*			trans	-157	155	149	53.2	0	0	0	0	111.2
62	P	55.4	Low	58.1	Low	108 Å²	108	114 Å²	114	70%	0.701	66%	0.656	S	S	*	*	S	Bend	cis	-132.3	149.3	-18.9	31.7	-13.4	0	0	0	112.7
63	D	44.2	Very low	60.9	Low	153 Å²	153	107.6 Å²	107.6	82%	0.818	63%	0.63	S	S	*	*			trans	143.4	49	155	-79.8	-15.2	0	0	0	110.5	P65	D63-P65 VanDerWaalsContact O-CD 3.22Å; D63-P65 WeakPolarHBondContact O-CD 3.41Å
64	V	52.8	Low	63.5	Low	123 Å²	123	109 Å²	109	75%	0.745	61%	0.614	S	S	*	*			trans	-65.7	118.3	145.2	-175.7	0	0	0	0	103.7	M66	V64-M66 WeakPolarHBondContact O-CG 3.45Å; V64-M66 PolarHBondContact O-N 2.82Å
65	P	59.1	Low	66.2	Low	67 Å²	67	110.1 Å²	110.1	44%	0.435	61%	0.611	S	S	.	*			trans	-62	94.6	174.7	24.7	-31	0	0	0	106.6	D63 C67 P93	D63-P65 VanDerWaalsContact O-CD 3.22Å; D63-P65 WeakPolarHBondContact O-CD 3.41Å; P65-C67 PolarHBondContact O-N 2.82Å; P65-P93 HydrophobicContact CB-CB 3.84Å; P65-P93 HydrophobicContact CB-CG 4.02Å; P65-P93 HydrophobicContact CG-CB 4.12Å; P65-P93 HydrophobicContact CG-CG 4.48Å
66	M	75.8	Confident	68.5	Low	136 Å²	136	111.4 Å²	111.4	67%	0.67	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-66.4	127.1	-173.9	-71.9	-168.7	-68.3	0	0	107	V64 N91	V64-M66 WeakPolarHBondContact O-CG 3.45Å; V64-M66 PolarHBondContact O-N 2.82Å; M66-N91 VanDerWaalsContact O-O 3.13Å
67	C	88.2	Confident	71.2	Confident	44 Å²	44	107.4 Å²	107.4	30%	0.297	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-53.9	138.3	171.9	-164.9	0	0	0	0	109.2	P65 C71 C73	P65-C67 PolarHBondContact O-N 2.82Å; C67-C71 VanDerWaalsContact SG-C 3.51Å; C67-C71 PolarHBondContact SG-O 2.84Å; C67-C73 WeakPolarHBondContact CA-SG 3.46Å; C67-C73 HydrophobicContact CB-CB 3.61Å; C67-C73 WeakPolarHBondContact CB-SG 3.39Å; C67-C73 WeakPolarHBondContact SG-CB 3.22Å; C67-C73 PolarHBondContact SG-N 2.96Å; C67-C73 CovalentContact SG-SG 2.02Å; C67-C73 PolarHBondContact SG-SG 3.21Å
68	P	90.3	Very high	73.6	Confident	11 Å²	11	98 Å²	98	7%	0.071	52%	0.524	C	S	.	.	P	Polyproline II helix	trans	-57.6	150.3	177.6	-21.1	29.9	0	0	0	112	G70 C71 P89 I92	P68-G70 PolarHBondContact O-N 3.17Å; P68-C71 HydrophobicContact CB-CB 4.31Å; P68-C71 VanDerWaalsContact O-CB 3.29Å; P68-C71 WeakPolarHBondContact O-CB 3.29Å; P68-C71 PolarHBondContact O-N 3.2Å; P68-P89 HydrophobicContact CB-CB 3.5Å; P68-P89 HydrophobicContact CB-CG 4.14Å; P68-P89 HydrophobicContact CG-CB 3.8Å; P68-P89 HydrophobicContact CG-CG 4.07Å; P68-I92 HydrophobicContact CG-CG1 4.18Å
69	F	88	Confident	76.4	Confident	204 Å²	204	92.6 Å²	92.6	90%	0.895	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	128.6	-176.2	-177	-93.3	0	0	0	111.6	C71	F69-C71 PolarHBondContact O-N 2.81Å
70	G	88.3	Confident	79	Confident	51 Å²	51	84.8 Å²	84.8	53%	0.526	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	-12.7	-177.4	0	0	0	0	0	114.6	P68 L83	P68-G70 PolarHBondContact O-N 3.17Å; G70-L83 VanDerWaalsContact C-CD1 3.45Å; G70-L83 WeakPolarHBondContact O-CD1 3.27Å; G70-L83 WeakPolarHBondContact O-CD2 3.49Å
71	C	94.1	Very high	81.8	Confident	19 Å²	19	78.8 Å²	78.8	13%	0.128	43%	0.43	C	S	.	.			trans	-83.6	155.4	177.1	-56.9	0	0	0	0	111.9	C67 P68 F69 Q79 C80	C67-C71 VanDerWaalsContact SG-C 3.51Å; C67-C71 PolarHBondContact SG-O 2.84Å; P68-C71 HydrophobicContact CB-CB 4.31Å; P68-C71 VanDerWaalsContact O-CB 3.29Å; P68-C71 WeakPolarHBondContact O-CB 3.29Å; P68-C71 PolarHBondContact O-N 3.2Å; F69-C71 PolarHBondContact O-N 2.81Å; C71-Q79 CarbonylContact C-O 3.59Å; C71-Q79 VanDerWaalsContact CA-O 3.24Å; C71-Q79 WeakPolarHBondContact CA-O 3.27Å; C71-Q79 WeakPolarHBondContact CB-O 3.47Å; C71-C80 HydrophobicContact CB-CB 4.11Å; C71-C80 WeakPolarHBondContact CB-SG 3.04Å; C71-C80 VanDerWaalsContact SG-CA 3.59Å; C71-C80 WeakPolarHBondContact SG-CB 3.43Å; C71-C80 CovalentContact SG-SG 2.02Å; C71-C80 PolarHBondContact SG-SG 3.24Å
72	H	92.9	Very high	84.3	Confident	125 Å²	125	78 Å²	78	58%	0.579	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	121.3	170.9	-175.8	67.7	0	0	0	109.7	Q79	H72-Q79 HydrophobicContact CB-CB 4.46Å; H72-Q79 PolarHBondContact N-O 2.02Å; H72-Q79 PolarHBondContact O-N 3.09Å
73	C	93.1	Very high	86.2	Confident	38 Å²	38	76.2 Å²	76.2	26%	0.257	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	118.7	-179.8	-60.6	0	0	0	0	109.8	C67 V77 V78	C67-C73 WeakPolarHBondContact CA-SG 3.46Å; C67-C73 HydrophobicContact CB-CB 3.61Å; C67-C73 WeakPolarHBondContact CB-SG 3.39Å; C67-C73 WeakPolarHBondContact SG-CB 3.22Å; C67-C73 PolarHBondContact SG-N 2.96Å; C67-C73 CovalentContact SG-SG 2.02Å; C67-C73 PolarHBondContact SG-SG 3.21Å; C73-V77 CarbonylContact C-O 3.53Å; C73-V77 VanDerWaalsContact CA-O 3.27Å; C73-V77 WeakPolarHBondContact CA-O 3.41Å; C73-V78 HydrophobicContact CB-CG2 4.46Å
74	Q	90.8	Very high	88.7	Confident	111 Å²	111	70.3 Å²	70.3	52%	0.519	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	131.6	-179.7	-175.7	63	16	0	0	109.8	R76 V77	Q74-R76 PolarHBondContact O-N 3.18Å; Q74-V77 PolarHBondContact N-O 3.27Å; Q74-V77 WeakPolarHBondContact O-CA 3.22Å; Q74-V77 VanDerWaalsContact O-CB 3.29Å; Q74-V77 WeakPolarHBondContact O-CB 2.99Å; Q74-V77 PolarHBondContact O-N 3.41Å
75	L	89.1	Confident	90.8	Very high	130 Å²	130	66.3 Å²	66.3	68%	0.681	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	49.5	173.4	-61.8	172.2	0	0	0	114.3	V77	L75-V77 PolarHBondContact O-N 2.78Å
76	R	92.1	Very high	92.6	Very high	134 Å²	134	67.7 Å²	67.7	51%	0.506	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	66	15.5	-178.7	-51.3	176.3	-178.6	162.7	0.6	114.7	Q74 D95 T96 K97 F98	Q74-R76 PolarHBondContact O-N 3.18Å; R76-D95 WeakPolarHBondContact CB-O 3.4Å; R76-D95 WeakPolarHBondContact CD-O 2.97Å; R76-D95 HydrophobicContact CG-CB 4.48Å; R76-D95 WeakPolarHBondContact CG-O 3.35Å; R76-T96 WeakPolarHBondContact O-CA 3.5Å; R76-K97 HydrophobicContact CB-CB 4.29Å; R76-K97 HydrophobicContact CB-CG 4.27Å; R76-K97 PolarHBondContact O-N 2.84Å; R76-F98 PolarHBondContact O-N 3.48Å
77	V	95.1	Very high	93.6	Very high	21 Å²	21	64.5 Å²	64.5	13%	0.127	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.6	170	-174	0	0	0	0	108.4	W31 C73 Q74 L75 F98	W31-V77 HydrophobicContact CH2-CG1 3.54Å; W31-V77 HydrophobicContact CZ3-CG1 3.85Å; C73-V77 CarbonylContact C-O 3.53Å; C73-V77 VanDerWaalsContact CA-O 3.27Å; C73-V77 WeakPolarHBondContact CA-O 3.41Å; Q74-V77 PolarHBondContact N-O 3.27Å; Q74-V77 WeakPolarHBondContact O-CA 3.22Å; Q74-V77 VanDerWaalsContact O-CB 3.29Å; Q74-V77 WeakPolarHBondContact O-CB 2.99Å; Q74-V77 PolarHBondContact O-N 3.41Å; L75-V77 PolarHBondContact O-N 2.78Å; V77-F98 WeakPolarHBondContact CA-O 3.39Å; V77-F98 HydrophobicContact CB-CB 4.35Å; V77-F98 HydrophobicContact CG1-CB 3.98Å; V77-F98 HydrophobicContact CG2-CB 4.12Å; V77-F98 HydrophobicContact CG2-CD2 3.97Å; V77-F98 HydrophobicContact CG2-CG 4.39Å
78	V	96.1	Very high	94	Very high	2 Å²	2	62.6 Å²	62.6	1%	0.012	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	108.2	176.2	177.8	0	0	0	0	107.7	C73 I92 P93 T96 F98 L99 D100	C73-V78 HydrophobicContact CB-CG2 4.46Å; V78-I92 HydrophobicContact CG2-CG2 4.18Å; V78-P93 HydrophobicContact CG2-CG 4.43Å; V78-T96 HydrophobicContact CB-CG2 4.08Å; V78-T96 HydrophobicContact CG2-CG2 3.59Å; V78-T96 WeakPolarHBondContact CG2-OG1 3.02Å; V78-F98 PolarHBondContact N-O 3.38Å; V78-L99 HydrophobicContact CB-CD1 3.88Å; V78-L99 HydrophobicContact CG1-CD1 3.73Å; V78-D100 PolarHBondContact O-N 3Å
79	Q	96.1	Very high	94.2	Very high	37 Å²	37	63 Å²	63	17%	0.173	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	112.1	-179.4	177.1	52.8	-67.2	0	0	110.1	W31 C71 H72 S81 D100	W31-Q79 HydrophobicContact CZ2-CB 4.41Å; W31-Q79 HydrophobicContact CZ2-CG 4.25Å; C71-Q79 CarbonylContact C-O 3.59Å; C71-Q79 VanDerWaalsContact CA-O 3.24Å; C71-Q79 WeakPolarHBondContact CA-O 3.27Å; C71-Q79 WeakPolarHBondContact CB-O 3.47Å; H72-Q79 HydrophobicContact CB-CB 4.46Å; H72-Q79 PolarHBondContact N-O 2.02Å; H72-Q79 PolarHBondContact O-N 3.09Å; Q79-S81 PolarHBondContact NE2-OG 3.14Å; Q79-S81 VanDerWaalsContact NE2-OG 3.14Å; Q79-S81 VanDerWaalsContact OE1-CB 3.28Å; Q79-S81 PolarHBondContact OE1-OG 3.1Å; Q79-D100 PolarHBondContact NE2-OD2 2.87Å; Q79-D100 PolarHBondContact OE1-O 3.33Å; Q79-D100 PolarHBondContact OE1-OD2 2.79Å
80	C	96.4	Very high	94.3	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.326	C	S	.	.			trans	-125	24.8	-178.6	-66.3	0	0	0	0	112.2	C71 L83 L85 D100 L101 N104	C71-C80 HydrophobicContact CB-CB 4.11Å; C71-C80 WeakPolarHBondContact CB-SG 3.04Å; C71-C80 VanDerWaalsContact SG-CA 3.59Å; C71-C80 WeakPolarHBondContact SG-CB 3.43Å; C71-C80 CovalentContact SG-SG 2.02Å; C71-C80 PolarHBondContact SG-SG 3.24Å; C80-L83 HydrophobicContact CB-CD1 4.15Å; C80-L85 HydrophobicContact CB-CD1 4.02Å; C80-D100 CarbonylContact C-O 3.55Å; C80-D100 WeakPolarHBondContact CA-O 3.4Å; C80-D100 WeakPolarHBondContact CB-O 3.25Å; C80-D100 PolarHBondContact N-O 3.15Å; C80-L101 HydrophobicContact CB-CD2 3.6Å; C80-N104 PolarHBondContact O-ND2 3.2Å
81	S	96.1	Very high	94.2	Very high	18 Å²	18	65.6 Å²	65.6	13%	0.126	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	147.6	-179.9	-64.3	0	0	0	0	113.8	Q79 L83 D100 Q102	Q79-S81 PolarHBondContact NE2-OG 3.14Å; Q79-S81 VanDerWaalsContact NE2-OG 3.14Å; Q79-S81 VanDerWaalsContact OE1-CB 3.28Å; Q79-S81 PolarHBondContact OE1-OG 3.1Å; S81-L83 WeakPolarHBondContact O-CG 3.3Å; S81-L83 PolarHBondContact O-N 3.16Å; S81-L83 VanDerWaalsContact O-N 3.09Å; S81-D100 PolarHBondContact OG-OD2 2.96Å; S81-Q102 WeakPolarHBondContact CA-O 3.18Å; S81-Q102 WeakPolarHBondContact OG-CG 3.25Å
82	D	96.8	Very high	94.1	Very high	106 Å²	106	65.7 Å²	65.7	57%	0.567	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	17.5	167.3	-54.6	-71.8	0	0	0	115.5	Q102 N103	D82-Q102 PolarHBondContact N-O 3.27Å; D82-N103 WeakPolarHBondContact OD1-CB 3.1Å; D82-N103 PolarHBondContact OD1-ND2 3.2Å
83	L	96.1	Very high	94.1	Very high	70 Å²	70	60.2 Å²	60.2	37%	0.366	31%	0.307	S	S	.	.	S	Bend	trans	-88.3	-6.7	-177.9	-64.7	178	0	0	0	113.7	G70 C80 S81 L85 N104	G70-L83 VanDerWaalsContact C-CD1 3.45Å; G70-L83 WeakPolarHBondContact O-CD1 3.27Å; G70-L83 WeakPolarHBondContact O-CD2 3.49Å; C80-L83 HydrophobicContact CB-CD1 4.15Å; S81-L83 WeakPolarHBondContact O-CG 3.3Å; S81-L83 PolarHBondContact O-N 3.16Å; S81-L83 VanDerWaalsContact O-N 3.09Å; L83-L85 VanDerWaalsContact C-N 3.28Å; L83-L85 HydrophobicContact CB-CD1 4.43Å; L83-L85 HydrophobicContact CB-CD2 4.18Å; L83-L85 HydrophobicContact CB-CG 3.88Å; L83-L85 HydrophobicContact CD1-CD1 4.37Å; L83-L85 PolarHBondContact O-N 2.93Å; L83-N104 PolarHBondContact N-OD1 2.94Å
84	G	96.3	Very high	94.1	Very high	30 Å²	30	62 Å²	62	31%	0.309	32%	0.318	S	S	.	.			trans	69.7	22.4	-177.2	0	0	0	0	0	114.2	T86 N104	G84-T86 PolarHBondContact O-N 2.85Å; G84-N104 PolarHBondContact N-OD1 3.09Å
85	L	96.7	Very high	94.2	Very high	38 Å²	38	60 Å²	60	20%	0.199	31%	0.311	C	S	.	.			trans	-57.6	133	-179.5	-58.9	175	0	0	0	111.1	C80 L83 P89 L101 N104 R105 I106	C80-L85 HydrophobicContact CB-CD1 4.02Å; L83-L85 VanDerWaalsContact C-N 3.28Å; L83-L85 HydrophobicContact CB-CD1 4.43Å; L83-L85 HydrophobicContact CB-CD2 4.18Å; L83-L85 HydrophobicContact CB-CG 3.88Å; L83-L85 HydrophobicContact CD1-CD1 4.37Å; L83-L85 PolarHBondContact O-N 2.93Å; L85-P89 HydrophobicContact CD1-CG 4.23Å; L85-L101 HydrophobicContact CD1-CD2 4.1Å; L85-N104 HydrophobicContact CB-CB 4.16Å; L85-N104 PolarHBondContact N-OD1 2.62Å; L85-R105 CarbonylContact O-C 3.53Å; L85-R105 VanDerWaalsContact O-CA 3.27Å; L85-R105 WeakPolarHBondContact O-CA 3.38Å; L85-R105 PolarHBondContact O-N 2.88Å; L85-I106 PolarHBondContact O-N 3.11Å
86	T	96.7	Very high	94.5	Very high	97 Å²	97	53.9 Å²	53.9	60%	0.595	28%	0.279	S	S	*	.	S	Bend	trans	-92.7	-16.9	178.6	53.2	0	0	0	0	113.3	G84 R105 I106	G84-T86 PolarHBondContact O-N 2.85Å; T86-R105 HydrophobicContact CG2-CB 4.44Å; T86-I106 WeakPolarHBondContact O-CA 3.39Å
87	E	96.8	Very high	94.6	Very high	68 Å²	68	51.8 Å²	51.8	32%	0.318	27%	0.273	S	S	.	.	S	Bend	trans	-141.7	164.2	175.5	60.1	176.6	-163.6	0	0	110.4	R90 K110	E87-R90 IonicContact OE1-NH2 3.02Å; E87-K110 IonicContact OE2-NZ 2.85Å; E87-K110 PolarHBondContact OE2-NZ 3.31Å
88	V	96.9	Very high	94.7	Very high	4 Å²	4	51.7 Å²	51.7	2%	0.024	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-61.1	129.3	172.8	179.4	0	0	0	0	108.5	I92 L101 I106 L109 D113 F114	V88-I92 HydrophobicContact CG1-CD1 3.93Å; V88-L101 HydrophobicContact CG1-CD1 4.15Å; V88-L101 HydrophobicContact CG2-CD1 4.33Å; V88-I106 HydrophobicContact CG2-CD1 4.31Å; V88-L109 HydrophobicContact CG2-CD2 3.69Å; V88-D113 HydrophobicContact CB-CB 3.94Å; V88-D113 HydrophobicContact CG1-CB 4.14Å; V88-D113 HydrophobicContact CG2-CB 3.99Å; V88-F114 HydrophobicContact CG1-CD1 4.31Å; V88-F114 HydrophobicContact CG1-CE1 3.83Å; V88-F114 HydrophobicContact CG1-CZ 4.49Å; V88-F114 HydrophobicContact CG2-CE1 4.21Å; V88-F114 HydrophobicContact CG2-CZ 4.06Å
89	P	94.4	Very high	94.8	Very high	19 Å²	19	51.6 Å²	51.6	12%	0.123	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-63.5	146.3	-177.3	22.2	-29.7	0	0	0	111.5	P68 L85 I92 L101	P68-P89 HydrophobicContact CB-CB 3.5Å; P68-P89 HydrophobicContact CB-CG 4.14Å; P68-P89 HydrophobicContact CG-CB 3.8Å; P68-P89 HydrophobicContact CG-CG 4.07Å; L85-P89 HydrophobicContact CD1-CG 4.23Å; P89-I92 HydrophobicContact CG-CD1 4.25Å; P89-I92 HydrophobicContact CG-CG1 4.28Å; P89-I92 WeakPolarHBondContact O-CD1 3.28Å; P89-L101 VanDerWaalsContact CD-CD2 3.5Å; P89-L101 HydrophobicContact CG-CD2 3.89Å
90	R	88.8	Confident	94.9	Very high	186 Å²	186	49.8 Å²	49.8	70%	0.702	26%	0.262	S	S	*	.	S	Bend	trans	-80.6	160.2	172.5	-57.5	-177.2	-168.1	-179.8	5	109.9	E87	E87-R90 IonicContact OE1-NH2 3.02Å
91	N	86	Confident	94.9	Very high	124 Å²	124	49.8 Å²	49.8	66%	0.663	26%	0.262	S	S	*	.			trans	65.5	35.8	175.7	-50.9	-25.3	0	0	0	114.9	M66	M66-N91 VanDerWaalsContact O-O 3.13Å
92	I	93.3	Very high	95	Very high	21 Å²	21	51 Å²	51	11%	0.108	27%	0.266	C	S	.	.			trans	-66.3	129.2	170.4	-59.1	163.2	0	0	0	108.6	P68 V78 V88 P89 T96 L99 L117	P68-I92 HydrophobicContact CG-CG1 4.18Å; V78-I92 HydrophobicContact CG2-CG2 4.18Å; V88-I92 HydrophobicContact CG1-CD1 3.93Å; P89-I92 HydrophobicContact CG-CD1 4.25Å; P89-I92 HydrophobicContact CG-CG1 4.28Å; P89-I92 WeakPolarHBondContact O-CD1 3.28Å; I92-T96 HydrophobicContact CG2-CG2 4.37Å; I92-L99 HydrophobicContact CD1-CD1 4.21Å; I92-L99 HydrophobicContact CD1-CD2 3.74Å; I92-L99 HydrophobicContact CG2-CD1 4.39Å; I92-L117 HydrophobicContact CB-CD1 4.35Å; I92-L117 HydrophobicContact CB-CD2 4.1Å; I92-L117 HydrophobicContact CD1-CD1 4.2Å; I92-L117 HydrophobicContact CG2-CD1 4Å; I92-L117 HydrophobicContact CG2-CD2 3.71Å
93	P	93.1	Very high	95	Very high	10 Å²	10	48.5 Å²	48.5	7%	0.065	25%	0.253	C	S	.	.			trans	-54	132.8	179.3	-25.7	31.7	0	0	0	112.7	P65 V78 D95 T96 L117	P65-P93 HydrophobicContact CB-CB 3.84Å; P65-P93 HydrophobicContact CB-CG 4.02Å; P65-P93 HydrophobicContact CG-CB 4.12Å; P65-P93 HydrophobicContact CG-CG 4.48Å; V78-P93 HydrophobicContact CG2-CG 4.43Å; P93-D95 VanDerWaalsContact CB-OD1 3.22Å; P93-D95 WeakPolarHBondContact CB-OD1 3.36Å; P93-D95 PolarHBondContact O-N 3.04Å; P93-T96 WeakPolarHBondContact O-CB 3.49Å; P93-T96 PolarHBondContact O-N 3.2Å; P93-T96 VanDerWaalsContact O-N 3.1Å; P93-T96 PolarHBondContact O-OG1 3.2Å; P93-L117 WeakPolarHBondContact O-CD2 3.17Å
94	P	92.3	Very high	95.1	Very high	75 Å²	75	45.6 Å²	45.6	49%	0.487	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-17.5	-175.3	27.8	-35.3	0	0	0	114.1	T96	P94-T96 VanDerWaalsContact C-N 3.27Å
95	D	92.9	Very high	95.2	Very high	71 Å²	71	51.4 Å²	51.4	38%	0.38	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-0.7	174.8	70.1	-36.6	0	0	0	113.3	R76 P93 K97	R76-D95 WeakPolarHBondContact CB-O 3.4Å; R76-D95 WeakPolarHBondContact CD-O 2.97Å; R76-D95 HydrophobicContact CG-CB 4.48Å; R76-D95 WeakPolarHBondContact CG-O 3.35Å; P93-D95 VanDerWaalsContact CB-OD1 3.22Å; P93-D95 WeakPolarHBondContact CB-OD1 3.36Å; P93-D95 PolarHBondContact O-N 3.04Å; D95-K97 PolarHBondContact O-N 2.82Å
96	T	94.9	Very high	95.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.24	C	C	.	.			trans	-57	125.5	178	-59.9	0	0	0	0	111.5	R76 V78 I92 P93 P94 F98 L99 N119 L120	R76-T96 WeakPolarHBondContact O-CA 3.5Å; V78-T96 HydrophobicContact CB-CG2 4.08Å; V78-T96 HydrophobicContact CG2-CG2 3.59Å; V78-T96 WeakPolarHBondContact CG2-OG1 3.02Å; I92-T96 HydrophobicContact CG2-CG2 4.37Å; P93-T96 WeakPolarHBondContact O-CB 3.49Å; P93-T96 PolarHBondContact O-N 3.2Å; P93-T96 VanDerWaalsContact O-N 3.1Å; P93-T96 PolarHBondContact O-OG1 3.2Å; P94-T96 VanDerWaalsContact C-N 3.27Å; T96-F98 VanDerWaalsContact CG2-O 3.29Å; T96-F98 WeakPolarHBondContact CG2-O 3.19Å; T96-L99 HydrophobicContact CG2-CB 4.31Å; T96-N119 CarbonylContact O-C 3.58Å; T96-L120 HydrophobicContact CG2-CD1 3.88Å; T96-L120 WeakPolarHBondContact O-CA 3.36Å; T96-L120 PolarHBondContact O-N 3.41Å
97	K	95.9	Very high	95.3	Very high	91 Å²	91	48.4 Å²	48.4	40%	0.396	23%	0.233	S	C	.	.	S	Bend	trans	-97.4	-33.4	171.5	-75.2	-170.8	169.6	-172.2	0	112.3	R76 D95 Y121 A122	R76-K97 HydrophobicContact CB-CB 4.29Å; R76-K97 HydrophobicContact CB-CG 4.27Å; R76-K97 PolarHBondContact O-N 2.84Å; D95-K97 PolarHBondContact O-N 2.82Å; K97-Y121 WeakPolarHBondContact O-CA 3.22Å; K97-Y121 WeakPolarHBondContact O-CB 3.29Å; K97-Y121 PolarHBondContact O-N 3.49Å; K97-A122 PolarHBondContact O-N 2.77Å; K97-A122 VanDerWaalsContact O-N 3.13Å
98	F	96.9	Very high	95.4	Very high	18 Å²	18	48.7 Å²	48.7	8%	0.079	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	119.2	-175.3	-63.4	-87.8	0	0	0	109.3	F30 R76 V77 V78 T96 Y121 A122	F30-F98 HydrophobicContact CE1-CB 4.02Å; F30-F98 HydrophobicContact CE1-CD1 4.3Å; F30-F98 HydrophobicContact CZ-CB 3.82Å; F30-F98 AromaticContact CZ-CD1 3.84Å; F30-F98 HydrophobicContact CZ-CD1 3.84Å; F30-F98 HydrophobicContact CZ-CG 4.32Å; R76-F98 PolarHBondContact O-N 3.48Å; V77-F98 WeakPolarHBondContact CA-O 3.39Å; V77-F98 HydrophobicContact CB-CB 4.35Å; V77-F98 HydrophobicContact CG1-CB 3.98Å; V77-F98 HydrophobicContact CG2-CB 4.12Å; V77-F98 HydrophobicContact CG2-CD2 3.97Å; V77-F98 HydrophobicContact CG2-CG 4.39Å; V78-F98 PolarHBondContact N-O 3.38Å; T96-F98 VanDerWaalsContact CG2-O 3.29Å; T96-F98 WeakPolarHBondContact CG2-O 3.19Å; F98-Y121 HydrophobicContact CD1-CD1 4.41Å; F98-Y121 AromaticContact CE1-CD1 3.6Å; F98-Y121 HydrophobicContact CE1-CD1 3.6Å; F98-Y121 HydrophobicContact CE1-CE1 4.17Å; F98-Y121 AromaticContact CZ-CD1 3.89Å; F98-Y121 HydrophobicContact CZ-CD1 3.89Å; F98-Y121 HydrophobicContact CZ-CE1 4.47Å; F98-A122 HydrophobicContact CD1-CB 3.83Å; F98-A122 HydrophobicContact CE1-CB 4.16Å
99	L	97.4	Very high	95.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	114.4	177.3	177.9	58.8	0	0	0	109	V78 I92 T96 L101 F114 L117 L120 A122 L123 S124	V78-L99 HydrophobicContact CB-CD1 3.88Å; V78-L99 HydrophobicContact CG1-CD1 3.73Å; I92-L99 HydrophobicContact CD1-CD1 4.21Å; I92-L99 HydrophobicContact CD1-CD2 3.74Å; I92-L99 HydrophobicContact CG2-CD1 4.39Å; T96-L99 HydrophobicContact CG2-CB 4.31Å; L99-L101 HydrophobicContact CD1-CD1 4.31Å; L99-L101 HydrophobicContact CD1-CD2 4.42Å; L99-L101 HydrophobicContact CD1-CG 4.08Å; L99-L101 HydrophobicContact CD2-CD1 3.95Å; L99-L101 HydrophobicContact CG-CD1 3.97Å; L99-L101 HydrophobicContact CG-CG 4.08Å; L99-F114 HydrophobicContact CD2-CD1 4.03Å; L99-F114 HydrophobicContact CD2-CE1 3.86Å; L99-L117 HydrophobicContact CD2-CD1 4.04Å; L99-L120 HydrophobicContact CB-CD1 3.67Å; L99-L120 HydrophobicContact CB-CD2 4.47Å; L99-A122 PolarHBondContact N-O 2.92Å; L99-A122 VanDerWaalsContact N-O 3.09Å; L99-L123 HydrophobicContact CB-CD1 4.08Å; L99-L123 HydrophobicContact CD2-CD1 3.83Å; L99-L123 HydrophobicContact CG-CD1 3.92Å; L99-S124 PolarHBondContact O-N 3.29Å
100	D	97.6	Very high	95.6	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	114.2	178.4	-169.1	13.8	0	0	0	111	F30 V78 Q79 C80 S81 Q102 S124	F30-D100 HydrophobicContact CD1-CB 4.26Å; F30-D100 HydrophobicContact CE1-CB 3.98Å; F30-D100 HydrophobicContact CZ-CB 4.39Å; V78-D100 PolarHBondContact O-N 3Å; Q79-D100 PolarHBondContact NE2-OD2 2.87Å; Q79-D100 PolarHBondContact OE1-O 3.33Å; Q79-D100 PolarHBondContact OE1-OD2 2.79Å; C80-D100 CarbonylContact C-O 3.55Å; C80-D100 WeakPolarHBondContact CA-O 3.4Å; C80-D100 WeakPolarHBondContact CB-O 3.25Å; C80-D100 PolarHBondContact N-O 3.15Å; S81-D100 PolarHBondContact OG-OD2 2.96Å; D100-Q102 WeakPolarHBondContact OD1-CB 3.45Å; D100-Q102 VanDerWaalsContact OD1-CG 3.25Å; D100-Q102 WeakPolarHBondContact OD1-CG 3.26Å; D100-Q102 PolarHBondContact OD1-N 3.35Å; D100-S124 VanDerWaalsContact OD1-CB 3.26Å; D100-S124 WeakPolarHBondContact OD1-CB 3.46Å; D100-S124 PolarHBondContact OD1-OG 3.31Å
101	L	97.4	Very high	95.9	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.228	C	C	.	.			trans	-121.1	22.5	-179.1	-67.2	164.9	0	0	0	110.7	C80 L85 V88 P89 L99 N104 I106 F114 L123 S124 V125 N128	C80-L101 HydrophobicContact CB-CD2 3.6Å; L85-L101 HydrophobicContact CD1-CD2 4.1Å; V88-L101 HydrophobicContact CG1-CD1 4.15Å; V88-L101 HydrophobicContact CG2-CD1 4.33Å; P89-L101 VanDerWaalsContact CD-CD2 3.5Å; P89-L101 HydrophobicContact CG-CD2 3.89Å; L99-L101 HydrophobicContact CD1-CD1 4.31Å; L99-L101 HydrophobicContact CD1-CD2 4.42Å; L99-L101 HydrophobicContact CD1-CG 4.08Å; L99-L101 HydrophobicContact CD2-CD1 3.95Å; L99-L101 HydrophobicContact CG-CD1 3.97Å; L99-L101 HydrophobicContact CG-CG 4.08Å; L101-N104 PolarHBondContact O-ND2 3.27Å; L101-I106 HydrophobicContact CB-CD1 4.17Å; L101-I106 HydrophobicContact CD1-CD1 4.36Å; L101-F114 HydrophobicContact CD1-CE1 4.41Å; L101-L123 HydrophobicContact CD1-CD1 4.4Å; L101-S124 WeakPolarHBondContact CA-O 3.26Å; L101-S124 WeakPolarHBondContact CB-O 3.4Å; L101-S124 PolarHBondContact N-O 3.12Å; L101-V125 HydrophobicContact CB-CG1 4.21Å; L101-V125 HydrophobicContact CD1-CG1 4.19Å; L101-N128 PolarHBondContact O-ND2 2.94Å
102	Q	97.1	Very high	96.3	Very high	44 Å²	44	45.2 Å²	45.2	21%	0.206	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	158.4	-177.5	65.4	176.7	38.9	0	0	113.4	S81 D82 D100 N104 R126	S81-Q102 WeakPolarHBondContact CA-O 3.18Å; S81-Q102 WeakPolarHBondContact OG-CG 3.25Å; D82-Q102 PolarHBondContact N-O 3.27Å; D100-Q102 WeakPolarHBondContact OD1-CB 3.45Å; D100-Q102 VanDerWaalsContact OD1-CG 3.25Å; D100-Q102 WeakPolarHBondContact OD1-CG 3.26Å; D100-Q102 PolarHBondContact OD1-N 3.35Å; Q102-N104 PolarHBondContact O-N 2.87Å; Q102-N104 PolarHBondContact O-ND2 3.24Å; Q102-R126 CarbonylContact C-O 3.28Å; Q102-R126 WeakPolarHBondContact CA-O 3.45Å; Q102-R126 HydrophobicContact CB-CB 4.14Å
103	N	97.7	Very high	96.5	Very high	53 Å²	53	45.8 Å²	45.8	28%	0.283	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	35.6	174.2	-58.2	-18.8	0	0	0	114.1	D82 R126 N127	D82-N103 WeakPolarHBondContact OD1-CB 3.1Å; D82-N103 PolarHBondContact OD1-ND2 3.2Å; N103-R126 PolarHBondContact N-O 2.81Å; N103-N127 VanDerWaalsContact CA-O 3.25Å; N103-N127 WeakPolarHBondContact CA-O 3.24Å; N103-N127 PolarHBondContact N-O 2.99Å; N103-N127 VanDerWaalsContact OD1-CB 3.24Å; N103-N127 WeakPolarHBondContact OD1-CB 3.44Å; N103-N127 PolarHBondContact OD1-ND2 3.27Å
104	N	98.3	Very high	96.6	Very high	8 Å²	8	45.3 Å²	45.3	4%	0.043	22%	0.222	C	C	.	.	S	Bend	trans	-105.4	-169	175.5	-79.1	-63.1	0	0	0	110.8	C80 L83 G84 L85 L101 Q102 I106 N128	C80-N104 PolarHBondContact O-ND2 3.2Å; L83-N104 PolarHBondContact N-OD1 2.94Å; G84-N104 PolarHBondContact N-OD1 3.09Å; L85-N104 HydrophobicContact CB-CB 4.16Å; L85-N104 PolarHBondContact N-OD1 2.62Å; L101-N104 PolarHBondContact O-ND2 3.27Å; Q102-N104 PolarHBondContact O-N 2.87Å; Q102-N104 PolarHBondContact O-ND2 3.24Å; N104-I106 HydrophobicContact CB-CD1 4.41Å; N104-I106 HydrophobicContact CB-CG1 4.19Å; N104-N128 VanDerWaalsContact CA-OD1 3.3Å; N104-N128 WeakPolarHBondContact CA-OD1 3.15Å; N104-N128 WeakPolarHBondContact CB-OD1 3.31Å; N104-N128 PolarHBondContact O-OD1 2.95Å
105	R	98.2	Very high	96.7	Very high	153 Å²	153	49.1 Å²	49.1	58%	0.577	23%	0.231	S	C	*	.			trans	-117.1	26.5	-178.7	-59.6	-179.2	-175.5	-160.5	3.7	111.8	L85 T86 T107 N128	L85-R105 CarbonylContact O-C 3.53Å; L85-R105 VanDerWaalsContact O-CA 3.27Å; L85-R105 WeakPolarHBondContact O-CA 3.38Å; L85-R105 PolarHBondContact O-N 2.88Å; T86-R105 HydrophobicContact CG2-CB 4.44Å; R105-T107 PolarHBondContact O-N 3.46Å; R105-N128 PolarHBondContact N-OD1 3.34Å
106	I	98.4	Very high	96.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.232	C	C	.	.			trans	-65.5	128.3	-178.2	-56.8	171.8	0	0	0	109.2	L85 T86 V88 L101 N104 E108 L109 N128 K129 I130	L85-I106 PolarHBondContact O-N 3.11Å; T86-I106 WeakPolarHBondContact O-CA 3.39Å; V88-I106 HydrophobicContact CG2-CD1 4.31Å; L101-I106 HydrophobicContact CB-CD1 4.17Å; L101-I106 HydrophobicContact CD1-CD1 4.36Å; N104-I106 HydrophobicContact CB-CD1 4.41Å; N104-I106 HydrophobicContact CB-CG1 4.19Å; I106-E108 WeakPolarHBondContact CG2-O 3.16Å; I106-L109 HydrophobicContact CG2-CD2 4.15Å; I106-N128 HydrophobicContact CB-CB 4.4Å; I106-N128 VanDerWaalsContact CB-OD1 3.31Å; I106-N128 WeakPolarHBondContact CB-OD1 3.2Å; I106-N128 WeakPolarHBondContact CG1-OD1 3.31Å; I106-N128 PolarHBondContact N-OD1 3.18Å; I106-K129 CarbonylContact O-C 3.55Å; I106-K129 VanDerWaalsContact O-CA 3.28Å; I106-K129 WeakPolarHBondContact O-CA 3.36Å; I106-K129 PolarHBondContact O-N 2.92Å; I106-I130 HydrophobicContact CB-CG1 4.32Å; I106-I130 HydrophobicContact CG2-CD1 4.4Å; I106-I130 HydrophobicContact CG2-CG1 4.1Å; I106-I130 WeakPolarHBondContact O-CG1 3.28Å; I106-I130 PolarHBondContact O-N 2.74Å; I106-I130 VanDerWaalsContact O-N 3.11Å
107	T	97.9	Very high	96.6	Very high	72 Å²	72	47.7 Å²	47.7	44%	0.442	23%	0.232	S	C	.	.			trans	-104.3	-24.9	-173.5	53.8	0	0	0	0	114	R105 K129 I130 S131	R105-T107 PolarHBondContact O-N 3.46Å; T107-K129 WeakPolarHBondContact CA-O 2.91Å; T107-K129 HydrophobicContact CG2-CB 4.29Å; T107-I130 WeakPolarHBondContact O-CA 3.2Å; T107-S131 PolarHBondContact O-N 2.99Å; T107-S131 PolarHBondContact O-OG 2.96Å
108	E	97.9	Very high	96.5	Very high	74 Å²	74	46.1 Å²	46.1	35%	0.346	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	157.4	179	63.2	179.3	-161.5	0	0	111.1	I106 K110 K132	I106-E108 WeakPolarHBondContact CG2-O 3.16Å; E108-K110 HydrophobicContact CG-CG 4.41Å; E108-K110 VanDerWaalsContact OE1-CE 3.3Å; E108-K110 WeakPolarHBondContact OE1-CE 3.45Å; E108-K132 CarbonylContact C-O 3.55Å; E108-K132 VanDerWaalsContact CA-O 3.24Å; E108-K132 WeakPolarHBondContact CA-O 3.41Å; E108-K132 HydrophobicContact CB-CB 4.02Å
109	L	98.1	Very high	96.4	Very high	3 Å²	3	49.1 Å²	49.1	2%	0.016	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.6	168.1	-54.3	176.4	0	0	0	109.6	V88 I106 D113 F114 I130 K132 V133 H134 T137 F138 F149	V88-L109 HydrophobicContact CG2-CD2 3.69Å; I106-L109 HydrophobicContact CG2-CD2 4.15Å; L109-D113 WeakPolarHBondContact CA-OD2 3.45Å; L109-F114 HydrophobicContact CD1-CE2 4.15Å; L109-F114 HydrophobicContact CD1-CZ 4.46Å; L109-F114 HydrophobicContact CD2-CE2 4.31Å; L109-F114 HydrophobicContact CD2-CZ 4.08Å; L109-I130 HydrophobicContact CD1-CD1 4.38Å; L109-I130 HydrophobicContact CD2-CD1 4.08Å; L109-I130 HydrophobicContact CG-CD1 4.19Å; L109-I130 HydrophobicContact CG-CG2 4.31Å; L109-K132 PolarHBondContact N-O 2.92Å; L109-V133 HydrophobicContact CB-CG1 4.33Å; L109-V133 HydrophobicContact CD1-CG1 4.33Å; L109-V133 HydrophobicContact CD1-CG2 4.15Å; L109-V133 HydrophobicContact CG-CG2 4.46Å; L109-H134 WeakPolarHBondContact O-CB 3.36Å; L109-H134 PolarHBondContact O-N 3.19Å; L109-T137 HydrophobicContact CB-CG2 3.76Å; L109-T137 HydrophobicContact CD1-CG2 4.26Å; L109-T137 PolarHBondContact O-OG1 3.39Å; L109-F138 HydrophobicContact CD1-CE1 4.39Å; L109-F138 HydrophobicContact CD1-CZ 4.11Å; L109-F149 HydrophobicContact CD1-CE1 3.79Å; L109-F149 HydrophobicContact CD1-CZ 3.58Å
110	K	97.3	Very high	96.4	Very high	78 Å²	78	49.1 Å²	49.1	34%	0.339	25%	0.247	S	C	.	.			trans	-92.2	170.7	-174.9	-53.3	169.2	-176.6	169.3	0	110.7	E87 E108 N112 D113 T137	E87-K110 IonicContact OE2-NZ 2.85Å; E87-K110 PolarHBondContact OE2-NZ 3.31Å; E108-K110 HydrophobicContact CG-CG 4.41Å; E108-K110 VanDerWaalsContact OE1-CE 3.3Å; E108-K110 WeakPolarHBondContact OE1-CE 3.45Å; K110-N112 VanDerWaalsContact C-N 3.3Å; K110-N112 PolarHBondContact O-N 2.91Å; K110-D113 WeakPolarHBondContact CB-OD1 3.36Å; K110-D113 PolarHBondContact N-OD2 3.08Å; K110-T137 PolarHBondContact O-OG1 3.19Å
111	E	95.8	Very high	96.3	Very high	76 Å²	76	52.2 Å²	52.2	36%	0.355	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-39.5	-176.9	179.8	164.5	-170.7	0	0	113.5	H134 K136	E111-H134 WeakPolarHBondContact CB-ND1 3.4Å; E111-H134 IonicContact OE2-CE1 2.78Å; E111-H134 PolarHBondContact OE2-CE1 3.14Å; E111-K136 HydrophobicContact CG-CB 3.94Å; E111-K136 HydrophobicContact CG-CD 4.4Å; E111-K136 WeakPolarHBondContact OE1-CD 3.49Å; E111-K136 IonicContact OE1-NZ 2.71Å; E111-K136 PolarHBondContact OE1-NZ 2.88Å
112	N	94.8	Very high	96.4	Very high	103 Å²	103	52.3 Å²	52.3	55%	0.551	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	8	-169.8	-66.1	-53.5	0	0	0	114.3	K110 F114 K115	K110-N112 VanDerWaalsContact C-N 3.3Å; K110-N112 PolarHBondContact O-N 2.91Å; N112-F114 PolarHBondContact O-N 3.39Å; N112-K115 HydrophobicContact CB-CB 4.42Å; N112-K115 WeakPolarHBondContact O-CB 3.3Å; N112-K115 PolarHBondContact O-N 2.84Å
113	D	96	Very high	96.4	Very high	32 Å²	32	50.2 Å²	50.2	17%	0.171	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-31.7	-174.7	-77.5	-4.4	0	0	0	113.1	V88 L109 K110	V88-D113 HydrophobicContact CB-CB 3.94Å; V88-D113 HydrophobicContact CG1-CB 4.14Å; V88-D113 HydrophobicContact CG2-CB 3.99Å; L109-D113 WeakPolarHBondContact CA-OD2 3.45Å; K110-D113 WeakPolarHBondContact CB-OD1 3.36Å; K110-D113 PolarHBondContact N-OD2 3.08Å
114	F	96	Very high	96.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.8	24.8	179.8	-50.5	-64.1	0	0	0	113	V88 L99 L101 L109 N112 G116 L117 L123 T137 F138 L141	V88-F114 HydrophobicContact CG1-CD1 4.31Å; V88-F114 HydrophobicContact CG1-CE1 3.83Å; V88-F114 HydrophobicContact CG1-CZ 4.49Å; V88-F114 HydrophobicContact CG2-CE1 4.21Å; V88-F114 HydrophobicContact CG2-CZ 4.06Å; L99-F114 HydrophobicContact CD2-CD1 4.03Å; L99-F114 HydrophobicContact CD2-CE1 3.86Å; L101-F114 HydrophobicContact CD1-CE1 4.41Å; L109-F114 HydrophobicContact CD1-CE2 4.15Å; L109-F114 HydrophobicContact CD1-CZ 4.46Å; L109-F114 HydrophobicContact CD2-CE2 4.31Å; L109-F114 HydrophobicContact CD2-CZ 4.08Å; N112-F114 PolarHBondContact O-N 3.39Å; F114-G116 PolarHBondContact O-N 3.42Å; F114-L117 HydrophobicContact CB-CD1 4.16Å; F114-L117 HydrophobicContact CD1-CD1 4.02Å; F114-L117 PolarHBondContact O-N 3.47Å; F114-L123 HydrophobicContact CD2-CD2 4.44Å; F114-L123 HydrophobicContact CE1-CD1 3.96Å; F114-L123 HydrophobicContact CE1-CD2 3.95Å; F114-L123 HydrophobicContact CE2-CD2 3.83Å; F114-L123 HydrophobicContact CZ-CD1 4.19Å; F114-L123 HydrophobicContact CZ-CD2 3.55Å; F114-T137 HydrophobicContact CD2-CG2 3.54Å; F114-T137 HydrophobicContact CE2-CG2 3.51Å; F114-F138 HydrophobicContact CD2-CD1 4.48Å; F114-F138 HydrophobicContact CD2-CE1 4.5Å; F114-F138 HydrophobicContact CE2-CE1 4.15Å; F114-L141 HydrophobicContact CB-CD1 4.34Å; F114-L141 HydrophobicContact CB-CD2 3.89Å; F114-L141 HydrophobicContact CB-CG 4.32Å; F114-L141 HydrophobicContact CD2-CD1 4.38Å; F114-L141 HydrophobicContact CG-CD1 4.44Å
115	K	93.8	Very high	96.4	Very high	156 Å²	156	47.4 Å²	47.4	68%	0.678	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	130	178.4	-175.1	178.6	177.4	-176.9	0	109.9	N112 L117	N112-K115 HydrophobicContact CB-CB 4.42Å; N112-K115 WeakPolarHBondContact O-CB 3.3Å; N112-K115 PolarHBondContact O-N 2.84Å; K115-L117 VanDerWaalsContact C-N 3.33Å
116	G	91.1	Very high	96.4	Very high	37 Å²	37	43.2 Å²	43.2	38%	0.381	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	87	-8.7	177.9	0	0	0	0	0	115.3	F114 T118	F114-G116 PolarHBondContact O-N 3.42Å; G116-T118 PolarHBondContact O-N 3.26Å
117	L	95.1	Very high	96.4	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.016	24%	0.239	C	C	.	.			trans	-83.5	52.5	178.7	-56.6	-176	0	0	0	112.3	I92 P93 L99 F114 K115 N119 L120 L141	I92-L117 HydrophobicContact CB-CD1 4.35Å; I92-L117 HydrophobicContact CB-CD2 4.1Å; I92-L117 HydrophobicContact CD1-CD1 4.2Å; I92-L117 HydrophobicContact CG2-CD1 4Å; I92-L117 HydrophobicContact CG2-CD2 3.71Å; P93-L117 WeakPolarHBondContact O-CD2 3.17Å; L99-L117 HydrophobicContact CD2-CD1 4.04Å; F114-L117 HydrophobicContact CB-CD1 4.16Å; F114-L117 HydrophobicContact CD1-CD1 4.02Å; F114-L117 PolarHBondContact O-N 3.47Å; K115-L117 VanDerWaalsContact C-N 3.33Å; L117-N119 PolarHBondContact O-N 2.97Å; L117-L120 HydrophobicContact CB-CB 4.2Å; L117-L120 WeakPolarHBondContact O-CB 2.96Å; L117-L120 PolarHBondContact O-N 2.77Å; L117-L141 HydrophobicContact CB-CD2 3.9Å; L117-L141 WeakPolarHBondContact O-CD2 3.45Å
118	T	94.1	Very high	96.4	Very high	58 Å²	58	43.8 Å²	43.8	36%	0.356	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-27.5	-174.9	53.2	0	0	0	0	113	G116 L120 H143	G116-T118 PolarHBondContact O-N 3.26Å; T118-L120 VanDerWaalsContact C-N 3.35Å; T118-H143 PolarHBondContact O-CD2 3.1Å; T118-H143 VanDerWaalsContact O-CD2 3.24Å
119	N	94.1	Very high	96.4	Very high	81 Å²	81	45.5 Å²	45.5	43%	0.433	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	1.3	-179.1	-63.5	-47.6	0	0	0	113.9	T96 L117 Y121	T96-N119 CarbonylContact O-C 3.58Å; L117-N119 PolarHBondContact O-N 2.97Å; N119-Y121 PolarHBondContact O-N 3.13Å
120	L	97.2	Very high	96.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.226	C	C	.	.			trans	-63.4	125	-178	-165	72.6	0	0	0	109.9	T96 L99 L117 T118 L123 L141 H143 M144	T96-L120 HydrophobicContact CG2-CD1 3.88Å; T96-L120 WeakPolarHBondContact O-CA 3.36Å; T96-L120 PolarHBondContact O-N 3.41Å; L99-L120 HydrophobicContact CB-CD1 3.67Å; L99-L120 HydrophobicContact CB-CD2 4.47Å; L117-L120 HydrophobicContact CB-CB 4.2Å; L117-L120 WeakPolarHBondContact O-CB 2.96Å; L117-L120 PolarHBondContact O-N 2.77Å; T118-L120 VanDerWaalsContact C-N 3.35Å; L120-L123 HydrophobicContact CD2-CB 4Å; L120-L141 HydrophobicContact CB-CD2 4.07Å; L120-L141 HydrophobicContact CD2-CD1 4.21Å; L120-L141 HydrophobicContact CD2-CD2 3.94Å; L120-H143 CarbonylContact O-C 3.6Å; L120-H143 VanDerWaalsContact O-C 3.29Å; L120-M144 WeakPolarHBondContact O-CA 3.36Å; L120-M144 WeakPolarHBondContact O-CB 3.37Å; L120-M144 PolarHBondContact O-N 3.04Å; L120-M144 VanDerWaalsContact O-N 3.11Å
121	Y	97.2	Very high	96.5	Very high	65 Å²	65	44.4 Å²	44.4	26%	0.255	23%	0.229	S	C	.	.			trans	-96.7	-44.6	-180	175.8	-94.2	0	0	0	111.2	K97 F98 N119 Q145 K146	K97-Y121 WeakPolarHBondContact O-CA 3.22Å; K97-Y121 WeakPolarHBondContact O-CB 3.29Å; K97-Y121 PolarHBondContact O-N 3.49Å; F98-Y121 HydrophobicContact CD1-CD1 4.41Å; F98-Y121 AromaticContact CE1-CD1 3.6Å; F98-Y121 HydrophobicContact CE1-CD1 3.6Å; F98-Y121 HydrophobicContact CE1-CE1 4.17Å; F98-Y121 AromaticContact CZ-CD1 3.89Å; F98-Y121 HydrophobicContact CZ-CD1 3.89Å; F98-Y121 HydrophobicContact CZ-CE1 4.47Å; N119-Y121 PolarHBondContact O-N 3.13Å; Y121-Q145 HydrophobicContact CD2-CB 4.29Å; Y121-Q145 HydrophobicContact CD2-CG 4.1Å; Y121-Q145 HydrophobicContact CE2-CB 3.89Å; Y121-Q145 HydrophobicContact CE2-CG 3.78Å; Y121-Q145 PolarHBondContact O-N 2.78Å; Y121-Q145 PolarHBondContact OH-OE1 3.25Å; Y121-K146 HydrophobicContact CE1-CD 3.92Å; Y121-K146 HydrophobicContact CE1-CG 4.38Å; Y121-K146 PolarHBondContact O-N 3.14Å; Y121-K146 VanDerWaalsContact O-N 3.15Å
122	A	97.9	Very high	96.5	Very high	2 Å²	2	47.3 Å²	47.3	2%	0.017	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	135.9	-179.6	0	0	0	0	0	112.1	F30 K97 F98 L99 K146	F30-A122 HydrophobicContact CE2-CB 3.89Å; F30-A122 HydrophobicContact CZ-CB 4.28Å; K97-A122 PolarHBondContact O-N 2.77Å; K97-A122 VanDerWaalsContact O-N 3.13Å; F98-A122 HydrophobicContact CD1-CB 3.83Å; F98-A122 HydrophobicContact CE1-CB 4.16Å; L99-A122 PolarHBondContact N-O 2.92Å; L99-A122 VanDerWaalsContact N-O 3.09Å; A122-K146 WeakPolarHBondContact CA-O 2.97Å; A122-K146 HydrophobicContact CB-CB 3.84Å
123	L	97.9	Very high	96.7	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.4	175.1	175.7	58.5	0	0	0	110.2	L99 L101 F114 L120 V125 F138 M144 K146 L147 Y148	L99-L123 HydrophobicContact CB-CD1 4.08Å; L99-L123 HydrophobicContact CD2-CD1 3.83Å; L99-L123 HydrophobicContact CG-CD1 3.92Å; L101-L123 HydrophobicContact CD1-CD1 4.4Å; F114-L123 HydrophobicContact CD2-CD2 4.44Å; F114-L123 HydrophobicContact CE1-CD1 3.96Å; F114-L123 HydrophobicContact CE1-CD2 3.95Å; F114-L123 HydrophobicContact CE2-CD2 3.83Å; F114-L123 HydrophobicContact CZ-CD1 4.19Å; F114-L123 HydrophobicContact CZ-CD2 3.55Å; L120-L123 HydrophobicContact CD2-CB 4Å; L123-V125 HydrophobicContact CD1-CG1 3.96Å; L123-V125 HydrophobicContact CG-CG1 4.18Å; L123-F138 HydrophobicContact CD2-CE1 4.17Å; L123-M144 HydrophobicContact CB-SD 3.92Å; L123-K146 PolarHBondContact N-O 3.44Å; L123-L147 HydrophobicContact CB-CD1 3.96Å; L123-L147 HydrophobicContact CD2-CD1 3.82Å; L123-L147 HydrophobicContact CG-CD1 4Å; L123-Y148 PolarHBondContact O-N 3.22Å
124	S	98.1	Very high	96.7	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.021	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	117.1	171.5	175.1	0	0	0	0	110.3	L99 D100 L101	L99-S124 PolarHBondContact O-N 3.29Å; D100-S124 VanDerWaalsContact OD1-CB 3.26Å; D100-S124 WeakPolarHBondContact OD1-CB 3.46Å; D100-S124 PolarHBondContact OD1-OG 3.31Å; L101-S124 WeakPolarHBondContact CA-O 3.26Å; L101-S124 WeakPolarHBondContact CB-O 3.4Å; L101-S124 PolarHBondContact N-O 3.12Å
125	V	97.6	Very high	96.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.25	C	C	.	.			trans	-123.7	30.7	170.5	-67.2	0	0	0	0	110.1	L101 L123 N128 I130 Y148 F149 N152	L101-V125 HydrophobicContact CB-CG1 4.21Å; L101-V125 HydrophobicContact CD1-CG1 4.19Å; L123-V125 HydrophobicContact CD1-CG1 3.96Å; L123-V125 HydrophobicContact CG-CG1 4.18Å; V125-N128 PolarHBondContact O-ND2 3.44Å; V125-I130 HydrophobicContact CB-CD1 3.75Å; V125-I130 HydrophobicContact CG1-CD1 4.39Å; V125-I130 HydrophobicContact CG2-CD1 3.8Å; V125-Y148 CarbonylContact C-O 3.57Å; V125-Y148 VanDerWaalsContact CG2-O 3.31Å; V125-Y148 WeakPolarHBondContact CG2-O 3.38Å; V125-Y148 PolarHBondContact N-O 2.82Å; V125-F149 HydrophobicContact CG2-CD1 3.41Å; V125-F149 VanDerWaalsContact CG2-CD1 3.41Å; V125-F149 HydrophobicContact CG2-CE1 3.51Å; V125-F149 HydrophobicContact CG2-CG 4.1Å; V125-F149 HydrophobicContact CG2-CZ 4.27Å; V125-N152 PolarHBondContact O-ND2 3.47Å
126	R	97.9	Very high	96.8	Very high	65 Å²	65	46.7 Å²	46.7	25%	0.245	24%	0.241	C	C	.	.			trans	-60.5	147.6	-177.8	-173.5	-176.7	-174.9	174.6	9	111.2	Q102 N103 N128 Y148 S150	Q102-R126 CarbonylContact C-O 3.28Å; Q102-R126 WeakPolarHBondContact CA-O 3.45Å; Q102-R126 HydrophobicContact CB-CB 4.14Å; N103-R126 PolarHBondContact N-O 2.81Å; R126-N128 PolarHBondContact O-N 3.3Å; R126-N128 PolarHBondContact O-ND2 3.04Å; R126-N128 VanDerWaalsContact O-ND2 3.15Å; R126-Y148 PolarHBondContact N-O 3.42Å; R126-S150 CarbonylContact C-O 3.53Å; R126-S150 VanDerWaalsContact CA-O 3.3Å; R126-S150 WeakPolarHBondContact CA-O 3.47Å; R126-S150 WeakPolarHBondContact CG-O 3.1Å
127	N	98.1	Very high	97	Very high	74 Å²	74	45 Å²	45	40%	0.396	22%	0.223	S	C	.	.	S	Bend	trans	53.9	54.7	172.8	-166	32.4	0	0	0	112.2	N103 S150 K151	N103-N127 VanDerWaalsContact CA-O 3.25Å; N103-N127 WeakPolarHBondContact CA-O 3.24Å; N103-N127 PolarHBondContact N-O 2.99Å; N103-N127 VanDerWaalsContact OD1-CB 3.24Å; N103-N127 WeakPolarHBondContact OD1-CB 3.44Å; N103-N127 PolarHBondContact OD1-ND2 3.27Å; N127-S150 PolarHBondContact N-O 3Å; N127-K151 WeakPolarHBondContact CA-O 3.46Å; N127-K151 HydrophobicContact CB-CB 4.1Å; N127-K151 HydrophobicContact CB-CD 4.41Å; N127-K151 PolarHBondContact N-O 3.18Å
128	N	98.6	Very high	97.1	Very high	9 Å²	9	45 Å²	45	5%	0.048	22%	0.223	C	C	.	.	S	Bend	trans	-119.9	-167.2	173.8	-89.2	-86.5	0	0	0	108.8	L101 N104 R105 I106 V125 R126 I130 K151 N152	L101-N128 PolarHBondContact O-ND2 2.94Å; N104-N128 VanDerWaalsContact CA-OD1 3.3Å; N104-N128 WeakPolarHBondContact CA-OD1 3.15Å; N104-N128 WeakPolarHBondContact CB-OD1 3.31Å; N104-N128 PolarHBondContact O-OD1 2.95Å; R105-N128 PolarHBondContact N-OD1 3.34Å; I106-N128 HydrophobicContact CB-CB 4.4Å; I106-N128 VanDerWaalsContact CB-OD1 3.31Å; I106-N128 WeakPolarHBondContact CB-OD1 3.2Å; I106-N128 WeakPolarHBondContact CG1-OD1 3.31Å; I106-N128 PolarHBondContact N-OD1 3.18Å; V125-N128 PolarHBondContact O-ND2 3.44Å; R126-N128 PolarHBondContact O-N 3.3Å; R126-N128 PolarHBondContact O-ND2 3.04Å; R126-N128 VanDerWaalsContact O-ND2 3.15Å; N128-I130 HydrophobicContact CB-CD1 4.18Å; N128-I130 HydrophobicContact CB-CG1 3.99Å; N128-K151 PolarHBondContact N-O 2.98Å; N128-N152 WeakPolarHBondContact CA-OD1 3.37Å; N128-N152 WeakPolarHBondContact CB-OD1 3.37Å; N128-N152 PolarHBondContact N-OD1 3.29Å; N128-N152 PolarHBondContact O-OD1 3.07Å
129	K	98.3	Very high	97.1	Very high	111 Å²	111	45.6 Å²	45.6	48%	0.483	23%	0.234	S	C	.	.			trans	-114.5	29	178.3	-61.1	-174.7	-179.1	-177.8	0	111.6	I106 T107 S131 N152 L153	I106-K129 CarbonylContact O-C 3.55Å; I106-K129 VanDerWaalsContact O-CA 3.28Å; I106-K129 WeakPolarHBondContact O-CA 3.36Å; I106-K129 PolarHBondContact O-N 2.92Å; T107-K129 WeakPolarHBondContact CA-O 2.91Å; T107-K129 HydrophobicContact CG2-CB 4.29Å; K129-S131 PolarHBondContact O-N 3.42Å; K129-N152 PolarHBondContact N-OD1 3.28Å; K129-L153 HydrophobicContact CB-CD1 4.09Å
130	I	98.6	Very high	97.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.224	C	C	.	.			trans	-68	118.8	-170.9	-59	169.9	0	0	0	109.4	I106 T107 L109 V125 N128 V133 F149 N152 L153 L154	I106-I130 HydrophobicContact CB-CG1 4.32Å; I106-I130 HydrophobicContact CG2-CD1 4.4Å; I106-I130 HydrophobicContact CG2-CG1 4.1Å; I106-I130 WeakPolarHBondContact O-CG1 3.28Å; I106-I130 PolarHBondContact O-N 2.74Å; I106-I130 VanDerWaalsContact O-N 3.11Å; T107-I130 WeakPolarHBondContact O-CA 3.2Å; L109-I130 HydrophobicContact CD1-CD1 4.38Å; L109-I130 HydrophobicContact CD2-CD1 4.08Å; L109-I130 HydrophobicContact CG-CD1 4.19Å; L109-I130 HydrophobicContact CG-CG2 4.31Å; V125-I130 HydrophobicContact CB-CD1 3.75Å; V125-I130 HydrophobicContact CG1-CD1 4.39Å; V125-I130 HydrophobicContact CG2-CD1 3.8Å; N128-I130 HydrophobicContact CB-CD1 4.18Å; N128-I130 HydrophobicContact CB-CG1 3.99Å; I130-V133 HydrophobicContact CG2-CG2 3.96Å; I130-F149 HydrophobicContact CD1-CD1 4.39Å; I130-F149 HydrophobicContact CD1-CE1 3.96Å; I130-F149 HydrophobicContact CG2-CE1 4.29Å; I130-N152 HydrophobicContact CB-CB 4.34Å; I130-N152 VanDerWaalsContact CB-OD1 3.29Å; I130-N152 WeakPolarHBondContact CB-OD1 3.33Å; I130-N152 WeakPolarHBondContact CG1-OD1 3.24Å; I130-N152 PolarHBondContact N-OD1 3.2Å; I130-L153 CarbonylContact O-C 3.59Å; I130-L153 VanDerWaalsContact O-CA 3.29Å; I130-L153 WeakPolarHBondContact O-CA 3.46Å; I130-L153 PolarHBondContact O-N 3.13Å; I130-L154 HydrophobicContact CG2-CD2 3.97Å; I130-L154 PolarHBondContact O-N 3.22Å
131	S	97.6	Very high	97	Very high	58 Å²	58	43.4 Å²	43.4	41%	0.406	22%	0.224	S	C	.	.			trans	-116.2	-20.8	179.1	62.6	0	0	0	0	113	T107 K129	T107-S131 PolarHBondContact O-N 2.99Å; T107-S131 PolarHBondContact O-OG 2.96Å; K129-S131 PolarHBondContact O-N 3.42Å
132	K	97.1	Very high	96.8	Very high	137 Å²	137	47.3 Å²	47.3	60%	0.596	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	139.1	-178.1	-64.3	177.3	-176.3	174.3	0	110.5	E108 L109	E108-K132 CarbonylContact C-O 3.55Å; E108-K132 VanDerWaalsContact CA-O 3.24Å; E108-K132 WeakPolarHBondContact CA-O 3.41Å; E108-K132 HydrophobicContact CB-CB 4.02Å; L109-K132 PolarHBondContact N-O 2.92Å
133	V	97.8	Very high	96.7	Very high	32 Å²	32	52.7 Å²	52.7	19%	0.194	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	123.3	174.4	-179.4	0	0	0	0	107.7	L109 I130 T137 F138 F149 L154 P158	L109-V133 HydrophobicContact CB-CG1 4.33Å; L109-V133 HydrophobicContact CD1-CG1 4.33Å; L109-V133 HydrophobicContact CD1-CG2 4.15Å; L109-V133 HydrophobicContact CG-CG2 4.46Å; I130-V133 HydrophobicContact CG2-CG2 3.96Å; V133-T137 HydrophobicContact CG1-CG2 4.41Å; V133-F138 HydrophobicContact CG1-CE2 3.69Å; V133-F138 HydrophobicContact CG1-CZ 4.01Å; V133-F149 HydrophobicContact CG2-CE1 4.3Å; V133-F149 HydrophobicContact CG2-CZ 4Å; V133-L154 HydrophobicContact CG2-CD2 3.81Å; V133-P158 HydrophobicContact CB-CB 4.31Å; V133-P158 HydrophobicContact CG1-CB 4.15Å; V133-P158 HydrophobicContact CG2-CG 4.27Å
134	H	97.6	Very high	96.6	Very high	72 Å²	72	52.7 Å²	52.7	33%	0.333	27%	0.267	S	S	.	.			trans	-69.3	139.1	178.6	-170.7	-94.2	0	0	0	110.5	L109 E111 K136 T137	L109-H134 WeakPolarHBondContact O-CB 3.36Å; L109-H134 PolarHBondContact O-N 3.19Å; E111-H134 WeakPolarHBondContact CB-ND1 3.4Å; E111-H134 IonicContact OE2-CE1 2.78Å; E111-H134 PolarHBondContact OE2-CE1 3.14Å; H134-K136 PolarHBondContact ND1-N 3.42Å; H134-K136 PolarHBondContact O-N 3.31Å; H134-T137 WeakPolarHBondContact CB-OG1 3.49Å; H134-T137 PolarHBondContact N-OG1 2.92Å; H134-T137 VanDerWaalsContact O-CB 3.29Å; H134-T137 WeakPolarHBondContact O-CB 3.1Å; H134-T137 PolarHBondContact O-N 3.29Å; H134-T137 PolarHBondContact O-OG1 3.24Å
135	P	94.6	Very high	96.6	Very high	59 Å²	59	55.9 Å²	55.9	38%	0.383	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-15.1	-175	-25.6	34.7	0	0	0	115.8	N160	P135-N160 WeakPolarHBondContact O-CB 3.26Å; P135-N160 PolarHBondContact O-ND2 2.98Å
136	K	95.6	Very high	96.6	Very high	115 Å²	115	57 Å²	57	50%	0.5	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-1.1	179.1	-68.8	178	179	178.6	0	113.9	E111 H134 F138 A139	E111-K136 HydrophobicContact CG-CB 3.94Å; E111-K136 HydrophobicContact CG-CD 4.4Å; E111-K136 WeakPolarHBondContact OE1-CD 3.49Å; E111-K136 IonicContact OE1-NZ 2.71Å; E111-K136 PolarHBondContact OE1-NZ 2.88Å; H134-K136 PolarHBondContact ND1-N 3.42Å; H134-K136 PolarHBondContact O-N 3.31Å; K136-F138 PolarHBondContact O-N 2.98Å; K136-F138 VanDerWaalsContact O-N 3.16Å; K136-A139 WeakPolarHBondContact O-CB 3.3Å; K136-A139 PolarHBondContact O-N 2.91Å; K136-A139 VanDerWaalsContact O-N 3.13Å
137	T	96.6	Very high	96.6	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-40.2	-179	-69	0	0	0	0	112.7	L109 K110 F114 V133 H134	L109-T137 HydrophobicContact CB-CG2 3.76Å; L109-T137 HydrophobicContact CD1-CG2 4.26Å; L109-T137 PolarHBondContact O-OG1 3.39Å; K110-T137 PolarHBondContact O-OG1 3.19Å; F114-T137 HydrophobicContact CD2-CG2 3.54Å; F114-T137 HydrophobicContact CE2-CG2 3.51Å; V133-T137 HydrophobicContact CG1-CG2 4.41Å; H134-T137 WeakPolarHBondContact CB-OG1 3.49Å; H134-T137 PolarHBondContact N-OG1 2.92Å; H134-T137 VanDerWaalsContact O-CB 3.29Å; H134-T137 WeakPolarHBondContact O-CB 3.1Å; H134-T137 PolarHBondContact O-N 3.29Å; H134-T137 PolarHBondContact O-OG1 3.24Å
138	F	96	Very high	96.6	Very high	4 Å²	4	51.1 Å²	51.1	2%	0.018	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-2.5	-175.9	-54.4	-57.2	0	0	0	114.8	L109 F114 L123 V133 K136 P140 L141 L147 F149 P158 L161 P162	L109-F138 HydrophobicContact CD1-CE1 4.39Å; L109-F138 HydrophobicContact CD1-CZ 4.11Å; F114-F138 HydrophobicContact CD2-CD1 4.48Å; F114-F138 HydrophobicContact CD2-CE1 4.5Å; F114-F138 HydrophobicContact CE2-CE1 4.15Å; L123-F138 HydrophobicContact CD2-CE1 4.17Å; V133-F138 HydrophobicContact CG1-CE2 3.69Å; V133-F138 HydrophobicContact CG1-CZ 4.01Å; K136-F138 PolarHBondContact O-N 2.98Å; K136-F138 VanDerWaalsContact O-N 3.16Å; F138-P140 VanDerWaalsContact C-N 3.29Å; F138-L141 HydrophobicContact CB-CD1 4.47Å; F138-L141 HydrophobicContact CD1-CD1 3.74Å; F138-L141 WeakPolarHBondContact O-CB 3.43Å; F138-L141 PolarHBondContact O-N 3.33Å; F138-L147 HydrophobicContact CE1-CD1 4.38Å; F138-L147 HydrophobicContact CE1-CD2 4.45Å; F138-L147 HydrophobicContact CZ-CD2 4.19Å; F138-F149 HydrophobicContact CE2-CE2 4.19Å; F138-F149 HydrophobicContact CE2-CZ 4.38Å; F138-F149 AromaticContact CZ-CE2 3.6Å; F138-F149 HydrophobicContact CZ-CE2 3.6Å; F138-F149 AromaticContact CZ-CZ 3.62Å; F138-F149 HydrophobicContact CZ-CZ 3.62Å; F138-P158 HydrophobicContact CE2-CB 4.07Å; F138-L161 HydrophobicContact CD2-CD2 4.05Å; F138-L161 HydrophobicContact CE2-CD2 3.97Å; F138-P162 HydrophobicContact CB-CG 3.8Å
139	A	94	Very high	96.5	Very high	71 Å²	71	50.7 Å²	50.7	59%	0.587	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-34.5	-178	0	0	0	0	0	114.2	K136 L141	K136-A139 WeakPolarHBondContact O-CB 3.3Å; K136-A139 PolarHBondContact O-N 2.91Å; K136-A139 VanDerWaalsContact O-N 3.13Å; A139-L141 VanDerWaalsContact C-N 3.32Å; A139-L141 PolarHBondContact O-N 2.74Å
140	P	94.6	Very high	96.5	Very high	33 Å²	33	45.7 Å²	45.7	21%	0.214	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-21	176	-20.2	34.2	0	0	0	114.7	F138 K142	F138-P140 VanDerWaalsContact C-N 3.29Å; P140-K142 VanDerWaalsContact C-N 3.29Å; P140-K142 PolarHBondContact O-N 3.41Å
141	L	96	Very high	96.5	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.005	25%	0.251	C	S	.	.			trans	-85	62.5	-165.8	-57	-174.5	0	0	0	112.6	F114 L117 L120 F138 A139 H143 M144 P162	F114-L141 HydrophobicContact CB-CD1 4.34Å; F114-L141 HydrophobicContact CB-CD2 3.89Å; F114-L141 HydrophobicContact CB-CG 4.32Å; F114-L141 HydrophobicContact CD2-CD1 4.38Å; F114-L141 HydrophobicContact CG-CD1 4.44Å; L117-L141 HydrophobicContact CB-CD2 3.9Å; L117-L141 WeakPolarHBondContact O-CD2 3.45Å; L120-L141 HydrophobicContact CB-CD2 4.07Å; L120-L141 HydrophobicContact CD2-CD1 4.21Å; L120-L141 HydrophobicContact CD2-CD2 3.94Å; F138-L141 HydrophobicContact CB-CD1 4.47Å; F138-L141 HydrophobicContact CD1-CD1 3.74Å; F138-L141 WeakPolarHBondContact O-CB 3.43Å; F138-L141 PolarHBondContact O-N 3.33Å; A139-L141 VanDerWaalsContact C-N 3.32Å; A139-L141 PolarHBondContact O-N 2.74Å; L141-H143 VanDerWaalsContact C-N 3.29Å; L141-H143 PolarHBondContact O-N 2.89Å; L141-M144 HydrophobicContact CB-CB 3.96Å; L141-M144 HydrophobicContact CB-SD 4.36Å; L141-M144 HydrophobicContact CD1-CE 4.18Å; L141-M144 HydrophobicContact CD1-SD 3.49Å; L141-M144 WeakPolarHBondContact CD1-SD 3.29Å; L141-M144 PolarHBondContact O-N 3.42Å; L141-P162 HydrophobicContact CB-CG 4.16Å; L141-P162 WeakPolarHBondContact O-CB 3.22Å
142	K	92.1	Very high	96.5	Very high	148 Å²	148	46.8 Å²	46.8	64%	0.643	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-27.3	-171.1	-63.4	-177.3	-177.8	179.9	0	114.2	P140 S164	P140-K142 VanDerWaalsContact C-N 3.29Å; P140-K142 PolarHBondContact O-N 3.41Å; K142-S164 VanDerWaalsContact O-CB 3.28Å; K142-S164 WeakPolarHBondContact O-CB 3.39Å; K142-S164 PolarHBondContact O-OG 2.75Å
143	H	95.1	Very high	96.6	Very high	114 Å²	114	43.1 Å²	43.1	53%	0.528	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	8.5	-176.6	-63.1	-63.3	0	0	0	114.3	T118 L120 L141 Q145	T118-H143 PolarHBondContact O-CD2 3.1Å; T118-H143 VanDerWaalsContact O-CD2 3.24Å; L120-H143 CarbonylContact O-C 3.6Å; L120-H143 VanDerWaalsContact O-C 3.29Å; L141-H143 VanDerWaalsContact C-N 3.29Å; L141-H143 PolarHBondContact O-N 2.89Å; H143-Q145 PolarHBondContact O-N 3.28Å
144	M	96.5	Very high	96.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.212	C	C	.	.			trans	-73.7	125.3	-176.3	-173.4	-177.2	77.5	0	0	111.5	L120 L123 L141 L147 P162 S164 L165	L120-M144 WeakPolarHBondContact O-CA 3.36Å; L120-M144 WeakPolarHBondContact O-CB 3.37Å; L120-M144 PolarHBondContact O-N 3.04Å; L120-M144 VanDerWaalsContact O-N 3.11Å; L123-M144 HydrophobicContact CB-SD 3.92Å; L141-M144 HydrophobicContact CB-CB 3.96Å; L141-M144 HydrophobicContact CB-SD 4.36Å; L141-M144 HydrophobicContact CD1-CE 4.18Å; L141-M144 HydrophobicContact CD1-SD 3.49Å; L141-M144 WeakPolarHBondContact CD1-SD 3.29Å; L141-M144 PolarHBondContact O-N 3.42Å; M144-L147 HydrophobicContact CE-CB 4.09Å; M144-L147 HydrophobicContact CE-CD1 4.19Å; M144-L147 HydrophobicContact CE-CD2 3.95Å; M144-L147 HydrophobicContact CE-CG 4.31Å; M144-L147 HydrophobicContact SD-CD1 4.33Å; M144-P162 HydrophobicContact CE-CG 3.62Å; M144-S164 CarbonylContact O-C 3.04Å; M144-S164 VanDerWaalsContact O-C 3.25Å; M144-S164 PolarHBondContact O-OG 3.24Å; M144-S164 VanDerWaalsContact O-OG 3.14Å; M144-L165 HydrophobicContact CE-CD1 3.83Å; M144-L165 PolarHBondContact O-N 3.16Å
145	Q	97.4	Very high	96.5	Very high	71 Å²	71	41.6 Å²	41.6	33%	0.332	22%	0.222	S	C	.	.			trans	-107.8	-30.3	-179	-65.1	-169.2	1.9	0	0	113.1	Y121 H143 L165 V166 E167	Y121-Q145 HydrophobicContact CD2-CB 4.29Å; Y121-Q145 HydrophobicContact CD2-CG 4.1Å; Y121-Q145 HydrophobicContact CE2-CB 3.89Å; Y121-Q145 HydrophobicContact CE2-CG 3.78Å; Y121-Q145 PolarHBondContact O-N 2.78Å; Y121-Q145 PolarHBondContact OH-OE1 3.25Å; H143-Q145 PolarHBondContact O-N 3.28Å; Q145-L165 WeakPolarHBondContact O-CD1 3.14Å; Q145-V166 HydrophobicContact CB-CB 4.35Å; Q145-V166 HydrophobicContact CB-CG2 4.09Å; Q145-V166 HydrophobicContact CG-CG2 4.14Å; Q145-V166 PolarHBondContact O-N 2.71Å; Q145-E167 PolarHBondContact O-N 3.13Å
146	K	98.1	Very high	96.6	Very high	23 Å²	23	41.5 Å²	41.5	10%	0.1	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	126.6	-173	-63.9	179.2	168.3	-173	0	111.3	Y121 A122 L123 Y148 E167	Y121-K146 HydrophobicContact CE1-CD 3.92Å; Y121-K146 HydrophobicContact CE1-CG 4.38Å; Y121-K146 PolarHBondContact O-N 3.14Å; Y121-K146 VanDerWaalsContact O-N 3.15Å; A122-K146 WeakPolarHBondContact CA-O 2.97Å; A122-K146 HydrophobicContact CB-CB 3.84Å; L123-K146 PolarHBondContact N-O 3.44Å; K146-Y148 HydrophobicContact CB-CE1 4.42Å; K146-Y148 WeakPolarHBondContact CD-OH 3.24Å; K146-E167 WeakPolarHBondContact CE-OE2 3.29Å; K146-E167 HydrophobicContact CG-CB 4.21Å
147	L	97.8	Very high	96.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	118.5	179.1	-175.3	57.5	0	0	0	111.4	L123 F138 M144 F149 L161 L165 E167 L168 R169	L123-L147 HydrophobicContact CB-CD1 3.96Å; L123-L147 HydrophobicContact CD2-CD1 3.82Å; L123-L147 HydrophobicContact CG-CD1 4Å; F138-L147 HydrophobicContact CE1-CD1 4.38Å; F138-L147 HydrophobicContact CE1-CD2 4.45Å; F138-L147 HydrophobicContact CZ-CD2 4.19Å; M144-L147 HydrophobicContact CE-CB 4.09Å; M144-L147 HydrophobicContact CE-CD1 4.19Å; M144-L147 HydrophobicContact CE-CD2 3.95Å; M144-L147 HydrophobicContact CE-CG 4.31Å; M144-L147 HydrophobicContact SD-CD1 4.33Å; L147-F149 HydrophobicContact CD1-CD2 4.1Å; L147-F149 HydrophobicContact CD1-CE2 4Å; L147-F149 HydrophobicContact CD2-CD2 3.81Å; L147-F149 HydrophobicContact CD2-CE2 3.64Å; L147-F149 HydrophobicContact CG-CD2 3.72Å; L147-F149 HydrophobicContact CG-CE2 3.9Å; L147-L161 HydrophobicContact CD2-CD2 3.67Å; L147-L165 HydrophobicContact CB-CD1 3.72Å; L147-L165 HydrophobicContact CB-CD2 4.45Å; L147-E167 PolarHBondContact N-O 3.15Å; L147-L168 HydrophobicContact CB-CD1 4.18Å; L147-L168 HydrophobicContact CD2-CD1 4.05Å; L147-L168 HydrophobicContact CG-CD1 4.17Å; L147-R169 PolarHBondContact O-N 3.43Å
148	Y	98.3	Very high	96.5	Very high	16 Å²	16	37.1 Å²	37.1	6%	0.063	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	104.8	-177.6	-52.6	-40.7	0	0	0	111.2	F30 L123 V125 R126 K146 E167 R169	F30-Y148 HydrophobicContact CD2-CD2 4.12Å; F30-Y148 AromaticContact CD2-CE2 3.95Å; F30-Y148 HydrophobicContact CD2-CE2 3.95Å; F30-Y148 HydrophobicContact CE2-CE2 4.43Å; L123-Y148 PolarHBondContact O-N 3.22Å; V125-Y148 CarbonylContact C-O 3.57Å; V125-Y148 VanDerWaalsContact CG2-O 3.31Å; V125-Y148 WeakPolarHBondContact CG2-O 3.38Å; V125-Y148 PolarHBondContact N-O 2.82Å; R126-Y148 PolarHBondContact N-O 3.42Å; K146-Y148 HydrophobicContact CB-CE1 4.42Å; K146-Y148 WeakPolarHBondContact CD-OH 3.24Å; Y148-E167 HydrophobicContact CE1-CG 4.15Å; Y148-E167 PolarHBondContact OH-OE2 2.98Å; Y148-E167 VanDerWaalsContact OH-OE2 3.14Å; Y148-R169 HydrophobicContact CD1-CB 3.83Å; Y148-R169 HydrophobicContact CD1-CG 3.71Å; Y148-R169 HydrophobicContact CE1-CB 4.47Å; Y148-R169 HydrophobicContact CE1-CG 3.85Å
149	F	96.9	Very high	96.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.24	C	C	.	.			trans	-107.6	7.8	179.5	-95.9	-59.9	0	0	0	113.9	L109 V125 I130 V133 F138 L147 N152 L154 P158 R169 I170 N173	L109-F149 HydrophobicContact CD1-CE1 3.79Å; L109-F149 HydrophobicContact CD1-CZ 3.58Å; V125-F149 HydrophobicContact CG2-CD1 3.41Å; V125-F149 VanDerWaalsContact CG2-CD1 3.41Å; V125-F149 HydrophobicContact CG2-CE1 3.51Å; V125-F149 HydrophobicContact CG2-CG 4.1Å; V125-F149 HydrophobicContact CG2-CZ 4.27Å; I130-F149 HydrophobicContact CD1-CD1 4.39Å; I130-F149 HydrophobicContact CD1-CE1 3.96Å; I130-F149 HydrophobicContact CG2-CE1 4.29Å; V133-F149 HydrophobicContact CG2-CE1 4.3Å; V133-F149 HydrophobicContact CG2-CZ 4Å; F138-F149 HydrophobicContact CE2-CE2 4.19Å; F138-F149 HydrophobicContact CE2-CZ 4.38Å; F138-F149 AromaticContact CZ-CE2 3.6Å; F138-F149 HydrophobicContact CZ-CE2 3.6Å; F138-F149 AromaticContact CZ-CZ 3.62Å; F138-F149 HydrophobicContact CZ-CZ 3.62Å; L147-F149 HydrophobicContact CD1-CD2 4.1Å; L147-F149 HydrophobicContact CD1-CE2 4Å; L147-F149 HydrophobicContact CD2-CD2 3.81Å; L147-F149 HydrophobicContact CD2-CE2 3.64Å; L147-F149 HydrophobicContact CG-CD2 3.72Å; L147-F149 HydrophobicContact CG-CE2 3.9Å; F149-N152 WeakPolarHBondContact O-CB 3.5Å; F149-N152 PolarHBondContact O-ND2 3.11Å; F149-L154 HydrophobicContact CB-CD1 4.1Å; F149-L154 HydrophobicContact CD1-CD1 3.74Å; F149-L154 HydrophobicContact CD2-CD1 4.44Å; F149-L154 HydrophobicContact CE1-CD1 4.17Å; F149-L154 HydrophobicContact CG-CD1 3.88Å; F149-P158 HydrophobicContact CE2-CG 4.01Å; F149-P158 HydrophobicContact CZ-CG 4.39Å; F149-R169 CarbonylContact C-O 3.56Å; F149-R169 WeakPolarHBondContact CA-O 3.49Å; F149-R169 PolarHBondContact N-O 2.97Å; F149-I170 HydrophobicContact CB-CB 4.33Å; F149-I170 HydrophobicContact CB-CD1 4.32Å; F149-I170 HydrophobicContact CB-CG1 4.03Å; F149-N173 PolarHBondContact O-ND2 3.28Å
150	S	98	Very high	96.2	Very high	6 Å²	6	46.2 Å²	46.2	4%	0.042	24%	0.24	C	C	.	.			trans	-64.4	150.3	-171	-56.1	0	0	0	0	112.1	R126 N127 N152 R169 H171	R126-S150 CarbonylContact C-O 3.53Å; R126-S150 VanDerWaalsContact CA-O 3.3Å; R126-S150 WeakPolarHBondContact CA-O 3.47Å; R126-S150 WeakPolarHBondContact CG-O 3.1Å; N127-S150 PolarHBondContact N-O 3Å; S150-N152 PolarHBondContact O-ND2 2.98Å; S150-R169 PolarHBondContact N-O 2.94Å; S150-R169 PolarHBondContact OG-O 3.39Å; S150-H171 CarbonylContact C-O 3.28Å; S150-H171 WeakPolarHBondContact CA-O 3.47Å; S150-H171 WeakPolarHBondContact CB-O 3.46Å; S150-H171 PolarHBondContact OG-N 3.34Å
151	K	98.1	Very high	96.2	Very high	74 Å²	74	45.4 Å²	45.4	32%	0.322	23%	0.234	S	C	.	.	S	Bend	trans	59	60.6	-176.8	-60.6	-177.3	173.2	-175.4	0	112.3	N127 N128 H171 E172	N127-K151 WeakPolarHBondContact CA-O 3.46Å; N127-K151 HydrophobicContact CB-CB 4.1Å; N127-K151 HydrophobicContact CB-CD 4.41Å; N127-K151 PolarHBondContact N-O 3.18Å; N128-K151 PolarHBondContact N-O 2.98Å; K151-H171 PolarHBondContact N-O 3Å; K151-E172 WeakPolarHBondContact CA-O 3.28Å; K151-E172 VanDerWaalsContact CE-CD 3.42Å; K151-E172 WeakPolarHBondContact CE-OE1 3.47Å; K151-E172 WeakPolarHBondContact CE-OE2 3.34Å; K151-E172 HydrophobicContact CG-CB 3.87Å; K151-E172 HydrophobicContact CG-CG 4.4Å; K151-E172 WeakPolarHBondContact CG-OE2 3.45Å; K151-E172 PolarHBondContact N-O 3Å; K151-E172 IonicContact NZ-OE1 2.84Å
152	N	98.6	Very high	96.2	Very high	7 Å²	7	45.9 Å²	45.9	4%	0.037	24%	0.237	C	C	.	.	S	Bend	trans	-134.7	-169.3	176.1	-86.4	-75.1	0	0	0	110.3	V125 N128 K129 I130 F149 S150 L154 E172 N173	V125-N152 PolarHBondContact O-ND2 3.47Å; N128-N152 WeakPolarHBondContact CA-OD1 3.37Å; N128-N152 WeakPolarHBondContact CB-OD1 3.37Å; N128-N152 PolarHBondContact N-OD1 3.29Å; N128-N152 PolarHBondContact O-OD1 3.07Å; K129-N152 PolarHBondContact N-OD1 3.28Å; I130-N152 HydrophobicContact CB-CB 4.34Å; I130-N152 VanDerWaalsContact CB-OD1 3.29Å; I130-N152 WeakPolarHBondContact CB-OD1 3.33Å; I130-N152 WeakPolarHBondContact CG1-OD1 3.24Å; I130-N152 PolarHBondContact N-OD1 3.2Å; F149-N152 WeakPolarHBondContact O-CB 3.5Å; F149-N152 PolarHBondContact O-ND2 3.11Å; S150-N152 PolarHBondContact O-ND2 2.98Å; N152-L154 HydrophobicContact CB-CG 4.49Å; N152-E172 PolarHBondContact N-O 2.87Å; N152-E172 VanDerWaalsContact N-O 3.14Å; N152-N173 WeakPolarHBondContact CA-OD1 3.49Å; N152-N173 WeakPolarHBondContact CB-OD1 3.45Å; N152-N173 PolarHBondContact O-OD1 3.47Å
153	L	98.3	Very high	96.3	Very high	60 Å²	60	41.7 Å²	41.7	31%	0.314	23%	0.23	S	C	.	.			trans	-114.5	24.2	-175.8	-55.3	177.5	0	0	0	112.1	K129 I130 A155 N173	K129-L153 HydrophobicContact CB-CD1 4.09Å; I130-L153 CarbonylContact O-C 3.59Å; I130-L153 VanDerWaalsContact O-CA 3.29Å; I130-L153 WeakPolarHBondContact O-CA 3.46Å; I130-L153 PolarHBondContact O-N 3.13Å; L153-A155 PolarHBondContact O-N 3.5Å; L153-N173 PolarHBondContact N-OD1 3.33Å
154	L	98.1	Very high	96.3	Very high	5 Å²	5	37.5 Å²	37.5	3%	0.026	21%	0.214	C	C	.	.			trans	-65.7	129.5	-176.2	-65.2	172.6	0	0	0	110.8	I130 V133 F149 N152 P158 I170 N173 R174 I175	I130-L154 HydrophobicContact CG2-CD2 3.97Å; I130-L154 PolarHBondContact O-N 3.22Å; V133-L154 HydrophobicContact CG2-CD2 3.81Å; F149-L154 HydrophobicContact CB-CD1 4.1Å; F149-L154 HydrophobicContact CD1-CD1 3.74Å; F149-L154 HydrophobicContact CD2-CD1 4.44Å; F149-L154 HydrophobicContact CE1-CD1 4.17Å; F149-L154 HydrophobicContact CG-CD1 3.88Å; N152-L154 HydrophobicContact CB-CG 4.49Å; L154-P158 HydrophobicContact CD1-CG 4.39Å; L154-I170 HydrophobicContact CD1-CD1 3.57Å; L154-I170 HydrophobicContact CD1-CG1 4.04Å; L154-N173 HydrophobicContact CB-CB 4.34Å; L154-N173 VanDerWaalsContact CB-OD1 3.28Å; L154-N173 WeakPolarHBondContact CB-OD1 3.28Å; L154-N173 WeakPolarHBondContact CG-OD1 3.41Å; L154-N173 PolarHBondContact N-OD1 2.69Å; L154-R174 CarbonylContact O-C 3.6Å; L154-R174 VanDerWaalsContact O-CA 3.24Å; L154-R174 WeakPolarHBondContact O-CA 3.06Å; L154-R174 WeakPolarHBondContact O-CB 3.49Å; L154-R174 PolarHBondContact O-N 2.97Å; L154-I175 WeakPolarHBondContact O-CG1 3.24Å; L154-I175 PolarHBondContact O-N 3.1Å; L154-I175 VanDerWaalsContact O-N 3.16Å
155	A	96.4	Very high	96.3	Very high	67 Å²	67	37.5 Å²	37.5	55%	0.554	21%	0.214	S	C	*	.	S	Bend	trans	-91.2	-16.1	177.3	0	0	0	0	0	113.5	L153	L153-A155 PolarHBondContact O-N 3.5Å
156	A	95.6	Very high	96.3	Very high	56 Å²	56	36.1 Å²	36.1	46%	0.463	21%	0.21	S	C	.	.	S	Bend	trans	-151.5	162.8	-179.2	0	0	0	0	0	110.6
157	I	95.8	Very high	96.3	Very high	13 Å²	13	36 Å²	36	7%	0.067	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-64.9	130.6	171.7	-56.6	-68.1	0	0	0	109.1	L161 I170 I175 V178 F183	I157-L161 HydrophobicContact CG2-CD1 4.27Å; I157-I170 HydrophobicContact CD1-CD1 4.15Å; I157-I170 HydrophobicContact CD1-CG2 4.27Å; I157-I175 HydrophobicContact CD1-CD1 3.7Å; I157-I175 HydrophobicContact CG1-CD1 4.49Å; I157-V178 HydrophobicContact CG1-CG1 4.41Å; I157-F183 HydrophobicContact CD1-CE1 4.39Å; I157-F183 HydrophobicContact CD1-CZ 4.06Å; I157-F183 HydrophobicContact CG1-CZ 4.1Å; I157-F183 HydrophobicContact CG2-CE1 3.95Å; I157-F183 HydrophobicContact CG2-CZ 4.34Å
158	P	94.5	Very high	96.3	Very high	10 Å²	10	36 Å²	36	7%	0.065	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-59	141.1	175.8	-24.2	34.2	0	0	0	112.2	V133 F138 F149 L154 L161	V133-P158 HydrophobicContact CB-CB 4.31Å; V133-P158 HydrophobicContact CG1-CB 4.15Å; V133-P158 HydrophobicContact CG2-CG 4.27Å; F138-P158 HydrophobicContact CE2-CB 4.07Å; F149-P158 HydrophobicContact CE2-CG 4.01Å; F149-P158 HydrophobicContact CZ-CG 4.39Å; L154-P158 HydrophobicContact CD1-CG 4.39Å; P158-L161 HydrophobicContact CB-CD2 4.18Å
159	K	92.3	Very high	96.3	Very high	155 Å²	155	36.4 Å²	36.4	67%	0.674	21%	0.211	S	C	*	.	S	Bend	trans	-79.9	155.8	176.3	-64	-175	178.7	-176.2	0	110.9	L161	K159-L161 VanDerWaalsContact C-N 3.34Å; K159-L161 PolarHBondContact O-N 3.19Å
160	N	92.4	Very high	96.3	Very high	111 Å²	111	36.4 Å²	36.4	59%	0.594	21%	0.211	S	C	*	.	S	Bend	trans	56.8	44	173.5	-49.9	-33.3	0	0	0	113.3	P135	P135-N160 WeakPolarHBondContact O-CB 3.26Å; P135-N160 PolarHBondContact O-ND2 2.98Å
161	L	94.8	Very high	96.2	Very high	16 Å²	16	37.7 Å²	37.7	8%	0.084	22%	0.216	C	C	.	.			trans	-59	144.9	168.7	-67	173.3	0	0	0	109.8	F138 L147 I157 P158 K159 A163 L165 L168 L186	F138-L161 HydrophobicContact CD2-CD2 4.05Å; F138-L161 HydrophobicContact CE2-CD2 3.97Å; L147-L161 HydrophobicContact CD2-CD2 3.67Å; I157-L161 HydrophobicContact CG2-CD1 4.27Å; P158-L161 HydrophobicContact CB-CD2 4.18Å; K159-L161 VanDerWaalsContact C-N 3.34Å; K159-L161 PolarHBondContact O-N 3.19Å; L161-A163 PolarHBondContact O-N 2.79Å; L161-L165 HydrophobicContact CB-CD2 4.5Å; L161-L165 HydrophobicContact CD1-CD2 4.47Å; L161-L168 HydrophobicContact CD1-CD2 3.94Å; L161-L186 HydrophobicContact CB-CD1 4.33Å; L161-L186 HydrophobicContact CB-CD2 4.01Å; L161-L186 HydrophobicContact CD1-CD1 4.14Å
162	P	94.4	Very high	96.2	Very high	12 Å²	12	38 Å²	38	8%	0.078	22%	0.219	C	C	.	.			trans	-61.3	137.1	-178	-28.2	40.1	0	0	0	112.7	F138 L141 M144 S164 L165 L186	F138-P162 HydrophobicContact CB-CG 3.8Å; L141-P162 HydrophobicContact CB-CG 4.16Å; L141-P162 WeakPolarHBondContact O-CB 3.22Å; M144-P162 HydrophobicContact CE-CG 3.62Å; P162-S164 PolarHBondContact O-N 3.15Å; P162-S164 VanDerWaalsContact O-N 3.16Å; P162-L165 WeakPolarHBondContact O-CB 3.3Å; P162-L165 PolarHBondContact O-N 3.13Å; P162-L186 WeakPolarHBondContact O-CD2 3.29Å
163	A	94.2	Very high	96.2	Very high	59 Å²	59	38.1 Å²	38.1	49%	0.488	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-16.6	179.7	0	0	0	0	0	113.8	L161 L165 G185 N188	L161-A163 PolarHBondContact O-N 2.79Å; A163-L165 VanDerWaalsContact C-N 3.26Å; A163-G185 WeakPolarHBondContact CB-O 3.28Å; A163-N188 PolarHBondContact O-ND2 2.58Å
164	S	95.7	Very high	96.2	Very high	27 Å²	27	42.5 Å²	42.5	19%	0.189	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-6.2	173.4	41.1	0	0	0	0	113.7	K142 M144 P162 V166	K142-S164 VanDerWaalsContact O-CB 3.28Å; K142-S164 WeakPolarHBondContact O-CB 3.39Å; K142-S164 PolarHBondContact O-OG 2.75Å; M144-S164 CarbonylContact O-C 3.04Å; M144-S164 VanDerWaalsContact O-C 3.25Å; M144-S164 PolarHBondContact O-OG 3.24Å; M144-S164 VanDerWaalsContact O-OG 3.14Å; P162-S164 PolarHBondContact O-N 3.15Å; P162-S164 VanDerWaalsContact O-N 3.16Å; S164-V166 PolarHBondContact O-N 3.04Å
165	L	96.7	Very high	96.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.231	C	C	.	.			trans	-63.3	136.2	-178.4	-159.2	73.4	0	0	0	111.1	M144 Q145 L147 L161 P162 A163 L168 L186 N188 M189	M144-L165 HydrophobicContact CE-CD1 3.83Å; M144-L165 PolarHBondContact O-N 3.16Å; Q145-L165 WeakPolarHBondContact O-CD1 3.14Å; L147-L165 HydrophobicContact CB-CD1 3.72Å; L147-L165 HydrophobicContact CB-CD2 4.45Å; L161-L165 HydrophobicContact CB-CD2 4.5Å; L161-L165 HydrophobicContact CD1-CD2 4.47Å; P162-L165 WeakPolarHBondContact O-CB 3.3Å; P162-L165 PolarHBondContact O-N 3.13Å; A163-L165 VanDerWaalsContact C-N 3.26Å; L165-L168 HydrophobicContact CD2-CB 4.03Å; L165-L168 HydrophobicContact CD2-CD1 4.43Å; L165-L186 HydrophobicContact CB-CD2 4.38Å; L165-N188 CarbonylContact O-C 3.58Å; L165-M189 HydrophobicContact CB-SD 3.83Å; L165-M189 HydrophobicContact CD2-CE 4.37Å; L165-M189 HydrophobicContact CD2-SD 3.96Å; L165-M189 HydrophobicContact CG-SD 3.85Å
166	V	97.3	Very high	96.1	Very high	42 Å²	42	45.8 Å²	45.8	26%	0.255	23%	0.234	S	C	.	.			trans	-117.3	-34.1	179.5	-179.9	0	0	0	0	110.3	Q145 S164 H190 C191	Q145-V166 HydrophobicContact CB-CB 4.35Å; Q145-V166 HydrophobicContact CB-CG2 4.09Å; Q145-V166 HydrophobicContact CG-CG2 4.14Å; Q145-V166 PolarHBondContact O-N 2.71Å; S164-V166 PolarHBondContact O-N 3.04Å; V166-H190 HydrophobicContact CG1-CB 3.63Å; V166-H190 PolarHBondContact O-N 3.36Å; V166-C191 PolarHBondContact O-N 3.05Å; V166-C191 VanDerWaalsContact O-N 3.1Å
167	E	97.9	Very high	96.1	Very high	20 Å²	20	49.4 Å²	49.4	9%	0.093	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	126.6	-175.9	-174.8	178.7	-178.5	0	0	111.2	Q145 K146 L147 Y148 R169 C191	Q145-E167 PolarHBondContact O-N 3.13Å; K146-E167 WeakPolarHBondContact CE-OE2 3.29Å; K146-E167 HydrophobicContact CG-CB 4.21Å; L147-E167 PolarHBondContact N-O 3.15Å; Y148-E167 HydrophobicContact CE1-CG 4.15Å; Y148-E167 PolarHBondContact OH-OE2 2.98Å; Y148-E167 VanDerWaalsContact OH-OE2 3.14Å; E167-R169 HydrophobicContact CG-CG 4.43Å; E167-R169 IonicContact OE1-CZ 3.98Å; E167-R169 IonicContact OE1-NE 3.18Å; E167-R169 PolarHBondContact OE1-NE 3.21Å; E167-R169 IonicContact OE1-NH2 3.57Å; E167-R169 PolarHBondContact OE1-NH2 2.99Å; E167-C191 WeakPolarHBondContact CA-O 3.34Å; E167-C191 HydrophobicContact CG-CB 4.09Å
168	L	97.9	Very high	96.2	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	118	174.9	177	63.7	0	0	0	109.9	L147 L161 L165 F183 M189 C191 I192 E193	L147-L168 HydrophobicContact CB-CD1 4.18Å; L147-L168 HydrophobicContact CD2-CD1 4.05Å; L147-L168 HydrophobicContact CG-CD1 4.17Å; L161-L168 HydrophobicContact CD1-CD2 3.94Å; L165-L168 HydrophobicContact CD2-CB 4.03Å; L165-L168 HydrophobicContact CD2-CD1 4.43Å; L168-F183 HydrophobicContact CD2-CE1 4.09Å; L168-M189 HydrophobicContact CB-CE 3.76Å; L168-C191 PolarHBondContact N-O 3.4Å; L168-I192 HydrophobicContact CB-CG1 4.46Å; L168-I192 WeakPolarHBondContact O-CA 3.41Å; L168-E193 PolarHBondContact O-N 2.93Å
169	R	98.3	Very high	96.2	Very high	25 Å²	25	50.4 Å²	50.4	9%	0.094	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	109.7	171.4	-55.9	-172	-174.1	-152.3	5.8	111	Q27 L147 Y148 F149 S150 E167 E193	Q27-R169 VanDerWaalsContact NE2-NH1 3.13Å; L147-R169 PolarHBondContact O-N 3.43Å; Y148-R169 HydrophobicContact CD1-CB 3.83Å; Y148-R169 HydrophobicContact CD1-CG 3.71Å; Y148-R169 HydrophobicContact CE1-CB 4.47Å; Y148-R169 HydrophobicContact CE1-CG 3.85Å; F149-R169 CarbonylContact C-O 3.56Å; F149-R169 WeakPolarHBondContact CA-O 3.49Å; F149-R169 PolarHBondContact N-O 2.97Å; S150-R169 PolarHBondContact N-O 2.94Å; S150-R169 PolarHBondContact OG-O 3.39Å; E167-R169 HydrophobicContact CG-CG 4.43Å; E167-R169 IonicContact OE1-CZ 3.98Å; E167-R169 IonicContact OE1-NE 3.18Å; E167-R169 PolarHBondContact OE1-NE 3.21Å; E167-R169 IonicContact OE1-NH2 3.57Å; E167-R169 PolarHBondContact OE1-NH2 2.99Å; R169-E193 HydrophobicContact CB-CB 4.43Å; R169-E193 WeakPolarHBondContact CD-OE2 3.18Å; R169-E193 HydrophobicContact CG-CB 4.25Å; R169-E193 HydrophobicContact CG-CG 4.49Å; R169-E193 IonicContact CZ-OE2 3.91Å; R169-E193 IonicContact NE-OE2 3.88Å; R169-E193 IonicContact NH1-OE1 3.7Å; R169-E193 IonicContact NH1-OE2 3.99Å
170	I	97.6	Very high	96.2	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.24	C	C	.	.			trans	-124.7	30.5	-178.3	-163.2	157.1	0	0	0	111.5	F149 L154 I157 N173 I175 E193 M194 N197	F149-I170 HydrophobicContact CB-CB 4.33Å; F149-I170 HydrophobicContact CB-CD1 4.32Å; F149-I170 HydrophobicContact CB-CG1 4.03Å; L154-I170 HydrophobicContact CD1-CD1 3.57Å; L154-I170 HydrophobicContact CD1-CG1 4.04Å; I157-I170 HydrophobicContact CD1-CD1 4.15Å; I157-I170 HydrophobicContact CD1-CG2 4.27Å; I170-N173 PolarHBondContact O-ND2 3.46Å; I170-I175 HydrophobicContact CD1-CD1 3.64Å; I170-I175 HydrophobicContact CG1-CD1 3.75Å; I170-I175 HydrophobicContact CG2-CD1 4.34Å; I170-E193 WeakPolarHBondContact CG2-O 3.33Å; I170-E193 PolarHBondContact N-O 3.02Å; I170-M194 HydrophobicContact CG2-CB 3.64Å; I170-N197 PolarHBondContact O-ND2 2.97Å
171	H	95.6	Very high	96.1	Very high	32 Å²	32	42.1 Å²	42.1	15%	0.148	23%	0.229	C	C	.	.			trans	-62.9	155.3	177.9	-167	86.2	0	0	0	111.9	S150 K151 N173 E193 G195 A196 E221	S150-H171 CarbonylContact C-O 3.28Å; S150-H171 WeakPolarHBondContact CA-O 3.47Å; S150-H171 WeakPolarHBondContact CB-O 3.46Å; S150-H171 PolarHBondContact OG-N 3.34Å; K151-H171 PolarHBondContact N-O 3Å; H171-N173 PolarHBondContact O-ND2 3.45Å; H171-N173 VanDerWaalsContact O-ND2 3.13Å; H171-E193 PolarHBondContact N-O 3.49Å; H171-G195 CarbonylContact C-O 3.56Å; H171-G195 VanDerWaalsContact CA-O 3.26Å; H171-G195 WeakPolarHBondContact CA-O 3.03Å; H171-G195 WeakPolarHBondContact ND1-CA 3.23Å; H171-G195 PolarHBondContact ND1-N 3.16Å; H171-G195 PolarHBondContact ND1-O 3.33Å; H171-A196 VanDerWaalsContact NE2-CB 3.33Å; H171-A196 WeakPolarHBondContact NE2-CB 3.38Å; H171-E221 IonicContact CE1-OE1 3.83Å; H171-E221 IonicContact NE2-OE1 2.67Å
172	E	97.7	Very high	95.9	Very high	81 Å²	81	42.7 Å²	42.7	38%	0.379	24%	0.235	S	C	.	.	S	Bend	trans	52.5	61.8	178.4	-78	173.5	-93.8	0	0	112.6	K151 N152 G195 A196	K151-E172 WeakPolarHBondContact CA-O 3.28Å; K151-E172 VanDerWaalsContact CE-CD 3.42Å; K151-E172 WeakPolarHBondContact CE-OE1 3.47Å; K151-E172 WeakPolarHBondContact CE-OE2 3.34Å; K151-E172 HydrophobicContact CG-CB 3.87Å; K151-E172 HydrophobicContact CG-CG 4.4Å; K151-E172 WeakPolarHBondContact CG-OE2 3.45Å; K151-E172 PolarHBondContact N-O 3Å; K151-E172 IonicContact NZ-OE1 2.84Å; N152-E172 PolarHBondContact N-O 2.87Å; N152-E172 VanDerWaalsContact N-O 3.14Å; E172-G195 PolarHBondContact N-O 3.09Å; E172-A196 VanDerWaalsContact CA-O 3.3Å; E172-A196 WeakPolarHBondContact CA-O 3.37Å; E172-A196 HydrophobicContact CB-CB 4.28Å; E172-A196 HydrophobicContact CG-CB 3.56Å
173	N	98.5	Very high	95.9	Very high	10 Å²	10	42.1 Å²	42.1	5%	0.053	23%	0.231	C	C	.	.	S	Bend	trans	-129.2	-169.8	175.1	-88.4	-84.6	0	0	0	110	F149 N152 L153 L154 I170 H171 I175 A196 N197	F149-N173 PolarHBondContact O-ND2 3.28Å; N152-N173 WeakPolarHBondContact CA-OD1 3.49Å; N152-N173 WeakPolarHBondContact CB-OD1 3.45Å; N152-N173 PolarHBondContact O-OD1 3.47Å; L153-N173 PolarHBondContact N-OD1 3.33Å; L154-N173 HydrophobicContact CB-CB 4.34Å; L154-N173 VanDerWaalsContact CB-OD1 3.28Å; L154-N173 WeakPolarHBondContact CB-OD1 3.28Å; L154-N173 WeakPolarHBondContact CG-OD1 3.41Å; L154-N173 PolarHBondContact N-OD1 2.69Å; I170-N173 PolarHBondContact O-ND2 3.46Å; H171-N173 PolarHBondContact O-ND2 3.45Å; H171-N173 VanDerWaalsContact O-ND2 3.13Å; N173-I175 HydrophobicContact CB-CD1 4.41Å; N173-I175 HydrophobicContact CB-CG1 4.23Å; N173-A196 PolarHBondContact N-O 2.8Å; N173-N197 VanDerWaalsContact CA-OD1 3.23Å; N173-N197 WeakPolarHBondContact CA-OD1 3.27Å; N173-N197 WeakPolarHBondContact CB-OD1 3.43Å; N173-N197 PolarHBondContact N-OD1 2.97Å; N173-N197 PolarHBondContact O-OD1 2.85Å
174	R	97.9	Very high	95.7	Very high	152 Å²	152	43.7 Å²	43.7	57%	0.574	24%	0.238	S	C	*	.			trans	-111.8	26.7	-178.7	-61.2	-176.6	177.6	-171.3	-0.2	112.2	L154 K176 N197	L154-R174 CarbonylContact O-C 3.6Å; L154-R174 VanDerWaalsContact O-CA 3.24Å; L154-R174 WeakPolarHBondContact O-CA 3.06Å; L154-R174 WeakPolarHBondContact O-CB 3.49Å; L154-R174 PolarHBondContact O-N 2.97Å; R174-K176 PolarHBondContact O-N 2.79Å; R174-N197 PolarHBondContact N-OD1 2.75Å
175	I	97.8	Very high	95.4	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.256	C	S	.	.			trans	-69.9	124.3	-176.7	-58.3	172.9	0	0	0	108.7	L154 I157 I170 N173 K177 N197 P198 I199	L154-I175 WeakPolarHBondContact O-CG1 3.24Å; L154-I175 PolarHBondContact O-N 3.1Å; L154-I175 VanDerWaalsContact O-N 3.16Å; I157-I175 HydrophobicContact CD1-CD1 3.7Å; I157-I175 HydrophobicContact CG1-CD1 4.49Å; I170-I175 HydrophobicContact CD1-CD1 3.64Å; I170-I175 HydrophobicContact CG1-CD1 3.75Å; I170-I175 HydrophobicContact CG2-CD1 4.34Å; N173-I175 HydrophobicContact CB-CD1 4.41Å; N173-I175 HydrophobicContact CB-CG1 4.23Å; I175-K177 WeakPolarHBondContact CG2-O 3.44Å; I175-N197 HydrophobicContact CB-CB 4.2Å; I175-N197 VanDerWaalsContact CB-OD1 3.28Å; I175-N197 WeakPolarHBondContact CB-OD1 3.49Å; I175-N197 WeakPolarHBondContact CG1-OD1 3.37Å; I175-N197 PolarHBondContact N-OD1 3.32Å; I175-P198 CarbonylContact O-C 3.5Å; I175-P198 VanDerWaalsContact O-CD 3.26Å; I175-P198 WeakPolarHBondContact O-CD 3.23Å; I175-I199 HydrophobicContact CB-CD1 4.3Å; I175-I199 HydrophobicContact CB-CG1 4.41Å; I175-I199 HydrophobicContact CG2-CD1 3.94Å; I175-I199 HydrophobicContact CG2-CG1 4.18Å; I175-I199 WeakPolarHBondContact O-CG1 3.33Å
176	K	96.3	Very high	95.2	Very high	140 Å²	140	45.1 Å²	45.1	61%	0.609	26%	0.257	S	S	*	.			trans	-108.6	-27.3	176.5	-66.8	179.4	-177.9	-179	0	112.5	R174 P198 G203	R174-K176 PolarHBondContact O-N 2.79Å; K176-P198 HydrophobicContact CG-CG 3.93Å; K176-G203 WeakPolarHBondContact O-CA 3.1Å
177	K	95.4	Very high	94.9	Very high	133 Å²	133	45.1 Å²	45.1	58%	0.578	27%	0.265	S	S	*	.			trans	-136.3	142.9	-174.7	-61.8	-172.6	177.1	-172.6	0	111.1	I175 G203	I175-K177 WeakPolarHBondContact CG2-O 3.44Å; K177-G203 CarbonylContact C-O 3.29Å; K177-G203 WeakPolarHBondContact CA-O 2.84Å
178	V	96.3	Very high	94.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-115.5	107.2	170.8	-173.6	0	0	0	0	106.6	I157 F183 M194 I199 G203 F204 E205 A208	I157-V178 HydrophobicContact CG1-CG1 4.41Å; V178-F183 HydrophobicContact CG1-CD2 4.44Å; V178-F183 HydrophobicContact CG1-CE2 3.66Å; V178-F183 HydrophobicContact CG1-CZ 4.32Å; V178-M194 HydrophobicContact CG2-CE 3.65Å; V178-I199 HydrophobicContact CG2-CD1 4.38Å; V178-G203 PolarHBondContact N-O 3.2Å; V178-F204 HydrophobicContact CB-CD1 3.94Å; V178-F204 HydrophobicContact CB-CE1 4.42Å; V178-F204 HydrophobicContact CG2-CD1 3.79Å; V178-F204 HydrophobicContact CG2-CE1 3.77Å; V178-E205 PolarHBondContact O-N 3.31Å; V178-A208 HydrophobicContact CB-CB 4.3Å; V178-A208 HydrophobicContact CG1-CB 3.86Å
179	A	94.7	Very high	94.6	Very high	43 Å²	43	49.7 Å²	49.7	36%	0.355	29%	0.29	S	S	.	.			trans	-73.6	157.4	-174.8	0	0	0	0	0	111.9	G181 S182 E205	A179-G181 PolarHBondContact O-N 2.83Å; A179-S182 PolarHBondContact N-OG 3.14Å; A179-S182 VanDerWaalsContact N-OG 3.11Å; A179-S182 WeakPolarHBondContact O-CB 3.45Å; A179-S182 PolarHBondContact O-N 3.49Å; A179-S182 VanDerWaalsContact O-N 3.09Å; A179-S182 PolarHBondContact O-OG 2.71Å; A179-E205 VanDerWaalsContact CA-OE2 3.23Å; A179-E205 WeakPolarHBondContact CA-OE2 3.25Å
180	A	93.8	Very high	94.4	Very high	58 Å²	58	52.9 Å²	52.9	48%	0.479	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	130.5	174.5	0	0	0	0	0	111.3	S182 E205	A180-S182 VanDerWaalsContact C-N 3.26Å; A180-S182 PolarHBondContact O-N 3.02Å; A180-E205 HydrophobicContact CB-CB 4.46Å; A180-E205 PolarHBondContact N-OE2 2.81Å
181	G	89.2	Confident	94.4	Very high	34 Å²	34	53.5 Å²	53.5	35%	0.351	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	15.5	180	0	0	0	0	0	115.6	A179 F183 S184 G207	A179-G181 PolarHBondContact O-N 2.83Å; G181-F183 PolarHBondContact O-N 3.39Å; G181-F183 VanDerWaalsContact O-N 3.1Å; G181-S184 VanDerWaalsContact O-CB 3.25Å; G181-S184 WeakPolarHBondContact O-CB 3.38Å; G181-S184 PolarHBondContact O-N 3.17Å; G181-G207 PolarHBondContact N-O 3.32Å; G181-G207 VanDerWaalsContact N-O 3.15Å
182	S	91.8	Very high	94.6	Very high	29 Å²	29	52 Å²	52	20%	0.203	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-28.3	175.1	-65.9	0	0	0	0	113.1	A179 A180	A179-S182 PolarHBondContact N-OG 3.14Å; A179-S182 VanDerWaalsContact N-OG 3.11Å; A179-S182 WeakPolarHBondContact O-CB 3.45Å; A179-S182 PolarHBondContact O-N 3.49Å; A179-S182 VanDerWaalsContact O-N 3.09Å; A179-S182 PolarHBondContact O-OG 2.71Å; A180-S182 VanDerWaalsContact C-N 3.26Å; A180-S182 PolarHBondContact O-N 3.02Å
183	F	93.7	Very high	94.6	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	18.5	178.4	-54.5	-70.5	0	0	0	113.1	I157 L168 V178 G181 G185 L186 I192 F209 L212	I157-F183 HydrophobicContact CD1-CE1 4.39Å; I157-F183 HydrophobicContact CD1-CZ 4.06Å; I157-F183 HydrophobicContact CG1-CZ 4.1Å; I157-F183 HydrophobicContact CG2-CE1 3.95Å; I157-F183 HydrophobicContact CG2-CZ 4.34Å; L168-F183 HydrophobicContact CD2-CE1 4.09Å; V178-F183 HydrophobicContact CG1-CD2 4.44Å; V178-F183 HydrophobicContact CG1-CE2 3.66Å; V178-F183 HydrophobicContact CG1-CZ 4.32Å; G181-F183 PolarHBondContact O-N 3.39Å; G181-F183 VanDerWaalsContact O-N 3.1Å; F183-G185 PolarHBondContact O-N 2.83Å; F183-L186 HydrophobicContact CB-CD1 4.1Å; F183-L186 HydrophobicContact CD1-CD1 3.93Å; F183-L186 WeakPolarHBondContact O-CB 3.43Å; F183-L186 PolarHBondContact O-N 3.01Å; F183-I192 HydrophobicContact CD1-CD1 4.07Å; F183-I192 HydrophobicContact CE1-CD1 3.92Å; F183-I192 HydrophobicContact CZ-CD1 4.32Å; F183-F209 AromaticContact CD2-CD1 3.72Å; F183-F209 HydrophobicContact CD2-CD1 3.72Å; F183-F209 AromaticContact CD2-CE1 3.95Å; F183-F209 HydrophobicContact CD2-CE1 3.95Å; F183-F209 AromaticContact CE2-CD1 3.76Å; F183-F209 HydrophobicContact CE2-CD1 3.76Å; F183-F209 AromaticContact CE2-CE1 3.47Å; F183-F209 HydrophobicContact CE2-CE1 3.47Å; F183-F209 VanDerWaalsContact CE2-CE1 3.47Å; F183-F209 HydrophobicContact CE2-CZ 4.3Å; F183-F209 HydrophobicContact CZ-CE1 4.37Å; F183-L212 HydrophobicContact CB-CB 4.32Å; F183-L212 HydrophobicContact CB-CD1 4.12Å; F183-L212 HydrophobicContact CB-CD2 4.05Å; F183-L212 HydrophobicContact CB-CG 4.39Å; F183-L212 HydrophobicContact CD2-CD2 4.24Å; F183-L212 HydrophobicContact CG-CD2 4.13Å
184	S	90.1	Very high	94.5	Very high	91 Å²	91	48.8 Å²	48.8	64%	0.636	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	136.5	-179.4	-166.3	0	0	0	0	111.2	G181 L186	G181-S184 VanDerWaalsContact O-CB 3.25Å; G181-S184 WeakPolarHBondContact O-CB 3.38Å; G181-S184 PolarHBondContact O-N 3.17Å; S184-L186 VanDerWaalsContact C-N 3.29Å; S184-L186 PolarHBondContact O-N 3.48Å
185	G	88.8	Confident	94.4	Very high	56 Å²	56	41.6 Å²	41.6	58%	0.577	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	-6.5	-178.4	0	0	0	0	0	115	A163 F183 G187	A163-G185 WeakPolarHBondContact CB-O 3.28Å; F183-G185 PolarHBondContact O-N 2.83Å; G185-G187 PolarHBondContact O-N 2.97Å; G185-G187 VanDerWaalsContact O-N 3.08Å
186	L	93.4	Very high	94.4	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.01	27%	0.269	C	S	.	.			trans	-84.2	77.5	176.9	-58.7	-174.3	0	0	0	111.2	L161 P162 L165 F183 S184 M189 L212	L161-L186 HydrophobicContact CB-CD1 4.33Å; L161-L186 HydrophobicContact CB-CD2 4.01Å; L161-L186 HydrophobicContact CD1-CD1 4.14Å; P162-L186 WeakPolarHBondContact O-CD2 3.29Å; L165-L186 HydrophobicContact CB-CD2 4.38Å; F183-L186 HydrophobicContact CB-CD1 4.1Å; F183-L186 HydrophobicContact CD1-CD1 3.93Å; F183-L186 WeakPolarHBondContact O-CB 3.43Å; F183-L186 PolarHBondContact O-N 3.01Å; S184-L186 VanDerWaalsContact C-N 3.29Å; S184-L186 PolarHBondContact O-N 3.48Å; L186-M189 HydrophobicContact CB-CG 3.64Å; L186-M189 HydrophobicContact CD1-CG 4.19Å; L186-M189 HydrophobicContact CD1-SD 4.31Å; L186-M189 HydrophobicContact CG-CG 4.46Å; L186-L212 HydrophobicContact CB-CD1 4.02Å; L186-L212 WeakPolarHBondContact O-CD1 3.11Å
187	G	91.1	Very high	94.5	Very high	42 Å²	42	36 Å²	36	43%	0.433	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-16.7	-176.1	0	0	0	0	0	115.7	G185	G185-G187 PolarHBondContact O-N 2.97Å; G185-G187 VanDerWaalsContact O-N 3.08Å
188	N	92.6	Very high	94.5	Very high	106 Å²	106	31.6 Å²	31.6	57%	0.567	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.9	13.3	-171.5	-60.9	-46.1	0	0	0	113.5	A163 L165 H190	A163-N188 PolarHBondContact O-ND2 2.58Å; L165-N188 CarbonylContact O-C 3.58Å; N188-H190 PolarHBondContact O-N 3.01Å
189	M	95.9	Very high	94.5	Very high	9 Å²	9	31.6 Å²	31.6	4%	0.044	23%	0.226	C	C	.	.			trans	-69.1	134	-175.2	-70.6	-67.5	-63.7	0	0	111.6	L165 L168 L186 C191 I192 L212 L214	L165-M189 HydrophobicContact CB-SD 3.83Å; L165-M189 HydrophobicContact CD2-CE 4.37Å; L165-M189 HydrophobicContact CD2-SD 3.96Å; L165-M189 HydrophobicContact CG-SD 3.85Å; L168-M189 HydrophobicContact CB-CE 3.76Å; L186-M189 HydrophobicContact CB-CG 3.64Å; L186-M189 HydrophobicContact CD1-CG 4.19Å; L186-M189 HydrophobicContact CD1-SD 4.31Å; L186-M189 HydrophobicContact CG-CG 4.46Å; M189-C191 WeakPolarHBondContact CE-O 3.38Å; M189-I192 HydrophobicContact CE-CD1 3.95Å; M189-I192 HydrophobicContact CE-CG1 3.44Å; M189-I192 VanDerWaalsContact CE-CG1 3.44Å; M189-L212 HydrophobicContact CB-CD1 3.88Å; M189-L212 HydrophobicContact CG-CD1 3.86Å; M189-L214 HydrophobicContact CB-CD1 3.88Å
190	H	95.6	Very high	94.6	Very high	92 Å²	92	34.3 Å²	34.3	43%	0.426	23%	0.231	S	C	.	.			trans	-106.6	-43.8	172.4	-174.4	-90.9	0	0	0	111.3	V166 N188 L214 N215 Y216	V166-H190 HydrophobicContact CG1-CB 3.63Å; V166-H190 PolarHBondContact O-N 3.36Å; N188-H190 PolarHBondContact O-N 3.01Å; H190-L214 VanDerWaalsContact C-CD1 3.42Å; H190-L214 WeakPolarHBondContact O-CD1 3.35Å; H190-N215 PolarHBondContact CD2-ND2 3.24Å; H190-N215 PolarHBondContact NE2-ND2 3.18Å; H190-N215 PolarHBondContact O-N 3.21Å; H190-Y216 PolarHBondContact O-N 3.28Å
191	C	97.5	Very high	94.7	Very high	13 Å²	13	33.8 Å²	33.8	9%	0.088	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	130.5	-169.5	175.1	0	0	0	0	112.5	V166 E167 L168 M189 Y216	V166-C191 PolarHBondContact O-N 3.05Å; V166-C191 VanDerWaalsContact O-N 3.1Å; E167-C191 WeakPolarHBondContact CA-O 3.34Å; E167-C191 HydrophobicContact CG-CB 4.09Å; L168-C191 PolarHBondContact N-O 3.4Å; M189-C191 WeakPolarHBondContact CE-O 3.38Å; C191-Y216 WeakPolarHBondContact CA-O 3.46Å; C191-Y216 HydrophobicContact CB-CD1 4.36Å; C191-Y216 VanDerWaalsContact SG-CD1 3.51Å
192	I	97.9	Very high	94.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	121.1	166.1	-62.8	-179.3	0	0	0	109.3	L168 F183 M189 M194 L212 L214 Y216 L217 R218	L168-I192 HydrophobicContact CB-CG1 4.46Å; L168-I192 WeakPolarHBondContact O-CA 3.41Å; F183-I192 HydrophobicContact CD1-CD1 4.07Å; F183-I192 HydrophobicContact CE1-CD1 3.92Å; F183-I192 HydrophobicContact CZ-CD1 4.32Å; M189-I192 HydrophobicContact CE-CD1 3.95Å; M189-I192 HydrophobicContact CE-CG1 3.44Å; M189-I192 VanDerWaalsContact CE-CG1 3.44Å; I192-M194 HydrophobicContact CG2-CB 4.38Å; I192-M194 HydrophobicContact CG2-CG 4.37Å; I192-M194 HydrophobicContact CG2-SD 4.18Å; I192-L212 HydrophobicContact CD1-CD2 3.85Å; I192-L214 HydrophobicContact CB-CD1 4.44Å; I192-L214 HydrophobicContact CB-CD2 4.05Å; I192-L214 HydrophobicContact CD1-CD1 4.24Å; I192-L214 HydrophobicContact CD1-CD2 3.92Å; I192-L214 HydrophobicContact CG1-CD1 3.84Å; I192-L214 HydrophobicContact CG1-CD2 3.98Å; I192-Y216 PolarHBondContact N-O 3.15Å; I192-L217 HydrophobicContact CB-CD1 3.93Å; I192-L217 HydrophobicContact CG2-CD1 3.97Å; I192-R218 PolarHBondContact O-N 3.25Å
193	E	97.8	Very high	95	Very high	25 Å²	25	35.6 Å²	35.6	12%	0.117	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	116	168.7	-69.1	-177.4	173.4	0	0	109.3	L168 R169 I170 H171 Y216 R218	L168-E193 PolarHBondContact O-N 2.93Å; R169-E193 HydrophobicContact CB-CB 4.43Å; R169-E193 WeakPolarHBondContact CD-OE2 3.18Å; R169-E193 HydrophobicContact CG-CB 4.25Å; R169-E193 HydrophobicContact CG-CG 4.49Å; R169-E193 IonicContact CZ-OE2 3.91Å; R169-E193 IonicContact NE-OE2 3.88Å; R169-E193 IonicContact NH1-OE1 3.7Å; R169-E193 IonicContact NH1-OE2 3.99Å; I170-E193 WeakPolarHBondContact CG2-O 3.33Å; I170-E193 PolarHBondContact N-O 3.02Å; H171-E193 PolarHBondContact N-O 3.49Å; E193-Y216 HydrophobicContact CG-CE1 4.07Å; E193-R218 HydrophobicContact CG-CB 4.44Å
194	M	96.8	Very high	95.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	24%	0.235	C	C	.	.			trans	-134.6	23.3	-178.4	65.3	-172.2	-67	0	0	113.2	I170 V178 I192 N197 I199 F204 L217 R218 I219	I170-M194 HydrophobicContact CG2-CB 3.64Å; V178-M194 HydrophobicContact CG2-CE 3.65Å; I192-M194 HydrophobicContact CG2-CB 4.38Å; I192-M194 HydrophobicContact CG2-CG 4.37Å; I192-M194 HydrophobicContact CG2-SD 4.18Å; M194-N197 PolarHBondContact O-ND2 3.42Å; M194-I199 HydrophobicContact CE-CD1 3.33Å; M194-F204 HydrophobicContact CE-CE1 4.33Å; M194-L217 HydrophobicContact SD-CD1 4.33Å; M194-R218 PolarHBondContact N-O 3.48Å; M194-I219 HydrophobicContact CG-CB 4.41Å; M194-I219 HydrophobicContact CG-CG1 3.85Å; M194-I219 HydrophobicContact CG-CG2 4.29Å; M194-I219 HydrophobicContact SD-CD1 4.23Å; M194-I219 HydrophobicContact SD-CG1 4.18Å
195	G	96.3	Very high	95.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.223	C	C	.	.			trans	-65.6	176.5	176.4	0	0	0	0	0	114.2	H171 E172 N197 S220	H171-G195 CarbonylContact C-O 3.56Å; H171-G195 VanDerWaalsContact CA-O 3.26Å; H171-G195 WeakPolarHBondContact CA-O 3.03Å; H171-G195 WeakPolarHBondContact ND1-CA 3.23Å; H171-G195 PolarHBondContact ND1-N 3.16Å; H171-G195 PolarHBondContact ND1-O 3.33Å; E172-G195 PolarHBondContact N-O 3.09Å; G195-N197 PolarHBondContact O-N 3.04Å; G195-N197 VanDerWaalsContact O-N 3.13Å; G195-N197 PolarHBondContact O-ND2 3.27Å; G195-S220 CarbonylContact C-O 3.57Å; G195-S220 VanDerWaalsContact C-O 3.28Å; G195-S220 WeakPolarHBondContact CA-O 3.19Å
196	A	97.3	Very high	95.5	Very high	22 Å²	22	39.3 Å²	39.3	18%	0.182	23%	0.23	C	C	.	.	S	Bend	trans	48.2	40.2	-175.7	0	0	0	0	0	112.4	H171 E172 N173 S220 E221	H171-A196 VanDerWaalsContact NE2-CB 3.33Å; H171-A196 WeakPolarHBondContact NE2-CB 3.38Å; E172-A196 VanDerWaalsContact CA-O 3.3Å; E172-A196 WeakPolarHBondContact CA-O 3.37Å; E172-A196 HydrophobicContact CB-CB 4.28Å; E172-A196 HydrophobicContact CG-CB 3.56Å; N173-A196 PolarHBondContact N-O 2.8Å; A196-S220 PolarHBondContact N-O 3.07Å; A196-E221 WeakPolarHBondContact CA-O 3.46Å; A196-E221 HydrophobicContact CB-CB 4.1Å
197	N	97.9	Very high	95.4	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.011	24%	0.243	C	C	.	.	S	Bend	trans	-119.9	141.2	171.7	-81.5	-83.2	0	0	0	108.5	I170 N173 R174 I175 M194 G195 I199 A222	I170-N197 PolarHBondContact O-ND2 2.97Å; N173-N197 VanDerWaalsContact CA-OD1 3.23Å; N173-N197 WeakPolarHBondContact CA-OD1 3.27Å; N173-N197 WeakPolarHBondContact CB-OD1 3.43Å; N173-N197 PolarHBondContact N-OD1 2.97Å; N173-N197 PolarHBondContact O-OD1 2.85Å; R174-N197 PolarHBondContact N-OD1 2.75Å; I175-N197 HydrophobicContact CB-CB 4.2Å; I175-N197 VanDerWaalsContact CB-OD1 3.28Å; I175-N197 WeakPolarHBondContact CB-OD1 3.49Å; I175-N197 WeakPolarHBondContact CG1-OD1 3.37Å; I175-N197 PolarHBondContact N-OD1 3.32Å; M194-N197 PolarHBondContact O-ND2 3.42Å; G195-N197 PolarHBondContact O-N 3.04Å; G195-N197 VanDerWaalsContact O-N 3.13Å; G195-N197 PolarHBondContact O-ND2 3.27Å; N197-I199 HydrophobicContact CB-CD1 3.84Å; N197-I199 HydrophobicContact CB-CG1 3.8Å; N197-I199 PolarHBondContact O-N 3.16Å; N197-A222 VanDerWaalsContact O-CA 3.31Å; N197-A222 WeakPolarHBondContact O-CA 3.49Å; N197-A222 VanDerWaalsContact O-CB 3.3Å; N197-A222 WeakPolarHBondContact O-CB 3.09Å
198	P	96.9	Very high	95.5	Very high	40 Å²	40	38.7 Å²	38.7	26%	0.26	22%	0.223	S	C	.	.			trans	-74.9	45.8	-178	33.2	-38.3	0	0	0	113.3	I175 K176	I175-P198 CarbonylContact O-C 3.5Å; I175-P198 VanDerWaalsContact O-CD 3.26Å; I175-P198 WeakPolarHBondContact O-CD 3.23Å; K176-P198 HydrophobicContact CG-CG 3.93Å
199	I	96.2	Very high	95.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.199	C	C	.	.			trans	-82.4	131.1	-179.5	-55.2	174.9	0	0	0	109.2	I175 V178 M194 N197 F204 K223	I175-I199 HydrophobicContact CB-CD1 4.3Å; I175-I199 HydrophobicContact CB-CG1 4.41Å; I175-I199 HydrophobicContact CG2-CD1 3.94Å; I175-I199 HydrophobicContact CG2-CG1 4.18Å; I175-I199 WeakPolarHBondContact O-CG1 3.33Å; V178-I199 HydrophobicContact CG2-CD1 4.38Å; M194-I199 HydrophobicContact CE-CD1 3.33Å; N197-I199 HydrophobicContact CB-CD1 3.84Å; N197-I199 HydrophobicContact CB-CG1 3.8Å; N197-I199 PolarHBondContact O-N 3.16Å; I199-F204 HydrophobicContact CG2-CD2 4.46Å; I199-F204 HydrophobicContact CG2-CE1 3.98Å; I199-F204 HydrophobicContact CG2-CE2 3.83Å; I199-F204 HydrophobicContact CG2-CZ 3.54Å; I199-K223 CarbonylContact O-C 3.27Å; I199-K223 VanDerWaalsContact O-CA 3.31Å; I199-K223 WeakPolarHBondContact O-CA 3.41Å; I199-K223 WeakPolarHBondContact O-CB 3.24Å; I199-K223 PolarHBondContact O-N 3.04Å
200	Q	96.3	Very high	95.3	Very high	99 Å²	99	41.5 Å²	41.5	46%	0.463	23%	0.23	S	C	.	.			trans	-106.2	166.6	172.2	-65.1	175.9	-12.9	0	0	109.5	S202 G203 K223	Q200-S202 VanDerWaalsContact C-N 3.25Å; Q200-S202 PolarHBondContact O-N 3.08Å; Q200-G203 WeakPolarHBondContact O-CA 3.35Å; Q200-G203 PolarHBondContact O-N 3.39Å; Q200-K223 HydrophobicContact CG-CB 3.8Å
201	N	95	Very high	94.9	Very high	47 Å²	47	40.4 Å²	40.4	25%	0.251	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-55	-39.6	176.1	-71	76.9	0	0	0	113	G203 F204 L224 T225 G226	N201-G203 PolarHBondContact O-N 3.17Å; N201-F204 PolarHBondContact O-N 2.78Å; N201-L224 WeakPolarHBondContact OD1-CA 3.35Å; N201-T225 PolarHBondContact OD1-N 3.22Å; N201-T225 PolarHBondContact OD1-OG1 2.99Å; N201-G226 PolarHBondContact ND2-O 3.16Å; N201-G226 PolarHBondContact OD1-N 3.23Å
202	S	94.6	Very high	94.7	Very high	98 Å²	98	40.1 Å²	40.1	69%	0.685	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-69.5	-8.9	174.8	58.9	0	0	0	0	114.2	Q200 F204	Q200-S202 VanDerWaalsContact C-N 3.25Å; Q200-S202 PolarHBondContact O-N 3.08Å; S202-F204 VanDerWaalsContact C-N 3.34Å
203	G	93.8	Very high	94.5	Very high	4 Å²	4	47 Å²	47	4%	0.041	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-76.7	-18.9	175.8	0	0	0	0	0	113.3	K176 K177 V178 Q200 N201	K176-G203 WeakPolarHBondContact O-CA 3.1Å; K177-G203 CarbonylContact C-O 3.29Å; K177-G203 WeakPolarHBondContact CA-O 2.84Å; V178-G203 PolarHBondContact N-O 3.2Å; Q200-G203 WeakPolarHBondContact O-CA 3.35Å; Q200-G203 PolarHBondContact O-N 3.39Å; N201-G203 PolarHBondContact O-N 3.17Å
204	F	95.6	Very high	94.4	Very high	31 Å²	31	45.9 Å²	45.9	14%	0.136	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-87.7	112.2	173.8	-57.3	-72.1	0	0	0	109.6	V178 M194 I199 N201 S202 F209 I219 L224 P228	V178-F204 HydrophobicContact CB-CD1 3.94Å; V178-F204 HydrophobicContact CB-CE1 4.42Å; V178-F204 HydrophobicContact CG2-CD1 3.79Å; V178-F204 HydrophobicContact CG2-CE1 3.77Å; M194-F204 HydrophobicContact CE-CE1 4.33Å; I199-F204 HydrophobicContact CG2-CD2 4.46Å; I199-F204 HydrophobicContact CG2-CE1 3.98Å; I199-F204 HydrophobicContact CG2-CE2 3.83Å; I199-F204 HydrophobicContact CG2-CZ 3.54Å; N201-F204 PolarHBondContact O-N 2.78Å; S202-F204 VanDerWaalsContact C-N 3.34Å; F204-F209 AromaticContact CD1-CE2 3.62Å; F204-F209 HydrophobicContact CD1-CE2 3.62Å; F204-F209 AromaticContact CD1-CZ 3.89Å; F204-F209 HydrophobicContact CD1-CZ 3.89Å; F204-F209 HydrophobicContact CE1-CE2 4Å; F204-F209 AromaticContact CE1-CZ 3.84Å; F204-F209 HydrophobicContact CE1-CZ 3.84Å; F204-F209 HydrophobicContact CG-CE2 4.37Å; F204-I219 HydrophobicContact CE1-CD1 4.26Å; F204-I219 HydrophobicContact CZ-CD1 3.82Å; F204-L224 HydrophobicContact CE2-CD2 3.63Å; F204-L224 HydrophobicContact CZ-CD2 4.26Å; F204-P228 HydrophobicContact CD2-CG 4.43Å; F204-P228 HydrophobicContact CE2-CG 4.02Å
205	E	94.9	Very high	94.3	Very high	83 Å²	83	48.6 Å²	48.6	39%	0.388	28%	0.28	S	S	.	.			trans	-71.6	148.2	173.3	-70	-178.7	179.9	0	0	110.7	V178 A179 A180 G207 A208	V178-E205 PolarHBondContact O-N 3.31Å; A179-E205 VanDerWaalsContact CA-OE2 3.23Å; A179-E205 WeakPolarHBondContact CA-OE2 3.25Å; A180-E205 HydrophobicContact CB-CB 4.46Å; A180-E205 PolarHBondContact N-OE2 2.81Å; E205-G207 PolarHBondContact O-N 2.9Å; E205-G207 VanDerWaalsContact O-N 3.17Å; E205-A208 WeakPolarHBondContact O-CB 3.5Å; E205-A208 PolarHBondContact O-N 2.85Å
206	P	92.8	Very high	94.4	Very high	111 Å²	111	50.4 Å²	50.4	72%	0.721	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	124.2	173.2	-26.7	35.2	0	0	0	111.3
207	G	90.3	Very high	94.5	Very high	28 Å²	28	49.4 Å²	49.4	29%	0.289	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	14.9	-176.3	0	0	0	0	0	115.4	G181 E205 F209 K210	G181-G207 PolarHBondContact N-O 3.32Å; G181-G207 VanDerWaalsContact N-O 3.15Å; E205-G207 PolarHBondContact O-N 2.9Å; E205-G207 VanDerWaalsContact O-N 3.17Å; G207-F209 PolarHBondContact O-N 3.02Å; G207-K210 VanDerWaalsContact O-CB 3.29Å; G207-K210 WeakPolarHBondContact O-CB 3.4Å; G207-K210 PolarHBondContact O-N 3.27Å; G207-K210 VanDerWaalsContact O-N 3.08Å
208	A	93.9	Very high	94.5	Very high	3 Å²	3	52.3 Å²	52.3	3%	0.025	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-41.8	171.1	0	0	0	0	0	112.9	V178 E205	V178-A208 HydrophobicContact CB-CB 4.3Å; V178-A208 HydrophobicContact CG1-CB 3.86Å; E205-A208 WeakPolarHBondContact O-CB 3.5Å; E205-A208 PolarHBondContact O-N 2.85Å
209	F	93.1	Very high	94.5	Very high	13 Å²	13	50.4 Å²	50.4	6%	0.057	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	15.2	-179	-57.3	-81.7	0	0	0	113.5	F183 F204 G207 G211 L212 L231 P232	F183-F209 AromaticContact CD2-CD1 3.72Å; F183-F209 HydrophobicContact CD2-CD1 3.72Å; F183-F209 AromaticContact CD2-CE1 3.95Å; F183-F209 HydrophobicContact CD2-CE1 3.95Å; F183-F209 AromaticContact CE2-CD1 3.76Å; F183-F209 HydrophobicContact CE2-CD1 3.76Å; F183-F209 AromaticContact CE2-CE1 3.47Å; F183-F209 HydrophobicContact CE2-CE1 3.47Å; F183-F209 VanDerWaalsContact CE2-CE1 3.47Å; F183-F209 HydrophobicContact CE2-CZ 4.3Å; F183-F209 HydrophobicContact CZ-CE1 4.37Å; F204-F209 AromaticContact CD1-CE2 3.62Å; F204-F209 HydrophobicContact CD1-CE2 3.62Å; F204-F209 AromaticContact CD1-CZ 3.89Å; F204-F209 HydrophobicContact CD1-CZ 3.89Å; F204-F209 HydrophobicContact CE1-CE2 4Å; F204-F209 AromaticContact CE1-CZ 3.84Å; F204-F209 HydrophobicContact CE1-CZ 3.84Å; F204-F209 HydrophobicContact CG-CE2 4.37Å; G207-F209 PolarHBondContact O-N 3.02Å; F209-G211 PolarHBondContact O-N 2.67Å; F209-L212 HydrophobicContact CD1-CD2 3.85Å; F209-L212 WeakPolarHBondContact O-CB 3.07Å; F209-L212 PolarHBondContact O-N 3.09Å; F209-L212 VanDerWaalsContact O-N 3.13Å; F209-L231 HydrophobicContact CD2-CD2 3.98Å; F209-L231 HydrophobicContact CE2-CD2 3.58Å; F209-L231 HydrophobicContact CZ-CD2 3.94Å; F209-P232 HydrophobicContact CB-CG 4.03Å; F209-P232 HydrophobicContact CD1-CG 4.5Å
210	K	90.1	Very high	94.6	Very high	161 Å²	161	50.5 Å²	50.5	70%	0.7	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	123.8	-175.7	-175.7	178.4	179.4	179.7	0	111.1	G207 L212	G207-K210 VanDerWaalsContact O-CB 3.29Å; G207-K210 WeakPolarHBondContact O-CB 3.4Å; G207-K210 PolarHBondContact O-N 3.27Å; G207-K210 VanDerWaalsContact O-N 3.08Å; K210-L212 PolarHBondContact O-N 2.87Å
211	G	87.8	Confident	94.6	Very high	68 Å²	68	50.5 Å²	50.5	70%	0.701	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	0.5	178	0	0	0	0	0	114.6	F209	F209-G211 PolarHBondContact O-N 2.67Å
212	L	93.4	Very high	94.6	Very high	7 Å²	7	48.6 Å²	48.6	4%	0.037	27%	0.269	C	S	.	.			trans	-76.8	129	173.1	-179.3	64.6	0	0	0	109.7	F183 L186 M189 I192 F209 K210 L214 P232	F183-L212 HydrophobicContact CB-CB 4.32Å; F183-L212 HydrophobicContact CB-CD1 4.12Å; F183-L212 HydrophobicContact CB-CD2 4.05Å; F183-L212 HydrophobicContact CB-CG 4.39Å; F183-L212 HydrophobicContact CD2-CD2 4.24Å; F183-L212 HydrophobicContact CG-CD2 4.13Å; L186-L212 HydrophobicContact CB-CD1 4.02Å; L186-L212 WeakPolarHBondContact O-CD1 3.11Å; M189-L212 HydrophobicContact CB-CD1 3.88Å; M189-L212 HydrophobicContact CG-CD1 3.86Å; I192-L212 HydrophobicContact CD1-CD2 3.85Å; F209-L212 HydrophobicContact CD1-CD2 3.85Å; F209-L212 WeakPolarHBondContact O-CB 3.07Å; F209-L212 PolarHBondContact O-N 3.09Å; F209-L212 VanDerWaalsContact O-N 3.13Å; K210-L212 PolarHBondContact O-N 2.87Å; L212-L214 HydrophobicContact CD2-CB 4.32Å; L212-L214 HydrophobicContact CD2-CD2 4.24Å; L212-L214 HydrophobicContact CG-CB 4.2Å; L212-P232 HydrophobicContact CB-CG 4.3Å; L212-P232 HydrophobicContact CD2-CG 4.01Å; L212-P232 HydrophobicContact CG-CG 4.23Å
213	K	93.1	Very high	94.7	Very high	145 Å²	145	48.5 Å²	48.5	63%	0.63	26%	0.256	S	S	*	.			trans	-103.2	128.8	164.3	-66.8	-175.3	179.3	-177.7	0	108	S234	K213-S234 WeakPolarHBondContact CA-OG 3.17Å
214	L	95.6	Very high	94.9	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	25%	0.254	C	S	.	.			trans	-151.2	136.2	-172.8	-173.9	67.5	0	0	0	110.8	M189 H190 I192 L212 Y216 L217 P232 S234 L235	M189-L214 HydrophobicContact CB-CD1 3.88Å; H190-L214 VanDerWaalsContact C-CD1 3.42Å; H190-L214 WeakPolarHBondContact O-CD1 3.35Å; I192-L214 HydrophobicContact CB-CD1 4.44Å; I192-L214 HydrophobicContact CB-CD2 4.05Å; I192-L214 HydrophobicContact CD1-CD1 4.24Å; I192-L214 HydrophobicContact CD1-CD2 3.92Å; I192-L214 HydrophobicContact CG1-CD1 3.84Å; I192-L214 HydrophobicContact CG1-CD2 3.98Å; L212-L214 HydrophobicContact CD2-CB 4.32Å; L212-L214 HydrophobicContact CD2-CD2 4.24Å; L212-L214 HydrophobicContact CG-CB 4.2Å; L214-Y216 WeakPolarHBondContact CD2-O 3.31Å; L214-Y216 WeakPolarHBondContact CG-O 3.33Å; L214-L217 HydrophobicContact CD2-CB 3.76Å; L214-L217 HydrophobicContact CD2-CD1 4.07Å; L214-L217 HydrophobicContact CD2-CD2 4.47Å; L214-L217 HydrophobicContact CD2-CG 4.31Å; L214-P232 HydrophobicContact CB-CB 4.49Å; L214-P232 HydrophobicContact CB-CG 4.34Å; L214-S234 PolarHBondContact N-OG 3.3Å; L214-S234 CarbonylContact O-C 3.09Å; L214-S234 VanDerWaalsContact O-O 3.12Å; L214-S234 PolarHBondContact O-OG 3.11Å; L214-L235 HydrophobicContact CB-CD2 4.26Å; L214-L235 HydrophobicContact CD2-CD2 4.09Å; L214-L235 HydrophobicContact CG-CD2 4.09Å; L214-L235 VanDerWaalsContact O-CA 3.31Å; L214-L235 WeakPolarHBondContact O-CA 3.48Å; L214-L235 PolarHBondContact O-N 3.21Å
215	N	96.4	Very high	95	Very high	57 Å²	57	50.1 Å²	50.1	31%	0.305	27%	0.268	S	S	.	.	S	Bend	trans	-92.7	-44.1	178	-69.3	-7.6	0	0	0	112.2	H190 H236 E237	H190-N215 PolarHBondContact CD2-ND2 3.24Å; H190-N215 PolarHBondContact NE2-ND2 3.18Å; H190-N215 PolarHBondContact O-N 3.21Å; N215-H236 PolarHBondContact O-N 3.01Å; N215-H236 PolarHBondContact OD1-ND1 3.31Å; N215-E237 PolarHBondContact O-N 3.09Å
216	Y	98.2	Very high	95.1	Very high	39 Å²	39	47 Å²	47	15%	0.153	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	123.8	-174.6	-178.4	-82.9	0	0	0	110.9	H190 C191 I192 E193 L214 R218 E237 H239	H190-Y216 PolarHBondContact O-N 3.28Å; C191-Y216 WeakPolarHBondContact CA-O 3.46Å; C191-Y216 HydrophobicContact CB-CD1 4.36Å; C191-Y216 VanDerWaalsContact SG-CD1 3.51Å; I192-Y216 PolarHBondContact N-O 3.15Å; E193-Y216 HydrophobicContact CG-CE1 4.07Å; L214-Y216 WeakPolarHBondContact CD2-O 3.31Å; L214-Y216 WeakPolarHBondContact CG-O 3.33Å; Y216-R218 HydrophobicContact CE1-CB 3.71Å; Y216-R218 WeakPolarHBondContact OH-CD 3.28Å; Y216-E237 HydrophobicContact CD2-CB 3.71Å; Y216-E237 HydrophobicContact CD2-CG 4.39Å; Y216-E237 VanDerWaalsContact CD2-OE2 3.29Å; Y216-E237 WeakPolarHBondContact CD2-OE2 3.29Å; Y216-E237 HydrophobicContact CE2-CB 4.29Å; Y216-E237 WeakPolarHBondContact CE2-OE2 3.45Å; Y216-H239 AromaticContact CE2-CD2 3.53Å; Y216-H239 AromaticContact CE2-NE2 3.66Å; Y216-H239 AromaticContact CZ-CD2 3.77Å
217	L	98.2	Very high	95.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	124.4	173.5	-180	58.6	0	0	0	110.8	I192 M194 L214 I219 L231 L235 E237 L238 H239	I192-L217 HydrophobicContact CB-CD1 3.93Å; I192-L217 HydrophobicContact CG2-CD1 3.97Å; M194-L217 HydrophobicContact SD-CD1 4.33Å; L214-L217 HydrophobicContact CD2-CB 3.76Å; L214-L217 HydrophobicContact CD2-CD1 4.07Å; L214-L217 HydrophobicContact CD2-CD2 4.47Å; L214-L217 HydrophobicContact CD2-CG 4.31Å; L217-I219 HydrophobicContact CD1-CD1 4.33Å; L217-I219 HydrophobicContact CD1-CG1 4Å; L217-I219 HydrophobicContact CD2-CD1 4.15Å; L217-I219 HydrophobicContact CD2-CG1 4.45Å; L217-I219 HydrophobicContact CG-CD1 4.27Å; L217-I219 HydrophobicContact CG-CG1 4.02Å; L217-L231 HydrophobicContact CD2-CD1 4.11Å; L217-L231 HydrophobicContact CD2-CD2 3.89Å; L217-L231 HydrophobicContact CD2-CG 4.4Å; L217-L235 HydrophobicContact CB-CD1 4.44Å; L217-L235 HydrophobicContact CB-CD2 3.59Å; L217-L235 HydrophobicContact CD2-CD1 4.24Å; L217-E237 PolarHBondContact N-O 2.85Å; L217-L238 HydrophobicContact CB-CD1 4.34Å; L217-L238 HydrophobicContact CD2-CD1 4.26Å; L217-L238 HydrophobicContact CG-CD1 4.34Å; L217-H239 PolarHBondContact O-N 2.84Å
218	R	98.4	Very high	95.6	Very high	64 Å²	64	41 Å²	41	24%	0.242	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	119.4	172.4	-174.2	161.2	-171	-158.7	-2	111.9	I192 E193 M194 Y216 H239 D241	I192-R218 PolarHBondContact O-N 3.25Å; E193-R218 HydrophobicContact CG-CB 4.44Å; M194-R218 PolarHBondContact N-O 3.48Å; Y216-R218 HydrophobicContact CE1-CB 3.71Å; Y216-R218 WeakPolarHBondContact OH-CD 3.28Å; R218-H239 WeakPolarHBondContact CA-O 3.3Å; R218-H239 HydrophobicContact CB-CB 3.93Å; R218-H239 HydrophobicContact CG-CB 3.64Å; R218-D241 IonicContact CZ-OD1 3.79Å; R218-D241 IonicContact CZ-OD2 3.49Å; R218-D241 IonicContact NE-OD1 3.79Å; R218-D241 PolarHBondContact NE-OD1 3.27Å; R218-D241 IonicContact NE-OD2 3.77Å; R218-D241 IonicContact NH2-OD1 3.45Å; R218-D241 IonicContact NH2-OD2 3.91Å; R218-D241 PolarHBondContact NH2-OD2 3.16Å
219	I	97.4	Very high	95.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.231	C	C	.	.			trans	-122.3	61.1	174.3	-41.9	-178	0	0	0	107.8	M194 F204 L217 A222 L224 H239 L240 N243	M194-I219 HydrophobicContact CG-CB 4.41Å; M194-I219 HydrophobicContact CG-CG1 3.85Å; M194-I219 HydrophobicContact CG-CG2 4.29Å; M194-I219 HydrophobicContact SD-CD1 4.23Å; M194-I219 HydrophobicContact SD-CG1 4.18Å; F204-I219 HydrophobicContact CE1-CD1 4.26Å; F204-I219 HydrophobicContact CZ-CD1 3.82Å; L217-I219 HydrophobicContact CD1-CD1 4.33Å; L217-I219 HydrophobicContact CD1-CG1 4Å; L217-I219 HydrophobicContact CD2-CD1 4.15Å; L217-I219 HydrophobicContact CD2-CG1 4.45Å; L217-I219 HydrophobicContact CG-CD1 4.27Å; L217-I219 HydrophobicContact CG-CG1 4.02Å; I219-A222 HydrophobicContact CG2-CB 4.08Å; I219-L224 HydrophobicContact CB-CD1 4.31Å; I219-L224 HydrophobicContact CG2-CD1 3.98Å; I219-H239 PolarHBondContact N-O 3.38Å; I219-L240 HydrophobicContact CB-CD2 3.95Å; I219-L240 HydrophobicContact CD1-CD2 4.42Å; I219-L240 HydrophobicContact CG1-CD2 4.31Å; I219-N243 PolarHBondContact O-ND2 3.27Å
220	S	96.9	Very high	95.4	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.007	25%	0.254	C	S	.	.			trans	-81.3	161.3	178.6	62.8	0	0	0	0	112.4	G195 A196 A222 D241	G195-S220 CarbonylContact C-O 3.57Å; G195-S220 VanDerWaalsContact C-O 3.28Å; G195-S220 WeakPolarHBondContact CA-O 3.19Å; A196-S220 PolarHBondContact N-O 3.07Å; S220-A222 PolarHBondContact O-N 2.85Å; S220-D241 CarbonylContact C-O 3.18Å; S220-D241 WeakPolarHBondContact CA-O 3.35Å; S220-D241 WeakPolarHBondContact CB-O 3.47Å; S220-D241 WeakPolarHBondContact CB-OD2 3.29Å
221	E	96.4	Very high	95.6	Very high	99 Å²	99	41.9 Å²	41.9	46%	0.463	22%	0.222	S	C	.	.	S	Bend	trans	55.6	32.6	170	-61.9	173.1	-106.7	0	0	113.6	H171 A196 D241 H242	H171-E221 IonicContact CE1-OE1 3.83Å; H171-E221 IonicContact NE2-OE1 2.67Å; A196-E221 WeakPolarHBondContact CA-O 3.46Å; A196-E221 HydrophobicContact CB-CB 4.1Å; E221-D241 PolarHBondContact N-O 3.24Å; E221-H242 WeakPolarHBondContact CA-O 3.37Å; E221-H242 HydrophobicContact CB-CB 4.38Å; E221-H242 HydrophobicContact CG-CB 3.52Å; E221-H242 PolarHBondContact N-O 3.21Å; E221-H242 VanDerWaalsContact N-O 3.09Å
222	A	96.3	Very high	95.9	Very high	7 Å²	7	39 Å²	39	6%	0.058	19%	0.19	C	C	.	.	S	Bend	trans	-103.1	-161.9	177.2	0	0	0	0	0	110.5	N197 I219 S220 L224 N243	N197-A222 VanDerWaalsContact O-CA 3.31Å; N197-A222 WeakPolarHBondContact O-CA 3.49Å; N197-A222 VanDerWaalsContact O-CB 3.3Å; N197-A222 WeakPolarHBondContact O-CB 3.09Å; I219-A222 HydrophobicContact CG2-CB 4.08Å; S220-A222 PolarHBondContact O-N 2.85Å; A222-L224 HydrophobicContact CB-CG 4.29Å; A222-N243 WeakPolarHBondContact CA-OD1 3.26Å; A222-N243 VanDerWaalsContact CB-OD1 3.28Å; A222-N243 WeakPolarHBondContact CB-OD1 3.46Å; A222-N243 PolarHBondContact N-OD1 3.3Å; A222-N243 PolarHBondContact O-OD1 2.9Å
223	K	97	Very high	95.9	Very high	96 Å²	96	43.2 Å²	43.2	42%	0.417	21%	0.213	S	C	.	.			trans	-116.7	37	179.2	-61.2	-171.7	175.9	-170.3	0	111	I199 Q200	I199-K223 CarbonylContact O-C 3.27Å; I199-K223 VanDerWaalsContact O-CA 3.31Å; I199-K223 WeakPolarHBondContact O-CA 3.41Å; I199-K223 WeakPolarHBondContact O-CB 3.24Å; I199-K223 PolarHBondContact O-N 3.04Å; Q200-K223 HydrophobicContact CG-CB 3.8Å
224	L	97.9	Very high	96	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.191	C	C	.	.			trans	-74.3	129.7	178.3	-55	-178	0	0	0	110	N201 F204 I219 A222 P228 L240 N243 Q244 I245	N201-L224 WeakPolarHBondContact OD1-CA 3.35Å; F204-L224 HydrophobicContact CE2-CD2 3.63Å; F204-L224 HydrophobicContact CZ-CD2 4.26Å; I219-L224 HydrophobicContact CB-CD1 4.31Å; I219-L224 HydrophobicContact CG2-CD1 3.98Å; A222-L224 HydrophobicContact CB-CG 4.29Å; L224-P228 HydrophobicContact CD1-CG 4.28Å; L224-L240 HydrophobicContact CD1-CD2 3.85Å; L224-N243 HydrophobicContact CB-CB 4.11Å; L224-N243 WeakPolarHBondContact CB-OD1 3.34Å; L224-N243 WeakPolarHBondContact CG-OD1 3.19Å; L224-N243 PolarHBondContact N-OD1 3.35Å; L224-Q244 CarbonylContact O-C 3.16Å; L224-Q244 WeakPolarHBondContact O-CA 3.42Å; L224-Q244 WeakPolarHBondContact O-CB 3.48Å; L224-Q244 PolarHBondContact O-N 3.13Å; L224-I245 HydrophobicContact CB-CG1 4.34Å; L224-I245 PolarHBondContact O-N 3.04Å; L224-I245 VanDerWaalsContact O-N 3.16Å
225	T	97.2	Very high	96.1	Very high	70 Å²	70	37.4 Å²	37.4	43%	0.429	19%	0.191	S	C	.	.	S	Bend	trans	-101.5	-12	177	59.3	0	0	0	0	112.9	N201 Q244 I245 Q246	N201-T225 PolarHBondContact OD1-N 3.22Å; N201-T225 PolarHBondContact OD1-OG1 2.99Å; T225-Q244 WeakPolarHBondContact CA-O 3.42Å; T225-I245 WeakPolarHBondContact O-CA 3.42Å; T225-Q246 PolarHBondContact O-N 3.11Å
226	G	97.1	Very high	96.2	Very high	16 Å²	16	37.8 Å²	37.8	17%	0.165	19%	0.191	C	C	.	.	S	Bend	trans	-151.4	166.5	178.1	0	0	0	0	0	111.1	N201 P228	N201-G226 PolarHBondContact ND2-O 3.16Å; N201-G226 PolarHBondContact OD1-N 3.23Å; G226-P228 WeakPolarHBondContact O-CD 3.4Å
227	V	97.1	Very high	96.2	Very high	5 Å²	5	38.1 Å²	38.1	3%	0.03	19%	0.194	C	C	.	.			trans	-71.9	125.4	173.3	179.6	0	0	0	0	108.6	L240 I245 V248 D252 L253 Y256 L264	V227-L240 HydrophobicContact CB-CD1 4.4Å; V227-L240 HydrophobicContact CG1-CD1 3.98Å; V227-L240 HydrophobicContact CG2-CD1 4.24Å; V227-I245 HydrophobicContact CG2-CD1 4.43Å; V227-I245 HydrophobicContact CG2-CG2 4.49Å; V227-V248 HydrophobicContact CG2-CG2 4.27Å; V227-D252 HydrophobicContact CB-CB 4.04Å; V227-D252 HydrophobicContact CG1-CB 4.46Å; V227-L253 HydrophobicContact CG1-CD2 4.16Å; V227-Y256 HydrophobicContact CG1-CE2 4.2Å; V227-L264 HydrophobicContact CG2-CD2 4.22Å
228	P	95.3	Very high	96.2	Very high	10 Å²	10	38.1 Å²	38.1	7%	0.065	19%	0.194	C	C	.	.			trans	-61.6	141.8	175.5	-20.6	32.6	0	0	0	110.6	F204 L224 G226 L231 Y256	F204-P228 HydrophobicContact CD2-CG 4.43Å; F204-P228 HydrophobicContact CE2-CG 4.02Å; L224-P228 HydrophobicContact CD1-CG 4.28Å; G226-P228 WeakPolarHBondContact O-CD 3.4Å; P228-L231 HydrophobicContact CB-CD1 4.19Å; P228-L231 HydrophobicContact CB-CD2 4.01Å; P228-L231 HydrophobicContact CB-CG 3.95Å; P228-L231 HydrophobicContact CG-CD1 4.39Å; P228-L231 HydrophobicContact CG-CD2 4.49Å; P228-Y256 PolarHBondContact O-OH 2.93Å
229	K	92.6	Very high	96.2	Very high	90 Å²	90	36.5 Å²	36.5	39%	0.391	19%	0.189	S	C	.	.	S	Bend	trans	-93.8	-21.2	-176.6	-64.3	-179.2	179.1	-178.6	0	114.2	E249 D252 R255 Y256	K229-E249 IonicContact NZ-OE2 3.93Å; K229-D252 WeakPolarHBondContact CE-OD1 3.2Å; K229-D252 IonicContact NZ-OD1 2.98Å; K229-R255 WeakPolarHBondContact O-CD 3.04Å; K229-Y256 VanDerWaalsContact C-OH 3.32Å; K229-Y256 PolarHBondContact O-OH 3.47Å
230	D	90.6	Very high	96.3	Very high	102 Å²	102	36.5 Å²	36.5	55%	0.545	19%	0.189	S	C	.	.	S	Bend	trans	-107.1	30.5	-171.2	-67.9	-32.7	0	0	0	113.9
231	L	94.5	Very high	96.3	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.01	19%	0.192	C	C	.	.	S	Bend	trans	-76.8	164.3	172.5	-51.7	173.4	0	0	0	110.9	F209 L217 P228 D233 L235 L238 Y256	F209-L231 HydrophobicContact CD2-CD2 3.98Å; F209-L231 HydrophobicContact CE2-CD2 3.58Å; F209-L231 HydrophobicContact CZ-CD2 3.94Å; L217-L231 HydrophobicContact CD2-CD1 4.11Å; L217-L231 HydrophobicContact CD2-CD2 3.89Å; L217-L231 HydrophobicContact CD2-CG 4.4Å; P228-L231 HydrophobicContact CB-CD1 4.19Å; P228-L231 HydrophobicContact CB-CD2 4.01Å; P228-L231 HydrophobicContact CB-CG 3.95Å; P228-L231 HydrophobicContact CG-CD1 4.39Å; P228-L231 HydrophobicContact CG-CD2 4.49Å; L231-D233 PolarHBondContact O-N 2.82Å; L231-L235 HydrophobicContact CB-CD1 3.87Å; L231-L235 HydrophobicContact CD1-CD1 4.44Å; L231-L238 HydrophobicContact CD1-CD1 3.74Å; L231-L238 HydrophobicContact CD1-CD2 3.96Å; L231-Y256 HydrophobicContact CB-CE1 3.6Å; L231-Y256 VanDerWaalsContact CB-OH 3.3Å; L231-Y256 WeakPolarHBondContact CB-OH 2.93Å; L231-Y256 HydrophobicContact CG-CE1 4.39Å; L231-Y256 VanDerWaalsContact CG-OH 3.28Å; L231-Y256 WeakPolarHBondContact CG-OH 3.44Å; L231-Y256 PolarHBondContact N-OH 2.99Å
232	P	94.1	Very high	96.4	Very high	7 Å²	7	36 Å²	36	5%	0.045	19%	0.187	C	C	.	.			trans	-57.3	137	176.4	-24.8	34.9	0	0	0	113	F209 L212 L214 S234 L235	F209-P232 HydrophobicContact CB-CG 4.03Å; F209-P232 HydrophobicContact CD1-CG 4.5Å; L212-P232 HydrophobicContact CB-CG 4.3Å; L212-P232 HydrophobicContact CD2-CG 4.01Å; L212-P232 HydrophobicContact CG-CG 4.23Å; L214-P232 HydrophobicContact CB-CB 4.49Å; L214-P232 HydrophobicContact CB-CG 4.34Å; P232-S234 VanDerWaalsContact C-N 3.27Å; P232-S234 PolarHBondContact O-N 2.98Å; P232-L235 HydrophobicContact CB-CG 4.33Å; P232-L235 WeakPolarHBondContact O-CD1 3.44Å; P232-L235 VanDerWaalsContact O-CG 3.24Å; P232-L235 WeakPolarHBondContact O-CG 3.43Å
233	D	93.8	Very high	96.5	Very high	96 Å²	96	36 Å²	36	51%	0.513	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-12.6	177.2	60.4	-5.9	0	0	0	113.8	L231 L235 N258	L231-D233 PolarHBondContact O-N 2.82Å; D233-L235 PolarHBondContact O-N 3.01Å; D233-N258 PolarHBondContact O-ND2 2.93Å
234	S	95.6	Very high	96.6	Very high	24 Å²	24	35.7 Å²	35.7	17%	0.168	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-3.3	174.5	45.7	0	0	0	0	114.1	K213 L214 P232 H236	K213-S234 WeakPolarHBondContact CA-OG 3.17Å; L214-S234 PolarHBondContact N-OG 3.3Å; L214-S234 CarbonylContact O-C 3.09Å; L214-S234 VanDerWaalsContact O-O 3.12Å; L214-S234 PolarHBondContact O-OG 3.11Å; P232-S234 VanDerWaalsContact C-N 3.27Å; P232-S234 PolarHBondContact O-N 2.98Å; S234-H236 PolarHBondContact O-CE1 3.18Å; S234-H236 PolarHBondContact O-N 3.08Å; S234-H236 PolarHBondContact O-ND1 3.35Å
235	L	97.2	Very high	96.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.186	C	C	.	.			trans	-62.5	133.8	-177.9	-74.5	171.3	0	0	0	112.3	L214 L217 L231 P232 D233 L238 N258 L259	L214-L235 HydrophobicContact CB-CD2 4.26Å; L214-L235 HydrophobicContact CD2-CD2 4.09Å; L214-L235 HydrophobicContact CG-CD2 4.09Å; L214-L235 VanDerWaalsContact O-CA 3.31Å; L214-L235 WeakPolarHBondContact O-CA 3.48Å; L214-L235 PolarHBondContact O-N 3.21Å; L217-L235 HydrophobicContact CB-CD1 4.44Å; L217-L235 HydrophobicContact CB-CD2 3.59Å; L217-L235 HydrophobicContact CD2-CD1 4.24Å; L231-L235 HydrophobicContact CB-CD1 3.87Å; L231-L235 HydrophobicContact CD1-CD1 4.44Å; P232-L235 HydrophobicContact CB-CG 4.33Å; P232-L235 WeakPolarHBondContact O-CD1 3.44Å; P232-L235 VanDerWaalsContact O-CG 3.24Å; P232-L235 WeakPolarHBondContact O-CG 3.43Å; D233-L235 PolarHBondContact O-N 3.01Å; L235-L238 HydrophobicContact CD1-CD1 4.43Å; L235-N258 CarbonylContact O-C 3.32Å; L235-N258 VanDerWaalsContact O-C 3.32Å; L235-L259 HydrophobicContact CB-CD2 3.87Å; L235-L259 PolarHBondContact O-N 3.4Å
236	H	98	Very high	96.6	Very high	66 Å²	66	37.9 Å²	37.9	31%	0.306	19%	0.191	S	C	.	.	S	Bend	trans	-106.3	-31	170.7	-67	82.5	0	0	0	111.1	N215 S234 H260 R261	N215-H236 PolarHBondContact O-N 3.01Å; N215-H236 PolarHBondContact OD1-ND1 3.31Å; S234-H236 PolarHBondContact O-CE1 3.18Å; S234-H236 PolarHBondContact O-N 3.08Å; S234-H236 PolarHBondContact O-ND1 3.35Å; H236-H260 AromaticContact CD2-CE1 3.83Å; H236-H260 PolarHBondContact O-N 3.27Å; H236-R261 PolarHBondContact O-N 3.22Å; H236-R261 VanDerWaalsContact O-N 3.12Å
237	E	98.6	Very high	96.6	Very high	46 Å²	46	38.3 Å²	38.3	22%	0.215	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	123.9	179.6	-57.6	-169.9	-170.5	0	0	110.4	N215 Y216 L217 H239 R261	N215-E237 PolarHBondContact O-N 3.09Å; Y216-E237 HydrophobicContact CD2-CB 3.71Å; Y216-E237 HydrophobicContact CD2-CG 4.39Å; Y216-E237 VanDerWaalsContact CD2-OE2 3.29Å; Y216-E237 WeakPolarHBondContact CD2-OE2 3.29Å; Y216-E237 HydrophobicContact CE2-CB 4.29Å; Y216-E237 WeakPolarHBondContact CE2-OE2 3.45Å; L217-E237 PolarHBondContact N-O 2.85Å; E237-H239 IonicContact OE2-NE2 2.83Å; E237-R261 HydrophobicContact CB-CB 4.36Å; E237-R261 HydrophobicContact CG-CB 4.02Å; E237-R261 HydrophobicContact CG-CG 4.16Å; E237-R261 IonicContact OE1-CZ 3.72Å; E237-R261 IonicContact OE1-NH1 3.56Å; E237-R261 PolarHBondContact OE1-NH1 2.66Å
238	L	98.6	Very high	96.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	117.7	177.9	177.1	59.8	0	0	0	109.7	L217 L231 L235 L240 Y256 L259 R261 L262 G263	L217-L238 HydrophobicContact CB-CD1 4.34Å; L217-L238 HydrophobicContact CD2-CD1 4.26Å; L217-L238 HydrophobicContact CG-CD1 4.34Å; L231-L238 HydrophobicContact CD1-CD1 3.74Å; L231-L238 HydrophobicContact CD1-CD2 3.96Å; L235-L238 HydrophobicContact CD1-CD1 4.43Å; L238-L240 HydrophobicContact CD1-CD1 4.5Å; L238-L240 HydrophobicContact CD1-CD2 3.97Å; L238-L240 HydrophobicContact CD1-CG 4.05Å; L238-L240 HydrophobicContact CD2-CD1 4.22Å; L238-L240 HydrophobicContact CG-CD1 4.32Å; L238-L240 HydrophobicContact CG-CG 4.09Å; L238-Y256 HydrophobicContact CD2-CD2 4.25Å; L238-Y256 HydrophobicContact CD2-CE2 4.25Å; L238-L259 HydrophobicContact CB-CD1 4.17Å; L238-L259 HydrophobicContact CB-CD2 3.78Å; L238-L259 HydrophobicContact CD2-CD1 4.39Å; L238-R261 PolarHBondContact N-O 3.41Å; L238-L262 HydrophobicContact CB-CD1 4.28Å; L238-L262 HydrophobicContact CD2-CD1 4.17Å; L238-L262 HydrophobicContact CG-CD1 4.24Å; L238-L262 WeakPolarHBondContact O-CA 3.26Å; L238-G263 PolarHBondContact O-N 3.11Å
239	H	98.6	Very high	96.7	Very high	30 Å²	30	42.5 Å²	42.5	14%	0.139	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	113.8	179.2	-67.4	-88.3	0	0	0	110.1	Y216 L217 R218 I219 E237	Y216-H239 AromaticContact CE2-CD2 3.53Å; Y216-H239 AromaticContact CE2-NE2 3.66Å; Y216-H239 AromaticContact CZ-CD2 3.77Å; L217-H239 PolarHBondContact O-N 2.84Å; R218-H239 WeakPolarHBondContact CA-O 3.3Å; R218-H239 HydrophobicContact CB-CB 3.93Å; R218-H239 HydrophobicContact CG-CB 3.64Å; I219-H239 PolarHBondContact N-O 3.38Å; E237-H239 IonicContact OE2-NE2 2.83Å
240	L	98.4	Very high	96.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.209	C	C	.	.			trans	-120.9	28.1	176.5	-57.2	177	0	0	0	110.2	I219 L224 V227 L238 N243 I245 G263 L264 N267	I219-L240 HydrophobicContact CB-CD2 3.95Å; I219-L240 HydrophobicContact CD1-CD2 4.42Å; I219-L240 HydrophobicContact CG1-CD2 4.31Å; L224-L240 HydrophobicContact CD1-CD2 3.85Å; V227-L240 HydrophobicContact CB-CD1 4.4Å; V227-L240 HydrophobicContact CG1-CD1 3.98Å; V227-L240 HydrophobicContact CG2-CD1 4.24Å; L238-L240 HydrophobicContact CD1-CD1 4.5Å; L238-L240 HydrophobicContact CD1-CD2 3.97Å; L238-L240 HydrophobicContact CD1-CG 4.05Å; L238-L240 HydrophobicContact CD2-CD1 4.22Å; L238-L240 HydrophobicContact CG-CD1 4.32Å; L238-L240 HydrophobicContact CG-CG 4.09Å; L240-N243 PolarHBondContact O-ND2 3.49Å; L240-I245 HydrophobicContact CB-CD1 3.89Å; L240-I245 HydrophobicContact CD1-CD1 4.15Å; L240-G263 CarbonylContact C-O 3.59Å; L240-G263 PolarHBondContact N-O 2.87Å; L240-L264 HydrophobicContact CB-CD2 4.05Å; L240-L264 HydrophobicContact CD1-CD2 4.23Å; L240-N267 PolarHBondContact O-ND2 2.77Å
241	D	97.9	Very high	97.1	Very high	14 Å²	14	42.3 Å²	42.3	8%	0.075	21%	0.211	C	C	.	.			trans	-62.9	155.2	179.4	58.3	-77.2	0	0	0	112.3	R218 S220 E221 N243 G265	R218-D241 IonicContact CZ-OD1 3.79Å; R218-D241 IonicContact CZ-OD2 3.49Å; R218-D241 IonicContact NE-OD1 3.79Å; R218-D241 PolarHBondContact NE-OD1 3.27Å; R218-D241 IonicContact NE-OD2 3.77Å; R218-D241 IonicContact NH2-OD1 3.45Å; R218-D241 IonicContact NH2-OD2 3.91Å; R218-D241 PolarHBondContact NH2-OD2 3.16Å; S220-D241 CarbonylContact C-O 3.18Å; S220-D241 WeakPolarHBondContact CA-O 3.35Å; S220-D241 WeakPolarHBondContact CB-O 3.47Å; S220-D241 WeakPolarHBondContact CB-OD2 3.29Å; E221-D241 PolarHBondContact N-O 3.24Å; D241-N243 PolarHBondContact O-N 3.23Å; D241-N243 PolarHBondContact O-ND2 3.02Å; D241-G265 CarbonylContact C-O 3.33Å; D241-G265 WeakPolarHBondContact CA-O 3.35Å
242	H	98.3	Very high	97.2	Very high	76 Å²	76	42.6 Å²	42.6	35%	0.352	21%	0.212	S	C	.	.	S	Bend	trans	58.2	43.6	178.5	-59.8	85.5	0	0	0	113.4	E221 G265 F266	E221-H242 WeakPolarHBondContact CA-O 3.37Å; E221-H242 HydrophobicContact CB-CB 4.38Å; E221-H242 HydrophobicContact CG-CB 3.52Å; E221-H242 PolarHBondContact N-O 3.21Å; E221-H242 VanDerWaalsContact N-O 3.09Å; H242-G265 PolarHBondContact N-O 3.33Å; H242-F266 CarbonylContact C-O 3.49Å; H242-F266 WeakPolarHBondContact CA-O 3.16Å; H242-F266 HydrophobicContact CB-CB 4.39Å; H242-F266 AromaticContact CD2-CG 3.73Å; H242-F266 AromaticContact CE1-CD2 3.49Å; H242-F266 VanDerWaalsContact CE1-CD2 3.49Å; H242-F266 WeakPolarHBondContact CE1-CD2 3.27Å; H242-F266 AromaticContact CE1-CG 3.7Å; H242-F266 PolarHBondContact N-O 2.91Å; H242-F266 AromaticContact NE2-CD1 3.65Å; H242-F266 AromaticContact NE2-CD2 3.59Å; H242-F266 AromaticContact NE2-CG 3.37Å; H242-F266 WeakPolarHBondContact NE2-CG 3.37Å
243	N	98.6	Very high	97.3	Very high	6 Å²	6	42.3 Å²	42.3	3%	0.032	21%	0.21	C	C	.	.	S	Bend	trans	-115.6	-166.9	174.7	-83.4	-76.5	0	0	0	110.8	I219 A222 L224 L240 D241 I245 F266 N267	I219-N243 PolarHBondContact O-ND2 3.27Å; A222-N243 WeakPolarHBondContact CA-OD1 3.26Å; A222-N243 VanDerWaalsContact CB-OD1 3.28Å; A222-N243 WeakPolarHBondContact CB-OD1 3.46Å; A222-N243 PolarHBondContact N-OD1 3.3Å; A222-N243 PolarHBondContact O-OD1 2.9Å; L224-N243 HydrophobicContact CB-CB 4.11Å; L224-N243 WeakPolarHBondContact CB-OD1 3.34Å; L224-N243 WeakPolarHBondContact CG-OD1 3.19Å; L224-N243 PolarHBondContact N-OD1 3.35Å; L240-N243 PolarHBondContact O-ND2 3.49Å; D241-N243 PolarHBondContact O-N 3.23Å; D241-N243 PolarHBondContact O-ND2 3.02Å; N243-I245 HydrophobicContact CB-CD1 4.26Å; N243-I245 HydrophobicContact CB-CG1 4.14Å; N243-F266 PolarHBondContact N-O 2.81Å; N243-N267 VanDerWaalsContact CA-OD1 3.26Å; N243-N267 WeakPolarHBondContact CA-OD1 3.38Å; N243-N267 WeakPolarHBondContact CB-OD1 3.41Å; N243-N267 PolarHBondContact N-OD1 3.17Å; N243-N267 PolarHBondContact O-OD1 2.97Å
244	Q	98.1	Very high	97.4	Very high	89 Å²	89	39.6 Å²	39.6	42%	0.416	20%	0.199	S	C	.	.			trans	-115.2	28.5	-179.7	-58.9	173.6	13.5	0	0	110.8	L224 T225 Q246 N267	L224-Q244 CarbonylContact O-C 3.16Å; L224-Q244 WeakPolarHBondContact O-CA 3.42Å; L224-Q244 WeakPolarHBondContact O-CB 3.48Å; L224-Q244 PolarHBondContact O-N 3.13Å; T225-Q244 WeakPolarHBondContact CA-O 3.42Å; Q244-Q246 PolarHBondContact O-N 3.01Å; Q244-N267 PolarHBondContact N-OD1 2.84Å
245	I	98.5	Very high	97.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.214	C	C	.	.			trans	-65.3	126.1	-176.1	-62.4	165.9	0	0	0	109.1	L224 T225 V227 L240 N243 A247 L264 N267 H268 I269	L224-I245 HydrophobicContact CB-CG1 4.34Å; L224-I245 PolarHBondContact O-N 3.04Å; L224-I245 VanDerWaalsContact O-N 3.16Å; T225-I245 WeakPolarHBondContact O-CA 3.42Å; V227-I245 HydrophobicContact CG2-CD1 4.43Å; V227-I245 HydrophobicContact CG2-CG2 4.49Å; L240-I245 HydrophobicContact CB-CD1 3.89Å; L240-I245 HydrophobicContact CD1-CD1 4.15Å; N243-I245 HydrophobicContact CB-CD1 4.26Å; N243-I245 HydrophobicContact CB-CG1 4.14Å; I245-A247 WeakPolarHBondContact CG2-O 3.49Å; I245-L264 HydrophobicContact CD1-CD2 3.84Å; I245-N267 HydrophobicContact CB-CB 4.29Å; I245-N267 VanDerWaalsContact CB-OD1 3.27Å; I245-N267 WeakPolarHBondContact CB-OD1 3.35Å; I245-N267 WeakPolarHBondContact CG1-OD1 3.42Å; I245-N267 PolarHBondContact N-OD1 3.25Å; I245-H268 CarbonylContact O-C 2.98Å; I245-H268 VanDerWaalsContact O-CA 3.26Å; I245-H268 WeakPolarHBondContact O-CA 3.21Å; I245-H268 PolarHBondContact O-N 3.39Å; I245-I269 HydrophobicContact CB-CG1 4.3Å; I245-I269 HydrophobicContact CG2-CD1 4.34Å; I245-I269 HydrophobicContact CG2-CG1 3.98Å; I245-I269 WeakPolarHBondContact O-CG1 3.43Å; I245-I269 PolarHBondContact O-N 2.93Å; I245-I269 VanDerWaalsContact O-N 3.07Å
246	Q	97	Very high	97.3	Very high	116 Å²	116	44.7 Å²	44.7	54%	0.542	21%	0.214	S	C	.	.			trans	-96.8	-30.6	-172.8	-61.8	-178.9	30.2	0	0	113.8	T225 Q244 I269 L270	T225-Q246 PolarHBondContact O-N 3.11Å; Q244-Q246 PolarHBondContact O-N 3.01Å; Q246-I269 CarbonylContact O-C 3.57Å; Q246-I269 VanDerWaalsContact O-CA 3.31Å; Q246-I269 WeakPolarHBondContact O-CA 3.34Å; Q246-L270 PolarHBondContact O-N 2.94Å
247	A	97.3	Very high	97.2	Very high	25 Å²	25	47.6 Å²	47.6	21%	0.207	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	162.1	179.9	0	0	0	0	0	109.8	I245 N271	I245-A247 WeakPolarHBondContact CG2-O 3.49Å; A247-N271 WeakPolarHBondContact CA-O 3.36Å; A247-N271 WeakPolarHBondContact CB-OD1 3.2Å
248	V	98	Very high	97.1	Very high	1 Å²	1	49 Å²	49	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	111.2	165.9	-179.8	0	0	0	0	107.4	V227 D252 L253 L264 I269 N271 I272 E273	V227-V248 HydrophobicContact CG2-CG2 4.27Å; V248-D252 HydrophobicContact CG1-CB 4.25Å; V248-L253 HydrophobicContact CG1-CD1 3.74Å; V248-L253 HydrophobicContact CG1-CG 4.1Å; V248-L264 HydrophobicContact CG2-CD1 4.09Å; V248-I269 HydrophobicContact CG2-CD1 4.3Å; V248-N271 PolarHBondContact N-O 3.05Å; V248-I272 HydrophobicContact CB-CB 4.5Å; V248-I272 HydrophobicContact CB-CG1 4.19Å; V248-I272 HydrophobicContact CB-CG2 4.24Å; V248-I272 HydrophobicContact CG1-CG2 4.49Å; V248-I272 HydrophobicContact CG2-CG1 4.25Å; V248-E273 WeakPolarHBondContact O-CB 3.23Å; V248-E273 PolarHBondContact O-N 3.06Å
249	E	97.2	Very high	97.1	Very high	102 Å²	102	49 Å²	49	48%	0.477	24%	0.235	S	C	.	.			trans	-82.2	166.5	-179	-58.7	-179.7	168.8	0	0	111.3	K229 E251 D252 S276	K229-E249 IonicContact NZ-OE2 3.93Å; E249-E251 VanDerWaalsContact C-N 3.34Å; E249-E251 PolarHBondContact O-N 2.95Å; E249-D252 PolarHBondContact N-OD2 2.94Å; E249-D252 PolarHBondContact O-N 3.45Å; E249-S276 WeakPolarHBondContact O-CB 3.21Å
250	L	95.6	Very high	97.1	Very high	66 Å²	66	50 Å²	50	35%	0.346	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	-48.1	-177.3	-177	60.3	0	0	0	113.4	E273 F279	L250-E273 HydrophobicContact CB-CG 4.47Å; L250-E273 PolarHBondContact N-OE2 2.88Å; L250-F279 HydrophobicContact CD1-CE2 4.14Å; L250-F279 HydrophobicContact CG-CE2 4.42Å; L250-F279 WeakPolarHBondContact O-CD2 3.34Å; L250-F279 WeakPolarHBondContact O-CE2 3.24Å
251	E	95.4	Very high	97.1	Very high	123 Å²	123	54.1 Å²	54.1	58%	0.575	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-8.4	-171.7	-63.5	-175.3	172.5	0	0	114.3	E249 L253 S254	E249-E251 VanDerWaalsContact C-N 3.34Å; E249-E251 PolarHBondContact O-N 2.95Å; E251-L253 PolarHBondContact O-N 2.86Å; E251-L253 VanDerWaalsContact O-N 3.09Å; E251-S254 VanDerWaalsContact O-CB 3.28Å; E251-S254 WeakPolarHBondContact O-CB 3.31Å; E251-S254 PolarHBondContact O-N 3.44Å; E251-S254 VanDerWaalsContact O-N 3.08Å; E251-S254 PolarHBondContact O-OG 2.82Å
252	D	96.4	Very high	97.1	Very high	8 Å²	8	53.6 Å²	53.6	4%	0.043	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-32	-174.5	-81.3	-5.7	0	0	0	113.2	V227 K229 V248 E249 Y256	V227-D252 HydrophobicContact CB-CB 4.04Å; V227-D252 HydrophobicContact CG1-CB 4.46Å; K229-D252 WeakPolarHBondContact CE-OD1 3.2Å; K229-D252 IonicContact NZ-OD1 2.98Å; V248-D252 HydrophobicContact CG1-CB 4.25Å; E249-D252 PolarHBondContact N-OD2 2.94Å; E249-D252 PolarHBondContact O-N 3.45Å; D252-Y256 WeakPolarHBondContact O-CE2 3.16Å
253	L	96.8	Very high	97.1	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	3	-175	-60.8	171.7	0	0	0	113.1	V227 V248 E251 R255 Y256 L262 L277 L280	V227-L253 HydrophobicContact CG1-CD2 4.16Å; V248-L253 HydrophobicContact CG1-CD1 3.74Å; V248-L253 HydrophobicContact CG1-CG 4.1Å; E251-L253 PolarHBondContact O-N 2.86Å; E251-L253 VanDerWaalsContact O-N 3.09Å; L253-R255 PolarHBondContact O-N 2.79Å; L253-R255 VanDerWaalsContact O-N 3.09Å; L253-Y256 HydrophobicContact CD2-CD2 3.99Å; L253-Y256 HydrophobicContact CD2-CE2 4.5Å; L253-Y256 PolarHBondContact O-N 3.1Å; L253-Y256 VanDerWaalsContact O-N 3.11Å; L253-L262 HydrophobicContact CD1-CD2 4.27Å; L253-L262 HydrophobicContact CD2-CD2 4.08Å; L253-L277 HydrophobicContact CD1-CD2 4.03Å; L253-L280 HydrophobicContact CB-CD2 4.17Å; L253-L280 HydrophobicContact CB-CG 4.34Å; L253-L280 HydrophobicContact CD1-CD1 3.88Å; L253-L280 HydrophobicContact CD1-CG 4.44Å; L253-L280 HydrophobicContact CD2-CD1 4.49Å
254	S	95.9	Very high	97.1	Very high	39 Å²	39	49.9 Å²	49.9	27%	0.273	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-27.6	-169.7	60.9	0	0	0	0	114.9	E251 K257	E251-S254 VanDerWaalsContact O-CB 3.28Å; E251-S254 WeakPolarHBondContact O-CB 3.31Å; E251-S254 PolarHBondContact O-N 3.44Å; E251-S254 VanDerWaalsContact O-N 3.08Å; E251-S254 PolarHBondContact O-OG 2.82Å; S254-K257 WeakPolarHBondContact O-CE 3.15Å
255	R	94.4	Very high	97.1	Very high	132 Å²	132	45.8 Å²	45.8	50%	0.498	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-18.9	-178.6	-59.8	-169.2	118.6	-132.9	0.6	113.8	K229 L253 K257	K229-R255 WeakPolarHBondContact O-CD 3.04Å; L253-R255 PolarHBondContact O-N 2.79Å; L253-R255 VanDerWaalsContact O-N 3.09Å; R255-K257 VanDerWaalsContact C-N 3.29Å; R255-K257 PolarHBondContact O-N 3.41Å; R255-K257 VanDerWaalsContact O-N 3.07Å
256	Y	95.8	Very high	97.1	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.236	C	C	.	.			trans	-92.6	47.8	-166.6	-49.9	-43	0	0	0	113.8	V227 P228 K229 L231 L238 D252 L253 N258 L259 L280	V227-Y256 HydrophobicContact CG1-CE2 4.2Å; P228-Y256 PolarHBondContact O-OH 2.93Å; K229-Y256 VanDerWaalsContact C-OH 3.32Å; K229-Y256 PolarHBondContact O-OH 3.47Å; L231-Y256 HydrophobicContact CB-CE1 3.6Å; L231-Y256 VanDerWaalsContact CB-OH 3.3Å; L231-Y256 WeakPolarHBondContact CB-OH 2.93Å; L231-Y256 HydrophobicContact CG-CE1 4.39Å; L231-Y256 VanDerWaalsContact CG-OH 3.28Å; L231-Y256 WeakPolarHBondContact CG-OH 3.44Å; L231-Y256 PolarHBondContact N-OH 2.99Å; L238-Y256 HydrophobicContact CD2-CD2 4.25Å; L238-Y256 HydrophobicContact CD2-CE2 4.25Å; D252-Y256 WeakPolarHBondContact O-CE2 3.16Å; L253-Y256 HydrophobicContact CD2-CD2 3.99Å; L253-Y256 HydrophobicContact CD2-CE2 4.5Å; L253-Y256 PolarHBondContact O-N 3.1Å; L253-Y256 VanDerWaalsContact O-N 3.11Å; Y256-N258 PolarHBondContact O-N 3.25Å; Y256-N258 VanDerWaalsContact O-N 3.13Å; Y256-L259 HydrophobicContact CD2-CD1 4.36Å; Y256-L259 HydrophobicContact CG-CD1 4.11Å; Y256-L259 PolarHBondContact O-N 3.27Å; Y256-L280 WeakPolarHBondContact O-CD2 3.47Å
257	K	95.6	Very high	97.2	Very high	126 Å²	126	44.8 Å²	44.8	55%	0.548	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-21.6	-169	-60.5	178.6	-177.3	177.1	0	114.4	S254 R255	S254-K257 WeakPolarHBondContact O-CE 3.15Å; R255-K257 VanDerWaalsContact C-N 3.29Å; R255-K257 PolarHBondContact O-N 3.41Å; R255-K257 VanDerWaalsContact O-N 3.07Å
258	N	96.7	Very high	97.3	Very high	76 Å²	76	47.2 Å²	47.2	41%	0.406	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	4.4	-176.9	-58.6	-51.7	0	0	0	113.5	D233 L235 Y256 H260	D233-N258 PolarHBondContact O-ND2 2.93Å; L235-N258 CarbonylContact O-C 3.32Å; L235-N258 VanDerWaalsContact O-C 3.32Å; Y256-N258 PolarHBondContact O-N 3.25Å; Y256-N258 VanDerWaalsContact O-N 3.13Å; N258-H260 PolarHBondContact O-CD2 2.84Å; N258-H260 PolarHBondContact O-N 3.16Å
259	L	98.1	Very high	97.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.218	C	C	.	.			trans	-64.6	133.7	-178.8	-76.1	177.9	0	0	0	112.2	L235 L238 Y256 L280 M282 L283	L235-L259 HydrophobicContact CB-CD2 3.87Å; L235-L259 PolarHBondContact O-N 3.4Å; L238-L259 HydrophobicContact CB-CD1 4.17Å; L238-L259 HydrophobicContact CB-CD2 3.78Å; L238-L259 HydrophobicContact CD2-CD1 4.39Å; Y256-L259 HydrophobicContact CD2-CD1 4.36Å; Y256-L259 HydrophobicContact CG-CD1 4.11Å; Y256-L259 PolarHBondContact O-N 3.27Å; L259-L280 HydrophobicContact CB-CD2 4.34Å; L259-L280 HydrophobicContact CD1-CD2 4.02Å; L259-M282 CarbonylContact O-C 3.24Å; L259-M282 VanDerWaalsContact O-C 3.24Å; L259-L283 HydrophobicContact CB-CD1 3.93Å; L259-L283 VanDerWaalsContact O-CA 3.3Å; L259-L283 WeakPolarHBondContact O-CA 3.36Å; L259-L283 PolarHBondContact O-N 2.85Å
260	H	98.2	Very high	97.3	Very high	51 Å²	51	46.9 Å²	46.9	24%	0.236	22%	0.219	C	C	.	.	S	Bend	trans	-103.9	-33.7	169.7	-65.5	174	0	0	0	111.5	H236 N258 R284 E285	H236-H260 AromaticContact CD2-CE1 3.83Å; H236-H260 PolarHBondContact O-N 3.27Å; N258-H260 PolarHBondContact O-CD2 2.84Å; N258-H260 PolarHBondContact O-N 3.16Å; H260-R284 WeakPolarHBondContact O-CA 3.33Å; H260-R284 PolarHBondContact O-N 2.92Å; H260-E285 PolarHBondContact O-N 3.43Å
261	R	98.8	Very high	97.2	Very high	87 Å²	87	48.2 Å²	48.2	33%	0.328	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	130.7	179	-56.9	-171.8	166.3	97.1	6.6	111.4	H236 E237 L238 E285	H236-R261 PolarHBondContact O-N 3.22Å; H236-R261 VanDerWaalsContact O-N 3.12Å; E237-R261 HydrophobicContact CB-CB 4.36Å; E237-R261 HydrophobicContact CG-CB 4.02Å; E237-R261 HydrophobicContact CG-CG 4.16Å; E237-R261 IonicContact OE1-CZ 3.72Å; E237-R261 IonicContact OE1-NH1 3.56Å; E237-R261 PolarHBondContact OE1-NH1 2.66Å; L238-R261 PolarHBondContact N-O 3.41Å; R261-E285 WeakPolarHBondContact CA-O 3.43Å; R261-E285 WeakPolarHBondContact CD-OE2 3.47Å; R261-E285 HydrophobicContact CG-CB 4.13Å; R261-E285 HydrophobicContact CG-CG 4.38Å; R261-E285 IonicContact CZ-OE1 3.57Å; R261-E285 IonicContact CZ-OE2 3.7Å; R261-E285 IonicContact NE-OE1 2.79Å; R261-E285 PolarHBondContact NE-OE1 3.47Å; R261-E285 IonicContact NE-OE2 3.8Å; R261-E285 PolarHBondContact NE-OE2 3Å; R261-E285 IonicContact NH2-OE1 3.53Å; R261-E285 PolarHBondContact NH2-OE1 3.05Å
262	L	98.7	Very high	97.4	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	110.7	173.9	179	58.4	0	0	0	109.7	L238 L253 L264 L280 L283 E285 L286 H287	L238-L262 HydrophobicContact CB-CD1 4.28Å; L238-L262 HydrophobicContact CD2-CD1 4.17Å; L238-L262 HydrophobicContact CG-CD1 4.24Å; L238-L262 WeakPolarHBondContact O-CA 3.26Å; L253-L262 HydrophobicContact CD1-CD2 4.27Å; L253-L262 HydrophobicContact CD2-CD2 4.08Å; L262-L264 HydrophobicContact CD1-CD1 4.28Å; L262-L264 HydrophobicContact CD1-CG 4.11Å; L262-L264 HydrophobicContact CD2-CD1 3.84Å; L262-L264 HydrophobicContact CG-CD1 3.94Å; L262-L264 HydrophobicContact CG-CG 4.07Å; L262-L280 HydrophobicContact CD2-CD1 3.8Å; L262-L283 HydrophobicContact CB-CD1 3.89Å; L262-L283 HydrophobicContact CB-CD2 4.32Å; L262-E285 PolarHBondContact N-O 3.29Å; L262-L286 HydrophobicContact CB-CD1 4.06Å; L262-L286 HydrophobicContact CD2-CD1 3.91Å; L262-L286 HydrophobicContact CG-CD1 4.07Å; L262-H287 PolarHBondContact O-N 3.29Å
263	G	98.7	Very high	97.4	Very high	2 Å²	2	47 Å²	47	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	112.8	175.4	0	0	0	0	0	111.5	L238 L240	L238-G263 PolarHBondContact O-N 3.11Å; L240-G263 CarbonylContact C-O 3.59Å; L240-G263 PolarHBondContact N-O 2.87Å
264	L	98.6	Very high	97.3	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	25%	0.245	C	C	.	.			trans	-127.2	15.7	175.8	-72	168.5	0	0	0	111.7	V227 L240 I245 V248 L262 N267 I269 H287 L288 N291	V227-L264 HydrophobicContact CG2-CD2 4.22Å; L240-L264 HydrophobicContact CB-CD2 4.05Å; L240-L264 HydrophobicContact CD1-CD2 4.23Å; I245-L264 HydrophobicContact CD1-CD2 3.84Å; V248-L264 HydrophobicContact CG2-CD1 4.09Å; L262-L264 HydrophobicContact CD1-CD1 4.28Å; L262-L264 HydrophobicContact CD1-CG 4.11Å; L262-L264 HydrophobicContact CD2-CD1 3.84Å; L262-L264 HydrophobicContact CG-CD1 3.94Å; L262-L264 HydrophobicContact CG-CG 4.07Å; L264-N267 PolarHBondContact O-ND2 3.36Å; L264-I269 HydrophobicContact CB-CD1 3.91Å; L264-I269 HydrophobicContact CD1-CD1 4.29Å; L264-I269 HydrophobicContact CD2-CD1 4.4Å; L264-I269 HydrophobicContact CG-CD1 4.45Å; L264-H287 CarbonylContact C-O 3.54Å; L264-H287 WeakPolarHBondContact CA-O 3.31Å; L264-H287 WeakPolarHBondContact CB-O 3.46Å; L264-H287 PolarHBondContact N-O 3.25Å; L264-L288 HydrophobicContact CB-CD2 3.75Å; L264-L288 HydrophobicContact CD1-CD2 3.92Å; L264-N291 PolarHBondContact O-ND2 3.36Å
265	G	98.4	Very high	97.3	Very high	3 Å²	3	51 Å²	51	3%	0.031	25%	0.247	C	C	.	.			trans	-60.6	157.3	178.6	0	0	0	0	0	112.8	D241 H242 N267 H287 D289	D241-G265 CarbonylContact C-O 3.33Å; D241-G265 WeakPolarHBondContact CA-O 3.35Å; H242-G265 PolarHBondContact N-O 3.33Å; G265-N267 PolarHBondContact O-N 2.83Å; G265-N267 PolarHBondContact O-ND2 2.9Å; G265-N267 VanDerWaalsContact O-ND2 3.11Å; G265-H287 PolarHBondContact N-O 2.94Å; G265-D289 CarbonylContact C-O 3.2Å; G265-D289 WeakPolarHBondContact CA-O 3.41Å
266	F	98.6	Very high	97.4	Very high	91 Å²	91	44.8 Å²	44.8	40%	0.399	22%	0.223	S	C	.	.	S	Bend	trans	54.1	53.9	178.5	-63.6	-94.5	0	0	0	112.7	H242 N243 D289 N290	H242-F266 CarbonylContact C-O 3.49Å; H242-F266 WeakPolarHBondContact CA-O 3.16Å; H242-F266 HydrophobicContact CB-CB 4.39Å; H242-F266 AromaticContact CD2-CG 3.73Å; H242-F266 AromaticContact CE1-CD2 3.49Å; H242-F266 VanDerWaalsContact CE1-CD2 3.49Å; H242-F266 WeakPolarHBondContact CE1-CD2 3.27Å; H242-F266 AromaticContact CE1-CG 3.7Å; H242-F266 PolarHBondContact N-O 2.91Å; H242-F266 AromaticContact NE2-CD1 3.65Å; H242-F266 AromaticContact NE2-CD2 3.59Å; H242-F266 AromaticContact NE2-CG 3.37Å; H242-F266 WeakPolarHBondContact NE2-CG 3.37Å; N243-F266 PolarHBondContact N-O 2.81Å; F266-D289 PolarHBondContact N-O 3.13Å; F266-N290 CarbonylContact C-O 3.55Å; F266-N290 VanDerWaalsContact CA-O 3.23Å; F266-N290 WeakPolarHBondContact CA-O 3.26Å; F266-N290 HydrophobicContact CB-CB 4.3Å; F266-N290 HydrophobicContact CD1-CB 3.66Å; F266-N290 HydrophobicContact CD2-CB 4.01Å; F266-N290 HydrophobicContact CE1-CB 3.91Å; F266-N290 VanDerWaalsContact CE1-CG 3.5Å; F266-N290 HydrophobicContact CE2-CB 4.22Å; F266-N290 WeakPolarHBondContact CE2-ND2 3.43Å; F266-N290 HydrophobicContact CG-CB 3.72Å; F266-N290 HydrophobicContact CZ-CB 4.18Å; F266-N290 VanDerWaalsContact CZ-ND2 3.27Å; F266-N290 WeakPolarHBondContact CZ-ND2 3.32Å; F266-N290 PolarHBondContact N-O 2.9Å
267	N	98.8	Very high	97.5	Very high	5 Å²	5	45 Å²	45	3%	0.027	22%	0.224	C	C	.	.	S	Bend	trans	-124.9	-165.1	176.7	-88.6	-80.4	0	0	0	110.4	L240 N243 Q244 I245 L264 G265 I269 N290 N291	L240-N267 PolarHBondContact O-ND2 2.77Å; N243-N267 VanDerWaalsContact CA-OD1 3.26Å; N243-N267 WeakPolarHBondContact CA-OD1 3.38Å; N243-N267 WeakPolarHBondContact CB-OD1 3.41Å; N243-N267 PolarHBondContact N-OD1 3.17Å; N243-N267 PolarHBondContact O-OD1 2.97Å; Q244-N267 PolarHBondContact N-OD1 2.84Å; I245-N267 HydrophobicContact CB-CB 4.29Å; I245-N267 VanDerWaalsContact CB-OD1 3.27Å; I245-N267 WeakPolarHBondContact CB-OD1 3.35Å; I245-N267 WeakPolarHBondContact CG1-OD1 3.42Å; I245-N267 PolarHBondContact N-OD1 3.25Å; L264-N267 PolarHBondContact O-ND2 3.36Å; G265-N267 PolarHBondContact O-N 2.83Å; G265-N267 PolarHBondContact O-ND2 2.9Å; G265-N267 VanDerWaalsContact O-ND2 3.11Å; N267-I269 HydrophobicContact CB-CD1 4.16Å; N267-I269 HydrophobicContact CB-CG1 4Å; N267-N290 PolarHBondContact N-O 2.98Å; N267-N290 VanDerWaalsContact N-O 3.13Å; N267-N291 WeakPolarHBondContact CA-OD1 3.07Å; N267-N291 WeakPolarHBondContact CB-OD1 3.08Å; N267-N291 PolarHBondContact O-OD1 3.18Å
268	H	98.2	Very high	97.5	Very high	76 Å²	76	43 Å²	43	35%	0.352	23%	0.227	S	C	.	.			trans	-118.8	31.8	177	-61.6	-26.6	0	0	0	111.4	I245 L270 N291	I245-H268 CarbonylContact O-C 2.98Å; I245-H268 VanDerWaalsContact O-CA 3.26Å; I245-H268 WeakPolarHBondContact O-CA 3.21Å; I245-H268 PolarHBondContact O-N 3.39Å; H268-L270 WeakPolarHBondContact O-CD1 3.31Å; H268-L270 PolarHBondContact O-N 3Å; H268-N291 PolarHBondContact N-OD1 3.46Å
269	I	98.6	Very high	97.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.222	C	C	.	.			trans	-69.4	114.9	-172.1	-59.3	167.8	0	0	0	109.4	I245 Q246 V248 L264 N267 I272 L288 N291 R292 L293	I245-I269 HydrophobicContact CB-CG1 4.3Å; I245-I269 HydrophobicContact CG2-CD1 4.34Å; I245-I269 HydrophobicContact CG2-CG1 3.98Å; I245-I269 WeakPolarHBondContact O-CG1 3.43Å; I245-I269 PolarHBondContact O-N 2.93Å; I245-I269 VanDerWaalsContact O-N 3.07Å; Q246-I269 CarbonylContact O-C 3.57Å; Q246-I269 VanDerWaalsContact O-CA 3.31Å; Q246-I269 WeakPolarHBondContact O-CA 3.34Å; V248-I269 HydrophobicContact CG2-CD1 4.3Å; L264-I269 HydrophobicContact CB-CD1 3.91Å; L264-I269 HydrophobicContact CD1-CD1 4.29Å; L264-I269 HydrophobicContact CD2-CD1 4.4Å; L264-I269 HydrophobicContact CG-CD1 4.45Å; N267-I269 HydrophobicContact CB-CD1 4.16Å; N267-I269 HydrophobicContact CB-CG1 4Å; I269-I272 HydrophobicContact CG2-CG1 3.97Å; I269-L288 HydrophobicContact CD1-CD2 3.97Å; I269-N291 HydrophobicContact CB-CB 4.34Å; I269-N291 VanDerWaalsContact CB-OD1 3.25Å; I269-N291 WeakPolarHBondContact CB-OD1 3.44Å; I269-N291 VanDerWaalsContact CG1-OD1 3.27Å; I269-N291 WeakPolarHBondContact CG1-OD1 3.35Å; I269-N291 PolarHBondContact N-OD1 3.19Å; I269-R292 CarbonylContact O-C 3.13Å; I269-R292 VanDerWaalsContact O-CA 3.31Å; I269-R292 WeakPolarHBondContact O-CA 3.47Å; I269-R292 PolarHBondContact O-N 3.43Å; I269-L293 HydrophobicContact CB-CD2 4.49Å; I269-L293 HydrophobicContact CG2-CD2 3.78Å; I269-L293 PolarHBondContact O-N 2.92Å
270	L	97.2	Very high	97.5	Very high	96 Å²	96	42.8 Å²	42.8	50%	0.503	22%	0.222	S	C	.	.			trans	-84	-40.7	173.7	-83.6	95.1	0	0	0	111.8	Q246 H268 R292	Q246-L270 PolarHBondContact O-N 2.94Å; H268-L270 WeakPolarHBondContact O-CD1 3.31Å; H268-L270 PolarHBondContact O-N 3Å; L270-R292 HydrophobicContact CG-CB 4.31Å
271	N	94.5	Very high	97.3	Very high	93 Å²	93	43.8 Å²	43.8	50%	0.497	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	147.2	-175	62.4	-44.4	0	0	0	111.8	A247 V248	A247-N271 WeakPolarHBondContact CA-O 3.36Å; A247-N271 WeakPolarHBondContact CB-OD1 3.2Å; V248-N271 PolarHBondContact N-O 3.05Å
272	I	97.8	Very high	97.2	Very high	17 Å²	17	42.8 Å²	42.8	9%	0.087	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	121.4	167.5	-62.4	-177.5	0	0	0	106.1	V248 I269 S276 L277 L288 L293 P297	V248-I272 HydrophobicContact CB-CB 4.5Å; V248-I272 HydrophobicContact CB-CG1 4.19Å; V248-I272 HydrophobicContact CB-CG2 4.24Å; V248-I272 HydrophobicContact CG1-CG2 4.49Å; V248-I272 HydrophobicContact CG2-CG1 4.25Å; I269-I272 HydrophobicContact CG2-CG1 3.97Å; I272-S276 WeakPolarHBondContact CG2-OG 3.46Å; I272-L277 HydrophobicContact CG2-CD1 4.42Å; I272-L277 HydrophobicContact CG2-CG 4.16Å; I272-L288 HydrophobicContact CD1-CD1 3.39Å; I272-L288 HydrophobicContact CD1-CD2 3.65Å; I272-L288 HydrophobicContact CD1-CG 4.18Å; I272-L293 HydrophobicContact CD1-CD2 4.45Å; I272-L293 HydrophobicContact CG1-CD2 4.16Å; I272-P297 HydrophobicContact CB-CB 4.44Å; I272-P297 HydrophobicContact CD1-CB 4.16Å; I272-P297 HydrophobicContact CD1-CG 3.87Å
273	E	97.3	Very high	97.2	Very high	89 Å²	89	42.7 Å²	42.7	42%	0.416	23%	0.233	S	C	.	.			trans	-66.9	140.9	-177	-168.2	176.5	168	0	0	111.2	V248 L250 G275 S276	V248-E273 WeakPolarHBondContact O-CB 3.23Å; V248-E273 PolarHBondContact O-N 3.06Å; L250-E273 HydrophobicContact CB-CG 4.47Å; L250-E273 PolarHBondContact N-OE2 2.88Å; E273-G275 PolarHBondContact O-N 3.12Å; E273-S276 WeakPolarHBondContact O-CB 3.4Å; E273-S276 PolarHBondContact O-N 2.93Å; E273-S276 PolarHBondContact O-OG 2.76Å
274	N	95.6	Very high	97.2	Very high	93 Å²	93	47.7 Å²	47.7	50%	0.497	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	129.1	-177.6	-56.9	-25.4	0	0	0	110.1	K298	N274-K298 WeakPolarHBondContact OD1-CB 3.24Å; N274-K298 WeakPolarHBondContact OD1-CD 3.45Å
275	G	95.4	Very high	97.2	Very high	30 Å²	30	49.7 Å²	49.7	31%	0.309	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.9	-17.9	-179.2	0	0	0	0	0	114.1	E273 L277 S278	E273-G275 PolarHBondContact O-N 3.12Å; G275-L277 VanDerWaalsContact C-N 3.33Å; G275-L277 PolarHBondContact O-N 3.45Å; G275-S278 VanDerWaalsContact O-CB 3.28Å; G275-S278 WeakPolarHBondContact O-CB 3.3Å; G275-S278 PolarHBondContact O-N 3.42Å; G275-S278 PolarHBondContact O-OG 3.1Å
276	S	97	Very high	97.2	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.007	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-55.7	-45.1	175.5	58.6	0	0	0	0	112.4	E249 I272 E273 S278 F279	E249-S276 WeakPolarHBondContact O-CB 3.21Å; I272-S276 WeakPolarHBondContact CG2-OG 3.46Å; E273-S276 WeakPolarHBondContact O-CB 3.4Å; E273-S276 PolarHBondContact O-N 2.93Å; E273-S276 PolarHBondContact O-OG 2.76Å; S276-S278 PolarHBondContact O-N 3.03Å; S276-F279 WeakPolarHBondContact O-CD2 3.47Å; S276-F279 PolarHBondContact O-N 3.47Å
277	L	97.2	Very high	97.2	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.021	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-70.1	-14.4	178	-61.5	179	0	0	0	114	L253 I272 G275 F279 L280 L286 P297 L300 M303	L253-L277 HydrophobicContact CD1-CD2 4.03Å; I272-L277 HydrophobicContact CG2-CD1 4.42Å; I272-L277 HydrophobicContact CG2-CG 4.16Å; G275-L277 VanDerWaalsContact C-N 3.33Å; G275-L277 PolarHBondContact O-N 3.45Å; L277-F279 PolarHBondContact O-N 3.03Å; L277-L280 HydrophobicContact CD2-CD1 4.42Å; L277-L280 PolarHBondContact O-N 3.26Å; L277-L286 HydrophobicContact CD1-CD2 4.09Å; L277-L286 HydrophobicContact CD2-CD2 4.3Å; L277-P297 HydrophobicContact CD1-CB 3.96Å; L277-L300 HydrophobicContact CD1-CD2 3.98Å; L277-M303 HydrophobicContact CB-SD 4.13Å; L277-M303 HydrophobicContact CD1-SD 4.36Å
278	S	95.9	Very high	97.2	Very high	86 Å²	86	47.3 Å²	47.3	60%	0.601	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-70.2	-20	179.9	75.8	0	0	0	0	112.9	G275 S276 L280	G275-S278 VanDerWaalsContact O-CB 3.28Å; G275-S278 WeakPolarHBondContact O-CB 3.3Å; G275-S278 PolarHBondContact O-N 3.42Å; G275-S278 PolarHBondContact O-OG 3.1Å; S276-S278 PolarHBondContact O-N 3.03Å; S278-L280 PolarHBondContact O-N 2.96Å
279	F	96.9	Very high	97.2	Very high	68 Å²	68	44.3 Å²	44.3	30%	0.298	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-72.5	-7.3	173.9	-65.7	-68.8	0	0	0	113.6	L250 S276 L277 P281	L250-F279 HydrophobicContact CD1-CE2 4.14Å; L250-F279 HydrophobicContact CG-CE2 4.42Å; L250-F279 WeakPolarHBondContact O-CD2 3.34Å; L250-F279 WeakPolarHBondContact O-CE2 3.24Å; S276-F279 WeakPolarHBondContact O-CD2 3.47Å; S276-F279 PolarHBondContact O-N 3.47Å; L277-F279 PolarHBondContact O-N 3.03Å; F279-P281 WeakPolarHBondContact O-CD 3.3Å
280	L	97.2	Very high	97.2	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	25%	0.247	C	C	.	.			trans	-110.6	66.2	-177.7	-51.9	-177.3	0	0	0	111.5	L253 Y256 L259 L262 L277 S278 M282 L283	L253-L280 HydrophobicContact CB-CD2 4.17Å; L253-L280 HydrophobicContact CB-CG 4.34Å; L253-L280 HydrophobicContact CD1-CD1 3.88Å; L253-L280 HydrophobicContact CD1-CG 4.44Å; L253-L280 HydrophobicContact CD2-CD1 4.49Å; Y256-L280 WeakPolarHBondContact O-CD2 3.47Å; L259-L280 HydrophobicContact CB-CD2 4.34Å; L259-L280 HydrophobicContact CD1-CD2 4.02Å; L262-L280 HydrophobicContact CD2-CD1 3.8Å; L277-L280 HydrophobicContact CD2-CD1 4.42Å; L277-L280 PolarHBondContact O-N 3.26Å; S278-L280 PolarHBondContact O-N 2.96Å; L280-M282 PolarHBondContact O-N 3.49Å; L280-L283 HydrophobicContact CB-CB 4.03Å; L280-L283 HydrophobicContact CD1-CD1 4.31Å; L280-L283 HydrophobicContact CD1-CD2 4.02Å; L280-L283 PolarHBondContact O-N 3.36Å
281	P	95.3	Very high	97.3	Very high	72 Å²	72	42.4 Å²	42.4	47%	0.468	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-24.2	-171.6	27.8	-36.1	0	0	0	113.4	F279 Y305	F279-P281 WeakPolarHBondContact O-CD 3.3Å; P281-Y305 VanDerWaalsContact O-CD2 3.31Å; P281-Y305 WeakPolarHBondContact O-CD2 3.25Å
282	M	96.3	Very high	97.4	Very high	66 Å²	66	44.6 Å²	44.6	33%	0.325	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	3.1	-174.9	-60.9	-59.9	-71.6	0	0	113.8	L259 L280 R284 Y305	L259-M282 CarbonylContact O-C 3.24Å; L259-M282 VanDerWaalsContact O-C 3.24Å; L280-M282 PolarHBondContact O-N 3.49Å; M282-R284 PolarHBondContact O-N 2.86Å; M282-Y305 HydrophobicContact CE-CE2 4.41Å; M282-Y305 HydrophobicContact SD-CD2 4.04Å; M282-Y305 HydrophobicContact SD-CE2 3.72Å
283	L	98.1	Very high	97.5	Very high	1 Å²	1	44 Å²	44	1%	0.005	22%	0.224	C	C	.	.			trans	-65.3	134.5	-173.6	-159.7	75.2	0	0	0	111.4	L259 L262 L280 L286 M303 Y305 L306	L259-L283 HydrophobicContact CB-CD1 3.93Å; L259-L283 VanDerWaalsContact O-CA 3.3Å; L259-L283 WeakPolarHBondContact O-CA 3.36Å; L259-L283 PolarHBondContact O-N 2.85Å; L262-L283 HydrophobicContact CB-CD1 3.89Å; L262-L283 HydrophobicContact CB-CD2 4.32Å; L280-L283 HydrophobicContact CB-CB 4.03Å; L280-L283 HydrophobicContact CD1-CD1 4.31Å; L280-L283 HydrophobicContact CD1-CD2 4.02Å; L280-L283 PolarHBondContact O-N 3.36Å; L283-L286 HydrophobicContact CD2-CB 3.93Å; L283-L286 HydrophobicContact CD2-CD1 4.18Å; L283-L286 HydrophobicContact CD2-CG 4.45Å; L283-M303 HydrophobicContact CB-CE 3.65Å; L283-M303 HydrophobicContact CD2-CE 3.58Å; L283-M303 HydrophobicContact CG-CE 4.21Å; L283-Y305 CarbonylContact O-C 3.22Å; L283-Y305 VanDerWaalsContact O-C 3.22Å; L283-L306 HydrophobicContact CD2-CD1 4.3Å; L283-L306 HydrophobicContact CG-CD1 4.5Å; L283-L306 WeakPolarHBondContact O-CA 3.06Å; L283-L306 PolarHBondContact O-N 3.09Å
284	R	98.1	Very high	97.4	Very high	106 Å²	106	42.7 Å²	42.7	40%	0.4	22%	0.222	S	C	.	.			trans	-112.9	-38	-179.1	-59.9	-174.7	-179.3	-160.6	-0.4	112.3	H260 M282 Y305 Q307 V308	H260-R284 WeakPolarHBondContact O-CA 3.33Å; H260-R284 PolarHBondContact O-N 2.92Å; M282-R284 PolarHBondContact O-N 2.86Å; R284-Y305 WeakPolarHBondContact CA-O 3.42Å; R284-Q307 PolarHBondContact O-N 3.13Å; R284-V308 PolarHBondContact O-N 3.15Å
285	E	98.6	Very high	97.5	Very high	45 Å²	45	45.6 Å²	45.6	21%	0.21	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	127	-176.7	-55	175.4	-157.3	0	0	110	H260 R261 L262 V308	H260-E285 PolarHBondContact O-N 3.43Å; R261-E285 WeakPolarHBondContact CA-O 3.43Å; R261-E285 WeakPolarHBondContact CD-OE2 3.47Å; R261-E285 HydrophobicContact CG-CB 4.13Å; R261-E285 HydrophobicContact CG-CG 4.38Å; R261-E285 IonicContact CZ-OE1 3.57Å; R261-E285 IonicContact CZ-OE2 3.7Å; R261-E285 IonicContact NE-OE1 2.79Å; R261-E285 PolarHBondContact NE-OE1 3.47Å; R261-E285 IonicContact NE-OE2 3.8Å; R261-E285 PolarHBondContact NE-OE2 3Å; R261-E285 IonicContact NH2-OE1 3.53Å; R261-E285 PolarHBondContact NH2-OE1 3.05Å; L262-E285 PolarHBondContact N-O 3.29Å; E285-V308 WeakPolarHBondContact CA-O 3.38Å; E285-V308 HydrophobicContact CB-CB 4.3Å; E285-V308 HydrophobicContact CG-CB 4.03Å; E285-V308 HydrophobicContact CG-CG2 4.22Å
286	L	98.6	Very high	97.6	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	110.4	178.9	178.1	59.4	0	0	0	109.6	L262 L277 L283 L288 L300 L306 V308 V309 Y310	L262-L286 HydrophobicContact CB-CD1 4.06Å; L262-L286 HydrophobicContact CD2-CD1 3.91Å; L262-L286 HydrophobicContact CG-CD1 4.07Å; L277-L286 HydrophobicContact CD1-CD2 4.09Å; L277-L286 HydrophobicContact CD2-CD2 4.3Å; L283-L286 HydrophobicContact CD2-CB 3.93Å; L283-L286 HydrophobicContact CD2-CD1 4.18Å; L283-L286 HydrophobicContact CD2-CG 4.45Å; L286-L288 HydrophobicContact CD1-CD1 4.08Å; L286-L288 HydrophobicContact CD1-CG 4.05Å; L286-L288 HydrophobicContact CD2-CD1 3.72Å; L286-L288 HydrophobicContact CG-CD1 3.79Å; L286-L288 HydrophobicContact CG-CG 4.05Å; L286-L300 HydrophobicContact CD2-CD2 3.98Å; L286-L306 HydrophobicContact CB-CD1 4.04Å; L286-V308 PolarHBondContact N-O 3.34Å; L286-V309 WeakPolarHBondContact O-CA 3.23Å; L286-Y310 PolarHBondContact O-N 3.21Å
287	H	98.7	Very high	97.6	Very high	48 Å²	48	44.7 Å²	44.7	22%	0.222	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116.7	177.7	-57.2	-176.8	0	0	0	109.2	L262 L264 G265 Y310	L262-H287 PolarHBondContact O-N 3.29Å; L264-H287 CarbonylContact C-O 3.54Å; L264-H287 WeakPolarHBondContact CA-O 3.31Å; L264-H287 WeakPolarHBondContact CB-O 3.46Å; L264-H287 PolarHBondContact N-O 3.25Å; G265-H287 PolarHBondContact N-O 2.94Å; H287-Y310 HydrophobicContact CB-CD2 4.42Å; H287-Y310 AromaticContact CD2-CD2 3.43Å; H287-Y310 VanDerWaalsContact CD2-CD2 3.43Å; H287-Y310 WeakPolarHBondContact CD2-CD2 3.28Å; H287-Y310 AromaticContact CD2-CE2 3.87Å; H287-Y310 AromaticContact CE1-CD2 3.88Å; H287-Y310 AromaticContact CE1-CE2 3.77Å; H287-Y310 AromaticContact CG-CD2 3.72Å; H287-Y310 AromaticContact ND1-CD2 3.97Å; H287-Y310 AromaticContact NE2-CD2 3.57Å; H287-Y310 AromaticContact NE2-CE2 3.48Å; H287-Y310 WeakPolarHBondContact NE2-CE2 3.3Å
288	L	98.6	Very high	97.5	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.238	C	C	.	.			trans	-131.5	17.4	-179.9	-77.4	169	0	0	0	111	L264 I269 I272 L286 N291 L293 P297 Y310 L311 N314	L264-L288 HydrophobicContact CB-CD2 3.75Å; L264-L288 HydrophobicContact CD1-CD2 3.92Å; I269-L288 HydrophobicContact CD1-CD2 3.97Å; I272-L288 HydrophobicContact CD1-CD1 3.39Å; I272-L288 HydrophobicContact CD1-CD2 3.65Å; I272-L288 HydrophobicContact CD1-CG 4.18Å; L286-L288 HydrophobicContact CD1-CD1 4.08Å; L286-L288 HydrophobicContact CD1-CG 4.05Å; L286-L288 HydrophobicContact CD2-CD1 3.72Å; L286-L288 HydrophobicContact CG-CD1 3.79Å; L286-L288 HydrophobicContact CG-CG 4.05Å; L288-N291 PolarHBondContact O-ND2 2.98Å; L288-L293 HydrophobicContact CB-CD1 4.02Å; L288-L293 HydrophobicContact CD1-CD1 4.3Å; L288-P297 HydrophobicContact CD1-CG 3.74Å; L288-Y310 CarbonylContact C-O 3.25Å; L288-Y310 VanDerWaalsContact C-O 3.27Å; L288-Y310 VanDerWaalsContact CA-O 3.32Å; L288-Y310 WeakPolarHBondContact CA-O 3.37Å; L288-Y310 WeakPolarHBondContact CB-O 3.09Å; L288-Y310 PolarHBondContact N-O 3.28Å; L288-L311 HydrophobicContact CB-CD2 3.84Å; L288-L311 HydrophobicContact CD1-CD2 4.16Å; L288-N314 PolarHBondContact O-ND2 3.14Å
289	D	98.4	Very high	97.4	Very high	13 Å²	13	47 Å²	47	7%	0.07	22%	0.221	C	C	.	.			trans	-63.8	162.1	176.5	60.4	-77.6	0	0	0	112.1	G265 F266 N291 Y310 H312	G265-D289 CarbonylContact C-O 3.2Å; G265-D289 WeakPolarHBondContact CA-O 3.41Å; F266-D289 PolarHBondContact N-O 3.13Å; D289-N291 VanDerWaalsContact C-N 3.35Å; D289-N291 PolarHBondContact O-N 3.44Å; D289-N291 PolarHBondContact O-ND2 3.49Å; D289-Y310 PolarHBondContact N-O 3.46Å; D289-Y310 VanDerWaalsContact N-O 3.16Å; D289-H312 CarbonylContact C-O 3.47Å; D289-H312 WeakPolarHBondContact CA-O 3.43Å; D289-H312 VanDerWaalsContact CB-CE1 3.46Å; D289-H312 WeakPolarHBondContact CB-CE1 3.25Å; D289-H312 WeakPolarHBondContact CB-NE2 3.42Å; D289-H312 IonicContact OD2-CE1 3.92Å; D289-H312 IonicContact OD2-NE2 3.72Å
290	N	98.5	Very high	97.3	Very high	44 Å²	44	43.8 Å²	43.8	24%	0.235	21%	0.207	C	C	.	.	S	Bend	trans	53.5	51.3	176.7	-66.8	-81.3	0	0	0	112.4	F266 N267 H312 S313	F266-N290 CarbonylContact C-O 3.55Å; F266-N290 VanDerWaalsContact CA-O 3.23Å; F266-N290 WeakPolarHBondContact CA-O 3.26Å; F266-N290 HydrophobicContact CB-CB 4.3Å; F266-N290 HydrophobicContact CD1-CB 3.66Å; F266-N290 HydrophobicContact CD2-CB 4.01Å; F266-N290 HydrophobicContact CE1-CB 3.91Å; F266-N290 VanDerWaalsContact CE1-CG 3.5Å; F266-N290 HydrophobicContact CE2-CB 4.22Å; F266-N290 WeakPolarHBondContact CE2-ND2 3.43Å; F266-N290 HydrophobicContact CG-CB 3.72Å; F266-N290 HydrophobicContact CZ-CB 4.18Å; F266-N290 VanDerWaalsContact CZ-ND2 3.27Å; F266-N290 WeakPolarHBondContact CZ-ND2 3.32Å; F266-N290 PolarHBondContact N-O 2.9Å; N267-N290 PolarHBondContact N-O 2.98Å; N267-N290 VanDerWaalsContact N-O 3.13Å; N290-H312 PolarHBondContact N-O 2.75Å; N290-H312 PolarHBondContact ND2-CE1 3.34Å; N290-S313 WeakPolarHBondContact CA-O 3.27Å; N290-S313 PolarHBondContact N-O 3.22Å; N290-S313 WeakPolarHBondContact OD1-CB 3.31Å
291	N	98.8	Very high	97.2	Very high	12 Å²	12	44.6 Å²	44.6	6%	0.064	21%	0.212	C	C	.	.	S	Bend	trans	-130.6	-168.3	-179.8	-88.7	-75.3	0	0	0	110.4	L264 N267 H268 I269 L288 D289 L293 S313 N314	L264-N291 PolarHBondContact O-ND2 3.36Å; N267-N291 WeakPolarHBondContact CA-OD1 3.07Å; N267-N291 WeakPolarHBondContact CB-OD1 3.08Å; N267-N291 PolarHBondContact O-OD1 3.18Å; H268-N291 PolarHBondContact N-OD1 3.46Å; I269-N291 HydrophobicContact CB-CB 4.34Å; I269-N291 VanDerWaalsContact CB-OD1 3.25Å; I269-N291 WeakPolarHBondContact CB-OD1 3.44Å; I269-N291 VanDerWaalsContact CG1-OD1 3.27Å; I269-N291 WeakPolarHBondContact CG1-OD1 3.35Å; I269-N291 PolarHBondContact N-OD1 3.19Å; L288-N291 PolarHBondContact O-ND2 2.98Å; D289-N291 VanDerWaalsContact C-N 3.35Å; D289-N291 PolarHBondContact O-N 3.44Å; D289-N291 PolarHBondContact O-ND2 3.49Å; N291-L293 HydrophobicContact CB-CG 4.38Å; N291-S313 PolarHBondContact N-O 2.91Å; N291-N314 WeakPolarHBondContact CA-OD1 3.47Å; N291-N314 WeakPolarHBondContact CB-OD1 3.31Å; N291-N314 PolarHBondContact O-OD1 3.28Å
292	R	98.3	Very high	97.1	Very high	139 Å²	139	46.4 Å²	46.4	53%	0.525	22%	0.218	S	C	.	.			trans	-116.4	25.8	-178.8	-56.9	-177.1	-172.2	-133.2	3.6	112	I269 L270 T294 N314	I269-R292 CarbonylContact O-C 3.13Å; I269-R292 VanDerWaalsContact O-CA 3.31Å; I269-R292 WeakPolarHBondContact O-CA 3.47Å; I269-R292 PolarHBondContact O-N 3.43Å; L270-R292 HydrophobicContact CG-CB 4.31Å; R292-T294 PolarHBondContact O-N 2.98Å; R292-N314 PolarHBondContact N-OD1 3.13Å
293	L	98.3	Very high	97	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.021	21%	0.205	C	C	.	.			trans	-63.9	133.1	-177.6	-64.3	172.9	0	0	0	110.1	I269 I272 L288 N291 P297 L311 N314 N315 I316	I269-L293 HydrophobicContact CB-CD2 4.49Å; I269-L293 HydrophobicContact CG2-CD2 3.78Å; I269-L293 PolarHBondContact O-N 2.92Å; I272-L293 HydrophobicContact CD1-CD2 4.45Å; I272-L293 HydrophobicContact CG1-CD2 4.16Å; L288-L293 HydrophobicContact CB-CD1 4.02Å; L288-L293 HydrophobicContact CD1-CD1 4.3Å; N291-L293 HydrophobicContact CB-CG 4.38Å; L293-P297 HydrophobicContact CD1-CG 4.34Å; L293-L311 HydrophobicContact CD1-CD2 3.88Å; L293-N314 HydrophobicContact CB-CB 4.37Å; L293-N314 VanDerWaalsContact CB-OD1 3.23Å; L293-N314 WeakPolarHBondContact CB-OD1 3.4Å; L293-N314 WeakPolarHBondContact CG-OD1 3.44Å; L293-N314 PolarHBondContact N-OD1 3.38Å; L293-N315 CarbonylContact O-C 2.97Å; L293-N315 WeakPolarHBondContact O-CA 3.33Å; L293-N315 PolarHBondContact O-N 3.1Å; L293-I316 HydrophobicContact CB-CG1 4.36Å; L293-I316 PolarHBondContact O-N 3.15Å; L293-I316 VanDerWaalsContact O-N 3.13Å
294	T	96.9	Very high	96.7	Very high	62 Å²	62	48.9 Å²	48.9	38%	0.38	23%	0.227	S	C	.	.	S	Bend	trans	-94.4	-12	178.7	54.4	0	0	0	0	113.7	R292 N315	R292-T294 PolarHBondContact O-N 2.98Å; T294-N315 WeakPolarHBondContact CA-O 3.49Å
295	R	96.9	Very high	96.6	Very high	155 Å²	155	48.8 Å²	48.8	59%	0.585	23%	0.227	S	C	*	.	S	Bend	trans	-154.1	160.7	-177.2	63.4	-173.3	69.9	-158.8	2.2	110.3
296	V	97.7	Very high	96.5	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.024	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-61.3	134.4	170.7	-177.7	0	0	0	0	109.6	K298 L300 L311 I316 V319 D323 F324	V296-K298 PolarHBondContact O-N 3.17Å; V296-L300 HydrophobicContact CG1-CD1 3.51Å; V296-L311 HydrophobicContact CG1-CD1 4.05Å; V296-L311 HydrophobicContact CG2-CD1 4.29Å; V296-I316 HydrophobicContact CG2-CD1 4.48Å; V296-I316 HydrophobicContact CG2-CG2 4.43Å; V296-V319 HydrophobicContact CG2-CG1 4.22Å; V296-V319 HydrophobicContact CG2-CG2 4.09Å; V296-D323 HydrophobicContact CB-CB 3.97Å; V296-D323 HydrophobicContact CG1-CB 3.99Å; V296-D323 HydrophobicContact CG2-CB 4.28Å; V296-F324 HydrophobicContact CG1-CE1 3.93Å; V296-F324 HydrophobicContact CG1-CE2 4.49Å; V296-F324 HydrophobicContact CG1-CZ 3.91Å; V296-F324 HydrophobicContact CG2-CE2 4.18Å; V296-F324 HydrophobicContact CG2-CZ 3.9Å
297	P	97.1	Very high	96.4	Very high	7 Å²	7	49 Å²	49	5%	0.045	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-57.2	134.9	178.6	-25.2	33.9	0	0	0	112.1	I272 L277 L288 L293 L300 L311	I272-P297 HydrophobicContact CB-CB 4.44Å; I272-P297 HydrophobicContact CD1-CB 4.16Å; I272-P297 HydrophobicContact CD1-CG 3.87Å; L277-P297 HydrophobicContact CD1-CB 3.96Å; L288-P297 HydrophobicContact CD1-CG 3.74Å; L293-P297 HydrophobicContact CD1-CG 4.34Å; P297-L300 WeakPolarHBondContact O-CG 3.42Å; P297-L311 HydrophobicContact CG-CD2 4.24Å
298	K	94.8	Very high	96.4	Very high	115 Å²	115	47.6 Å²	47.6	50%	0.5	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	144.7	176.3	-65.1	-163.9	-173.6	173.2	0	110.6	N274 V296	N274-K298 WeakPolarHBondContact OD1-CB 3.24Å; N274-K298 WeakPolarHBondContact OD1-CD 3.45Å; V296-K298 PolarHBondContact O-N 3.17Å
299	G	93.3	Very high	96.3	Very high	25 Å²	25	47.6 Å²	47.6	26%	0.258	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	104.2	-13.6	176.2	0	0	0	0	0	114.6	P301 N302	G299-P301 VanDerWaalsContact C-N 3.26Å; G299-N302 WeakPolarHBondContact O-CB 3.36Å; G299-N302 PolarHBondContact O-N 2.89Å
300	L	96	Very high	96.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-50.6	-38.6	172.6	-55.9	-178.3	0	0	0	113.6	L277 L286 V296 P297 N302 M303 L306 V309 F324 R333	L277-L300 HydrophobicContact CD1-CD2 3.98Å; L286-L300 HydrophobicContact CD2-CD2 3.98Å; V296-L300 HydrophobicContact CG1-CD1 3.51Å; P297-L300 WeakPolarHBondContact O-CG 3.42Å; L300-N302 PolarHBondContact O-N 3.07Å; L300-N302 VanDerWaalsContact O-N 3.12Å; L300-M303 HydrophobicContact CD2-SD 3.91Å; L300-M303 PolarHBondContact O-N 2.82Å; L300-M303 VanDerWaalsContact O-N 3.14Å; L300-L306 HydrophobicContact CB-CD2 4.43Å; L300-L306 HydrophobicContact CD2-CD2 3.75Å; L300-V309 HydrophobicContact CD1-CG2 4.25Å; L300-F324 HydrophobicContact CD1-CD1 4.02Å; L300-F324 HydrophobicContact CD1-CE1 4Å; L300-R333 PolarHBondContact O-NH1 3.34Å; L300-R333 PolarHBondContact O-NH2 3.2Å
301	P	93.8	Very high	96.3	Very high	18 Å²	18	48.2 Å²	48.2	12%	0.117	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-56.8	-29.1	176.7	-29.2	39.1	0	0	0	114.4	G299 D322 D323 P326 R333	G299-P301 VanDerWaalsContact C-N 3.26Å; P301-D322 WeakPolarHBondContact CG-O 3.49Å; P301-D323 WeakPolarHBondContact CD-O 3.36Å; P301-P326 HydrophobicContact CB-CB 4.38Å; P301-R333 PolarHBondContact O-NH1 3.41Å
302	N	92.6	Very high	96.3	Very high	110 Å²	110	49.2 Å²	49.2	59%	0.588	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-90.3	-8.4	-174.7	-59.9	-25.8	0	0	0	112.9	G299 L300 K304	G299-N302 WeakPolarHBondContact O-CB 3.36Å; G299-N302 PolarHBondContact O-N 2.89Å; L300-N302 PolarHBondContact O-N 3.07Å; L300-N302 VanDerWaalsContact O-N 3.12Å; N302-K304 PolarHBondContact O-N 2.9Å
303	M	94.1	Very high	96.3	Very high	10 Å²	10	43.5 Å²	43.5	5%	0.049	21%	0.208	C	C	.	.			trans	-84.3	97.9	-177.1	-59.7	-178.9	73.2	0	0	110.5	L277 L283 L300 Y305 L306 R333	L277-M303 HydrophobicContact CB-SD 4.13Å; L277-M303 HydrophobicContact CD1-SD 4.36Å; L283-M303 HydrophobicContact CB-CE 3.65Å; L283-M303 HydrophobicContact CD2-CE 3.58Å; L283-M303 HydrophobicContact CG-CE 4.21Å; L300-M303 HydrophobicContact CD2-SD 3.91Å; L300-M303 PolarHBondContact O-N 2.82Å; L300-M303 VanDerWaalsContact O-N 3.14Å; M303-Y305 VanDerWaalsContact C-N 3.32Å; M303-Y305 PolarHBondContact O-N 3.23Å; M303-L306 HydrophobicContact CB-CB 3.7Å; M303-L306 HydrophobicContact CB-CD2 4.28Å; M303-L306 HydrophobicContact CE-CD1 4.28Å; M303-L306 PolarHBondContact O-N 3.34Å; M303-L306 HydrophobicContact SD-CD2 3.98Å; M303-R333 PolarHBondContact O-NE 3.19Å
304	K	93.2	Very high	96.3	Very high	110 Å²	110	44 Å²	44	48%	0.478	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-30.1	-168.8	-65.1	179.8	-178.4	175.7	0	115.1	N302 R333 T334	N302-K304 PolarHBondContact O-N 2.9Å; K304-R333 WeakPolarHBondContact O-CA 3.47Å; K304-T334 PolarHBondContact O-N 2.99Å; K304-T334 PolarHBondContact O-OG1 3.46Å; K304-T334 VanDerWaalsContact O-OG1 3.13Å
305	Y	95.6	Very high	96.3	Very high	103 Å²	103	45.4 Å²	45.4	40%	0.404	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	2.2	-176.2	-59.6	-74	0	0	0	113.8	P281 M282 L283 R284 M303 Q307 T334	P281-Y305 VanDerWaalsContact O-CD2 3.31Å; P281-Y305 WeakPolarHBondContact O-CD2 3.25Å; M282-Y305 HydrophobicContact CE-CE2 4.41Å; M282-Y305 HydrophobicContact SD-CD2 4.04Å; M282-Y305 HydrophobicContact SD-CE2 3.72Å; L283-Y305 CarbonylContact O-C 3.22Å; L283-Y305 VanDerWaalsContact O-C 3.22Å; R284-Y305 WeakPolarHBondContact CA-O 3.42Å; M303-Y305 VanDerWaalsContact C-N 3.32Å; M303-Y305 PolarHBondContact O-N 3.23Å; Y305-Q307 PolarHBondContact O-N 3.31Å; Y305-T334 VanDerWaalsContact CA-OG1 3.32Å; Y305-T334 WeakPolarHBondContact CA-OG1 3.1Å; Y305-T334 HydrophobicContact CD1-CG2 4.43Å; Y305-T334 PolarHBondContact O-OG1 3.5Å
306	L	96.8	Very high	96.4	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.188	C	C	.	.			trans	-70.1	124.1	-178.3	-171.9	73.2	0	0	0	109.7	L283 L286 L300 M303 T334 Y336	L283-L306 HydrophobicContact CD2-CD1 4.3Å; L283-L306 HydrophobicContact CG-CD1 4.5Å; L283-L306 WeakPolarHBondContact O-CA 3.06Å; L283-L306 PolarHBondContact O-N 3.09Å; L286-L306 HydrophobicContact CB-CD1 4.04Å; L300-L306 HydrophobicContact CB-CD2 4.43Å; L300-L306 HydrophobicContact CD2-CD2 3.75Å; M303-L306 HydrophobicContact CB-CB 3.7Å; M303-L306 HydrophobicContact CB-CD2 4.28Å; M303-L306 HydrophobicContact CE-CD1 4.28Å; M303-L306 PolarHBondContact O-N 3.34Å; M303-L306 HydrophobicContact SD-CD2 3.98Å; L306-T334 PolarHBondContact O-OG1 3.4Å; L306-Y336 HydrophobicContact CD2-CE1 3.81Å; L306-Y336 HydrophobicContact CG-CE1 4.05Å
307	Q	96.1	Very high	96.2	Very high	50 Å²	50	40.8 Å²	40.8	23%	0.234	21%	0.207	C	C	.	.			trans	-117.8	-36.6	-176.8	-69.2	175.1	11.9	0	0	111.9	R284 Y305 Y336 N337 G338	R284-Q307 PolarHBondContact O-N 3.13Å; Y305-Q307 PolarHBondContact O-N 3.31Å; Q307-Y336 CarbonylContact O-C 3.44Å; Q307-Y336 VanDerWaalsContact O-CA 3.3Å; Q307-Y336 WeakPolarHBondContact O-CA 3.42Å; Q307-Y336 WeakPolarHBondContact O-CD1 3.21Å; Q307-N337 HydrophobicContact CB-CB 4.45Å; Q307-N337 PolarHBondContact O-N 2.52Å; Q307-N337 PolarHBondContact OE1-ND2 3.22Å; Q307-G338 PolarHBondContact O-N 3.08Å
308	V	97.9	Very high	96.1	Very high	19 Å²	19	47.8 Å²	47.8	12%	0.115	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129.5	-177	-175.9	0	0	0	0	110	R284 E285 L286 Y310 G338	R284-V308 PolarHBondContact O-N 3.15Å; E285-V308 WeakPolarHBondContact CA-O 3.38Å; E285-V308 HydrophobicContact CB-CB 4.3Å; E285-V308 HydrophobicContact CG-CB 4.03Å; E285-V308 HydrophobicContact CG-CG2 4.22Å; L286-V308 PolarHBondContact N-O 3.34Å; V308-Y310 HydrophobicContact CG1-CD1 3.92Å; V308-Y310 HydrophobicContact CG1-CE1 3.42Å; V308-Y310 VanDerWaalsContact CG1-CE1 3.42Å; V308-Y310 HydrophobicContact CG1-CE2 4.12Å; V308-Y310 HydrophobicContact CG1-CG 4.46Å; V308-G338 CarbonylContact C-O 3.57Å; V308-G338 VanDerWaalsContact CA-O 3.3Å; V308-G338 WeakPolarHBondContact CA-O 3.46Å
309	V	98.3	Very high	96.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	117.6	172.7	60.6	0	0	0	0	110.2	L286 L300 L311 F324 Y336 G338 I339 S340	L286-V309 WeakPolarHBondContact O-CA 3.23Å; L300-V309 HydrophobicContact CD1-CG2 4.25Å; V309-L311 HydrophobicContact CG2-CD1 4.07Å; V309-L311 HydrophobicContact CG2-CD2 4.41Å; V309-L311 HydrophobicContact CG2-CG 3.96Å; V309-F324 HydrophobicContact CG1-CD1 4.22Å; V309-F324 HydrophobicContact CG1-CE1 3.92Å; V309-Y336 HydrophobicContact CB-CE1 4.38Å; V309-Y336 HydrophobicContact CG1-CD1 4.11Å; V309-Y336 HydrophobicContact CG1-CE1 3.66Å; V309-G338 PolarHBondContact N-O 3.22Å; V309-I339 HydrophobicContact CG1-CB 4.38Å; V309-I339 HydrophobicContact CG1-CG1 3.87Å; V309-I339 HydrophobicContact CG1-CG2 4.25Å; V309-I339 WeakPolarHBondContact O-CA 3.49Å; V309-S340 PolarHBondContact O-N 3.19Å; V309-S340 VanDerWaalsContact O-N 3.15Å
310	Y	98.5	Very high	96.4	Very high	69 Å²	69	43.4 Å²	43.4	27%	0.271	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	119.8	176.4	-61.8	-29.4	0	0	0	110.9	L286 H287 L288 D289 V308 S340	L286-Y310 PolarHBondContact O-N 3.21Å; H287-Y310 HydrophobicContact CB-CD2 4.42Å; H287-Y310 AromaticContact CD2-CD2 3.43Å; H287-Y310 VanDerWaalsContact CD2-CD2 3.43Å; H287-Y310 WeakPolarHBondContact CD2-CD2 3.28Å; H287-Y310 AromaticContact CD2-CE2 3.87Å; H287-Y310 AromaticContact CE1-CD2 3.88Å; H287-Y310 AromaticContact CE1-CE2 3.77Å; H287-Y310 AromaticContact CG-CD2 3.72Å; H287-Y310 AromaticContact ND1-CD2 3.97Å; H287-Y310 AromaticContact NE2-CD2 3.57Å; H287-Y310 AromaticContact NE2-CE2 3.48Å; H287-Y310 WeakPolarHBondContact NE2-CE2 3.3Å; L288-Y310 CarbonylContact C-O 3.25Å; L288-Y310 VanDerWaalsContact C-O 3.27Å; L288-Y310 VanDerWaalsContact CA-O 3.32Å; L288-Y310 WeakPolarHBondContact CA-O 3.37Å; L288-Y310 WeakPolarHBondContact CB-O 3.09Å; L288-Y310 PolarHBondContact N-O 3.28Å; D289-Y310 PolarHBondContact N-O 3.46Å; D289-Y310 VanDerWaalsContact N-O 3.16Å; V308-Y310 HydrophobicContact CG1-CD1 3.92Å; V308-Y310 HydrophobicContact CG1-CE1 3.42Å; V308-Y310 VanDerWaalsContact CG1-CE1 3.42Å; V308-Y310 HydrophobicContact CG1-CE2 4.12Å; V308-Y310 HydrophobicContact CG1-CG 4.46Å; Y310-S340 WeakPolarHBondContact CA-OG 3.3Å; Y310-S340 WeakPolarHBondContact CB-OG 3.4Å
311	L	98.3	Very high	96.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.235	C	C	.	.			trans	-130	14.8	-179.7	-63.6	167.2	0	0	0	111.5	L288 L293 V296 P297 V309 N314 I316 F324 S340 L341 N344	L288-L311 HydrophobicContact CB-CD2 3.84Å; L288-L311 HydrophobicContact CD1-CD2 4.16Å; L293-L311 HydrophobicContact CD1-CD2 3.88Å; V296-L311 HydrophobicContact CG1-CD1 4.05Å; V296-L311 HydrophobicContact CG2-CD1 4.29Å; P297-L311 HydrophobicContact CG-CD2 4.24Å; V309-L311 HydrophobicContact CG2-CD1 4.07Å; V309-L311 HydrophobicContact CG2-CD2 4.41Å; V309-L311 HydrophobicContact CG2-CG 3.96Å; L311-N314 PolarHBondContact O-ND2 3.29Å; L311-I316 HydrophobicContact CB-CD1 3.96Å; L311-I316 HydrophobicContact CD1-CD1 4.36Å; L311-I316 HydrophobicContact CD2-CD1 4.46Å; L311-I316 HydrophobicContact CG-CD1 4.49Å; L311-F324 HydrophobicContact CD1-CE1 3.97Å; L311-F324 HydrophobicContact CD1-CZ 4.01Å; L311-S340 CarbonylContact C-O 3.54Å; L311-S340 VanDerWaalsContact C-O 3.28Å; L311-S340 WeakPolarHBondContact CA-O 3.45Å; L311-S340 WeakPolarHBondContact CB-O 3.45Å; L311-S340 PolarHBondContact N-O 2.84Å; L311-S340 PolarHBondContact N-OG 2.96Å; L311-S340 VanDerWaalsContact N-OG 3.11Å; L311-L341 HydrophobicContact CB-CD2 3.97Å; L311-L341 HydrophobicContact CD1-CD2 4.15Å; L311-N344 PolarHBondContact O-ND2 3Å
312	H	97.9	Very high	96.5	Very high	33 Å²	33	46.5 Å²	46.5	15%	0.153	24%	0.24	C	C	.	.			trans	-68	161.1	-179.9	69.5	81.2	0	0	0	110.9	D289 N290 N314 S340 F342	D289-H312 CarbonylContact C-O 3.47Å; D289-H312 WeakPolarHBondContact CA-O 3.43Å; D289-H312 VanDerWaalsContact CB-CE1 3.46Å; D289-H312 WeakPolarHBondContact CB-CE1 3.25Å; D289-H312 WeakPolarHBondContact CB-NE2 3.42Å; D289-H312 IonicContact OD2-CE1 3.92Å; D289-H312 IonicContact OD2-NE2 3.72Å; N290-H312 PolarHBondContact N-O 2.75Å; N290-H312 PolarHBondContact ND2-CE1 3.34Å; H312-N314 PolarHBondContact O-N 3.06Å; H312-N314 PolarHBondContact O-ND2 3.13Å; H312-N314 VanDerWaalsContact O-ND2 3.09Å; H312-S340 PolarHBondContact CD2-OG 2.86Å; H312-S340 PolarHBondContact N-O 3.17Å; H312-S340 PolarHBondContact N-OG 3.02Å; H312-F342 CarbonylContact C-O 3.57Å; H312-F342 WeakPolarHBondContact CA-O 3.42Å; H312-F342 HydrophobicContact CB-CD1 3.67Å; H312-F342 HydrophobicContact CB-CD2 3.72Å; H312-F342 HydrophobicContact CB-CE1 3.5Å; H312-F342 VanDerWaalsContact CB-CE1 3.5Å; H312-F342 HydrophobicContact CB-CE2 3.54Å; H312-F342 HydrophobicContact CB-CG 3.78Å; H312-F342 HydrophobicContact CB-CZ 3.43Å; H312-F342 VanDerWaalsContact CB-CZ 3.43Å; H312-F342 VanDerWaalsContact CB-O 3.29Å; H312-F342 WeakPolarHBondContact CB-O 3.15Å; H312-F342 AromaticContact CD2-CE1 3.72Å; H312-F342 AromaticContact CD2-CZ 3.43Å; H312-F342 VanDerWaalsContact CD2-CZ 3.43Å; H312-F342 WeakPolarHBondContact CD2-CZ 3.2Å; H312-F342 AromaticContact CE1-CZ 3.89Å; H312-F342 AromaticContact CG-CE1 3.64Å; H312-F342 AromaticContact CG-CE2 3.55Å; H312-F342 AromaticContact CG-CZ 3.2Å; H312-F342 AromaticContact ND1-CE2 3.56Å; H312-F342 AromaticContact ND1-CZ 3.51Å; H312-F342 AromaticContact NE2-CZ 3.88Å
313	S	97.9	Very high	96.6	Very high	20 Å²	20	43.6 Å²	43.6	14%	0.14	23%	0.225	C	C	.	.	S	Bend	trans	55.3	51.2	176.9	-39.5	0	0	0	0	111.6	N290 N291 F342 E343	N290-S313 WeakPolarHBondContact CA-O 3.27Å; N290-S313 PolarHBondContact N-O 3.22Å; N290-S313 WeakPolarHBondContact OD1-CB 3.31Å; N291-S313 PolarHBondContact N-O 2.91Å; S313-F342 PolarHBondContact N-O 2.76Å; S313-E343 VanDerWaalsContact CA-O 3.24Å; S313-E343 WeakPolarHBondContact CA-O 3.34Å; S313-E343 WeakPolarHBondContact CB-OE2 3.22Å; S313-E343 PolarHBondContact N-O 2.03Å; S313-E343 PolarHBondContact OG-OE2 2.78Å
314	N	98.4	Very high	96.7	Very high	13 Å²	13	43.1 Å²	43.1	7%	0.07	22%	0.222	C	C	.	.	S	Bend	trans	-127	-171.2	177.6	-90.8	-84.1	0	0	0	109.9	L288 N291 R292 L293 L311 H312 I316 E343 N344	L288-N314 PolarHBondContact O-ND2 3.14Å; N291-N314 WeakPolarHBondContact CA-OD1 3.47Å; N291-N314 WeakPolarHBondContact CB-OD1 3.31Å; N291-N314 PolarHBondContact O-OD1 3.28Å; R292-N314 PolarHBondContact N-OD1 3.13Å; L293-N314 HydrophobicContact CB-CB 4.37Å; L293-N314 VanDerWaalsContact CB-OD1 3.23Å; L293-N314 WeakPolarHBondContact CB-OD1 3.4Å; L293-N314 WeakPolarHBondContact CG-OD1 3.44Å; L293-N314 PolarHBondContact N-OD1 3.38Å; L311-N314 PolarHBondContact O-ND2 3.29Å; H312-N314 PolarHBondContact O-N 3.06Å; H312-N314 PolarHBondContact O-ND2 3.13Å; H312-N314 VanDerWaalsContact O-ND2 3.09Å; N314-I316 HydrophobicContact CB-CD1 4.3Å; N314-I316 HydrophobicContact CB-CG1 4.14Å; N314-E343 PolarHBondContact N-O 2.94Å; N314-N344 VanDerWaalsContact CA-OD1 3.31Å; N314-N344 WeakPolarHBondContact CA-OD1 3.25Å; N314-N344 WeakPolarHBondContact CB-OD1 3.29Å; N314-N344 PolarHBondContact N-OD1 3.07Å; N314-N344 PolarHBondContact O-OD1 2.95Å
315	N	97.8	Very high	96.7	Very high	92 Å²	92	37.9 Å²	37.9	49%	0.492	20%	0.2	S	C	.	.			trans	-111.8	32.5	178.3	-160	41.8	0	0	0	112.5	L293 T294 S317 N344 P345	L293-N315 CarbonylContact O-C 2.97Å; L293-N315 WeakPolarHBondContact O-CA 3.33Å; L293-N315 PolarHBondContact O-N 3.1Å; T294-N315 WeakPolarHBondContact CA-O 3.49Å; N315-S317 PolarHBondContact O-N 3.2Å; N315-N344 PolarHBondContact N-OD1 2.79Å; N315-P345 WeakPolarHBondContact OD1-CG 3.47Å
316	I	97.5	Very high	96.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.19	C	C	.	.			trans	-73.3	115.1	-176.6	-60.3	171.2	0	0	0	109.5	L293 V296 L311 N314 Q318 V319 L341 N344 P345 V346	L293-I316 HydrophobicContact CB-CG1 4.36Å; L293-I316 PolarHBondContact O-N 3.15Å; L293-I316 VanDerWaalsContact O-N 3.13Å; V296-I316 HydrophobicContact CG2-CD1 4.48Å; V296-I316 HydrophobicContact CG2-CG2 4.43Å; L311-I316 HydrophobicContact CB-CD1 3.96Å; L311-I316 HydrophobicContact CD1-CD1 4.36Å; L311-I316 HydrophobicContact CD2-CD1 4.46Å; L311-I316 HydrophobicContact CG-CD1 4.49Å; N314-I316 HydrophobicContact CB-CD1 4.3Å; N314-I316 HydrophobicContact CB-CG1 4.14Å; I316-Q318 WeakPolarHBondContact CG2-O 3.19Å; I316-V319 HydrophobicContact CG2-CG2 4.01Å; I316-L341 HydrophobicContact CD1-CD2 4.34Å; I316-N344 HydrophobicContact CB-CB 4.28Å; I316-N344 VanDerWaalsContact CB-OD1 3.25Å; I316-N344 WeakPolarHBondContact CB-OD1 3.47Å; I316-N344 WeakPolarHBondContact CG1-OD1 3.41Å; I316-N344 PolarHBondContact N-OD1 3.19Å; I316-P345 WeakPolarHBondContact O-CD 3.06Å; I316-V346 HydrophobicContact CG2-CG1 4.33Å; I316-V346 WeakPolarHBondContact O-CB 3.46Å; I316-V346 WeakPolarHBondContact O-CG1 3.37Å; I316-V346 PolarHBondContact O-N 3.28Å
317	S	95.4	Very high	95.8	Very high	62 Å²	62	44.4 Å²	44.4	43%	0.434	23%	0.227	S	C	.	.			trans	-98.3	-18.5	-178.7	58.6	0	0	0	0	114	N315	N315-S317 PolarHBondContact O-N 3.2Å
318	Q	95.1	Very high	94.8	Very high	154 Å²	154	44.4 Å²	44.4	72%	0.72	24%	0.241	S	C	*	.			trans	-144.3	143.1	-178.1	-65.1	-178.2	-5.2	0	0	110.4	I316	I316-Q318 WeakPolarHBondContact CG2-O 3.19Å
319	V	97.3	Very high	92.8	Very high	18 Å²	18	53.9 Å²	53.9	11%	0.109	28%	0.281	C	S	.	.			trans	-130.2	115.5	175.1	-179	0	0	0	0	108.6	V296 I316 D323 F324 V346 V351 T355	V296-V319 HydrophobicContact CG2-CG1 4.22Å; V296-V319 HydrophobicContact CG2-CG2 4.09Å; I316-V319 HydrophobicContact CG2-CG2 4.01Å; V319-D323 HydrophobicContact CG1-CB 4.4Å; V319-F324 HydrophobicContact CG1-CD2 4.35Å; V319-F324 HydrophobicContact CG1-CE2 3.73Å; V319-V346 HydrophobicContact CG2-CG1 4.13Å; V319-V346 HydrophobicContact CG2-CG2 4.19Å; V319-V351 HydrophobicContact CB-CG1 4.23Å; V319-V351 HydrophobicContact CB-CG2 4.06Å; V319-V351 HydrophobicContact CG1-CG1 4.12Å; V319-V351 HydrophobicContact CG2-CG2 4.31Å; V319-T355 HydrophobicContact CG1-CG2 3.75Å
320	G	96.4	Very high	91	Very high	30 Å²	30	57.6 Å²	57.6	31%	0.309	32%	0.319	S	S	.	.			trans	-76.9	157.5	177.9	0	0	0	0	0	113.3	D322 D323 T355	G320-D322 PolarHBondContact O-N 2.95Å; G320-D322 VanDerWaalsContact O-N 3.15Å; G320-D323 VanDerWaalsContact N-CG 3.31Å; G320-D323 PolarHBondContact N-OD2 2.95Å; G320-D323 WeakPolarHBondContact O-CB 3.39Å; G320-D323 PolarHBondContact O-N 3.28Å; G320-T355 WeakPolarHBondContact O-CG2 3.49Å
321	V	95.8	Very high	89.4	Confident	42 Å²	42	59.3 Å²	59.3	26%	0.255	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-25.6	-179.1	-176.7	0	0	0	0	112.9	Q352 A354 T355 R357	V321-Q352 HydrophobicContact CG2-CB 4.19Å; V321-Q352 VanDerWaalsContact CG2-CD 3.48Å; V321-Q352 HydrophobicContact CG2-CG 4.22Å; V321-A354 HydrophobicContact CG1-CB 3.98Å; V321-T355 WeakPolarHBondContact CA-OG1 3.39Å; V321-T355 WeakPolarHBondContact O-CA 2.96Å; V321-R357 PolarHBondContact O-NH1 3.09Å
322	D	94.9	Very high	88.3	Confident	42 Å²	42	69 Å²	69	23%	0.225	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	13.6	-176.8	-57.1	-52.3	0	0	0	113	P301 G320 F324 C325 R327 R357	P301-D322 WeakPolarHBondContact CG-O 3.49Å; G320-D322 PolarHBondContact O-N 2.95Å; G320-D322 VanDerWaalsContact O-N 3.15Å; D322-F324 VanDerWaalsContact C-N 3.31Å; D322-F324 PolarHBondContact O-N 3.3Å; D322-C325 WeakPolarHBondContact CA-O 3.4Å; D322-R327 HydrophobicContact CB-CG 4.44Å; D322-R327 WeakPolarHBondContact OD1-CG 3.32Å; D322-R327 IonicContact OD2-CZ 3.29Å; D322-R327 VanDerWaalsContact OD2-CZ 3.29Å; D322-R327 IonicContact OD2-NE 2.69Å; D322-R327 PolarHBondContact OD2-NE 3.39Å; D322-R327 IonicContact OD2-NH2 3.39Å; D322-R327 PolarHBondContact OD2-NH2 2.8Å; D322-R357 IonicContact OD1-CZ 3.17Å; D322-R357 IonicContact OD1-NH1 3.74Å; D322-R357 IonicContact OD1-NH2 2.9Å; D322-R357 PolarHBondContact OD1-NH2 3.11Å
323	D	96.5	Very high	87.7	Confident	49 Å²	49	69.1 Å²	69.1	26%	0.262	37%	0.373	S	S	.	.	S	Bend	trans	-69.7	-30.7	-176.2	-78.1	-0.3	0	0	0	112.3	V296 P301 V319 G320	V296-D323 HydrophobicContact CB-CB 3.97Å; V296-D323 HydrophobicContact CG1-CB 3.99Å; V296-D323 HydrophobicContact CG2-CB 4.28Å; P301-D323 WeakPolarHBondContact CD-O 3.36Å; V319-D323 HydrophobicContact CG1-CB 4.4Å; G320-D323 VanDerWaalsContact N-CG 3.31Å; G320-D323 PolarHBondContact N-OD2 2.95Å; G320-D323 WeakPolarHBondContact O-CB 3.39Å; G320-D323 PolarHBondContact O-N 3.28Å
324	F	95.6	Very high	87.3	Confident	0 Å²	0	70 Å²	70	0%	0	38%	0.377	C	S	.	.	S	Bend	trans	-107.3	-42.4	177.6	-62.9	-75.3	0	0	0	112.6	V296 L300 V309 L311 V319 D322 R333 Y336 I339 L341 T355 F356	V296-F324 HydrophobicContact CG1-CE1 3.93Å; V296-F324 HydrophobicContact CG1-CE2 4.49Å; V296-F324 HydrophobicContact CG1-CZ 3.91Å; V296-F324 HydrophobicContact CG2-CE2 4.18Å; V296-F324 HydrophobicContact CG2-CZ 3.9Å; L300-F324 HydrophobicContact CD1-CD1 4.02Å; L300-F324 HydrophobicContact CD1-CE1 4Å; V309-F324 HydrophobicContact CG1-CD1 4.22Å; V309-F324 HydrophobicContact CG1-CE1 3.92Å; L311-F324 HydrophobicContact CD1-CE1 3.97Å; L311-F324 HydrophobicContact CD1-CZ 4.01Å; V319-F324 HydrophobicContact CG1-CD2 4.35Å; V319-F324 HydrophobicContact CG1-CE2 3.73Å; D322-F324 VanDerWaalsContact C-N 3.31Å; D322-F324 PolarHBondContact O-N 3.3Å; F324-R333 PolarHBondContact O-NH1 3.43Å; F324-Y336 HydrophobicContact CB-CE2 3.86Å; F324-Y336 HydrophobicContact CD1-CE2 4.49Å; F324-Y336 PolarHBondContact O-OH 3.34Å; F324-I339 HydrophobicContact CD1-CD1 3.94Å; F324-I339 HydrophobicContact CE1-CD1 4.32Å; F324-I339 HydrophobicContact CE1-CG2 3.94Å; F324-I339 HydrophobicContact CG-CD1 4.11Å; F324-I339 HydrophobicContact CZ-CG2 3.94Å; F324-L341 HydrophobicContact CE2-CD1 4.09Å; F324-L341 HydrophobicContact CZ-CD1 4.05Å; F324-L341 HydrophobicContact CZ-CD2 4.33Å; F324-T355 HydrophobicContact CD2-CG2 3.82Å; F324-T355 HydrophobicContact CE2-CG2 4.35Å; F324-F356 HydrophobicContact CD2-CD1 4.24Å; F324-F356 AromaticContact CD2-CE1 3.83Å; F324-F356 HydrophobicContact CD2-CE1 3.83Å; F324-F356 AromaticContact CE2-CE1 3.79Å; F324-F356 HydrophobicContact CE2-CE1 3.79Å; F324-F356 HydrophobicContact CE2-CZ 4.47Å
325	C	93.5	Very high	87	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	40%	0.399	C	S	.	.	S	Bend	trans	-107.3	140.5	-170.5	-59	0	0	0	0	112.2	D322 T355 R357 C358	D322-C325 WeakPolarHBondContact CA-O 3.4Å; C325-T355 PolarHBondContact SG-O 3.17Å; C325-R357 HydrophobicContact CB-CG 3.7Å; C325-R357 VanDerWaalsContact CB-CZ 3.45Å; C325-R357 PolarHBondContact O-NH2 3.18Å; C325-C358 WeakPolarHBondContact CA-SG 3.35Å; C325-C358 HydrophobicContact CB-CB 3.84Å; C325-C358 WeakPolarHBondContact CB-SG 3.37Å; C325-C358 VanDerWaalsContact SG-CA 3.6Å; C325-C358 WeakPolarHBondContact SG-CB 3.44Å; C325-C358 PolarHBondContact SG-N 3.32Å; C325-C358 CovalentContact SG-SG 2.03Å; C325-C358 PolarHBondContact SG-SG 3.37Å
326	P	90.3	Very high	86.9	Confident	32 Å²	32	71.5 Å²	71.5	21%	0.208	38%	0.376	C	S	.	.			trans	-72.9	153.6	178	30.4	-34.9	0	0	0	112.1	P301 R357	P301-P326 HydrophobicContact CB-CB 4.38Å; P326-R357 VanDerWaalsContact C-NH2 3.25Å; P326-R357 PolarHBondContact O-NE 3.45Å; P326-R357 PolarHBondContact O-NH2 3.07Å
327	R	83.3	Confident	86.7	Confident	207 Å²	207	75.6 Å²	75.6	78%	0.781	40%	0.398	S	S	*	.	S	Bend	trans	-70.4	-35	178.1	-72.5	-177.3	178.6	168.5	3.7	113.9	D322	D322-R327 HydrophobicContact CB-CG 4.44Å; D322-R327 WeakPolarHBondContact OD1-CG 3.32Å; D322-R327 IonicContact OD2-CZ 3.29Å; D322-R327 VanDerWaalsContact OD2-CZ 3.29Å; D322-R327 IonicContact OD2-NE 2.69Å; D322-R327 PolarHBondContact OD2-NE 3.39Å; D322-R327 IonicContact OD2-NH2 3.39Å; D322-R327 PolarHBondContact OD2-NH2 2.8Å
328	G	73.6	Confident	86.7	Confident	51 Å²	51	73 Å²	73	53%	0.526	38%	0.381	S	S	.	.	S	Bend	trans	-93.3	134.1	-173	0	0	0	0	0	113.4	G330	G328-G330 PolarHBondContact O-N 3.46Å
329	F	57.7	Low	86.8	Confident	217 Å²	217	65.7 Å²	65.7	95%	0.952	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	114.8	162.9	-72	-87.9	0	0	0	108.5
330	G	58.8	Low	86.8	Confident	78 Å²	78	64.8 Å²	64.8	80%	0.804	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	156.4	-18.8	177.6	0	0	0	0	0	116	G328 K332	G328-G330 PolarHBondContact O-N 3.46Å; G330-K332 PolarHBondContact O-N 3.43Å
331	M	66.4	Low	86.8	Confident	105 Å²	105	63.4 Å²	63.4	52%	0.517	33%	0.327	S	S	.	.			trans	-81.2	115.4	170.7	-75	-168.3	171.6	0	0	110.1	R333	M331-R333 PolarHBondContact O-N 3.43Å
332	K	74.2	Confident	86.7	Confident	205 Å²	205	63.8 Å²	63.8	89%	0.891	33%	0.325	S	S	*	.			trans	-63.6	104.6	162.9	-71.3	-174.3	-179.4	-178.2	0	107.7	G330	G330-K332 PolarHBondContact O-N 3.43Å
333	R	85.6	Confident	86.8	Confident	35 Å²	35	68.3 Å²	68.3	13%	0.132	35%	0.345	C	S	.	.			trans	-133.1	145.5	-176.1	171.6	171	-175.8	-171.4	-2.4	109.4	L300 P301 M303 K304 F324 M331 Y336	L300-R333 PolarHBondContact O-NH1 3.34Å; L300-R333 PolarHBondContact O-NH2 3.2Å; P301-R333 PolarHBondContact O-NH1 3.41Å; M303-R333 PolarHBondContact O-NE 3.19Å; K304-R333 WeakPolarHBondContact O-CA 3.47Å; F324-R333 PolarHBondContact O-NH1 3.43Å; M331-R333 PolarHBondContact O-N 3.43Å; R333-Y336 PolarHBondContact NH2-OH 3.42Å
334	T	89.8	Confident	86.8	Confident	39 Å²	39	67 Å²	67	24%	0.239	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-69.9	134.3	171.5	54	0	0	0	0	110.8	K304 Y305 L306	K304-T334 PolarHBondContact O-N 2.99Å; K304-T334 PolarHBondContact O-OG1 3.46Å; K304-T334 VanDerWaalsContact O-OG1 3.13Å; Y305-T334 VanDerWaalsContact CA-OG1 3.32Å; Y305-T334 WeakPolarHBondContact CA-OG1 3.1Å; Y305-T334 HydrophobicContact CD1-CG2 4.43Å; Y305-T334 PolarHBondContact O-OG1 3.5Å; L306-T334 PolarHBondContact O-OG1 3.4Å
335	Y	92.1	Very high	86.8	Confident	135 Å²	135	70 Å²	70	53%	0.529	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-62.1	149.3	169.3	-69.7	-90.3	0	0	0	110.3	C358 N360	Y335-C358 WeakPolarHBondContact CA-O 3.38Å; Y335-C358 WeakPolarHBondContact CD1-O 3.47Å; Y335-N360 HydrophobicContact CG-CB 4.47Å
336	Y	95	Very high	86.9	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-68.7	135.3	169.8	-73.2	-83.6	0	0	0	110.4	L306 Q307 V309 F324 R333 I339 C358 V359 N360	L306-Y336 HydrophobicContact CD2-CE1 3.81Å; L306-Y336 HydrophobicContact CG-CE1 4.05Å; Q307-Y336 CarbonylContact O-C 3.44Å; Q307-Y336 VanDerWaalsContact O-CA 3.3Å; Q307-Y336 WeakPolarHBondContact O-CA 3.42Å; Q307-Y336 WeakPolarHBondContact O-CD1 3.21Å; V309-Y336 HydrophobicContact CB-CE1 4.38Å; V309-Y336 HydrophobicContact CG1-CD1 4.11Å; V309-Y336 HydrophobicContact CG1-CE1 3.66Å; F324-Y336 HydrophobicContact CB-CE2 3.86Å; F324-Y336 HydrophobicContact CD1-CE2 4.49Å; F324-Y336 PolarHBondContact O-OH 3.34Å; R333-Y336 PolarHBondContact NH2-OH 3.42Å; Y336-I339 HydrophobicContact CD1-CD1 4.13Å; Y336-I339 HydrophobicContact CD1-CG1 3.94Å; Y336-I339 HydrophobicContact CD2-CD1 3.99Å; Y336-I339 HydrophobicContact CE2-CD1 4.41Å; Y336-I339 HydrophobicContact CG-CD1 3.81Å; Y336-I339 HydrophobicContact CG-CG1 3.99Å; Y336-C358 PolarHBondContact N-O 3.19Å; Y336-C358 VanDerWaalsContact N-O 3.13Å; Y336-V359 HydrophobicContact CD2-CG2 4.43Å; Y336-N360 PolarHBondContact O-N 3.09Å
337	N	93.5	Very high	86.9	Confident	86 Å²	86	71.6 Å²	71.6	46%	0.46	36%	0.364	S	S	.	.	S	Bend	trans	-101.5	-16.4	172.6	-67.7	-16.8	0	0	0	112.1	Q307 A364	Q307-N337 HydrophobicContact CB-CB 4.45Å; Q307-N337 PolarHBondContact O-N 2.52Å; Q307-N337 PolarHBondContact OE1-ND2 3.22Å; N337-A364 VanDerWaalsContact O-CB 3.24Å; N337-A364 WeakPolarHBondContact O-CB 3.33Å
338	G	95.3	Very high	87.2	Confident	8 Å²	8	67.8 Å²	67.8	8%	0.082	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	124	177.9	0	0	0	0	0	112.5	Q307 V308 V309 A364	Q307-G338 PolarHBondContact O-N 3.08Å; V308-G338 CarbonylContact C-O 3.57Å; V308-G338 VanDerWaalsContact CA-O 3.3Å; V308-G338 WeakPolarHBondContact CA-O 3.46Å; V309-G338 PolarHBondContact N-O 3.22Å; G338-A364 CarbonylContact C-O 3.07Å; G338-A364 WeakPolarHBondContact CA-O 3.36Å
339	I	97	Very high	88	Confident	0 Å²	0	73 Å²	73	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	122.5	169.2	-58.9	179.8	0	0	0	107.4	V309 F324 Y336 L341 F356 V359 A364 Q366	V309-I339 HydrophobicContact CG1-CB 4.38Å; V309-I339 HydrophobicContact CG1-CG1 3.87Å; V309-I339 HydrophobicContact CG1-CG2 4.25Å; V309-I339 WeakPolarHBondContact O-CA 3.49Å; F324-I339 HydrophobicContact CD1-CD1 3.94Å; F324-I339 HydrophobicContact CE1-CD1 4.32Å; F324-I339 HydrophobicContact CE1-CG2 3.94Å; F324-I339 HydrophobicContact CG-CD1 4.11Å; F324-I339 HydrophobicContact CZ-CG2 3.94Å; Y336-I339 HydrophobicContact CD1-CD1 4.13Å; Y336-I339 HydrophobicContact CD1-CG1 3.94Å; Y336-I339 HydrophobicContact CD2-CD1 3.99Å; Y336-I339 HydrophobicContact CE2-CD1 4.41Å; Y336-I339 HydrophobicContact CG-CD1 3.81Å; Y336-I339 HydrophobicContact CG-CG1 3.99Å; I339-L341 HydrophobicContact CG2-CD1 4.1Å; I339-L341 HydrophobicContact CG2-CG 4.1Å; I339-F356 HydrophobicContact CD1-CD1 3.98Å; I339-F356 HydrophobicContact CD1-CE1 4.22Å; I339-F356 HydrophobicContact CG2-CE1 4.37Å; I339-V359 HydrophobicContact CD1-CG2 3.75Å; I339-A364 PolarHBondContact N-O 3.44Å; I339-Q366 PolarHBondContact O-N 2.79Å
340	S	96.7	Very high	89.6	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126.8	174.2	76.3	0	0	0	0	111.2	V309 Y310 L311 H312	V309-S340 PolarHBondContact O-N 3.19Å; V309-S340 VanDerWaalsContact O-N 3.15Å; Y310-S340 WeakPolarHBondContact CA-OG 3.3Å; Y310-S340 WeakPolarHBondContact CB-OG 3.4Å; L311-S340 CarbonylContact C-O 3.54Å; L311-S340 VanDerWaalsContact C-O 3.28Å; L311-S340 WeakPolarHBondContact CA-O 3.45Å; L311-S340 WeakPolarHBondContact CB-O 3.45Å; L311-S340 PolarHBondContact N-O 2.84Å; L311-S340 PolarHBondContact N-OG 2.96Å; L311-S340 VanDerWaalsContact N-OG 3.11Å; H312-S340 PolarHBondContact CD2-OG 2.86Å; H312-S340 PolarHBondContact N-O 3.17Å; H312-S340 PolarHBondContact N-OG 3.02Å
341	L	96.7	Very high	91.3	Very high	1 Å²	1	64.4 Å²	64.4	1%	0.005	30%	0.298	C	S	.	.			trans	-133.2	0.5	179.9	-74.9	169	0	0	0	113.1	L311 I316 F324 I339 N344 F356 Q366 F367	L311-L341 HydrophobicContact CB-CD2 3.97Å; L311-L341 HydrophobicContact CD1-CD2 4.15Å; I316-L341 HydrophobicContact CD1-CD2 4.34Å; F324-L341 HydrophobicContact CE2-CD1 4.09Å; F324-L341 HydrophobicContact CZ-CD1 4.05Å; F324-L341 HydrophobicContact CZ-CD2 4.33Å; I339-L341 HydrophobicContact CG2-CD1 4.1Å; I339-L341 HydrophobicContact CG2-CG 4.1Å; L341-N344 PolarHBondContact O-ND2 3.44Å; L341-N344 VanDerWaalsContact O-ND2 3.07Å; L341-F356 HydrophobicContact CD1-CE1 4.07Å; L341-F356 HydrophobicContact CD1-CZ 3.79Å; L341-Q366 PolarHBondContact N-O 2.98Å; L341-F367 HydrophobicContact CB-CD2 3.77Å; L341-F367 HydrophobicContact CB-CE2 3.73Å; L341-F367 HydrophobicContact CD1-CD2 4.12Å; L341-F367 HydrophobicContact CD1-CE2 3.84Å; L341-F367 HydrophobicContact CG-CE2 4.45Å
342	F	95.3	Very high	92.7	Very high	50 Å²	50	64.9 Å²	64.9	22%	0.219	30%	0.299	C	S	.	.			trans	-57.8	160.4	174.7	66	-93.9	0	0	0	112.2	H312 S313 N344 Q366	H312-F342 CarbonylContact C-O 3.57Å; H312-F342 WeakPolarHBondContact CA-O 3.42Å; H312-F342 HydrophobicContact CB-CD1 3.67Å; H312-F342 HydrophobicContact CB-CD2 3.72Å; H312-F342 HydrophobicContact CB-CE1 3.5Å; H312-F342 VanDerWaalsContact CB-CE1 3.5Å; H312-F342 HydrophobicContact CB-CE2 3.54Å; H312-F342 HydrophobicContact CB-CG 3.78Å; H312-F342 HydrophobicContact CB-CZ 3.43Å; H312-F342 VanDerWaalsContact CB-CZ 3.43Å; H312-F342 VanDerWaalsContact CB-O 3.29Å; H312-F342 WeakPolarHBondContact CB-O 3.15Å; H312-F342 AromaticContact CD2-CE1 3.72Å; H312-F342 AromaticContact CD2-CZ 3.43Å; H312-F342 VanDerWaalsContact CD2-CZ 3.43Å; H312-F342 WeakPolarHBondContact CD2-CZ 3.2Å; H312-F342 AromaticContact CE1-CZ 3.89Å; H312-F342 AromaticContact CG-CE1 3.64Å; H312-F342 AromaticContact CG-CE2 3.55Å; H312-F342 AromaticContact CG-CZ 3.2Å; H312-F342 AromaticContact ND1-CE2 3.56Å; H312-F342 AromaticContact ND1-CZ 3.51Å; H312-F342 AromaticContact NE2-CZ 3.88Å; S313-F342 PolarHBondContact N-O 2.76Å; F342-N344 VanDerWaalsContact C-N 3.26Å; F342-N344 PolarHBondContact O-N 3.41Å; F342-N344 PolarHBondContact O-ND2 3.22Å; F342-Q366 HydrophobicContact CD1-CB 4.05Å; F342-Q366 HydrophobicContact CE1-CB 4.32Å; F342-Q366 PolarHBondContact N-O 2.69Å
343	E	95.6	Very high	93.5	Very high	136 Å²	136	60.9 Å²	60.9	64%	0.636	29%	0.294	S	S	*	.	S	Bend	trans	53.8	41.7	-175.9	-69.3	176.1	-169.5	0	0	113.5	S313 N314	S313-E343 VanDerWaalsContact CA-O 3.24Å; S313-E343 WeakPolarHBondContact CA-O 3.34Å; S313-E343 WeakPolarHBondContact CB-OE2 3.22Å; S313-E343 PolarHBondContact N-O 2.03Å; S313-E343 PolarHBondContact OG-OE2 2.78Å; N314-E343 PolarHBondContact N-O 2.94Å
344	N	96.6	Very high	93.9	Very high	22 Å²	22	61.4 Å²	61.4	12%	0.118	31%	0.305	C	S	.	.	S	Bend	trans	-121.4	157.5	165.7	-79.4	-88.5	0	0	0	109.7	L311 N314 N315 I316 L341 F342 V346	L311-N344 PolarHBondContact O-ND2 3Å; N314-N344 VanDerWaalsContact CA-OD1 3.31Å; N314-N344 WeakPolarHBondContact CA-OD1 3.25Å; N314-N344 WeakPolarHBondContact CB-OD1 3.29Å; N314-N344 PolarHBondContact N-OD1 3.07Å; N314-N344 PolarHBondContact O-OD1 2.95Å; N315-N344 PolarHBondContact N-OD1 2.79Å; I316-N344 HydrophobicContact CB-CB 4.28Å; I316-N344 VanDerWaalsContact CB-OD1 3.25Å; I316-N344 WeakPolarHBondContact CB-OD1 3.47Å; I316-N344 WeakPolarHBondContact CG1-OD1 3.41Å; I316-N344 PolarHBondContact N-OD1 3.19Å; L341-N344 PolarHBondContact O-ND2 3.44Å; L341-N344 VanDerWaalsContact O-ND2 3.07Å; F342-N344 VanDerWaalsContact C-N 3.26Å; F342-N344 PolarHBondContact O-N 3.41Å; F342-N344 PolarHBondContact O-ND2 3.22Å; N344-V346 HydrophobicContact CB-CG1 3.94Å; N344-V346 PolarHBondContact O-N 3.21Å
345	P	96.3	Very high	94.2	Very high	63 Å²	63	59.6 Å²	59.6	41%	0.409	29%	0.294	S	S	.	.	S	Bend	trans	-59	-27.6	173.9	-25.3	32.7	0	0	0	114.9	N315 I316 N347	N315-P345 WeakPolarHBondContact OD1-CG 3.47Å; I316-P345 WeakPolarHBondContact O-CD 3.06Å; P345-N347 PolarHBondContact O-N 3.25Å
346	V	94.6	Very high	94.3	Very high	5 Å²	5	54.6 Å²	54.6	3%	0.03	28%	0.275	C	S	.	.			trans	-66.3	129.1	178.9	62.6	0	0	0	0	111.8	I316 V319 N344 E350 V351 F367	I316-V346 HydrophobicContact CG2-CG1 4.33Å; I316-V346 WeakPolarHBondContact O-CB 3.46Å; I316-V346 WeakPolarHBondContact O-CG1 3.37Å; I316-V346 PolarHBondContact O-N 3.28Å; V319-V346 HydrophobicContact CG2-CG1 4.13Å; V319-V346 HydrophobicContact CG2-CG2 4.19Å; N344-V346 HydrophobicContact CB-CG1 3.94Å; N344-V346 PolarHBondContact O-N 3.21Å; V346-E350 HydrophobicContact CG2-CB 4.45Å; V346-V351 HydrophobicContact CG2-CG2 3.68Å; V346-F367 HydrophobicContact CG1-CZ 4.16Å
347	N	90.9	Very high	94.2	Very high	60 Å²	60	59.3 Å²	59.3	32%	0.321	29%	0.293	S	S	.	.			trans	-90.7	153.9	177.3	-62.4	-70.2	0	0	0	111.8	P345 W349 E350	P345-N347 PolarHBondContact O-N 3.25Å; N347-W349 VanDerWaalsContact C-N 3.26Å; N347-W349 HydrophobicContact CB-CD2 3.77Å; N347-W349 HydrophobicContact CB-CE3 4.25Å; N347-W349 HydrophobicContact CB-CG 4.32Å; N347-W349 HydrophobicContact CB-CH2 3.83Å; N347-W349 HydrophobicContact CB-CZ2 3.33Å; N347-W349 HydrophobicContact CB-CZ3 4.27Å; N347-W349 PolarHBondContact O-N 3.15Å; N347-W349 WeakPolarHBondContact OD1-CZ2 3.02Å; N347-E350 HydrophobicContact CB-CG 4.23Å; N347-E350 PolarHBondContact N-OE2 2.95Å; N347-E350 PolarHBondContact ND2-OE1 3.12Å; N347-E350 WeakPolarHBondContact O-CB 3.43Å; N347-E350 PolarHBondContact O-N 3.14Å; N347-E350 VanDerWaalsContact O-N 3.1Å
348	Y	89.6	Confident	94.1	Very high	127 Å²	127	56.2 Å²	56.2	50%	0.498	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-64.9	-30.9	-176.2	81.2	-87.5	0	0	0	112.9	E350 V351 F367 N369	Y348-E350 VanDerWaalsContact C-N 3.27Å; Y348-E350 PolarHBondContact O-N 3.44Å; Y348-V351 PolarHBondContact O-N 3.2Å; Y348-F367 VanDerWaalsContact CB-CD1 3.42Å; Y348-F367 VanDerWaalsContact CB-CE1 3.5Å; Y348-N369 WeakPolarHBondContact CD1-ND2 3.28Å; Y348-N369 WeakPolarHBondContact CE1-ND2 3.36Å
349	W	89.5	Confident	93.9	Very high	162 Å²	162	56.8 Å²	56.8	61%	0.614	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-75.4	-13.7	178.8	57.1	74.7	0	0	0	113.3	N347	N347-W349 VanDerWaalsContact C-N 3.26Å; N347-W349 HydrophobicContact CB-CD2 3.77Å; N347-W349 HydrophobicContact CB-CE3 4.25Å; N347-W349 HydrophobicContact CB-CG 4.32Å; N347-W349 HydrophobicContact CB-CH2 3.83Å; N347-W349 HydrophobicContact CB-CZ2 3.33Å; N347-W349 HydrophobicContact CB-CZ3 4.27Å; N347-W349 PolarHBondContact O-N 3.15Å; N347-W349 WeakPolarHBondContact OD1-CZ2 3.02Å
350	E	92.6	Very high	93.3	Very high	102 Å²	102	62.3 Å²	62.3	48%	0.477	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-84.6	-19.2	175.1	-66.3	162.6	-178	0	0	111.7	V346 N347 Y348	V346-E350 HydrophobicContact CG2-CB 4.45Å; N347-E350 HydrophobicContact CB-CG 4.23Å; N347-E350 PolarHBondContact N-OE2 2.95Å; N347-E350 PolarHBondContact ND2-OE1 3.12Å; N347-E350 WeakPolarHBondContact O-CB 3.43Å; N347-E350 PolarHBondContact O-N 3.14Å; N347-E350 VanDerWaalsContact O-N 3.1Å; Y348-E350 VanDerWaalsContact C-N 3.27Å; Y348-E350 PolarHBondContact O-N 3.44Å
351	V	94.8	Very high	92.9	Very high	12 Å²	12	66.3 Å²	66.3	7%	0.073	33%	0.331	C	S	.	.	S	Bend	trans	-92.2	120.4	-178.7	-170.9	0	0	0	0	109.9	V319 V346 Y348 T355 F356 F367	V319-V351 HydrophobicContact CB-CG1 4.23Å; V319-V351 HydrophobicContact CB-CG2 4.06Å; V319-V351 HydrophobicContact CG1-CG1 4.12Å; V319-V351 HydrophobicContact CG2-CG2 4.31Å; V346-V351 HydrophobicContact CG2-CG2 3.68Å; Y348-V351 PolarHBondContact O-N 3.2Å; V351-T355 HydrophobicContact CG1-CG2 3.91Å; V351-F356 HydrophobicContact CG1-CE2 3.62Å; V351-F356 HydrophobicContact CG1-CZ 3.95Å; V351-F367 HydrophobicContact CG2-CE2 4.08Å; V351-F367 HydrophobicContact CG2-CZ 4.07Å
352	Q	94.6	Very high	92.4	Very high	115 Å²	115	76.3 Å²	76.3	54%	0.537	37%	0.368	S	S	.	.			trans	-65.2	138	178.4	-62.6	-175.7	28.1	0	0	111	V321 A354 T355	V321-Q352 HydrophobicContact CG2-CB 4.19Å; V321-Q352 VanDerWaalsContact CG2-CD 3.48Å; V321-Q352 HydrophobicContact CG2-CG 4.22Å; Q352-A354 PolarHBondContact O-N 3.25Å; Q352-A354 VanDerWaalsContact O-N 3.1Å; Q352-T355 WeakPolarHBondContact O-CB 3.37Å; Q352-T355 PolarHBondContact O-N 3.19Å; Q352-T355 PolarHBondContact O-OG1 3.13Å
353	P	91.9	Very high	92	Very high	121 Å²	121	80.7 Å²	80.7	79%	0.786	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-55.9	-31.8	177	-28.1	35.5	0	0	0	113.8	T355 F356	P353-T355 PolarHBondContact O-N 2.75Å; P353-T355 VanDerWaalsContact O-N 3.15Å; P353-F356 PolarHBondContact O-N 3.44Å
354	A	93.6	Very high	91.8	Very high	46 Å²	46	74.8 Å²	74.8	38%	0.38	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-61.3	-20.3	177	0	0	0	0	0	113.8	V321 Q352 F356 R357	V321-A354 HydrophobicContact CG1-CB 3.98Å; Q352-A354 PolarHBondContact O-N 3.25Å; Q352-A354 VanDerWaalsContact O-N 3.1Å; A354-F356 PolarHBondContact O-N 3.33Å; A354-R357 WeakPolarHBondContact O-CB 3.01Å; A354-R357 WeakPolarHBondContact O-CG 3.31Å; A354-R357 PolarHBondContact O-N 3.33Å; A354-R357 PolarHBondContact O-NH1 2.99Å
355	T	95.4	Very high	91.6	Very high	1 Å²	1	75.3 Å²	75.3	1%	0.006	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-56.3	-34.8	174.7	-62	0	0	0	0	112.3	V319 G320 V321 F324 C325 V351 Q352 P353	V319-T355 HydrophobicContact CG1-CG2 3.75Å; G320-T355 WeakPolarHBondContact O-CG2 3.49Å; V321-T355 WeakPolarHBondContact CA-OG1 3.39Å; V321-T355 WeakPolarHBondContact O-CA 2.96Å; F324-T355 HydrophobicContact CD2-CG2 3.82Å; F324-T355 HydrophobicContact CE2-CG2 4.35Å; C325-T355 PolarHBondContact SG-O 3.17Å; V351-T355 HydrophobicContact CG1-CG2 3.91Å; Q352-T355 WeakPolarHBondContact O-CB 3.37Å; Q352-T355 PolarHBondContact O-N 3.19Å; Q352-T355 PolarHBondContact O-OG1 3.13Å; P353-T355 PolarHBondContact O-N 2.75Å; P353-T355 VanDerWaalsContact O-N 3.15Å
356	F	94.3	Very high	91.3	Very high	29 Å²	29	76.6 Å²	76.6	13%	0.127	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-106.5	21.4	-173.7	-56.5	-67.1	0	0	0	113.9	F324 I339 L341 V351 P353 A354 C358 V359 I365	F324-F356 HydrophobicContact CD2-CD1 4.24Å; F324-F356 AromaticContact CD2-CE1 3.83Å; F324-F356 HydrophobicContact CD2-CE1 3.83Å; F324-F356 AromaticContact CE2-CE1 3.79Å; F324-F356 HydrophobicContact CE2-CE1 3.79Å; F324-F356 HydrophobicContact CE2-CZ 4.47Å; I339-F356 HydrophobicContact CD1-CD1 3.98Å; I339-F356 HydrophobicContact CD1-CE1 4.22Å; I339-F356 HydrophobicContact CG2-CE1 4.37Å; L341-F356 HydrophobicContact CD1-CE1 4.07Å; L341-F356 HydrophobicContact CD1-CZ 3.79Å; V351-F356 HydrophobicContact CG1-CE2 3.62Å; V351-F356 HydrophobicContact CG1-CZ 3.95Å; P353-F356 PolarHBondContact O-N 3.44Å; A354-F356 PolarHBondContact O-N 3.33Å; F356-C358 PolarHBondContact O-N 2.65Å; F356-V359 HydrophobicContact CB-CG2 3.77Å; F356-V359 HydrophobicContact CD1-CG2 4.19Å; F356-V359 HydrophobicContact CG-CG2 4.45Å; F356-V359 WeakPolarHBondContact O-CB 3.38Å; F356-V359 WeakPolarHBondContact O-CG2 3.42Å; F356-V359 PolarHBondContact O-N 3.08Å; F356-V359 VanDerWaalsContact O-N 3.07Å; F356-I365 HydrophobicContact CB-CD1 3.56Å; F356-I365 HydrophobicContact CD1-CD1 4.02Å; F356-I365 HydrophobicContact CD1-CG1 4.42Å; F356-I365 HydrophobicContact CD2-CD1 3.92Å; F356-I365 HydrophobicContact CE1-CG2 4.34Å; F356-I365 HydrophobicContact CE2-CG2 4.43Å; F356-I365 HydrophobicContact CG-CD1 3.57Å; F356-I365 HydrophobicContact CG-CG1 4.43Å; F356-I365 HydrophobicContact CZ-CG2 4.24Å
357	R	92.8	Very high	90.9	Very high	100 Å²	100	78 Å²	78	38%	0.377	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-14.6	-178.6	65.8	-175.9	174.3	-83.7	10.1	116	V321 D322 C325 P326 A354	V321-R357 PolarHBondContact O-NH1 3.09Å; D322-R357 IonicContact OD1-CZ 3.17Å; D322-R357 IonicContact OD1-NH1 3.74Å; D322-R357 IonicContact OD1-NH2 2.9Å; D322-R357 PolarHBondContact OD1-NH2 3.11Å; C325-R357 HydrophobicContact CB-CG 3.7Å; C325-R357 VanDerWaalsContact CB-CZ 3.45Å; C325-R357 PolarHBondContact O-NH2 3.18Å; P326-R357 VanDerWaalsContact C-NH2 3.25Å; P326-R357 PolarHBondContact O-NE 3.45Å; P326-R357 PolarHBondContact O-NH2 3.07Å; A354-R357 WeakPolarHBondContact O-CB 3.01Å; A354-R357 WeakPolarHBondContact O-CG 3.31Å; A354-R357 PolarHBondContact O-N 3.33Å; A354-R357 PolarHBondContact O-NH1 2.99Å
358	C	91.5	Very high	89.7	Confident	20 Å²	20	77.3 Å²	77.3	14%	0.135	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	25.8	-179.1	69.1	0	0	0	0	112.7	C325 Y335 Y336 F356	C325-C358 WeakPolarHBondContact CA-SG 3.35Å; C325-C358 HydrophobicContact CB-CB 3.84Å; C325-C358 WeakPolarHBondContact CB-SG 3.37Å; C325-C358 VanDerWaalsContact SG-CA 3.6Å; C325-C358 WeakPolarHBondContact SG-CB 3.44Å; C325-C358 PolarHBondContact SG-N 3.32Å; C325-C358 CovalentContact SG-SG 2.03Å; C325-C358 PolarHBondContact SG-SG 3.37Å; Y335-C358 WeakPolarHBondContact CA-O 3.38Å; Y335-C358 WeakPolarHBondContact CD1-O 3.47Å; Y336-C358 PolarHBondContact N-O 3.19Å; Y336-C358 VanDerWaalsContact N-O 3.13Å; F356-C358 PolarHBondContact O-N 2.65Å
359	V	92.6	Very high	87.7	Confident	20 Å²	20	74.9 Å²	74.9	12%	0.121	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-102.3	141.1	172.5	-172.4	0	0	0	0	109.1	Y336 I339 F356 D361 A364 I365	Y336-V359 HydrophobicContact CD2-CG2 4.43Å; I339-V359 HydrophobicContact CD1-CG2 3.75Å; F356-V359 HydrophobicContact CB-CG2 3.77Å; F356-V359 HydrophobicContact CD1-CG2 4.19Å; F356-V359 HydrophobicContact CG-CG2 4.45Å; F356-V359 WeakPolarHBondContact O-CB 3.38Å; F356-V359 WeakPolarHBondContact O-CG2 3.42Å; F356-V359 PolarHBondContact O-N 3.08Å; F356-V359 VanDerWaalsContact O-N 3.07Å; V359-D361 WeakPolarHBondContact CG1-O 3.28Å; V359-A364 HydrophobicContact CG1-CB 3.65Å; V359-I365 HydrophobicContact CB-CD1 4.41Å; V359-I365 HydrophobicContact CB-CG1 4.49Å; V359-I365 HydrophobicContact CG1-CD1 4.3Å; V359-I365 HydrophobicContact CG1-CG1 3.93Å; V359-I365 HydrophobicContact CG2-CD1 4.29Å; V359-I365 HydrophobicContact CG2-CG1 4.34Å
360	N	84.5	Confident	85.7	Confident	117 Å²	117	74.9 Å²	74.9	63%	0.626	37%	0.374	S	S	*	.	S	Bend	trans	-76.8	-36.3	-173.8	-164.9	25	0	0	0	113.3	Y335 Y336	Y335-N360 HydrophobicContact CG-CB 4.47Å; Y336-N360 PolarHBondContact O-N 3.09Å
361	D	87.8	Confident	83.2	Confident	84 Å²	84	79 Å²	79	45%	0.449	39%	0.391	S	S	.	.			trans	-138.1	146	-175.8	-170.6	-10.2	0	0	0	110.2	V359 F363 A364	V359-D361 WeakPolarHBondContact CG1-O 3.28Å; D361-F363 PolarHBondContact O-N 2.89Å; D361-F363 WeakPolarHBondContact OD1-CD2 3.47Å; D361-F363 PolarHBondContact OD1-N 2.89Å; D361-F363 VanDerWaalsContact OD1-N 3.08Å; D361-A364 HydrophobicContact CB-CB 4.49Å; D361-A364 WeakPolarHBondContact O-CB 3.15Å; D361-A364 PolarHBondContact O-N 3.35Å; D361-A364 VanDerWaalsContact O-N 3.16Å
362	R	85.6	Confident	80.3	Confident	211 Å²	211	91.4 Å²	91.4	80%	0.796	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-60.2	-34.9	171.1	-174.8	178.5	179.6	178.6	-0.1	111.6	A364 I365	R362-A364 PolarHBondContact O-N 3.28Å; R362-I365 PolarHBondContact O-N 2.77Å; R362-I365 VanDerWaalsContact O-N 3.17Å
363	F	87.4	Confident	79.6	Confident	142 Å²	142	90.2 Å²	90.2	62%	0.623	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-68.9	-18	177.7	-66.5	-71.4	0	0	0	113.6	D361 I365 Y370	D361-F363 PolarHBondContact O-N 2.89Å; D361-F363 WeakPolarHBondContact OD1-CD2 3.47Å; D361-F363 PolarHBondContact OD1-N 2.89Å; D361-F363 VanDerWaalsContact OD1-N 3.08Å; F363-I365 PolarHBondContact O-N 3.44Å; F363-Y370 VanDerWaalsContact CD1-OH 3.25Å; F363-Y370 WeakPolarHBondContact CD1-OH 3.47Å; F363-Y370 WeakPolarHBondContact CE1-OH 2.87Å
364	A	90.2	Very high	78.9	Confident	12 Å²	12	88.6 Å²	88.6	10%	0.099	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-67.9	-18.7	173.3	0	0	0	0	0	112.4	N337 G338 I339 V359 D361 R362	N337-A364 VanDerWaalsContact O-CB 3.24Å; N337-A364 WeakPolarHBondContact O-CB 3.33Å; G338-A364 CarbonylContact C-O 3.07Å; G338-A364 WeakPolarHBondContact CA-O 3.36Å; I339-A364 PolarHBondContact N-O 3.44Å; V359-A364 HydrophobicContact CG1-CB 3.65Å; D361-A364 HydrophobicContact CB-CB 4.49Å; D361-A364 WeakPolarHBondContact O-CB 3.15Å; D361-A364 PolarHBondContact O-N 3.35Å; D361-A364 VanDerWaalsContact O-N 3.16Å; R362-A364 PolarHBondContact O-N 3.28Å
365	I	93	Very high	78.1	Confident	32 Å²	32	90.9 Å²	90.9	16%	0.164	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	102.1	-179.1	-51	167.1	0	0	0	108.7	F356 V359 R362 F363 F367	F356-I365 HydrophobicContact CB-CD1 3.56Å; F356-I365 HydrophobicContact CD1-CD1 4.02Å; F356-I365 HydrophobicContact CD1-CG1 4.42Å; F356-I365 HydrophobicContact CD2-CD1 3.92Å; F356-I365 HydrophobicContact CE1-CG2 4.34Å; F356-I365 HydrophobicContact CE2-CG2 4.43Å; F356-I365 HydrophobicContact CG-CD1 3.57Å; F356-I365 HydrophobicContact CG-CG1 4.43Å; F356-I365 HydrophobicContact CZ-CG2 4.24Å; V359-I365 HydrophobicContact CB-CD1 4.41Å; V359-I365 HydrophobicContact CB-CG1 4.49Å; V359-I365 HydrophobicContact CG1-CD1 4.3Å; V359-I365 HydrophobicContact CG1-CG1 3.93Å; V359-I365 HydrophobicContact CG2-CD1 4.29Å; V359-I365 HydrophobicContact CG2-CG1 4.34Å; R362-I365 PolarHBondContact O-N 2.77Å; R362-I365 VanDerWaalsContact O-N 3.17Å; F363-I365 PolarHBondContact O-N 3.44Å; I365-F367 PolarHBondContact O-N 2.78Å
366	Q	91.1	Very high	77.1	Confident	90 Å²	90	96.2 Å²	96.2	42%	0.421	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	85.8	173	-62	177.2	-1	0	0	109	I339 L341 F342	I339-Q366 PolarHBondContact O-N 2.79Å; L341-Q366 PolarHBondContact N-O 2.98Å; F342-Q366 HydrophobicContact CD1-CB 4.05Å; F342-Q366 HydrophobicContact CE1-CB 4.32Å; F342-Q366 PolarHBondContact N-O 2.69Å
367	F	84.5	Confident	76	Confident	35 Å²	35	100.4 Å²	100.4	15%	0.154	47%	0.468	C	S	.	.			trans	-95.6	144.5	165.6	-138.2	-82.1	0	0	0	108.1	L341 V346 Y348 V351 I365 N369	L341-F367 HydrophobicContact CB-CD2 3.77Å; L341-F367 HydrophobicContact CB-CE2 3.73Å; L341-F367 HydrophobicContact CD1-CD2 4.12Å; L341-F367 HydrophobicContact CD1-CE2 3.84Å; L341-F367 HydrophobicContact CG-CE2 4.45Å; V346-F367 HydrophobicContact CG1-CZ 4.16Å; Y348-F367 VanDerWaalsContact CB-CD1 3.42Å; Y348-F367 VanDerWaalsContact CB-CE1 3.5Å; V351-F367 HydrophobicContact CG2-CE2 4.08Å; V351-F367 HydrophobicContact CG2-CZ 4.07Å; I365-F367 PolarHBondContact O-N 2.78Å; F367-N369 PolarHBondContact O-N 3.3Å
368	G	65.8	Low	74.9	Confident	46 Å²	46	100.5 Å²	100.5	47%	0.474	47%	0.474	S	S	.	.	S	Bend	trans	-64.5	21	-168.9	0	0	0	0	0	117.3
369	N	48.6	Very low	73.7	Confident	76 Å²	76	106.2 Å²	106.2	41%	0.406	50%	0.498	S	S	.	.			trans	-119.3	77.2	177.2	-82.5	-15.4	0	0	0	111.5	Y348 F367	Y348-N369 WeakPolarHBondContact CD1-ND2 3.28Å; Y348-N369 WeakPolarHBondContact CE1-ND2 3.36Å; F367-N369 PolarHBondContact O-N 3.3Å
370	Y	46.3	Very low	72.2	Confident	161 Å²	161	112.8 Å²	112.8	63%	0.631	53%	0.527	S	S	*	.			trans	-109.2	62.7	135.1	-71.5	-83.4	0	0	0	107.9	F363 K372	F363-Y370 VanDerWaalsContact CD1-OH 3.25Å; F363-Y370 WeakPolarHBondContact CD1-OH 3.47Å; F363-Y370 WeakPolarHBondContact CE1-OH 2.87Å; Y370-K372 VanDerWaalsContact C-N 3.3Å; Y370-K372 PolarHBondContact O-N 2.62Å; Y370-K372 VanDerWaalsContact O-N 3.1Å
371	K	40.2	Very low	71.2	Confident	188 Å²	188	112.5 Å²	112.5	82%	0.817	52%	0.518	S	S	*	.			trans	-68.6	101.5	153.4	-79.3	-172.3	176.3	-179	0	105.6
372	K	34.2	Very low	69.7	Low	273 Å²	273	115.1 Å²	115.1	100%	1.187	53%	0.525	S	S	*	.			trans	-65.3	0	157.1	-88.4	-172.7	175.8	-179.9	0	109.3	Y370	Y370-K372 VanDerWaalsContact C-N 3.3Å; Y370-K372 PolarHBondContact O-N 2.62Å; Y370-K372 VanDerWaalsContact O-N 3.1Å

Retrieved 372 of 372 residues in 451.8 ms (Link to these results)

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