A0A059WQE7_HUMAN Loading...

MHC class I antigen

AlphaFold DB , UniProt , Accession A0A059WQE7, Species HUMAN (Homo sapiens, Human), Gene HLA-DQB1, Length 269 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.2	Very low	42	Very low	248 Å²	248	169.3 Å²	169.3	100%	1.222	87%	0.868	S	S	*	*				0	114	0	-78.1	154.9	90.4	0	0	108.8
2	S	34.2	Very low	42.9	Very low	128 Å²	128	159.7 Å²	159.7	90%	0.895	84%	0.842	S	S	*	*			trans	-171	116	145.5	-166.5	0	0	0	0	108.3
3	W	31.8	Very low	43.5	Very low	254 Å²	254	158.1 Å²	158.1	96%	0.962	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-78.2	145.4	-171.8	-93.1	-26.3	0	0	0	112.8	K5	W3-K5 PolarHBondContact O-N 3.35Å
4	K	40.2	Very low	44.3	Very low	209 Å²	209	160.6 Å²	160.6	91%	0.909	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-62.8	124.6	166.8	-64.1	179.4	177.1	-175.3	0	109.8
5	K	39.8	Very low	45.1	Very low	206 Å²	206	153.8 Å²	153.8	90%	0.896	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-83.6	116.1	165.9	-75.8	-174.9	-179.8	179.2	0	109.2	W3	W3-K5 PolarHBondContact O-N 3.35Å
6	A	49.3	Very low	46	Very low	97 Å²	97	147.8 Å²	147.8	80%	0.802	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-75.4	128.1	167.7	0	0	0	0	0	109.7	R8	A6-R8 PolarHBondContact O-N 3.13Å
7	L	43.4	Very low	46.7	Very low	170 Å²	170	143.9 Å²	143.9	89%	0.89	77%	0.766	S	S	*	*			trans	-74.9	109.6	171.2	-132.4	83	0	0	0	108.4
8	R	42.5	Very low	47.6	Very low	242 Å²	242	140.5 Å²	140.5	91%	0.913	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-79	117	169.5	-95.8	-176.9	178.4	-179.7	-0	109	A6	A6-R8 PolarHBondContact O-N 3.13Å
9	I	47.1	Very low	48.3	Very low	137 Å²	137	138.1 Å²	138.1	70%	0.703	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-76.4	131	169.1	-58.7	175.3	0	0	0	108.1	G11	I9-G11 PolarHBondContact O-N 3.48Å
10	P	42.3	Very low	48.8	Very low	106 Å²	106	137 Å²	137	69%	0.688	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-66	129.6	-176.7	-14.9	28.2	0	0	0	111.6	G12	P10-G12 PolarHBondContact O-N 3.39Å
11	G	52.2	Low	49.3	Very low	65 Å²	65	136.7 Å²	136.7	67%	0.67	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-2.2	-175.2	0	0	0	0	0	116.6	I9	I9-G11 PolarHBondContact O-N 3.48Å
12	G	53.3	Low	50.2	Low	54 Å²	54	130.1 Å²	130.1	56%	0.557	70%	0.701	S	S	*	*	H	α-helix	trans	-77.2	-29.4	-178.4	0	0	0	0	0	114.6	P10 A16	P10-G12 PolarHBondContact O-N 3.39Å; G12-A16 PolarHBondContact O-N 3.49Å
13	L	50.1	Low	51.5	Low	139 Å²	139	126.6 Å²	126.6	73%	0.728	68%	0.679	S	S	*	*	H	α-helix	trans	-72.4	-35.2	-174.7	-141.9	78.9	0	0	0	112.2	T17	L13-T17 PolarHBondContact O-N 2.81Å; L13-T17 PolarHBondContact O-OG1 3.32Å
14	R	54.2	Low	52.7	Low	194 Å²	194	121.3 Å²	121.3	73%	0.732	67%	0.667	S	S	*	*	H	α-helix	trans	-70.1	-40	-179.6	-75.2	-173.6	177.1	-179.1	-1.1	112.6	T17 V18	R14-T17 WeakPolarHBondContact CA-OG1 3.45Å; R14-T17 PolarHBondContact O-N 3.24Å; R14-T17 PolarHBondContact O-OG1 2.88Å; R14-V18 WeakPolarHBondContact O-CB 3.42Å; R14-V18 VanDerWaalsContact O-CG2 3.27Å; R14-V18 WeakPolarHBondContact O-CG2 3.36Å; R14-V18 PolarHBondContact O-N 3.14Å
15	A	57.1	Low	53.5	Low	58 Å²	58	118.2 Å²	118.2	48%	0.479	66%	0.659	S	S	.	*	H	α-helix	trans	-62.6	-48.4	177.8	0	0	0	0	0	110.5	T17 V18 T19	A15-T17 PolarHBondContact O-N 3.39Å; A15-V18 PolarHBondContact O-N 3.41Å; A15-V18 VanDerWaalsContact O-N 3.14Å; A15-T19 PolarHBondContact O-N 3.4Å; A15-T19 PolarHBondContact O-OG1 3.48Å
16	A	59.2	Low	54.3	Low	57 Å²	57	112.3 Å²	112.3	47%	0.471	64%	0.644	S	S	.	*	H	α-helix	trans	-59.2	-43	178.3	0	0	0	0	0	112.9	G12 T19 L20	G12-A16 PolarHBondContact O-N 3.49Å; A16-T19 PolarHBondContact O-N 2.97Å; A16-L20 WeakPolarHBondContact O-CB 3.41Å; A16-L20 PolarHBondContact O-N 3.02Å
17	T	58.3	Low	54.4	Low	82 Å²	82	111.8 Å²	111.8	50%	0.503	63%	0.631	S	S	.	*	H	α-helix	trans	-65.5	-37.2	175.4	33.1	0	0	0	0	113.4	L13 R14 A15 L20 M21	L13-T17 PolarHBondContact O-N 2.81Å; L13-T17 PolarHBondContact O-OG1 3.32Å; R14-T17 WeakPolarHBondContact CA-OG1 3.45Å; R14-T17 PolarHBondContact O-N 3.24Å; R14-T17 PolarHBondContact O-OG1 2.88Å; A15-T17 PolarHBondContact O-N 3.39Å; T17-L20 PolarHBondContact O-N 2.91Å; T17-M21 WeakPolarHBondContact O-CB 3.4Å; T17-M21 WeakPolarHBondContact O-CG 3.47Å; T17-M21 PolarHBondContact O-N 2.88Å
18	V	62.5	Low	54.8	Low	83 Å²	83	109.2 Å²	109.2	50%	0.503	63%	0.625	S	S	.	*	H	α-helix	trans	-71.9	-38.7	178.8	170.1	0	0	0	0	110.5	R14 A15 M21 L22	R14-V18 WeakPolarHBondContact O-CB 3.42Å; R14-V18 VanDerWaalsContact O-CG2 3.27Å; R14-V18 WeakPolarHBondContact O-CG2 3.36Å; R14-V18 PolarHBondContact O-N 3.14Å; A15-V18 PolarHBondContact O-N 3.41Å; A15-V18 VanDerWaalsContact O-N 3.14Å; V18-M21 PolarHBondContact O-N 3.01Å; V18-L22 HydrophobicContact CG1-CD1 3.7Å; V18-L22 WeakPolarHBondContact O-CB 3.32Å; V18-L22 WeakPolarHBondContact O-CD1 3.39Å; V18-L22 PolarHBondContact O-N 3.47Å
19	T	60.8	Low	55.2	Low	95 Å²	95	103.2 Å²	103.2	58%	0.583	62%	0.615	S	S	*	*	H	α-helix	trans	-65.9	-38.9	174.2	-41.8	0	0	0	0	111.8	A15 A16 A23	A15-T19 PolarHBondContact O-N 3.4Å; A15-T19 PolarHBondContact O-OG1 3.48Å; A16-T19 PolarHBondContact O-N 2.97Å; T19-A23 VanDerWaalsContact O-CB 3.29Å; T19-A23 WeakPolarHBondContact O-CB 3.18Å; T19-A23 PolarHBondContact O-N 3.28Å
20	L	58.8	Low	55.6	Low	116 Å²	116	100.7 Å²	100.7	61%	0.607	61%	0.614	S	S	*	*	H	α-helix	trans	-65.6	-43.3	174.5	-127.2	90.9	0	0	0	111.8	A16 T17 A23 M24	A16-L20 WeakPolarHBondContact O-CB 3.41Å; A16-L20 PolarHBondContact O-N 3.02Å; T17-L20 PolarHBondContact O-N 2.91Å; L20-A23 PolarHBondContact O-N 3.45Å; L20-M24 VanDerWaalsContact O-CG 3.22Å; L20-M24 WeakPolarHBondContact O-CG 3.32Å; L20-M24 PolarHBondContact O-N 3.45Å
21	M	59.5	Low	56	Low	131 Å²	131	104.2 Å²	104.2	65%	0.645	62%	0.621	S	S	*	*	H	α-helix	trans	-66.2	-41.3	178.1	-71.4	-86.3	-94.7	0	0	111.6	T17 V18 M24 L25	T17-M21 WeakPolarHBondContact O-CB 3.4Å; T17-M21 WeakPolarHBondContact O-CG 3.47Å; T17-M21 PolarHBondContact O-N 2.88Å; V18-M21 PolarHBondContact O-N 3.01Å; M21-M24 PolarHBondContact O-N 3.48Å; M21-L25 WeakPolarHBondContact O-CB 3.37Å; M21-L25 WeakPolarHBondContact O-CD1 3.34Å; M21-L25 WeakPolarHBondContact O-CG 3.4Å; M21-L25 PolarHBondContact O-N 2.94Å
22	L	58.3	Low	56.1	Low	110 Å²	110	103.9 Å²	103.9	58%	0.576	62%	0.618	S	S	*	*	H	α-helix	trans	-64.6	-40.4	174	-85.7	154.3	0	0	0	111.9	V18 L25 S26	V18-L22 HydrophobicContact CG1-CD1 3.7Å; V18-L22 WeakPolarHBondContact O-CB 3.32Å; V18-L22 WeakPolarHBondContact O-CD1 3.39Å; V18-L22 PolarHBondContact O-N 3.47Å; L22-L25 PolarHBondContact O-N 3Å; L22-S26 WeakPolarHBondContact O-CB 3.31Å; L22-S26 PolarHBondContact O-N 3.33Å; L22-S26 PolarHBondContact O-OG 3.39Å
23	A	60.2	Low	56.4	Low	53 Å²	53	112.5 Å²	112.5	44%	0.438	63%	0.634	S	S	.	*	H	α-helix	trans	-62.9	-41.9	175.9	0	0	0	0	0	111.9	T19 L20 S26	T19-A23 VanDerWaalsContact O-CB 3.29Å; T19-A23 WeakPolarHBondContact O-CB 3.18Å; T19-A23 PolarHBondContact O-N 3.28Å; L20-A23 PolarHBondContact O-N 3.45Å; A23-S26 WeakPolarHBondContact CA-OG 3.49Å; A23-S26 PolarHBondContact O-N 2.95Å; A23-S26 PolarHBondContact O-OG 2.86Å
24	M	58.3	Low	57.4	Low	143 Å²	143	113.5 Å²	113.5	70%	0.704	64%	0.64	S	S	*	*	H	α-helix	trans	-70.5	-29.3	176.4	-67.1	-67.2	-176.1	0	0	113.3	L20 M21	L20-M24 VanDerWaalsContact O-CG 3.22Å; L20-M24 WeakPolarHBondContact O-CG 3.32Å; L20-M24 PolarHBondContact O-N 3.45Å; M21-M24 PolarHBondContact O-N 3.48Å
25	L	57.4	Low	58.6	Low	144 Å²	144	109.2 Å²	109.2	75%	0.754	64%	0.64	S	S	*	*	H	α-helix	trans	-81.6	-17.7	174.3	-77.3	159	0	0	0	113	M21 L22	M21-L25 WeakPolarHBondContact O-CB 3.37Å; M21-L25 WeakPolarHBondContact O-CD1 3.34Å; M21-L25 WeakPolarHBondContact O-CG 3.4Å; M21-L25 PolarHBondContact O-N 2.94Å; L22-L25 PolarHBondContact O-N 3Å
26	S	55.7	Low	59.9	Low	82 Å²	82	112.5 Å²	112.5	57%	0.573	66%	0.656	S	S	*	*	S	Bend	trans	-95.7	2.5	-176.5	63	0	0	0	0	115.3	L22 A23 P28	L22-S26 WeakPolarHBondContact O-CB 3.31Å; L22-S26 PolarHBondContact O-N 3.33Å; L22-S26 PolarHBondContact O-OG 3.39Å; A23-S26 WeakPolarHBondContact CA-OG 3.49Å; A23-S26 PolarHBondContact O-N 2.95Å; A23-S26 PolarHBondContact O-OG 2.86Å; S26-P28 WeakPolarHBondContact O-CD 3.27Å
27	T	50.8	Low	61.4	Low	87 Å²	87	117.5 Å²	117.5	53%	0.534	67%	0.669	S	S	.	*			trans	-89.2	100	164	53.2	0	0	0	0	108.3	V29	T27-V29 PolarHBondContact O-N 3.31Å
28	P	52.8	Low	63.2	Low	116 Å²	116	119.4 Å²	119.4	75%	0.753	68%	0.677	S	S	*	*			trans	-65.7	91.1	149.3	31.1	-27.5	0	0	0	104.1	S26 A30	S26-P28 WeakPolarHBondContact O-CD 3.27Å; P28-A30 PolarHBondContact O-N 3.11Å
29	V	50.3	Low	64.7	Low	116 Å²	116	121.3 Å²	121.3	70%	0.703	68%	0.678	S	S	*	*			trans	-66.9	77.5	146.8	-178	0	0	0	0	103.3	T27 E31	T27-V29 PolarHBondContact O-N 3.31Å; V29-E31 HydrophobicContact CG1-CB 4.43Å; V29-E31 PolarHBondContact O-N 3.4Å
30	A	55	Low	66.5	Low	84 Å²	84	119.2 Å²	119.2	69%	0.694	67%	0.665	S	S	*	*			trans	-59.8	93.6	146.1	0	0	0	0	0	102.2	P28 G32	P28-A30 PolarHBondContact O-N 3.11Å; A30-G32 PolarHBondContact O-N 3.46Å
31	E	50.7	Low	68.3	Low	179 Å²	179	121.3 Å²	121.3	84%	0.836	67%	0.666	S	S	*	*			trans	-55.6	87.2	157.4	-162.2	165.3	-155.2	0	0	103.2	V29 R33	V29-E31 HydrophobicContact CG1-CB 4.43Å; V29-E31 PolarHBondContact O-N 3.4Å; E31-R33 PolarHBondContact O-N 3.34Å
32	G	54.9	Low	70.2	Confident	58 Å²	58	118.4 Å²	118.4	60%	0.598	65%	0.651	S	S	*	*			trans	-59.9	101.6	174.6	0	0	0	0	0	103	A30 D34	A30-G32 PolarHBondContact O-N 3.46Å; G32-D34 PolarHBondContact O-N 3.25Å
33	R	60.3	Low	72.1	Confident	236 Å²	236	118.7 Å²	118.7	89%	0.891	65%	0.648	S	S	*	*			trans	-44.7	115.9	162.8	-99.1	176.9	167.7	159.6	-3.2	104.7	E31 S35	E31-R33 PolarHBondContact O-N 3.34Å; R33-S35 PolarHBondContact O-N 2.98Å
34	D	70.5	Confident	73.9	Confident	160 Å²	160	120.5 Å²	120.5	86%	0.856	65%	0.646	S	S	*	*			trans	-47	114.8	172.2	-88.2	-31.8	0	0	0	106.3	G32	G32-D34 PolarHBondContact O-N 3.25Å
35	S	78.4	Confident	75.8	Confident	104 Å²	104	116 Å²	116	73%	0.727	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-56	131.7	172.3	-68.6	0	0	0	0	106	R33 E37	R33-S35 PolarHBondContact O-N 2.98Å; S35-E37 PolarHBondContact O-N 3.45Å
36	P	86.1	Confident	77.8	Confident	126 Å²	126	112.6 Å²	112.6	82%	0.818	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-55.2	131.6	-178.4	20.1	-30	0	0	0	109.6
37	E	90.9	Very high	79.8	Confident	163 Å²	163	110.7 Å²	110.7	76%	0.762	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-66.8	133.6	173.8	-63.2	-176.7	173.5	0	0	109.2	S35 F39	S35-E37 PolarHBondContact O-N 3.45Å; E37-F39 HydrophobicContact CB-CE2 3.79Å; E37-F39 HydrophobicContact CB-CZ 4.12Å; E37-F39 WeakPolarHBondContact OE2-CZ 3.36Å
38	D	94.3	Very high	82.1	Confident	122 Å²	122	111.1 Å²	111.1	65%	0.652	59%	0.591	S	S	*	*			trans	-117	137	178	-169.2	11.7	0	0	0	110.2	V40	D38-V40 WeakPolarHBondContact OD2-CG2 3.33Å
39	F	95.6	Very high	84.3	Confident	122 Å²	122	109 Å²	109	54%	0.535	57%	0.57	S	S	.	*			trans	-133	106	-179	-59.5	-77.1	0	0	0	108.7	E37 Y64	E37-F39 HydrophobicContact CB-CE2 3.79Å; E37-F39 HydrophobicContact CB-CZ 4.12Å; E37-F39 WeakPolarHBondContact OE2-CZ 3.36Å; F39-Y64 HydrophobicContact CB-CE2 4.43Å; F39-Y64 WeakPolarHBondContact CD1-OH 3.35Å
40	V	97.8	Very high	86.5	Confident	52 Å²	52	107.7 Å²	107.7	32%	0.315	56%	0.562	S	S	.	*			trans	-108.5	120.8	-169.5	-174.9	0	0	0	0	110.2	D38 Q42 N65	D38-V40 WeakPolarHBondContact OD2-CG2 3.33Å; V40-Q42 HydrophobicContact CG1-CG 3.88Å; V40-N65 PolarHBondContact N-OD1 3.3Å; V40-N65 WeakPolarHBondContact O-CA 3.31Å; V40-N65 PolarHBondContact O-N 3.13Å
41	Y	97.7	Very high	88.5	Confident	159 Å²	159	109.6 Å²	109.6	62%	0.624	56%	0.561	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99.8	131.4	166.1	-84.8	-85.7	0	0	0	110.3	Y64 Y69	Y41-Y64 AromaticContact CD1-CD2 3.96Å; Y41-Y64 HydrophobicContact CD1-CD2 3.96Å; Y41-Y64 AromaticContact CD2-CD2 3.73Å; Y41-Y64 HydrophobicContact CD2-CD2 3.73Å; Y41-Y64 AromaticContact CD2-CE2 3.94Å; Y41-Y64 HydrophobicContact CD2-CE2 3.94Å; Y41-Y64 AromaticContact CE1-CD2 3.57Å; Y41-Y64 HydrophobicContact CE1-CD2 3.57Å; Y41-Y64 HydrophobicContact CE1-CE2 4.4Å; Y41-Y64 HydrophobicContact CE1-CG 4.15Å; Y41-Y64 AromaticContact CE2-CD2 3.31Å; Y41-Y64 HydrophobicContact CE2-CD2 3.31Å; Y41-Y64 AromaticContact CE2-CE2 3.34Å; Y41-Y64 HydrophobicContact CE2-CE2 3.34Å; Y41-Y64 HydrophobicContact CG-CD2 4.04Å; Y41-Y64 AromaticContact CZ-CD2 3.22Å; Y41-Y64 AromaticContact CZ-CE2 3.61Å; Y41-Y69 HydrophobicContact CE1-CE1 4.17Å
42	Q	98.5	Very high	90.6	Very high	70 Å²	70	102.4 Å²	102.4	33%	0.327	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	138.5	175.4	-53.1	171.3	62	0	0	109.9	V40 I63 N65	V40-Q42 HydrophobicContact CG1-CG 3.88Å; Q42-I63 HydrophobicContact CB-CB 4.16Å; Q42-I63 PolarHBondContact N-O 3.09Å; Q42-I63 PolarHBondContact O-N 3.48Å; Q42-N65 PolarHBondContact NE2-O 3.01Å
43	F	98.3	Very high	92.6	Very high	117 Å²	117	101.7 Å²	101.7	51%	0.513	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131.4	169.1	171.2	-104.1	0	0	0	108.8	A45 T60 R61 Y62	F43-A45 HydrophobicContact CE1-CB 3.78Å; F43-A45 HydrophobicContact CZ-CB 3.91Å; F43-T60 HydrophobicContact CE2-CG2 4.11Å; F43-T60 HydrophobicContact CZ-CG2 3.97Å; F43-R61 WeakPolarHBondContact CA-O 3.48Å; F43-Y62 HydrophobicContact CD2-CD1 4.07Å; F43-Y62 AromaticContact CD2-CE1 3.75Å; F43-Y62 HydrophobicContact CD2-CE1 3.75Å; F43-Y62 HydrophobicContact CD2-CE2 4.36Å; F43-Y62 AromaticContact CD2-CZ 3.9Å; F43-Y62 AromaticContact CE2-CE1 3.99Å; F43-Y62 HydrophobicContact CE2-CE1 3.99Å; F43-Y62 HydrophobicContact CE2-CE2 4.11Å; F43-Y62 AromaticContact CE2-CZ 3.68Å
44	K	98.6	Very high	94.3	Very high	91 Å²	91	97.6 Å²	97.6	40%	0.396	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	117.2	176.7	-60	-174.2	-179.2	-179.3	0	109.9	M46 T60 R61 I63	K44-M46 HydrophobicContact CB-CG 4.42Å; K44-M46 HydrophobicContact CB-SD 4.22Å; K44-T60 CarbonylContact O-C 3.46Å; K44-T60 VanDerWaalsContact O-CA 3.3Å; K44-T60 WeakPolarHBondContact O-CA 3.38Å; K44-R61 HydrophobicContact CB-CB 4.36Å; K44-R61 PolarHBondContact N-O 2.92Å; K44-R61 PolarHBondContact O-N 3.25Å; K44-I63 HydrophobicContact CD-CD1 3.86Å; K44-I63 HydrophobicContact CG-CD1 4.19Å
45	A	98.2	Very high	95.6	Very high	49 Å²	49	97.4 Å²	97.4	41%	0.405	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	107.6	171.6	0	0	0	0	0	109.1	F43 Y58 T60	F43-A45 HydrophobicContact CE1-CB 3.78Å; F43-A45 HydrophobicContact CZ-CB 3.91Å; A45-Y58 HydrophobicContact CB-CE2 4.05Å; A45-T60 HydrophobicContact CB-CG2 4.36Å
46	M	98.5	Very high	96.5	Very high	72 Å²	72	93 Å²	93	36%	0.355	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129.8	-171.9	-54.1	-63.2	-65.7	0	0	110.2	K44 Y48 Y58 V59	K44-M46 HydrophobicContact CB-CG 4.42Å; K44-M46 HydrophobicContact CB-SD 4.22Å; M46-Y48 HydrophobicContact CB-CD2 4.39Å; M46-Y48 HydrophobicContact CB-CE2 3.61Å; M46-Y58 WeakPolarHBondContact O-CA 3.13Å; M46-Y58 WeakPolarHBondContact O-CD2 3.38Å; M46-V59 HydrophobicContact CB-CB 4.46Å; M46-V59 PolarHBondContact N-O 2.98Å; M46-V59 PolarHBondContact O-N 3.41Å
47	C	98.6	Very high	97.1	Very high	41 Å²	41	91.1 Å²	91.1	28%	0.277	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	118.4	171.3	-60.2	0	0	0	0	109.1	F49 C111	C47-F49 HydrophobicContact CB-CD2 4.4Å; C47-F49 HydrophobicContact CB-CE1 4.48Å; C47-F49 HydrophobicContact CB-CE2 3.48Å; C47-F49 VanDerWaalsContact CB-CE2 3.48Å; C47-F49 HydrophobicContact CB-CZ 3.53Å; C47-C111 HydrophobicContact CB-CB 3.57Å; C47-C111 WeakPolarHBondContact CB-SG 3.48Å; C47-C111 WeakPolarHBondContact SG-CA 3.34Å; C47-C111 WeakPolarHBondContact SG-CB 3.39Å; C47-C111 CovalentContact SG-SG 2.03Å; C47-C111 PolarHBondContact SG-SG 3.45Å
48	Y	98.4	Very high	97.5	Very high	96 Å²	96	83.6 Å²	83.6	38%	0.376	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	123.4	176.8	-57.9	-86.4	0	0	0	109.3	M46 V56 R57 V59	M46-Y48 HydrophobicContact CB-CD2 4.39Å; M46-Y48 HydrophobicContact CB-CE2 3.61Å; Y48-V56 WeakPolarHBondContact O-CA 3.29Å; Y48-R57 PolarHBondContact N-O 2.92Å; Y48-R57 PolarHBondContact O-N 3.47Å; Y48-V59 HydrophobicContact CD2-CG2 4.3Å; Y48-V59 HydrophobicContact CE2-CB 4.23Å; Y48-V59 HydrophobicContact CE2-CG2 3.93Å
49	F	98.3	Very high	97.7	Very high	73 Å²	73	77.8 Å²	77.8	32%	0.32	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	128.7	-175.9	-59.1	-82.6	0	0	0	110.2	C47 V56 C111 Y115	C47-F49 HydrophobicContact CB-CD2 4.4Å; C47-F49 HydrophobicContact CB-CE1 4.48Å; C47-F49 HydrophobicContact CB-CE2 3.48Å; C47-F49 VanDerWaalsContact CB-CE2 3.48Å; C47-F49 HydrophobicContact CB-CZ 3.53Å; F49-V56 HydrophobicContact CD1-CG1 4.01Å; F49-V56 HydrophobicContact CD1-CG2 3.87Å; F49-V56 HydrophobicContact CE1-CG1 3.82Å; F49-V56 HydrophobicContact CE1-CG2 4.18Å; F49-C111 HydrophobicContact CE1-CB 4.08Å; F49-C111 WeakPolarHBondContact CE1-O 3.35Å; F49-C111 HydrophobicContact CZ-CB 3.91Å; F49-C111 WeakPolarHBondContact CZ-O 3.44Å; F49-Y115 HydrophobicContact CB-CD2 4.24Å; F49-Y115 HydrophobicContact CB-CE2 4.02Å; F49-Y115 AromaticContact CD1-CD2 3.42Å; F49-Y115 HydrophobicContact CD1-CD2 3.42Å; F49-Y115 VanDerWaalsContact CD1-CD2 3.42Å; F49-Y115 HydrophobicContact CD1-CE2 4.01Å; F49-Y115 HydrophobicContact CD1-CG 4Å; F49-Y115 AromaticContact CD2-CD2 3.89Å; F49-Y115 HydrophobicContact CD2-CD2 3.89Å; F49-Y115 HydrophobicContact CD2-CE2 4.34Å; F49-Y115 AromaticContact CE1-CD2 3.61Å; F49-Y115 HydrophobicContact CE1-CD2 3.61Å; F49-Y115 AromaticContact CE1-CG 3.9Å; F49-Y115 HydrophobicContact CE1-CG 3.9Å; F49-Y115 HydrophobicContact CE2-CD2 4.05Å; F49-Y115 AromaticContact CG-CD2 3.58Å; F49-Y115 HydrophobicContact CG-CD2 3.58Å; F49-Y115 AromaticContact CG-CE2 3.87Å; F49-Y115 HydrophobicContact CG-CE2 3.87Å; F49-Y115 AromaticContact CZ-CD2 3.91Å; F49-Y115 HydrophobicContact CZ-CD2 3.91Å; F49-Y115 HydrophobicContact CZ-CG 4.36Å
50	T	97.8	Very high	97.9	Very high	87 Å²	87	72 Å²	72	53%	0.534	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	130.3	175.2	-56.8	0	0	0	0	109.2	R55	T50-R55 PolarHBondContact N-O 3.03Å; T50-R55 PolarHBondContact O-N 3.4Å
51	N	96.3	Very high	97.9	Very high	124 Å²	124	72.9 Å²	72.9	66%	0.663	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	59	-174.5	-162.6	23.2	0	0	0	112.3	T53 E54	N51-T53 PolarHBondContact O-N 3.43Å; N51-E54 HydrophobicContact CB-CB 4.33Å; N51-E54 PolarHBondContact ND2-OE2 2.89Å; N51-E54 WeakPolarHBondContact O-CB 3.45Å; N51-E54 PolarHBondContact O-N 3.04Å
52	G	94.6	Very high	97.9	Very high	28 Å²	28	67.5 Å²	67.5	29%	0.289	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	-124.5	-173.3	0	0	0	0	0	111.9	Y115	G52-Y115 WeakPolarHBondContact CA-OH 3.12Å
53	T	96.9	Very high	98	Very high	43 Å²	43	64.9 Å²	64.9	26%	0.264	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	10.7	174.5	54.7	0	0	0	0	112.5	N51 R55 R112 Y115	N51-T53 PolarHBondContact O-N 3.43Å; T53-R55 VanDerWaalsContact C-N 3.34Å; T53-R55 PolarHBondContact O-N 2.89Å; T53-R112 PolarHBondContact O-NH1 3.25Å; T53-Y115 HydrophobicContact CG2-CD1 3.33Å; T53-Y115 HydrophobicContact CG2-CE1 3.85Å; T53-Y115 HydrophobicContact CG2-CG 3.74Å
54	E	96.1	Very high	97.9	Very high	150 Å²	150	62.1 Å²	62.1	70%	0.701	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-45	-179.4	-166.3	179.6	-146.6	0	0	111.3	N51	N51-E54 HydrophobicContact CB-CB 4.33Å; N51-E54 PolarHBondContact ND2-OE2 2.89Å; N51-E54 WeakPolarHBondContact O-CB 3.45Å; N51-E54 PolarHBondContact O-N 3.04Å
55	R	97.6	Very high	97.9	Very high	157 Å²	157	60.6 Å²	60.6	59%	0.592	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.8	121.2	169.6	-178.2	176.2	-178	171.3	1.9	110.2	T50 T53	T50-R55 PolarHBondContact N-O 3.03Å; T50-R55 PolarHBondContact O-N 3.4Å; T53-R55 VanDerWaalsContact C-N 3.34Å; T53-R55 PolarHBondContact O-N 2.89Å
56	V	98.4	Very high	97.8	Very high	11 Å²	11	69.6 Å²	69.6	7%	0.067	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	135.1	176.3	-172.6	0	0	0	0	108.3	Y48 F49 L107 C111 R112	Y48-V56 WeakPolarHBondContact O-CA 3.29Å; F49-V56 HydrophobicContact CD1-CG1 4.01Å; F49-V56 HydrophobicContact CD1-CG2 3.87Å; F49-V56 HydrophobicContact CE1-CG1 3.82Å; F49-V56 HydrophobicContact CE1-CG2 4.18Å; V56-L107 HydrophobicContact CB-CD1 4.16Å; V56-L107 HydrophobicContact CG1-CD1 3.86Å; V56-C111 HydrophobicContact CG1-CB 3.76Å; V56-R112 HydrophobicContact CG2-CG 4.15Å
57	R	98.5	Very high	97.8	Very high	87 Å²	87	70.9 Å²	70.9	33%	0.328	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	127.6	172.3	179	-177.4	173	-169.6	1.7	109.6	Y48 V59 D73 S74 D75	Y48-R57 PolarHBondContact N-O 2.92Å; Y48-R57 PolarHBondContact O-N 3.47Å; R57-V59 HydrophobicContact CG-CG2 4.05Å; R57-D73 IonicContact CZ-OD1 2.7Å; R57-D73 IonicContact CZ-OD2 2.93Å; R57-D73 IonicContact NE-OD1 2.67Å; R57-D73 PolarHBondContact NE-OD1 2.91Å; R57-D73 IonicContact NE-OD2 3.85Å; R57-D73 PolarHBondContact NE-OD2 3.5Å; R57-D73 IonicContact NH2-OD1 3.85Å; R57-D73 IonicContact NH2-OD2 3.62Å; R57-D73 PolarHBondContact NH2-OD2 2.99Å; R57-S74 WeakPolarHBondContact CA-OG 3.22Å; R57-D75 WeakPolarHBondContact CD-OD2 3.33Å; R57-D75 IonicContact NE-OD2 3.26Å
58	Y	98.8	Very high	97.8	Very high	4 Å²	4	70.2 Å²	70.2	2%	0.016	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	129.7	177.4	-180	-127	0	0	0	110.3	A45 M46 T60 F72 S74 T103 E106 C111	A45-Y58 HydrophobicContact CB-CE2 4.05Å; M46-Y58 WeakPolarHBondContact O-CA 3.13Å; M46-Y58 WeakPolarHBondContact O-CD2 3.38Å; Y58-T60 HydrophobicContact CE1-CG2 3.61Å; Y58-T60 HydrophobicContact CE2-CG2 4.03Å; Y58-T60 WeakPolarHBondContact OH-CG2 3.12Å; Y58-F72 HydrophobicContact CD1-CD1 4.22Å; Y58-F72 HydrophobicContact CD1-CE1 4.14Å; Y58-S74 PolarHBondContact N-OG 2.97Å; Y58-S74 PolarHBondContact O-N 3.45Å; Y58-S74 PolarHBondContact O-OG 3.4Å; Y58-T103 HydrophobicContact CE1-CG2 4.15Å; Y58-E106 HydrophobicContact CD1-CB 4.12Å; Y58-E106 HydrophobicContact CE1-CB 3.51Å; Y58-E106 HydrophobicContact CE1-CG 4.48Å; Y58-E106 VanDerWaalsContact CE1-OE2 3.27Å; Y58-E106 WeakPolarHBondContact CE1-OE2 3.32Å; Y58-E106 VanDerWaalsContact CZ-OE2 3.28Å; Y58-E106 PolarHBondContact OH-OE2 3.33Å; Y58-C111 WeakPolarHBondContact CD2-SG 3.25Å
59	V	98.8	Very high	97.8	Very high	1 Å²	1	66.5 Å²	66.5	1%	0.006	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	120.5	179.2	-175.8	0	0	0	0	109.4	M46 Y48 R57 R61 R71 F72	M46-V59 HydrophobicContact CB-CB 4.46Å; M46-V59 PolarHBondContact N-O 2.98Å; M46-V59 PolarHBondContact O-N 3.41Å; Y48-V59 HydrophobicContact CD2-CG2 4.3Å; Y48-V59 HydrophobicContact CE2-CB 4.23Å; Y48-V59 HydrophobicContact CE2-CG2 3.93Å; R57-V59 HydrophobicContact CG-CG2 4.05Å; V59-R61 HydrophobicContact CG1-CG 4.02Å; V59-R71 HydrophobicContact CG1-CG 3.95Å; V59-F72 CarbonylContact C-O 3.59Å; V59-F72 VanDerWaalsContact CA-O 3.28Å; V59-F72 WeakPolarHBondContact CA-O 3.48Å; V59-F72 WeakPolarHBondContact CG1-O 3.21Å
60	T	98.7	Very high	97.8	Very high	1 Å²	1	63 Å²	63	1%	0.006	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	136.8	167.4	67.1	0	0	0	0	110	F43 K44 A45 Y58 R71 F72	F43-T60 HydrophobicContact CE2-CG2 4.11Å; F43-T60 HydrophobicContact CZ-CG2 3.97Å; K44-T60 CarbonylContact O-C 3.46Å; K44-T60 VanDerWaalsContact O-CA 3.3Å; K44-T60 WeakPolarHBondContact O-CA 3.38Å; A45-T60 HydrophobicContact CB-CG2 4.36Å; Y58-T60 HydrophobicContact CE1-CG2 3.61Å; Y58-T60 HydrophobicContact CE2-CG2 4.03Å; Y58-T60 WeakPolarHBondContact OH-CG2 3.12Å; T60-R71 VanDerWaalsContact O-CA 3.22Å; T60-R71 WeakPolarHBondContact O-CA 3.34Å; T60-R71 WeakPolarHBondContact O-CG 3.07Å; T60-F72 PolarHBondContact N-O 2.99Å; T60-F72 PolarHBondContact O-N 3.45Å; T60-F72 WeakPolarHBondContact OG1-CB 3.45Å
61	R	98.7	Very high	97.9	Very high	69 Å²	69	61.6 Å²	61.6	26%	0.26	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	129.8	-179.8	-55	-173.4	175.9	-140.9	7.3	109.9	F43 K44 V59 I63 E68	F43-R61 WeakPolarHBondContact CA-O 3.48Å; K44-R61 HydrophobicContact CB-CB 4.36Å; K44-R61 PolarHBondContact N-O 2.92Å; K44-R61 PolarHBondContact O-N 3.25Å; V59-R61 HydrophobicContact CG1-CG 4.02Å; R61-I63 HydrophobicContact CB-CD1 4.31Å; R61-I63 HydrophobicContact CB-CG1 4.27Å; R61-E68 HydrophobicContact CB-CG 4.23Å; R61-E68 VanDerWaalsContact CG-OE1 3.29Å; R61-E68 WeakPolarHBondContact CG-OE1 3.45Å; R61-E68 IonicContact CZ-OE2 3.46Å; R61-E68 IonicContact NE-OE1 3.67Å; R61-E68 IonicContact NE-OE2 2.65Å; R61-E68 IonicContact NH1-OE1 3.61Å; R61-E68 IonicContact NH1-OE2 3.48Å; R61-E68 PolarHBondContact NH1-OE2 2.89Å
62	Y	98.6	Very high	98	Very high	46 Å²	46	55.8 Å²	55.8	18%	0.18	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	118.8	175.3	-62.1	-99	0	0	0	108	F43 E68 Y69 A70 Y79 W93	F43-Y62 HydrophobicContact CD2-CD1 4.07Å; F43-Y62 AromaticContact CD2-CE1 3.75Å; F43-Y62 HydrophobicContact CD2-CE1 3.75Å; F43-Y62 HydrophobicContact CD2-CE2 4.36Å; F43-Y62 AromaticContact CD2-CZ 3.9Å; F43-Y62 AromaticContact CE2-CE1 3.99Å; F43-Y62 HydrophobicContact CE2-CE1 3.99Å; F43-Y62 HydrophobicContact CE2-CE2 4.11Å; F43-Y62 AromaticContact CE2-CZ 3.68Å; Y62-E68 CarbonylContact O-C 3.51Å; Y62-E68 WeakPolarHBondContact O-CA 3.29Å; Y62-Y69 VanDerWaalsContact O-CD1 3.31Å; Y62-Y69 WeakPolarHBondContact O-CD1 3.24Å; Y62-Y69 PolarHBondContact O-N 3.14Å; Y62-A70 PolarHBondContact N-O 2.83Å; Y62-Y79 HydrophobicContact CE2-CD1 4.38Å; Y62-Y79 AromaticContact CE2-CE1 3.9Å; Y62-Y79 HydrophobicContact CE2-CE1 3.9Å; Y62-W93 AromaticContact CD1-CH2 3.53Å; Y62-W93 HydrophobicContact CD1-CH2 3.53Å; Y62-W93 HydrophobicContact CD1-CZ2 4.18Å; Y62-W93 HydrophobicContact CD1-CZ3 4.29Å; Y62-W93 AromaticContact CD2-CH2 3.85Å; Y62-W93 HydrophobicContact CD2-CH2 3.85Å; Y62-W93 AromaticContact CD2-CZ3 3.77Å; Y62-W93 HydrophobicContact CD2-CZ3 3.77Å; Y62-W93 AromaticContact CE1-CH2 3.62Å; Y62-W93 HydrophobicContact CE1-CH2 3.62Å; Y62-W93 AromaticContact CE1-CZ2 3.98Å; Y62-W93 HydrophobicContact CE1-CZ2 3.98Å; Y62-W93 HydrophobicContact CE1-CZ3 4.29Å; Y62-W93 AromaticContact CE2-CH2 3.97Å; Y62-W93 HydrophobicContact CE2-CH2 3.97Å; Y62-W93 AromaticContact CE2-CZ3 3.8Å; Y62-W93 HydrophobicContact CE2-CZ3 3.8Å; Y62-W93 AromaticContact CG-CH2 3.64Å; Y62-W93 HydrophobicContact CG-CH2 3.64Å; Y62-W93 HydrophobicContact CG-CZ3 4.03Å; Y62-W93 AromaticContact CZ-CH2 3.84Å
63	I	98.8	Very high	98.2	Very high	15 Å²	15	55 Å²	55	8%	0.077	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	125.1	-167.4	-53.6	168.5	0	0	0	108.4	Q42 K44 R61 E67 E68	Q42-I63 HydrophobicContact CB-CB 4.16Å; Q42-I63 PolarHBondContact N-O 3.09Å; Q42-I63 PolarHBondContact O-N 3.48Å; K44-I63 HydrophobicContact CD-CD1 3.86Å; K44-I63 HydrophobicContact CG-CD1 4.19Å; R61-I63 HydrophobicContact CB-CD1 4.31Å; R61-I63 HydrophobicContact CB-CG1 4.27Å; I63-E67 CarbonylContact C-O 3.55Å; I63-E67 WeakPolarHBondContact CA-O 3.42Å; I63-E68 HydrophobicContact CG1-CB 4.08Å; I63-E68 HydrophobicContact CG1-CG 4.33Å
64	Y	98.2	Very high	98.3	Very high	60 Å²	60	53.9 Å²	53.9	24%	0.235	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.1	170.6	-179	-116.1	0	0	0	108.9	F39 Y41 R66 E67 L85	F39-Y64 HydrophobicContact CB-CE2 4.43Å; F39-Y64 WeakPolarHBondContact CD1-OH 3.35Å; Y41-Y64 AromaticContact CD1-CD2 3.96Å; Y41-Y64 HydrophobicContact CD1-CD2 3.96Å; Y41-Y64 AromaticContact CD2-CD2 3.73Å; Y41-Y64 HydrophobicContact CD2-CD2 3.73Å; Y41-Y64 AromaticContact CD2-CE2 3.94Å; Y41-Y64 HydrophobicContact CD2-CE2 3.94Å; Y41-Y64 AromaticContact CE1-CD2 3.57Å; Y41-Y64 HydrophobicContact CE1-CD2 3.57Å; Y41-Y64 HydrophobicContact CE1-CE2 4.4Å; Y41-Y64 HydrophobicContact CE1-CG 4.15Å; Y41-Y64 AromaticContact CE2-CD2 3.31Å; Y41-Y64 HydrophobicContact CE2-CD2 3.31Å; Y41-Y64 AromaticContact CE2-CE2 3.34Å; Y41-Y64 HydrophobicContact CE2-CE2 3.34Å; Y41-Y64 HydrophobicContact CG-CD2 4.04Å; Y41-Y64 AromaticContact CZ-CD2 3.22Å; Y41-Y64 AromaticContact CZ-CE2 3.61Å; Y64-R66 PolarHBondContact O-N 2.98Å; Y64-E67 PolarHBondContact N-O 3.22Å; Y64-E67 PolarHBondContact O-N 3.42Å; Y64-L85 HydrophobicContact CD1-CD2 4.26Å
65	N	96.9	Very high	98.4	Very high	59 Å²	59	51 Å²	51	32%	0.316	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	-96.6	-164.7	-63.2	-37.4	0	0	0	111.5	V40 Q42	V40-N65 PolarHBondContact N-OD1 3.3Å; V40-N65 WeakPolarHBondContact O-CA 3.31Å; V40-N65 PolarHBondContact O-N 3.13Å; Q42-N65 PolarHBondContact NE2-O 3.01Å
66	R	97.2	Very high	98.4	Very high	238 Å²	238	46.1 Å²	46.1	90%	0.898	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-125.4	6.3	176.7	-61.3	-179.9	67	178.5	1.1	112.6	Y64	Y64-R66 PolarHBondContact O-N 2.98Å
67	E	98.3	Very high	98.4	Very high	98 Å²	98	50.9 Å²	50.9	46%	0.458	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	113.1	-178.2	-172.1	177.9	161.2	0	0	109.6	I63 Y64 Y69 T83	I63-E67 CarbonylContact C-O 3.55Å; I63-E67 WeakPolarHBondContact CA-O 3.42Å; Y64-E67 PolarHBondContact N-O 3.22Å; Y64-E67 PolarHBondContact O-N 3.42Å; E67-Y69 PolarHBondContact O-N 3.38Å; E67-T83 HydrophobicContact CG-CG2 3.81Å; E67-T83 WeakPolarHBondContact OE1-CB 2.99Å; E67-T83 WeakPolarHBondContact OE1-CG2 3.02Å; E67-T83 PolarHBondContact OE1-OG1 3.47Å
68	E	98.6	Very high	98.3	Very high	28 Å²	28	48.8 Å²	48.8	13%	0.131	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	112.9	170.5	-179.7	-178.3	176.6	0	0	108.7	R61 Y62 I63 R71 V82 T83	R61-E68 HydrophobicContact CB-CG 4.23Å; R61-E68 VanDerWaalsContact CG-OE1 3.29Å; R61-E68 WeakPolarHBondContact CG-OE1 3.45Å; R61-E68 IonicContact CZ-OE2 3.46Å; R61-E68 IonicContact NE-OE1 3.67Å; R61-E68 IonicContact NE-OE2 2.65Å; R61-E68 IonicContact NH1-OE1 3.61Å; R61-E68 IonicContact NH1-OE2 3.48Å; R61-E68 PolarHBondContact NH1-OE2 2.89Å; Y62-E68 CarbonylContact O-C 3.51Å; Y62-E68 WeakPolarHBondContact O-CA 3.29Å; I63-E68 HydrophobicContact CG1-CB 4.08Å; I63-E68 HydrophobicContact CG1-CG 4.33Å; E68-R71 IonicContact OE1-CZ 2.93Å; E68-R71 IonicContact OE1-NE 3.6Å; E68-R71 PolarHBondContact OE1-NE 2.97Å; E68-R71 IonicContact OE1-NH2 2.63Å; E68-R71 PolarHBondContact OE1-NH2 3.4Å; E68-R71 IonicContact OE2-CZ 3.96Å; E68-R71 IonicContact OE2-NH2 3.43Å; E68-R71 PolarHBondContact OE2-NH2 2.87Å; E68-V82 HydrophobicContact CG-CG2 4.25Å; E68-V82 WeakPolarHBondContact O-CB 3.38Å; E68-V82 WeakPolarHBondContact O-CG1 3.16Å; E68-T83 VanDerWaalsContact O-CG2 3.31Å; E68-T83 WeakPolarHBondContact O-CG2 3.37Å
69	Y	98.6	Very high	98.3	Very high	17 Å²	17	49 Å²	49	7%	0.067	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-28.2	-173.9	70.5	-98.3	0	0	0	112.8	Y41 Y62 E67 V82 T83 L85 G86 D89 W93	Y41-Y69 HydrophobicContact CE1-CE1 4.17Å; Y62-Y69 VanDerWaalsContact O-CD1 3.31Å; Y62-Y69 WeakPolarHBondContact O-CD1 3.24Å; Y62-Y69 PolarHBondContact O-N 3.14Å; E67-Y69 PolarHBondContact O-N 3.38Å; Y69-V82 PolarHBondContact O-N 3.33Å; Y69-T83 PolarHBondContact O-N 3.02Å; Y69-L85 HydrophobicContact CD1-CD2 4.32Å; Y69-L85 HydrophobicContact CG-CD2 4.15Å; Y69-L85 HydrophobicContact CG-CG 4.38Å; Y69-G86 WeakPolarHBondContact O-CA 3.23Å; Y69-D89 HydrophobicContact CE2-CB 4.22Å; Y69-D89 WeakPolarHBondContact CE2-OD2 3.34Å; Y69-D89 PolarHBondContact OH-OD2 2.96Å; Y69-W93 HydrophobicContact CE2-CH2 4.44Å
70	A	98.6	Very high	98.3	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	154.7	177.9	0	0	0	0	0	112.2	Y62 R80 W93	Y62-A70 PolarHBondContact N-O 2.83Å; A70-R80 WeakPolarHBondContact CA-O 3.14Å; A70-W93 HydrophobicContact CB-CH2 4.44Å; A70-W93 HydrophobicContact CB-CZ3 3.81Å
71	R	98.7	Very high	98.3	Very high	58 Å²	58	58.3 Å²	58.3	22%	0.219	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	143.1	-175.5	165.9	179	-58.2	176.8	13.7	112.4	V59 T60 E68 D73 Y79 R80 V82	V59-R71 HydrophobicContact CG1-CG 3.95Å; T60-R71 VanDerWaalsContact O-CA 3.22Å; T60-R71 WeakPolarHBondContact O-CA 3.34Å; T60-R71 WeakPolarHBondContact O-CG 3.07Å; E68-R71 IonicContact OE1-CZ 2.93Å; E68-R71 IonicContact OE1-NE 3.6Å; E68-R71 PolarHBondContact OE1-NE 2.97Å; E68-R71 IonicContact OE1-NH2 2.63Å; E68-R71 PolarHBondContact OE1-NH2 3.4Å; E68-R71 IonicContact OE2-CZ 3.96Å; E68-R71 IonicContact OE2-NH2 3.43Å; E68-R71 PolarHBondContact OE2-NH2 2.87Å; R71-D73 HydrophobicContact CG-CB 4.41Å; R71-Y79 CarbonylContact O-C 3.57Å; R71-Y79 VanDerWaalsContact O-CA 3.24Å; R71-Y79 WeakPolarHBondContact O-CA 3.32Å; R71-R80 PolarHBondContact N-O 2.94Å; R71-R80 PolarHBondContact O-N 3.4Å; R71-V82 HydrophobicContact CB-CG2 3.96Å
72	F	98.8	Very high	98.3	Very high	1 Å²	1	58.6 Å²	58.6	0%	0.004	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	141.1	153.4	177	-88.1	0	0	0	109.7	Y58 V59 T60 E77 Y79 L100 T103 R104	Y58-F72 HydrophobicContact CD1-CD1 4.22Å; Y58-F72 HydrophobicContact CD1-CE1 4.14Å; V59-F72 CarbonylContact C-O 3.59Å; V59-F72 VanDerWaalsContact CA-O 3.28Å; V59-F72 WeakPolarHBondContact CA-O 3.48Å; V59-F72 WeakPolarHBondContact CG1-O 3.21Å; T60-F72 PolarHBondContact N-O 2.99Å; T60-F72 PolarHBondContact O-N 3.45Å; T60-F72 WeakPolarHBondContact OG1-CB 3.45Å; F72-E77 VanDerWaalsContact CE2-C 3.45Å; F72-Y79 HydrophobicContact CB-CD1 3.74Å; F72-Y79 HydrophobicContact CB-CE1 3.7Å; F72-Y79 HydrophobicContact CB-CG 4.27Å; F72-Y79 HydrophobicContact CD2-CD2 4.22Å; F72-Y79 HydrophobicContact CD2-CE2 4.18Å; F72-Y79 HydrophobicContact CD2-CG 4.49Å; F72-L100 HydrophobicContact CD2-CD1 4.2Å; F72-L100 HydrophobicContact CE2-CD1 3.85Å; F72-T103 HydrophobicContact CB-CG2 4.06Å; F72-T103 HydrophobicContact CD1-CG2 3.58Å; F72-T103 HydrophobicContact CD2-CG2 3.82Å; F72-T103 HydrophobicContact CE1-CG2 3.89Å; F72-T103 HydrophobicContact CE2-CG2 4.11Å; F72-T103 HydrophobicContact CG-CG2 3.55Å; F72-T103 HydrophobicContact CZ-CG2 4.14Å; F72-R104 HydrophobicContact CE2-CG 4.06Å; F72-R104 HydrophobicContact CZ-CB 4.48Å; F72-R104 HydrophobicContact CZ-CG 3.77Å
73	D	98.7	Very high	98.3	Very high	13 Å²	13	57.8 Å²	57.8	7%	0.07	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	125	177	-161.8	-38.1	0	0	0	108.9	R57 R71 D75 V76 E77	R57-D73 IonicContact CZ-OD1 2.7Å; R57-D73 IonicContact CZ-OD2 2.93Å; R57-D73 IonicContact NE-OD1 2.67Å; R57-D73 PolarHBondContact NE-OD1 2.91Å; R57-D73 IonicContact NE-OD2 3.85Å; R57-D73 PolarHBondContact NE-OD2 3.5Å; R57-D73 IonicContact NH2-OD1 3.85Å; R57-D73 IonicContact NH2-OD2 3.62Å; R57-D73 PolarHBondContact NH2-OD2 2.99Å; R71-D73 HydrophobicContact CG-CB 4.41Å; D73-D75 PolarHBondContact O-N 3.47Å; D73-D75 PolarHBondContact OD1-N 3.34Å; D73-V76 HydrophobicContact CB-CB 4.17Å; D73-V76 HydrophobicContact CB-CG2 4.09Å; D73-V76 CarbonylContact O-C 3.5Å; D73-V76 WeakPolarHBondContact O-CA 3.27Å; D73-V76 PolarHBondContact O-N 3.44Å; D73-E77 PolarHBondContact O-N 2.92Å
74	S	98.4	Very high	98.2	Very high	19 Å²	19	63 Å²	63	13%	0.133	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-23	-177.6	64	0	0	0	0	113.4	R57 Y58 V76 E77	R57-S74 WeakPolarHBondContact CA-OG 3.22Å; Y58-S74 PolarHBondContact N-OG 2.97Å; Y58-S74 PolarHBondContact O-N 3.45Å; Y58-S74 PolarHBondContact O-OG 3.4Å; S74-V76 PolarHBondContact O-N 3.37Å; S74-E77 WeakPolarHBondContact O-CG 3.45Å
75	D	98.1	Very high	98.2	Very high	90 Å²	90	64.2 Å²	64.2	48%	0.481	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-14.3	174.4	-68.9	-6.6	0	0	0	111.8	R57 D73	R57-D75 WeakPolarHBondContact CD-OD2 3.33Å; R57-D75 IonicContact NE-OD2 3.26Å; D73-D75 PolarHBondContact O-N 3.47Å; D73-D75 PolarHBondContact OD1-N 3.34Å
76	V	98.1	Very high	98.2	Very high	54 Å²	54	61.4 Å²	61.4	33%	0.327	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-26.4	-178.4	-179.7	0	0	0	0	112	D73 S74 V78 R80	D73-V76 HydrophobicContact CB-CB 4.17Å; D73-V76 HydrophobicContact CB-CG2 4.09Å; D73-V76 CarbonylContact O-C 3.5Å; D73-V76 WeakPolarHBondContact O-CA 3.27Å; D73-V76 PolarHBondContact O-N 3.44Å; S74-V76 PolarHBondContact O-N 3.37Å; V76-V78 HydrophobicContact CG1-CG2 3.76Å; V76-V78 PolarHBondContact O-N 2.93Å; V76-V78 VanDerWaalsContact O-N 3.13Å; V76-R80 HydrophobicContact CG1-CG 4.49Å
77	E	97.7	Very high	98.3	Very high	110 Å²	110	52.2 Å²	52.2	51%	0.514	28%	0.277	S	S	.	.			trans	59.7	17.1	176.4	-55.5	-171.3	145	0	0	115.9	F72 D73 S74 L100 R104	F72-E77 VanDerWaalsContact CE2-C 3.45Å; D73-E77 PolarHBondContact O-N 2.92Å; S74-E77 WeakPolarHBondContact O-CG 3.45Å; E77-L100 WeakPolarHBondContact O-CD1 3.46Å; E77-R104 VanDerWaalsContact O-CZ 3.27Å; E77-R104 PolarHBondContact O-NE 2.95Å; E77-R104 PolarHBondContact O-NH2 2.93Å
78	V	98.1	Very high	98.3	Very high	44 Å²	44	51.7 Å²	51.7	27%	0.267	28%	0.282	S	S	.	.	S	Bend	trans	-140.8	158.5	173.6	-64.4	0	0	0	0	111.2	V76 R80 L100	V76-V78 HydrophobicContact CG1-CG2 3.76Å; V76-V78 PolarHBondContact O-N 2.93Å; V76-V78 VanDerWaalsContact O-N 3.13Å; V78-R80 HydrophobicContact CG2-CG 4.42Å; V78-L100 HydrophobicContact CG1-CD2 4.36Å
79	Y	98.6	Very high	98.3	Very high	8 Å²	8	52.9 Å²	52.9	3%	0.031	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	138.3	169.8	-66.9	-92.2	0	0	0	110.3	Y62 R71 F72 W93 N94 V99 L100 T103	Y62-Y79 HydrophobicContact CE2-CD1 4.38Å; Y62-Y79 AromaticContact CE2-CE1 3.9Å; Y62-Y79 HydrophobicContact CE2-CE1 3.9Å; R71-Y79 CarbonylContact O-C 3.57Å; R71-Y79 VanDerWaalsContact O-CA 3.24Å; R71-Y79 WeakPolarHBondContact O-CA 3.32Å; F72-Y79 HydrophobicContact CB-CD1 3.74Å; F72-Y79 HydrophobicContact CB-CE1 3.7Å; F72-Y79 HydrophobicContact CB-CG 4.27Å; F72-Y79 HydrophobicContact CD2-CD2 4.22Å; F72-Y79 HydrophobicContact CD2-CE2 4.18Å; F72-Y79 HydrophobicContact CD2-CG 4.49Å; Y79-W93 HydrophobicContact CD1-CB 4.47Å; Y79-W93 HydrophobicContact CD1-CD2 4.25Å; Y79-W93 AromaticContact CD1-CE3 3.37Å; Y79-W93 HydrophobicContact CD1-CE3 3.37Å; Y79-W93 AromaticContact CD1-CZ3 3.94Å; Y79-W93 HydrophobicContact CD1-CZ3 3.94Å; Y79-W93 HydrophobicContact CD2-CB 3.68Å; Y79-W93 HydrophobicContact CE1-CD2 4.28Å; Y79-W93 AromaticContact CE1-CE3 3.71Å; Y79-W93 HydrophobicContact CE1-CE3 3.71Å; Y79-W93 HydrophobicContact CE1-CZ3 4.24Å; Y79-W93 HydrophobicContact CE2-CB 3.84Å; Y79-W93 HydrophobicContact CG-CB 4.01Å; Y79-W93 AromaticContact CG-CE3 3.85Å; Y79-W93 HydrophobicContact CG-CE3 3.85Å; Y79-N94 PolarHBondContact N-OD1 2.7Å; Y79-N94 PolarHBondContact O-ND2 2.85Å; Y79-V99 HydrophobicContact CE2-CG1 4.33Å; Y79-L100 HydrophobicContact CD2-CD1 4.03Å; Y79-L100 HydrophobicContact CE2-CD1 4.13Å; Y79-T103 PolarHBondContact OH-OG1 3.3Å
80	R	98.6	Very high	98.2	Very high	155 Å²	155	52.3 Å²	52.3	59%	0.585	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.6	138.8	172.9	-68.1	-165.6	177.5	178.8	4.5	110.4	A70 R71 V76 V78	A70-R80 WeakPolarHBondContact CA-O 3.14Å; R71-R80 PolarHBondContact N-O 2.94Å; R71-R80 PolarHBondContact O-N 3.4Å; V76-R80 HydrophobicContact CG1-CG 4.49Å; V78-R80 HydrophobicContact CG2-CG 4.42Å
81	A	98.3	Very high	98.2	Very high	43 Å²	43	59 Å²	59	36%	0.355	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	133.3	163.4	0	0	0	0	0	109.1	P87 A90	A81-P87 HydrophobicContact CB-CB 4.5Å; A81-P87 HydrophobicContact CB-CG 3.94Å; A81-A90 HydrophobicContact CB-CB 4.41Å
82	V	98.4	Very high	98.2	Very high	74 Å²	74	62.9 Å²	62.9	45%	0.448	34%	0.335	S	S	.	.	S	Bend	trans	-98.6	-30.9	174.5	179.5	0	0	0	0	109.9	E68 Y69 R71	E68-V82 HydrophobicContact CG-CG2 4.25Å; E68-V82 WeakPolarHBondContact O-CB 3.38Å; E68-V82 WeakPolarHBondContact O-CG1 3.16Å; Y69-V82 PolarHBondContact O-N 3.33Å; R71-V82 HydrophobicContact CB-CG2 3.96Å
83	T	98.3	Very high	98.2	Very high	29 Å²	29	64.7 Å²	64.7	18%	0.178	34%	0.342	C	S	.	.	S	Bend	trans	-135.1	169.3	178.5	76.9	0	0	0	0	110.7	E67 E68 Y69 L85 G86 P87	E67-T83 HydrophobicContact CG-CG2 3.81Å; E67-T83 WeakPolarHBondContact OE1-CB 2.99Å; E67-T83 WeakPolarHBondContact OE1-CG2 3.02Å; E67-T83 PolarHBondContact OE1-OG1 3.47Å; E68-T83 VanDerWaalsContact O-CG2 3.31Å; E68-T83 WeakPolarHBondContact O-CG2 3.37Å; Y69-T83 PolarHBondContact O-N 3.02Å; T83-L85 PolarHBondContact O-N 2.94Å; T83-G86 PolarHBondContact O-N 3.42Å; T83-P87 WeakPolarHBondContact O-CD 3.39Å
84	P	98	Very high	98.2	Very high	124 Å²	124	66.6 Å²	66.6	81%	0.805	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-15.6	-177.8	-25.8	36.3	0	0	0	115.4	P87	P84-P87 VanDerWaalsContact C-CD 3.5Å; P84-P87 WeakPolarHBondContact O-CD 3.48Å
85	L	97.1	Very high	98.2	Very high	86 Å²	86	69.7 Å²	69.7	45%	0.45	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-28.8	174.6	-179.8	64.8	0	0	0	112.4	Y64 Y69 T83 P87 P88	Y64-L85 HydrophobicContact CD1-CD2 4.26Å; Y69-L85 HydrophobicContact CD1-CD2 4.32Å; Y69-L85 HydrophobicContact CG-CD2 4.15Å; Y69-L85 HydrophobicContact CG-CG 4.38Å; T83-L85 PolarHBondContact O-N 2.94Å; L85-P87 VanDerWaalsContact C-CD 3.45Å; L85-P88 WeakPolarHBondContact O-CD 3.43Å
86	G	97.8	Very high	98.2	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	37%	0.368	C	S	.	.	S	Bend	trans	-83.9	-14.9	-171.4	0	0	0	0	0	120.3	Y69 T83 D89 A90	Y69-G86 WeakPolarHBondContact O-CA 3.23Å; T83-G86 PolarHBondContact O-N 3.42Å; G86-D89 PolarHBondContact O-N 3.15Å; G86-A90 WeakPolarHBondContact O-CB 3.27Å; G86-A90 PolarHBondContact O-N 3.13Å
87	P	98.5	Very high	98.1	Very high	46 Å²	46	74.2 Å²	74.2	30%	0.299	39%	0.386	S	S	.	.	H	α-helix	trans	-54.4	-45.5	-179.6	-25.1	33.8	0	0	0	114.7	A81 T83 P84 L85 D89 A90 E91	A81-P87 HydrophobicContact CB-CB 4.5Å; A81-P87 HydrophobicContact CB-CG 3.94Å; T83-P87 WeakPolarHBondContact O-CD 3.39Å; P84-P87 VanDerWaalsContact C-CD 3.5Å; P84-P87 WeakPolarHBondContact O-CD 3.48Å; L85-P87 VanDerWaalsContact C-CD 3.45Å; P87-D89 VanDerWaalsContact C-N 3.31Å; P87-D89 PolarHBondContact O-N 3.03Å; P87-A90 PolarHBondContact O-N 3.49Å; P87-E91 WeakPolarHBondContact O-CB 3.4Å; P87-E91 WeakPolarHBondContact O-CG 3.16Å; P87-E91 PolarHBondContact O-N 3.03Å
88	P	98.3	Very high	98.1	Very high	86 Å²	86	76.9 Å²	76.9	56%	0.558	40%	0.398	S	S	*	.	H	α-helix	trans	-56.8	-44.4	179.7	-25	34.9	0	0	0	112.9	L85 Y92	L85-P88 WeakPolarHBondContact O-CD 3.43Å; P88-Y92 VanDerWaalsContact O-CB 3.23Å; P88-Y92 WeakPolarHBondContact O-CB 3.27Å; P88-Y92 PolarHBondContact O-N 2.84Å
89	D	97.8	Very high	98.1	Very high	54 Å²	54	77.3 Å²	77.3	29%	0.289	40%	0.401	S	S	.	.	H	α-helix	trans	-71.5	-45	-179.4	-75.5	-18	0	0	0	111.8	Y69 G86 P87 E91 Y92 W93	Y69-D89 HydrophobicContact CE2-CB 4.22Å; Y69-D89 WeakPolarHBondContact CE2-OD2 3.34Å; Y69-D89 PolarHBondContact OH-OD2 2.96Å; G86-D89 PolarHBondContact O-N 3.15Å; P87-D89 VanDerWaalsContact C-N 3.31Å; P87-D89 PolarHBondContact O-N 3.03Å; D89-E91 PolarHBondContact O-N 2.89Å; D89-Y92 PolarHBondContact O-N 2.96Å; D89-W93 HydrophobicContact CB-CD2 4.32Å; D89-W93 HydrophobicContact CB-CE3 4.17Å; D89-W93 HydrophobicContact CB-CH2 3.71Å; D89-W93 HydrophobicContact CB-CZ2 3.83Å; D89-W93 HydrophobicContact CB-CZ3 3.88Å; D89-W93 WeakPolarHBondContact O-CB 3.48Å; D89-W93 PolarHBondContact O-N 2.83Å
90	A	98.3	Very high	98	Very high	5 Å²	5	77.7 Å²	77.7	4%	0.041	40%	0.403	C	S	.	.	H	α-helix	trans	-63.5	-42.7	-179.8	0	0	0	0	0	112	A81 G86 P87 N94	A81-A90 HydrophobicContact CB-CB 4.41Å; G86-A90 WeakPolarHBondContact O-CB 3.27Å; G86-A90 PolarHBondContact O-N 3.13Å; P87-A90 PolarHBondContact O-N 3.49Å; A90-N94 VanDerWaalsContact O-CB 3.26Å; A90-N94 WeakPolarHBondContact O-CB 3.45Å; A90-N94 PolarHBondContact O-N 2.89Å; A90-N94 PolarHBondContact O-ND2 3.18Å
91	E	98.2	Very high	98	Very high	139 Å²	139	74.6 Å²	74.6	65%	0.65	40%	0.396	S	S	*	.	H	α-helix	trans	-64.6	-46.2	175.6	-71.9	174.5	-166	0	0	111.3	P87 D89 N94 S95	P87-E91 WeakPolarHBondContact O-CB 3.4Å; P87-E91 WeakPolarHBondContact O-CG 3.16Å; P87-E91 PolarHBondContact O-N 3.03Å; D89-E91 PolarHBondContact O-N 2.89Å; E91-N94 PolarHBondContact O-N 3.43Å; E91-S95 WeakPolarHBondContact O-CB 3.42Å; E91-S95 PolarHBondContact O-N 3.32Å
92	Y	98.2	Very high	98	Very high	141 Å²	141	80.8 Å²	80.8	55%	0.553	41%	0.41	S	S	*	.	H	α-helix	trans	-59.6	-52.1	177.8	178.2	-110.1	0	0	0	111.7	P88 D89 N94 S95 Q96	P88-Y92 VanDerWaalsContact O-CB 3.23Å; P88-Y92 WeakPolarHBondContact O-CB 3.27Å; P88-Y92 PolarHBondContact O-N 2.84Å; D89-Y92 PolarHBondContact O-N 2.96Å; Y92-N94 PolarHBondContact O-N 2.8Å; Y92-S95 PolarHBondContact O-N 2.93Å; Y92-S95 VanDerWaalsContact O-N 3.16Å; Y92-S95 PolarHBondContact O-OG 3.35Å; Y92-Q96 HydrophobicContact CE2-CG 4.37Å; Y92-Q96 WeakPolarHBondContact O-CG 3.43Å; Y92-Q96 PolarHBondContact O-N 2.82Å
93	W	98.4	Very high	98	Very high	39 Å²	39	77.6 Å²	77.6	15%	0.148	39%	0.391	C	S	.	.	H	α-helix	trans	-64.3	-37.8	-179.5	-61	-32.2	0	0	0	113	Y62 Y69 A70 Y79 D89 S95 Q96 V99	Y62-W93 AromaticContact CD1-CH2 3.53Å; Y62-W93 HydrophobicContact CD1-CH2 3.53Å; Y62-W93 HydrophobicContact CD1-CZ2 4.18Å; Y62-W93 HydrophobicContact CD1-CZ3 4.29Å; Y62-W93 AromaticContact CD2-CH2 3.85Å; Y62-W93 HydrophobicContact CD2-CH2 3.85Å; Y62-W93 AromaticContact CD2-CZ3 3.77Å; Y62-W93 HydrophobicContact CD2-CZ3 3.77Å; Y62-W93 AromaticContact CE1-CH2 3.62Å; Y62-W93 HydrophobicContact CE1-CH2 3.62Å; Y62-W93 AromaticContact CE1-CZ2 3.98Å; Y62-W93 HydrophobicContact CE1-CZ2 3.98Å; Y62-W93 HydrophobicContact CE1-CZ3 4.29Å; Y62-W93 AromaticContact CE2-CH2 3.97Å; Y62-W93 HydrophobicContact CE2-CH2 3.97Å; Y62-W93 AromaticContact CE2-CZ3 3.8Å; Y62-W93 HydrophobicContact CE2-CZ3 3.8Å; Y62-W93 AromaticContact CG-CH2 3.64Å; Y62-W93 HydrophobicContact CG-CH2 3.64Å; Y62-W93 HydrophobicContact CG-CZ3 4.03Å; Y62-W93 AromaticContact CZ-CH2 3.84Å; Y69-W93 HydrophobicContact CE2-CH2 4.44Å; A70-W93 HydrophobicContact CB-CH2 4.44Å; A70-W93 HydrophobicContact CB-CZ3 3.81Å; Y79-W93 HydrophobicContact CD1-CB 4.47Å; Y79-W93 HydrophobicContact CD1-CD2 4.25Å; Y79-W93 AromaticContact CD1-CE3 3.37Å; Y79-W93 HydrophobicContact CD1-CE3 3.37Å; Y79-W93 AromaticContact CD1-CZ3 3.94Å; Y79-W93 HydrophobicContact CD1-CZ3 3.94Å; Y79-W93 HydrophobicContact CD2-CB 3.68Å; Y79-W93 HydrophobicContact CE1-CD2 4.28Å; Y79-W93 AromaticContact CE1-CE3 3.71Å; Y79-W93 HydrophobicContact CE1-CE3 3.71Å; Y79-W93 HydrophobicContact CE1-CZ3 4.24Å; Y79-W93 HydrophobicContact CE2-CB 3.84Å; Y79-W93 HydrophobicContact CG-CB 4.01Å; Y79-W93 AromaticContact CG-CE3 3.85Å; Y79-W93 HydrophobicContact CG-CE3 3.85Å; D89-W93 HydrophobicContact CB-CD2 4.32Å; D89-W93 HydrophobicContact CB-CE3 4.17Å; D89-W93 HydrophobicContact CB-CH2 3.71Å; D89-W93 HydrophobicContact CB-CZ2 3.83Å; D89-W93 HydrophobicContact CB-CZ3 3.88Å; D89-W93 WeakPolarHBondContact O-CB 3.48Å; D89-W93 PolarHBondContact O-N 2.83Å; W93-S95 VanDerWaalsContact C-N 3.3Å; W93-S95 PolarHBondContact O-N 2.81Å; W93-Q96 PolarHBondContact O-N 3.35Å; W93-V99 HydrophobicContact CB-CG1 4.42Å
94	N	98.5	Very high	98	Very high	53 Å²	53	79.6 Å²	79.6	28%	0.283	40%	0.395	S	S	.	.	H	α-helix	trans	-69.6	-27.2	176.2	-73.9	-34.8	0	0	0	112.9	Y79 A90 E91 Y92 Q96	Y79-N94 PolarHBondContact N-OD1 2.7Å; Y79-N94 PolarHBondContact O-ND2 2.85Å; A90-N94 VanDerWaalsContact O-CB 3.26Å; A90-N94 WeakPolarHBondContact O-CB 3.45Å; A90-N94 PolarHBondContact O-N 2.89Å; A90-N94 PolarHBondContact O-ND2 3.18Å; E91-N94 PolarHBondContact O-N 3.43Å; Y92-N94 PolarHBondContact O-N 2.8Å; N94-Q96 VanDerWaalsContact C-N 3.28Å
95	S	98.1	Very high	98.1	Very high	83 Å²	83	75.8 Å²	75.8	58%	0.58	37%	0.373	S	S	*	.	H	α-helix	trans	-72.1	-23.5	175.3	78	0	0	0	0	112.8	E91 Y92 W93 K97	E91-S95 WeakPolarHBondContact O-CB 3.42Å; E91-S95 PolarHBondContact O-N 3.32Å; Y92-S95 PolarHBondContact O-N 2.93Å; Y92-S95 VanDerWaalsContact O-N 3.16Å; Y92-S95 PolarHBondContact O-OG 3.35Å; W93-S95 VanDerWaalsContact C-N 3.3Å; W93-S95 PolarHBondContact O-N 2.81Å; S95-K97 PolarHBondContact O-N 2.92Å
96	Q	98.1	Very high	98.1	Very high	78 Å²	78	73.4 Å²	73.4	36%	0.364	36%	0.36	S	S	.	.			trans	-90.5	93.8	-179.9	-60	-63.8	-16.7	0	0	110.6	Y92 W93 N94 E98 V99 L100	Y92-Q96 HydrophobicContact CE2-CG 4.37Å; Y92-Q96 WeakPolarHBondContact O-CG 3.43Å; Y92-Q96 PolarHBondContact O-N 2.82Å; W93-Q96 PolarHBondContact O-N 3.35Å; N94-Q96 VanDerWaalsContact C-N 3.28Å; Q96-E98 VanDerWaalsContact C-N 3.27Å; Q96-E98 PolarHBondContact O-N 3.34Å; Q96-E98 VanDerWaalsContact O-N 3.17Å; Q96-V99 HydrophobicContact CB-CB 3.93Å; Q96-V99 HydrophobicContact CB-CG2 3.69Å; Q96-V99 HydrophobicContact CG-CG2 4.46Å; Q96-V99 WeakPolarHBondContact O-CB 3.31Å; Q96-V99 PolarHBondContact O-N 2.92Å; Q96-L100 PolarHBondContact O-N 2.93Å; Q96-L100 VanDerWaalsContact O-N 3.15Å
97	K	97.1	Very high	98.2	Very high	162 Å²	162	75 Å²	75	70%	0.704	37%	0.368	S	S	*	.	H	α-helix	trans	-51.4	-43.7	-176.7	-174.1	177.7	-180	-179.1	0	113.2	S95 V99 L100 E101	S95-K97 PolarHBondContact O-N 2.92Å; K97-V99 VanDerWaalsContact C-N 3.35Å; K97-V99 PolarHBondContact O-N 2.9Å; K97-L100 PolarHBondContact O-N 2.84Å; K97-E101 HydrophobicContact CG-CG 4.14Å; K97-E101 WeakPolarHBondContact O-CB 3.02Å; K97-E101 VanDerWaalsContact O-CG 3.32Å; K97-E101 WeakPolarHBondContact O-CG 3.04Å; K97-E101 PolarHBondContact O-N 3.18Å
98	E	97.6	Very high	98.2	Very high	165 Å²	165	76.8 Å²	76.8	77%	0.771	38%	0.375	S	S	*	.	H	α-helix	trans	-62.3	-40.5	-179.7	-172.1	-179.6	171.8	0	0	112.5	Q96 R102	Q96-E98 VanDerWaalsContact C-N 3.27Å; Q96-E98 PolarHBondContact O-N 3.34Å; Q96-E98 VanDerWaalsContact O-N 3.17Å; E98-R102 WeakPolarHBondContact O-CB 3.47Å; E98-R102 PolarHBondContact O-N 2.86Å
99	V	97.4	Very high	98.2	Very high	54 Å²	54	76.9 Å²	76.9	33%	0.327	38%	0.375	S	S	.	.	H	α-helix	trans	-64.7	-46.1	178.7	175.5	0	0	0	0	110.5	Y79 W93 Q96 K97 T103	Y79-V99 HydrophobicContact CE2-CG1 4.33Å; W93-V99 HydrophobicContact CB-CG1 4.42Å; Q96-V99 HydrophobicContact CB-CB 3.93Å; Q96-V99 HydrophobicContact CB-CG2 3.69Å; Q96-V99 HydrophobicContact CG-CG2 4.46Å; Q96-V99 WeakPolarHBondContact O-CB 3.31Å; Q96-V99 PolarHBondContact O-N 2.92Å; K97-V99 VanDerWaalsContact C-N 3.35Å; K97-V99 PolarHBondContact O-N 2.9Å; V99-T103 WeakPolarHBondContact O-CB 3.13Å; V99-T103 PolarHBondContact O-N 2.84Å; V99-T103 PolarHBondContact O-OG1 2.82Å
100	L	98.1	Very high	98.2	Very high	15 Å²	15	76.6 Å²	76.6	8%	0.079	38%	0.375	C	S	.	.	H	α-helix	trans	-67.1	-46	-178.2	-176	58.1	0	0	0	112.1	F72 E77 V78 Y79 Q96 K97 T103 R104	F72-L100 HydrophobicContact CD2-CD1 4.2Å; F72-L100 HydrophobicContact CE2-CD1 3.85Å; E77-L100 WeakPolarHBondContact O-CD1 3.46Å; V78-L100 HydrophobicContact CG1-CD2 4.36Å; Y79-L100 HydrophobicContact CD2-CD1 4.03Å; Y79-L100 HydrophobicContact CE2-CD1 4.13Å; Q96-L100 PolarHBondContact O-N 2.93Å; Q96-L100 VanDerWaalsContact O-N 3.15Å; K97-L100 PolarHBondContact O-N 2.84Å; L100-T103 PolarHBondContact O-N 3.24Å; L100-R104 WeakPolarHBondContact O-CG 3.42Å; L100-R104 PolarHBondContact O-N 3.06Å
101	E	98.3	Very high	98.2	Very high	91 Å²	91	76.4 Å²	76.4	43%	0.425	37%	0.373	S	S	.	.	H	α-helix	trans	-64.5	-40.6	176.9	-68.6	-53.8	143.7	0	0	112.2	K97 T103 R104 A105	K97-E101 HydrophobicContact CG-CG 4.14Å; K97-E101 WeakPolarHBondContact O-CB 3.02Å; K97-E101 VanDerWaalsContact O-CG 3.32Å; K97-E101 WeakPolarHBondContact O-CG 3.04Å; K97-E101 PolarHBondContact O-N 3.18Å; E101-T103 VanDerWaalsContact C-N 3.32Å; E101-T103 PolarHBondContact O-N 2.95Å; E101-R104 PolarHBondContact O-N 3.23Å; E101-R104 IonicContact OE1-CZ 3.14Å; E101-R104 IonicContact OE1-NH1 2.8Å; E101-R104 PolarHBondContact OE1-NH1 2.83Å; E101-A105 PolarHBondContact O-N 3.17Å
102	R	98.3	Very high	98.2	Very high	173 Å²	173	73.2 Å²	73.2	65%	0.653	36%	0.355	S	S	*	.	H	α-helix	trans	-58.8	-46.1	174.1	179.1	178.2	173.1	170.1	1	111.2	E98 R104 A105 E106	E98-R102 WeakPolarHBondContact O-CB 3.47Å; E98-R102 PolarHBondContact O-N 2.86Å; R102-R104 VanDerWaalsContact C-N 3.35Å; R102-R104 PolarHBondContact O-N 2.92Å; R102-A105 WeakPolarHBondContact O-CB 3.36Å; R102-A105 PolarHBondContact O-N 3.1Å; R102-A105 VanDerWaalsContact O-N 3.16Å; R102-E106 WeakPolarHBondContact O-CG 3.44Å; R102-E106 PolarHBondContact O-N 2.88Å; R102-E106 VanDerWaalsContact O-N 3.13Å
103	T	98.3	Very high	98.2	Very high	7 Å²	7	71.5 Å²	71.5	4%	0.043	35%	0.352	C	S	.	.	H	α-helix	trans	-67.7	-34.9	-178.5	-52.9	0	0	0	0	112.1	Y58 F72 Y79 V99 L100 E101 A105 E106	Y58-T103 HydrophobicContact CE1-CG2 4.15Å; F72-T103 HydrophobicContact CB-CG2 4.06Å; F72-T103 HydrophobicContact CD1-CG2 3.58Å; F72-T103 HydrophobicContact CD2-CG2 3.82Å; F72-T103 HydrophobicContact CE1-CG2 3.89Å; F72-T103 HydrophobicContact CE2-CG2 4.11Å; F72-T103 HydrophobicContact CG-CG2 3.55Å; F72-T103 HydrophobicContact CZ-CG2 4.14Å; Y79-T103 PolarHBondContact OH-OG1 3.3Å; V99-T103 WeakPolarHBondContact O-CB 3.13Å; V99-T103 PolarHBondContact O-N 2.84Å; V99-T103 PolarHBondContact O-OG1 2.82Å; L100-T103 PolarHBondContact O-N 3.24Å; E101-T103 VanDerWaalsContact C-N 3.32Å; E101-T103 PolarHBondContact O-N 2.95Å; T103-A105 VanDerWaalsContact C-N 3.35Å; T103-E106 WeakPolarHBondContact O-CB 3.44Å; T103-E106 PolarHBondContact O-N 2.98Å
104	R	98.6	Very high	98.1	Very high	71 Å²	71	73 Å²	73	27%	0.268	36%	0.363	S	S	.	.	H	α-helix	trans	-61	-44.5	170.1	-72.2	167.9	-179.8	164.7	-5.3	111.4	F72 E77 L100 E101 R102 E106 L107	F72-R104 HydrophobicContact CE2-CG 4.06Å; F72-R104 HydrophobicContact CZ-CB 4.48Å; F72-R104 HydrophobicContact CZ-CG 3.77Å; E77-R104 VanDerWaalsContact O-CZ 3.27Å; E77-R104 PolarHBondContact O-NE 2.95Å; E77-R104 PolarHBondContact O-NH2 2.93Å; L100-R104 WeakPolarHBondContact O-CG 3.42Å; L100-R104 PolarHBondContact O-N 3.06Å; E101-R104 PolarHBondContact O-N 3.23Å; E101-R104 IonicContact OE1-CZ 3.14Å; E101-R104 IonicContact OE1-NH1 2.8Å; E101-R104 PolarHBondContact OE1-NH1 2.83Å; R102-R104 VanDerWaalsContact C-N 3.35Å; R102-R104 PolarHBondContact O-N 2.92Å; R104-E106 VanDerWaalsContact C-N 3.26Å; R104-E106 PolarHBondContact O-N 2.84Å; R104-L107 WeakPolarHBondContact O-CB 3.27Å; R104-L107 PolarHBondContact O-N 3.48Å
105	A	98.5	Very high	98.1	Very high	43 Å²	43	72.3 Å²	72.3	36%	0.355	36%	0.356	S	S	.	.	H	α-helix	trans	-65.8	-24.7	179.8	0	0	0	0	0	113.7	E101 R102 T103 L107 D108 T109	E101-A105 PolarHBondContact O-N 3.17Å; R102-A105 WeakPolarHBondContact O-CB 3.36Å; R102-A105 PolarHBondContact O-N 3.1Å; R102-A105 VanDerWaalsContact O-N 3.16Å; T103-A105 VanDerWaalsContact C-N 3.35Å; A105-L107 PolarHBondContact O-N 2.75Å; A105-L107 VanDerWaalsContact O-N 3.16Å; A105-D108 PolarHBondContact O-N 2.76Å; A105-T109 PolarHBondContact O-N 2.96Å; A105-T109 PolarHBondContact O-OG1 2.77Å
106	E	98.6	Very high	98	Very high	37 Å²	37	72.8 Å²	72.8	17%	0.173	35%	0.349	C	S	.	.	H	α-helix	trans	-61.4	-22.2	178.3	-72.7	176.1	172.4	0	0	113.6	Y58 R102 T103 R104 D108 T109 V110 C111	Y58-E106 HydrophobicContact CD1-CB 4.12Å; Y58-E106 HydrophobicContact CE1-CB 3.51Å; Y58-E106 HydrophobicContact CE1-CG 4.48Å; Y58-E106 VanDerWaalsContact CE1-OE2 3.27Å; Y58-E106 WeakPolarHBondContact CE1-OE2 3.32Å; Y58-E106 VanDerWaalsContact CZ-OE2 3.28Å; Y58-E106 PolarHBondContact OH-OE2 3.33Å; R102-E106 WeakPolarHBondContact O-CG 3.44Å; R102-E106 PolarHBondContact O-N 2.88Å; R102-E106 VanDerWaalsContact O-N 3.13Å; T103-E106 WeakPolarHBondContact O-CB 3.44Å; T103-E106 PolarHBondContact O-N 2.98Å; R104-E106 VanDerWaalsContact C-N 3.26Å; R104-E106 PolarHBondContact O-N 2.84Å; E106-D108 PolarHBondContact O-N 3.48Å; E106-T109 WeakPolarHBondContact CA-OG1 3.39Å; E106-V110 HydrophobicContact CB-CB 4.32Å; E106-V110 HydrophobicContact CB-CG2 3.92Å; E106-V110 HydrophobicContact CG-CG2 3.86Å; E106-V110 WeakPolarHBondContact O-CA 3.47Å; E106-V110 VanDerWaalsContact O-CB 3.23Å; E106-V110 WeakPolarHBondContact O-CB 3.24Å; E106-V110 PolarHBondContact O-N 2.95Å; E106-C111 PolarHBondContact O-N 2.81Å
107	L	98.4	Very high	97.9	Very high	32 Å²	32	73.2 Å²	73.2	17%	0.168	35%	0.354	C	S	.	.	I	π-helix	trans	-52.3	-42.7	168.6	-175.6	78.2	0	0	0	111.3	V56 R104 A105 C111 R112	V56-L107 HydrophobicContact CB-CD1 4.16Å; V56-L107 HydrophobicContact CG1-CD1 3.86Å; R104-L107 WeakPolarHBondContact O-CB 3.27Å; R104-L107 PolarHBondContact O-N 3.48Å; A105-L107 PolarHBondContact O-N 2.75Å; A105-L107 VanDerWaalsContact O-N 3.16Å; L107-C111 VanDerWaalsContact O-CB 3.23Å; L107-C111 WeakPolarHBondContact O-CB 3.13Å; L107-C111 PolarHBondContact O-N 2.88Å; L107-R112 PolarHBondContact O-N 3.32Å; L107-R112 VanDerWaalsContact O-N 3.13Å
108	D	98.4	Very high	97.9	Very high	84 Å²	84	69.3 Å²	69.3	45%	0.449	34%	0.338	S	S	.	.	I	π-helix	trans	-94.3	-48.9	-177.9	-63.7	-33.7	0	0	0	111.4	A105 E106 V110 R112 H113	A105-D108 PolarHBondContact O-N 2.76Å; E106-D108 PolarHBondContact O-N 3.48Å; D108-V110 VanDerWaalsContact C-N 3.29Å; D108-V110 PolarHBondContact O-N 3.06Å; D108-R112 WeakPolarHBondContact OD1-CD 3.39Å; D108-R112 IonicContact OD1-CZ 3.12Å; D108-R112 IonicContact OD1-NE 3.89Å; D108-R112 PolarHBondContact OD1-NE 2.99Å; D108-H113 PolarHBondContact O-N 2.91Å
109	T	98.3	Very high	97.8	Very high	89 Å²	89	64 Å²	64	55%	0.546	32%	0.315	S	S	.	.	I	π-helix	trans	-73	-21.7	-173.2	65.2	0	0	0	0	113.3	A105 E106 H113	A105-T109 PolarHBondContact O-N 2.96Å; A105-T109 PolarHBondContact O-OG1 2.77Å; E106-T109 WeakPolarHBondContact CA-OG1 3.39Å; T109-H113 VanDerWaalsContact O-CB 3.23Å; T109-H113 WeakPolarHBondContact O-CB 3.19Å
110	V	98.2	Very high	97.6	Very high	47 Å²	47	71.4 Å²	71.4	29%	0.285	34%	0.337	S	S	.	.	I	π-helix	trans	-109.8	-63.3	175.3	-177.5	0	0	0	0	110.1	E106 D108 N114	E106-V110 HydrophobicContact CB-CB 4.32Å; E106-V110 HydrophobicContact CB-CG2 3.92Å; E106-V110 HydrophobicContact CG-CG2 3.86Å; E106-V110 WeakPolarHBondContact O-CA 3.47Å; E106-V110 VanDerWaalsContact O-CB 3.23Å; E106-V110 WeakPolarHBondContact O-CB 3.24Å; E106-V110 PolarHBondContact O-N 2.95Å; D108-V110 VanDerWaalsContact C-N 3.29Å; D108-V110 PolarHBondContact O-N 3.06Å; V110-N114 WeakPolarHBondContact O-CB 3.4Å; V110-N114 PolarHBondContact O-N 2.95Å; V110-N114 PolarHBondContact O-ND2 2.94Å
111	C	98.5	Very high	97.3	Very high	1 Å²	1	74.8 Å²	74.8	1%	0.007	36%	0.358	C	S	.	.	I	π-helix	trans	-67.1	-56.8	-170.3	-57.6	0	0	0	0	112.5	C47 F49 V56 Y58 E106 L107 H113 N114 Y115	C47-C111 HydrophobicContact CB-CB 3.57Å; C47-C111 WeakPolarHBondContact CB-SG 3.48Å; C47-C111 WeakPolarHBondContact SG-CA 3.34Å; C47-C111 WeakPolarHBondContact SG-CB 3.39Å; C47-C111 CovalentContact SG-SG 2.03Å; C47-C111 PolarHBondContact SG-SG 3.45Å; F49-C111 HydrophobicContact CE1-CB 4.08Å; F49-C111 WeakPolarHBondContact CE1-O 3.35Å; F49-C111 HydrophobicContact CZ-CB 3.91Å; F49-C111 WeakPolarHBondContact CZ-O 3.44Å; V56-C111 HydrophobicContact CG1-CB 3.76Å; Y58-C111 WeakPolarHBondContact CD2-SG 3.25Å; E106-C111 PolarHBondContact O-N 2.81Å; L107-C111 VanDerWaalsContact O-CB 3.23Å; L107-C111 WeakPolarHBondContact O-CB 3.13Å; L107-C111 PolarHBondContact O-N 2.88Å; C111-H113 PolarHBondContact O-N 2.84Å; C111-N114 PolarHBondContact O-N 3.14Å; C111-Y115 WeakPolarHBondContact O-CB 3.39Å; C111-Y115 PolarHBondContact O-N 2.88Å
112	R	98.4	Very high	97.2	Very high	73 Å²	73	71.8 Å²	71.8	28%	0.275	35%	0.346	S	S	.	.	I	π-helix	trans	-65	-42.2	-179.6	-65.3	-176.4	-166.1	-83.1	-5.5	111.8	T53 V56 L107 D108 Y115 Q116	T53-R112 PolarHBondContact O-NH1 3.25Å; V56-R112 HydrophobicContact CG2-CG 4.15Å; L107-R112 PolarHBondContact O-N 3.32Å; L107-R112 VanDerWaalsContact O-N 3.13Å; D108-R112 WeakPolarHBondContact OD1-CD 3.39Å; D108-R112 IonicContact OD1-CZ 3.12Å; D108-R112 IonicContact OD1-NE 3.89Å; D108-R112 PolarHBondContact OD1-NE 2.99Å; R112-Y115 PolarHBondContact O-N 2.84Å; R112-Q116 WeakPolarHBondContact O-CG 3.39Å; R112-Q116 PolarHBondContact O-N 2.88Å
113	H	97.5	Very high	97.1	Very high	104 Å²	104	66.4 Å²	66.4	48%	0.481	33%	0.33	S	S	.	.	H	α-helix	trans	-55.6	-54.5	176.1	178.4	74	0	0	0	111.8	D108 T109 C111 Y115 Q116	D108-H113 PolarHBondContact O-N 2.91Å; T109-H113 VanDerWaalsContact O-CB 3.23Å; T109-H113 WeakPolarHBondContact O-CB 3.19Å; C111-H113 PolarHBondContact O-N 2.84Å; H113-Y115 VanDerWaalsContact C-N 3.31Å; H113-Y115 PolarHBondContact O-N 2.77Å; H113-Q116 WeakPolarHBondContact O-CB 3.25Å; H113-Q116 PolarHBondContact O-N 2.73Å; H113-Q116 VanDerWaalsContact O-N 3.1Å
114	N	98.1	Very high	97	Very high	71 Å²	71	71.6 Å²	71.6	38%	0.38	35%	0.354	S	S	.	.	H	α-helix	trans	-64.4	-36.7	-179.3	-70.4	-17.2	0	0	0	111.8	V110 C111 Q116 L117 E118	V110-N114 WeakPolarHBondContact O-CB 3.4Å; V110-N114 PolarHBondContact O-N 2.95Å; V110-N114 PolarHBondContact O-ND2 2.94Å; C111-N114 PolarHBondContact O-N 3.14Å; N114-Q116 PolarHBondContact O-N 3.01Å; N114-L117 WeakPolarHBondContact O-CA 3.48Å; N114-L117 WeakPolarHBondContact O-CB 3.33Å; N114-L117 PolarHBondContact O-N 2.95Å; N114-E118 WeakPolarHBondContact O-CG 3.39Å; N114-E118 PolarHBondContact O-N 2.03Å
115	Y	97.9	Very high	96.9	Very high	38 Å²	38	73.1 Å²	73.1	15%	0.149	36%	0.36	C	S	.	.	H	α-helix	trans	-56.6	-36.4	174.7	-169.4	-87.6	0	0	0	112.4	F49 G52 T53 C111 R112 H113 L117 E118 L119 L123	F49-Y115 HydrophobicContact CB-CD2 4.24Å; F49-Y115 HydrophobicContact CB-CE2 4.02Å; F49-Y115 AromaticContact CD1-CD2 3.42Å; F49-Y115 HydrophobicContact CD1-CD2 3.42Å; F49-Y115 VanDerWaalsContact CD1-CD2 3.42Å; F49-Y115 HydrophobicContact CD1-CE2 4.01Å; F49-Y115 HydrophobicContact CD1-CG 4Å; F49-Y115 AromaticContact CD2-CD2 3.89Å; F49-Y115 HydrophobicContact CD2-CD2 3.89Å; F49-Y115 HydrophobicContact CD2-CE2 4.34Å; F49-Y115 AromaticContact CE1-CD2 3.61Å; F49-Y115 HydrophobicContact CE1-CD2 3.61Å; F49-Y115 AromaticContact CE1-CG 3.9Å; F49-Y115 HydrophobicContact CE1-CG 3.9Å; F49-Y115 HydrophobicContact CE2-CD2 4.05Å; F49-Y115 AromaticContact CG-CD2 3.58Å; F49-Y115 HydrophobicContact CG-CD2 3.58Å; F49-Y115 AromaticContact CG-CE2 3.87Å; F49-Y115 HydrophobicContact CG-CE2 3.87Å; F49-Y115 AromaticContact CZ-CD2 3.91Å; F49-Y115 HydrophobicContact CZ-CD2 3.91Å; F49-Y115 HydrophobicContact CZ-CG 4.36Å; G52-Y115 WeakPolarHBondContact CA-OH 3.12Å; T53-Y115 HydrophobicContact CG2-CD1 3.33Å; T53-Y115 HydrophobicContact CG2-CE1 3.85Å; T53-Y115 HydrophobicContact CG2-CG 3.74Å; C111-Y115 WeakPolarHBondContact O-CB 3.39Å; C111-Y115 PolarHBondContact O-N 2.88Å; R112-Y115 PolarHBondContact O-N 2.84Å; H113-Y115 VanDerWaalsContact C-N 3.31Å; H113-Y115 PolarHBondContact O-N 2.77Å; Y115-L117 VanDerWaalsContact C-N 3.28Å; Y115-L117 PolarHBondContact O-N 3.5Å; Y115-E118 PolarHBondContact O-N 3.17Å; Y115-L119 HydrophobicContact CD1-CD1 3.64Å; Y115-L119 HydrophobicContact CD1-CG 3.76Å; Y115-L119 HydrophobicContact CE1-CD1 3.56Å; Y115-L119 HydrophobicContact CE1-CD2 3.81Å; Y115-L119 HydrophobicContact CE1-CG 3.48Å; Y115-L119 VanDerWaalsContact CE1-CG 3.48Å; Y115-L119 WeakPolarHBondContact O-CB 3.49Å; Y115-L119 WeakPolarHBondContact O-CG 3.45Å; Y115-L119 PolarHBondContact O-N 2.84Å; Y115-L123 HydrophobicContact CD2-CD1 4.3Å; Y115-L123 HydrophobicContact CE1-CD1 3.99Å; Y115-L123 HydrophobicContact CE2-CD1 3.63Å; Y115-L123 VanDerWaalsContact CZ-CD1 3.43Å; Y115-L123 WeakPolarHBondContact OH-CD1 3.46Å
116	Q	96.4	Very high	96.9	Very high	93 Å²	93	76.5 Å²	76.5	44%	0.435	36%	0.363	S	S	.	.	H	α-helix	trans	-65.5	-30.4	175.1	-61.4	-53.4	-44.4	0	0	113.3	R112 H113 N114	R112-Q116 WeakPolarHBondContact O-CG 3.39Å; R112-Q116 PolarHBondContact O-N 2.88Å; H113-Q116 WeakPolarHBondContact O-CB 3.25Å; H113-Q116 PolarHBondContact O-N 2.73Å; H113-Q116 VanDerWaalsContact O-N 3.1Å; N114-Q116 PolarHBondContact O-N 3.01Å
117	L	95.9	Very high	96.9	Very high	88 Å²	88	76.7 Å²	76.7	46%	0.461	37%	0.367	S	S	.	.	H	α-helix	trans	-73.1	-46.9	173.6	-55.3	178.2	0	0	0	110.2	N114 Y115 L119 R120 T121	N114-L117 WeakPolarHBondContact O-CA 3.48Å; N114-L117 WeakPolarHBondContact O-CB 3.33Å; N114-L117 PolarHBondContact O-N 2.95Å; Y115-L117 VanDerWaalsContact C-N 3.28Å; Y115-L117 PolarHBondContact O-N 3.5Å; L117-L119 PolarHBondContact O-N 3.04Å; L117-R120 PolarHBondContact O-N 2.92Å; L117-T121 PolarHBondContact O-OG1 2.91Å
118	E	96.3	Very high	96.9	Very high	79 Å²	79	81 Å²	81	37%	0.369	39%	0.386	S	S	.	.	H	α-helix	trans	-63.7	-29.5	178.7	-62.3	-55.5	156.6	0	0	113	N114 Y115 R120 T121 T122 L123	N114-E118 WeakPolarHBondContact O-CG 3.39Å; N114-E118 PolarHBondContact O-N 2.03Å; Y115-E118 PolarHBondContact O-N 3.17Å; E118-R120 PolarHBondContact O-N 2.91Å; E118-R120 VanDerWaalsContact O-N 3.12Å; E118-T121 CarbonylContact O-C 3.49Å; E118-T121 PolarHBondContact O-N 3.03Å; E118-T122 PolarHBondContact O-N 2.92Å; E118-T122 VanDerWaalsContact O-N 3.13Å; E118-T122 WeakPolarHBondContact OE2-CB 3.26Å; E118-T122 PolarHBondContact OE2-OG1 2.86Å; E118-L123 HydrophobicContact CB-CD1 4.44Å; E118-L123 HydrophobicContact CB-CG 4.34Å; E118-L123 WeakPolarHBondContact O-CB 3.11Å; E118-L123 PolarHBondContact O-N 2.62Å
119	L	94.6	Very high	96.9	Very high	54 Å²	54	77.3 Å²	77.3	28%	0.283	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-19.7	172.7	-90.6	172	0	0	0	113.9	Y115 L117 L123 Q124	Y115-L119 HydrophobicContact CD1-CD1 3.64Å; Y115-L119 HydrophobicContact CD1-CG 3.76Å; Y115-L119 HydrophobicContact CE1-CD1 3.56Å; Y115-L119 HydrophobicContact CE1-CD2 3.81Å; Y115-L119 HydrophobicContact CE1-CG 3.48Å; Y115-L119 VanDerWaalsContact CE1-CG 3.48Å; Y115-L119 WeakPolarHBondContact O-CB 3.49Å; Y115-L119 WeakPolarHBondContact O-CG 3.45Å; Y115-L119 PolarHBondContact O-N 2.84Å; L117-L119 PolarHBondContact O-N 3.04Å; L119-L123 HydrophobicContact CD2-CD1 3.81Å; L119-L123 HydrophobicContact CG-CD1 3.94Å; L119-Q124 WeakPolarHBondContact O-CG 3.38Å; L119-Q124 PolarHBondContact O-NE2 3.28Å
120	R	93.3	Very high	96.9	Very high	210 Å²	210	76.8 Å²	76.8	79%	0.792	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-21.8	179	-60	-180	-177.5	-177.2	-0	112.9	L117 E118	L117-R120 PolarHBondContact O-N 2.92Å; E118-R120 PolarHBondContact O-N 2.91Å; E118-R120 VanDerWaalsContact O-N 3.12Å
121	T	93.6	Very high	96.9	Very high	85 Å²	85	75.4 Å²	75.4	52%	0.521	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	-85	-174.2	53.1	0	0	0	0	110.6	L117 E118 L123 Q124 R125	L117-T121 PolarHBondContact O-OG1 2.91Å; E118-T121 CarbonylContact O-C 3.49Å; E118-T121 PolarHBondContact O-N 3.03Å; T121-L123 PolarHBondContact O-N 3.32Å; T121-Q124 PolarHBondContact O-N 2.91Å; T121-R125 PolarHBondContact O-N 2.84Å
122	T	95.8	Very high	96.9	Very high	28 Å²	28	78.8 Å²	78.8	17%	0.172	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-40.9	-170.5	-63.9	0	0	0	0	113.4	E118 Q124 R125 Y155 W185	E118-T122 PolarHBondContact O-N 2.92Å; E118-T122 VanDerWaalsContact O-N 3.13Å; E118-T122 WeakPolarHBondContact OE2-CB 3.26Å; E118-T122 PolarHBondContact OE2-OG1 2.86Å; T122-Q124 VanDerWaalsContact C-N 3.32Å; T122-R125 WeakPolarHBondContact O-CB 3.13Å; T122-R125 PolarHBondContact O-N 2.87Å; T122-Y155 WeakPolarHBondContact CG2-OH 3.44Å; T122-W185 HydrophobicContact CG2-CH2 4.33Å; T122-W185 HydrophobicContact CG2-CZ3 3.62Å
123	L	95.5	Very high	96.7	Very high	61 Å²	61	76.6 Å²	76.6	32%	0.319	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-22.4	-176.2	-61.5	178.8	0	0	0	112.6	Y115 E118 L119 T121 R126	Y115-L123 HydrophobicContact CD2-CD1 4.3Å; Y115-L123 HydrophobicContact CE1-CD1 3.99Å; Y115-L123 HydrophobicContact CE2-CD1 3.63Å; Y115-L123 VanDerWaalsContact CZ-CD1 3.43Å; Y115-L123 WeakPolarHBondContact OH-CD1 3.46Å; E118-L123 HydrophobicContact CB-CD1 4.44Å; E118-L123 HydrophobicContact CB-CG 4.34Å; E118-L123 WeakPolarHBondContact O-CB 3.11Å; E118-L123 PolarHBondContact O-N 2.62Å; L119-L123 HydrophobicContact CD2-CD1 3.81Å; L119-L123 HydrophobicContact CG-CD1 3.94Å; T121-L123 PolarHBondContact O-N 3.32Å; L123-R126 PolarHBondContact O-NH1 3.19Å; L123-R126 PolarHBondContact O-NH2 3.28Å
124	Q	95.5	Very high	96.5	Very high	115 Å²	115	74 Å²	74	54%	0.537	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-12.5	174.9	-58.3	-59.2	-23.7	0	0	113	L119 T121 T122 R126	L119-Q124 WeakPolarHBondContact O-CG 3.38Å; L119-Q124 PolarHBondContact O-NE2 3.28Å; T121-Q124 PolarHBondContact O-N 2.91Å; T122-Q124 VanDerWaalsContact C-N 3.32Å; Q124-R126 PolarHBondContact O-N 2.99Å
125	R	97.1	Very high	96.1	Very high	104 Å²	104	73.2 Å²	73.2	39%	0.392	36%	0.361	S	S	.	.			trans	-58	127.7	178.4	-177.4	178.9	177	81.8	-2	110	T121 T122 V127 Y155	T121-R125 PolarHBondContact O-N 2.84Å; T122-R125 WeakPolarHBondContact O-CB 3.13Å; T122-R125 PolarHBondContact O-N 2.87Å; R125-V127 HydrophobicContact CG-CG2 4.26Å; R125-Y155 HydrophobicContact CB-CD1 3.87Å; R125-Y155 HydrophobicContact CB-CE1 3.84Å; R125-Y155 HydrophobicContact CG-CD1 3.71Å; R125-Y155 HydrophobicContact CG-CE1 4.13Å; R125-Y155 HydrophobicContact CG-CG 4.35Å; R125-Y155 WeakPolarHBondContact O-CD1 2.98Å
126	R	97.9	Very high	95.4	Very high	113 Å²	113	73.6 Å²	73.6	43%	0.426	37%	0.37	S	S	.	.			trans	-133.3	127.3	173.5	-65.1	-60.8	178.4	-85.7	-6	107.7	L123 Q124 Y155	L123-R126 PolarHBondContact O-NH1 3.19Å; L123-R126 PolarHBondContact O-NH2 3.28Å; Q124-R126 PolarHBondContact O-N 2.99Å; R126-Y155 CarbonylContact C-O 3.49Å; R126-Y155 WeakPolarHBondContact CA-O 3.47Å
127	V	98.4	Very high	94.1	Very high	41 Å²	41	77.4 Å²	77.4	25%	0.248	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-129.8	123.4	174.3	-171.7	0	0	0	0	107.2	R125 D153 F154 Y155 H209 S211	R125-V127 HydrophobicContact CG-CG2 4.26Å; V127-D153 WeakPolarHBondContact CG1-O 3.41Å; V127-F154 WeakPolarHBondContact O-CA 3.35Å; V127-Y155 PolarHBondContact N-O 2.98Å; V127-Y155 PolarHBondContact O-N 3.29Å; V127-Y155 VanDerWaalsContact O-N 3.16Å; V127-H209 PolarHBondContact O-CE1 3.41Å; V127-H209 VanDerWaalsContact O-CE1 3.24Å; V127-S211 PolarHBondContact O-OG 3.25Å
128	E	98.5	Very high	92.2	Very high	122 Å²	122	75.8 Å²	75.8	57%	0.57	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-71.3	138.5	-178.9	-63.4	-176.7	-178.8	0	0	111.4	S211 L212	E128-S211 VanDerWaalsContact CA-OG 3.26Å; E128-S211 WeakPolarHBondContact CA-OG 3.49Å; E128-S211 WeakPolarHBondContact CG-OG 3.35Å; E128-L212 HydrophobicContact CB-CD2 3.98Å; E128-L212 HydrophobicContact CG-CD2 3.71Å
129	P	98.6	Very high	90.2	Very high	7 Å²	7	81.6 Å²	81.6	5%	0.045	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-69.9	144.8	177	24.1	-29.2	0	0	0	112.1	V131 V151 T152 F154 V207 H209 L212 I216	P129-V131 HydrophobicContact CB-CG2 4.37Å; P129-V151 HydrophobicContact CB-CG1 3.51Å; P129-V151 HydrophobicContact CG-CG1 4.32Å; P129-T152 VanDerWaalsContact CA-O 3.32Å; P129-T152 WeakPolarHBondContact CA-O 3.06Å; P129-F154 HydrophobicContact CB-CB 3.76Å; P129-F154 HydrophobicContact CB-CD1 4.1Å; P129-F154 HydrophobicContact CB-CG 4.23Å; P129-F154 HydrophobicContact CG-CB 4.39Å; P129-V207 HydrophobicContact CG-CG1 3.99Å; P129-H209 HydrophobicContact CG-CB 4.31Å; P129-L212 HydrophobicContact CG-CD1 4.11Å; P129-I216 HydrophobicContact CG-CD1 4.2Å
130	T	98.5	Very high	88.4	Confident	78 Å²	78	83.5 Å²	83.5	48%	0.479	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	128	160.1	-59.5	0	0	0	0	108.7	V151 T152	T130-V151 WeakPolarHBondContact O-CA 3.48Å; T130-T152 PolarHBondContact N-O 3.3Å; T130-T152 PolarHBondContact O-N 2.63Å
131	V	98.6	Very high	86.4	Confident	19 Å²	19	77.9 Å²	77.9	12%	0.115	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	125.5	-176.2	-173.4	0	0	0	0	109.7	P129 S150 V151 V207 I216 V218	P129-V131 HydrophobicContact CB-CG2 4.37Å; V131-S150 WeakPolarHBondContact CA-O 3.41Å; V131-V151 HydrophobicContact CG1-CG2 4.41Å; V131-V151 HydrophobicContact CG2-CG1 4.3Å; V131-V151 HydrophobicContact CG2-CG2 4.48Å; V131-V207 HydrophobicContact CG1-CG2 3.97Å; V131-V207 HydrophobicContact CG2-CB 4.13Å; V131-V207 HydrophobicContact CG2-CG1 4.39Å; V131-V207 HydrophobicContact CG2-CG2 3.73Å; V131-I216 HydrophobicContact CB-CG2 3.96Å; V131-I216 HydrophobicContact CG2-CB 4.26Å; V131-I216 HydrophobicContact CG2-CD1 4.21Å; V131-I216 HydrophobicContact CG2-CG2 3.74Å; V131-V218 HydrophobicContact CB-CG2 3.8Å; V131-V218 HydrophobicContact CG1-CB 4.24Å; V131-V218 HydrophobicContact CG1-CG2 3.59Å
132	T	97.8	Very high	84.4	Confident	71 Å²	71	81 Å²	81	44%	0.436	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	140.8	176.4	57.6	0	0	0	0	110.4	C149 S150	T132-C149 CarbonylContact O-C 3.59Å; T132-C149 WeakPolarHBondContact O-CA 3.42Å; T132-S150 PolarHBondContact N-O 3.08Å; T132-S150 PolarHBondContact O-N 2.86Å
133	I	96.1	Very high	82.5	Confident	27 Å²	27	85.6 Å²	85.6	14%	0.138	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128.2	171.7	-60.6	174.4	0	0	0	108.2	L147 V148 W163 C205 V218 W220	I133-L147 HydrophobicContact CG2-CB 4.5Å; I133-L147 HydrophobicContact CG2-CD2 4.13Å; I133-V148 WeakPolarHBondContact CA-O 3.32Å; I133-W163 HydrophobicContact CD1-CH2 3.86Å; I133-W163 HydrophobicContact CD1-CZ3 3.9Å; I133-W163 HydrophobicContact CG1-CH2 3.99Å; I133-W163 HydrophobicContact CG2-CH2 3.85Å; I133-C205 HydrophobicContact CD1-CB 3.71Å; I133-C205 HydrophobicContact CG1-CB 3.99Å; I133-V218 HydrophobicContact CB-CG1 4.5Å; I133-V218 HydrophobicContact CD1-CB 3.98Å; I133-V218 HydrophobicContact CD1-CG1 3.83Å; I133-V218 WeakPolarHBondContact CD1-O 3.3Å; I133-V218 HydrophobicContact CG1-CB 4.25Å; I133-V218 HydrophobicContact CG1-CG1 3.91Å; I133-W220 HydrophobicContact CB-CB 4.22Å; I133-W220 HydrophobicContact CD1-CB 4.11Å; I133-W220 HydrophobicContact CG2-CB 3.65Å; I133-W220 HydrophobicContact CG2-CG 3.93Å
134	S	92	Very high	81	Confident	49 Å²	49	85.4 Å²	85.4	34%	0.343	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	139.6	174.6	59.1	0	0	0	0	110.8	V148	S134-V148 PolarHBondContact N-O 2.69Å; S134-V148 PolarHBondContact O-N 2.99Å
135	P	90.7	Very high	80.3	Confident	55 Å²	55	81 Å²	81	36%	0.357	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	136.9	170.4	32.4	-33.2	0	0	0	109.7	H144 L147 W220	P135-H144 HydrophobicContact CB-CB 4.14Å; P135-L147 HydrophobicContact CB-CD2 4.24Å; P135-W220 HydrophobicContact CB-CZ2 4.49Å
136	S	82.2	Confident	79.9	Confident	46 Å²	46	77.5 Å²	77.5	32%	0.322	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	154.5	174.6	-174.5	0	0	0	0	110.6	L146	S136-L146 PolarHBondContact N-O 2.93Å
137	R	69.4	Low	79.7	Confident	173 Å²	173	72.1 Å²	72.1	65%	0.653	39%	0.389	S	S	*	.			trans	-98.8	125	176.3	-67.7	-176.9	-176.5	175.9	1.6	108.8
138	T	56.7	Low	79.6	Confident	54 Å²	54	71 Å²	71	33%	0.331	38%	0.382	S	S	.	.			trans	-84.1	126.3	161.9	27.7	0	0	0	0	108.5	A140 L141	T138-A140 PolarHBondContact O-N 2.87Å; T138-L141 PolarHBondContact O-N 3.49Å
139	E	54.5	Low	79.6	Confident	201 Å²	201	65.2 Å²	65.2	94%	0.939	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-23.3	-176.1	-69.8	-178.6	156.5	0	0	113.5
140	A	54.9	Low	79.6	Confident	94 Å²	94	65.8 Å²	65.8	78%	0.777	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-24.6	-177.6	0	0	0	0	0	115.5	T138	T138-A140 PolarHBondContact O-N 2.87Å
141	L	52.4	Low	79.6	Confident	93 Å²	93	62 Å²	62	49%	0.487	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.8	-1.1	-162.3	-85.3	155.6	0	0	0	117	T138 H143 N145	T138-L141 PolarHBondContact O-N 3.49Å; L141-H143 PolarHBondContact O-N 3.16Å; L141-H143 PolarHBondContact O-ND1 3.47Å; L141-N145 WeakPolarHBondContact CD1-ND2 3.39Å
142	N	51.9	Low	79.6	Confident	149 Å²	149	62.6 Å²	62.6	80%	0.797	34%	0.339	S	S	*	.	S	Bend	trans	50.6	13.5	179.3	-84.2	-22.3	0	0	0	115.6
143	H	56.4	Low	79.6	Confident	125 Å²	125	62.6 Å²	62.6	58%	0.579	34%	0.337	S	S	*	.	S	Bend	trans	-127.7	153.8	177.5	-68.5	77.5	0	0	0	109.5	L141 N145	L141-H143 PolarHBondContact O-N 3.16Å; L141-H143 PolarHBondContact O-ND1 3.47Å; H143-N145 VanDerWaalsContact C-N 3.26Å; H143-N145 VanDerWaalsContact CB-OD1 3.24Å; H143-N145 WeakPolarHBondContact CB-OD1 2.97Å; H143-N145 PolarHBondContact O-N 2.85Å
144	H	63.1	Low	79.7	Confident	57 Å²	57	61.3 Å²	61.3	26%	0.264	33%	0.33	S	S	.	.			trans	-73.6	78.8	174.6	-68.3	-72.3	0	0	0	110.2	P135 M195	P135-H144 HydrophobicContact CB-CB 4.14Å; H144-M195 WeakPolarHBondContact O-CE 3.33Å
145	N	79.9	Confident	80	Confident	24 Å²	24	60.4 Å²	60.4	13%	0.128	32%	0.32	C	S	.	.			trans	-96.4	8.7	-179.8	-63.4	1.7	0	0	0	112.6	L141 H143 E194 M195	L141-N145 WeakPolarHBondContact CD1-ND2 3.39Å; H143-N145 VanDerWaalsContact C-N 3.26Å; H143-N145 VanDerWaalsContact CB-OD1 3.24Å; H143-N145 WeakPolarHBondContact CB-OD1 2.97Å; H143-N145 PolarHBondContact O-N 2.85Å; N145-E194 CarbonylContact O-C 3.56Å; N145-E194 WeakPolarHBondContact O-CA 3.43Å; N145-M195 CarbonylContact C-O 3.56Å; N145-M195 VanDerWaalsContact CA-O 3.27Å; N145-M195 WeakPolarHBondContact CA-O 3.31Å; N145-M195 WeakPolarHBondContact CB-O 3.36Å; N145-M195 PolarHBondContact O-N 2.89Å
146	L	89.6	Confident	80.4	Confident	30 Å²	30	59 Å²	59	16%	0.157	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	125.8	-178.4	-165.6	71.4	0	0	0	109.5	S136 V148 M192 L193 E194	S136-L146 PolarHBondContact N-O 2.93Å; L146-V148 HydrophobicContact CD2-CG2 4.33Å; L146-V148 HydrophobicContact CG-CG2 4.43Å; L146-M192 HydrophobicContact CD1-CB 4.03Å; L146-M192 HydrophobicContact CD2-CB 4.49Å; L146-M192 HydrophobicContact CD2-SD 4.44Å; L146-M192 HydrophobicContact CG-CB 4.37Å; L146-L193 WeakPolarHBondContact CA-O 3Å; L146-E194 HydrophobicContact CD1-CB 4.48Å
147	L	93.4	Very high	81.1	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	136.7	165.7	-69.9	174.9	0	0	0	109.4	I133 P135 W163 M192 L193 M195 Y203 W220	I133-L147 HydrophobicContact CG2-CB 4.5Å; I133-L147 HydrophobicContact CG2-CD2 4.13Å; P135-L147 HydrophobicContact CB-CD2 4.24Å; L147-W163 HydrophobicContact CB-CH2 3.77Å; L147-W163 HydrophobicContact CB-CZ2 4Å; L147-W163 HydrophobicContact CB-CZ3 4.5Å; L147-W163 HydrophobicContact CD1-CH2 4.32Å; L147-W163 HydrophobicContact CD1-CZ3 4.32Å; L147-M192 CarbonylContact O-C 3.57Å; L147-M192 VanDerWaalsContact O-CA 3.23Å; L147-M192 WeakPolarHBondContact O-CA 3.38Å; L147-L193 PolarHBondContact N-O 3.04Å; L147-L193 PolarHBondContact O-N 2.89Å; L147-M195 HydrophobicContact CD1-CE 4.1Å; L147-M195 HydrophobicContact CD1-CG 4.21Å; L147-M195 HydrophobicContact CD2-CE 3.88Å; L147-M195 HydrophobicContact CG-CE 3.67Å; L147-M195 HydrophobicContact CG-CG 4.04Å; L147-Y203 HydrophobicContact CD1-CD1 3.91Å; L147-Y203 HydrophobicContact CD1-CD2 3.95Å; L147-Y203 HydrophobicContact CD1-CG 3.53Å; L147-W220 HydrophobicContact CD1-CD2 4.12Å; L147-W220 HydrophobicContact CD1-CE3 3.63Å; L147-W220 HydrophobicContact CD1-CZ3 4.07Å; L147-W220 HydrophobicContact CD2-CD2 3.58Å; L147-W220 HydrophobicContact CD2-CE3 3.81Å; L147-W220 HydrophobicContact CD2-CG 4.02Å; L147-W220 HydrophobicContact CD2-CH2 4.24Å; L147-W220 HydrophobicContact CD2-CZ2 4.05Å; L147-W220 HydrophobicContact CD2-CZ3 4.12Å; L147-W220 HydrophobicContact CG-CE3 4.32Å
148	V	96.3	Very high	82.5	Confident	17 Å²	17	57.6 Å²	57.6	10%	0.103	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	115	178	-171.3	0	0	0	0	108.5	I133 S134 L146 L190 M192	I133-V148 WeakPolarHBondContact CA-O 3.32Å; S134-V148 PolarHBondContact N-O 2.69Å; S134-V148 PolarHBondContact O-N 2.99Å; L146-V148 HydrophobicContact CD2-CG2 4.33Å; L146-V148 HydrophobicContact CG-CG2 4.43Å; V148-L190 HydrophobicContact CG1-CB 4.37Å; V148-L190 HydrophobicContact CG1-CD2 3.8Å; V148-M192 HydrophobicContact CB-CG 4.5Å; V148-M192 HydrophobicContact CG1-CG 4.09Å; V148-M192 HydrophobicContact CG2-CG 4.09Å
149	C	98	Very high	84.5	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	106.9	167.6	-175.9	0	0	0	0	108	T132 W163 V191 C205	T132-C149 CarbonylContact O-C 3.59Å; T132-C149 WeakPolarHBondContact O-CA 3.42Å; C149-W163 HydrophobicContact CB-CH2 4.07Å; C149-W163 HydrophobicContact CB-CZ2 3.45Å; C149-W163 VanDerWaalsContact CB-CZ2 3.45Å; C149-V191 PolarHBondContact N-O 3.38Å; C149-V191 PolarHBondContact O-N 2.75Å; C149-C205 HydrophobicContact CB-CB 3.67Å; C149-C205 WeakPolarHBondContact CB-SG 3.38Å; C149-C205 WeakPolarHBondContact SG-CB 3.37Å; C149-C205 CovalentContact SG-SG 2.03Å; C149-C205 PolarHBondContact SG-SG 2.94Å
150	S	98.4	Very high	86.6	Confident	19 Å²	19	51.7 Å²	51.7	13%	0.133	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	116	176.9	-49.9	0	0	0	0	108.5	V131 T132 L190	V131-S150 WeakPolarHBondContact CA-O 3.41Å; T132-S150 PolarHBondContact N-O 3.08Å; T132-S150 PolarHBondContact O-N 2.86Å; S150-L190 VanDerWaalsContact OG-CD2 3.27Å; S150-L190 WeakPolarHBondContact OG-CD2 3.36Å
151	V	98.7	Very high	88.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	108.7	179.8	-172.1	0	0	0	0	107.3	P129 T130 V131 F154 I159 V161 Q188 I189 V207	P129-V151 HydrophobicContact CB-CG1 3.51Å; P129-V151 HydrophobicContact CG-CG1 4.32Å; T130-V151 WeakPolarHBondContact O-CA 3.48Å; V131-V151 HydrophobicContact CG1-CG2 4.41Å; V131-V151 HydrophobicContact CG2-CG1 4.3Å; V131-V151 HydrophobicContact CG2-CG2 4.48Å; V151-F154 HydrophobicContact CB-CE1 4.45Å; V151-F154 HydrophobicContact CG1-CD1 3.98Å; V151-F154 HydrophobicContact CG1-CE1 3.98Å; V151-F154 WeakPolarHBondContact O-CE1 3.19Å; V151-I159 HydrophobicContact CG1-CD1 3.49Å; V151-I159 VanDerWaalsContact CG1-CD1 3.49Å; V151-V161 HydrophobicContact CG2-CG1 4.31Å; V151-V161 HydrophobicContact CG2-CG2 4.01Å; V151-Q188 CarbonylContact O-C 3.58Å; V151-Q188 VanDerWaalsContact O-CA 3.27Å; V151-Q188 WeakPolarHBondContact O-CA 3.3Å; V151-I189 HydrophobicContact CB-CG2 3.91Å; V151-I189 HydrophobicContact CG2-CG2 4.5Å; V151-I189 PolarHBondContact N-O 2.74Å; V151-I189 PolarHBondContact O-N 2.8Å; V151-V207 HydrophobicContact CG1-CG1 4.02Å; V151-V207 HydrophobicContact CG1-CG2 4.46Å; V151-V207 HydrophobicContact CG2-CG2 3.82Å
152	T	98.6	Very high	90.8	Very high	30 Å²	30	46.6 Å²	46.6	18%	0.184	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	162.9	-169.1	67.4	0	0	0	0	112.5	P129 T130 F154 Q188	P129-T152 VanDerWaalsContact CA-O 3.32Å; P129-T152 WeakPolarHBondContact CA-O 3.06Å; T130-T152 PolarHBondContact N-O 3.3Å; T130-T152 PolarHBondContact O-N 2.63Å; T152-F154 VanDerWaalsContact C-N 3.33Å; T152-F154 PolarHBondContact O-N 3.19Å; T152-Q188 HydrophobicContact CG2-CB 4.16Å
153	D	98.1	Very high	93	Very high	71 Å²	71	39.6 Å²	39.6	38%	0.38	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	61.7	32.2	165.7	-47.7	-49.8	0	0	0	115.4	V127 F187	V127-D153 WeakPolarHBondContact CG1-O 3.41Å; D153-F187 PolarHBondContact N-O 3.06Å; D153-F187 VanDerWaalsContact N-O 3.08Å
154	F	98.7	Very high	95	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	158.4	-177.8	64	-90.2	0	0	0	114.2	V127 P129 V151 T152 P156 I159 L179 T186 F187 I189 H209	V127-F154 WeakPolarHBondContact O-CA 3.35Å; P129-F154 HydrophobicContact CB-CB 3.76Å; P129-F154 HydrophobicContact CB-CD1 4.1Å; P129-F154 HydrophobicContact CB-CG 4.23Å; P129-F154 HydrophobicContact CG-CB 4.39Å; V151-F154 HydrophobicContact CB-CE1 4.45Å; V151-F154 HydrophobicContact CG1-CD1 3.98Å; V151-F154 HydrophobicContact CG1-CE1 3.98Å; V151-F154 WeakPolarHBondContact O-CE1 3.19Å; T152-F154 VanDerWaalsContact C-N 3.33Å; T152-F154 PolarHBondContact O-N 3.19Å; F154-P156 WeakPolarHBondContact CD2-O 3.31Å; F154-I159 HydrophobicContact CD1-CD1 3.86Å; F154-I159 HydrophobicContact CD2-CB 4.44Å; F154-I159 HydrophobicContact CD2-CD1 3.83Å; F154-I159 HydrophobicContact CE1-CD1 3.68Å; F154-I159 HydrophobicContact CE2-CB 3.8Å; F154-I159 HydrophobicContact CE2-CD1 3.66Å; F154-I159 HydrophobicContact CE2-CG1 4.35Å; F154-I159 HydrophobicContact CE2-CG2 3.83Å; F154-I159 HydrophobicContact CG-CD1 3.94Å; F154-I159 HydrophobicContact CZ-CB 4.13Å; F154-I159 HydrophobicContact CZ-CD1 3.58Å; F154-I159 HydrophobicContact CZ-CG1 4.47Å; F154-I159 HydrophobicContact CZ-CG2 3.76Å; F154-L179 HydrophobicContact CE2-CD1 4.02Å; F154-L179 HydrophobicContact CZ-CD1 3.61Å; F154-T186 WeakPolarHBondContact O-CA 3.22Å; F154-F187 VanDerWaalsContact CD1-O 3.25Å; F154-F187 WeakPolarHBondContact CD1-O 3.34Å; F154-F187 HydrophobicContact CD2-CB 4.16Å; F154-F187 HydrophobicContact CE1-CB 4.31Å; F154-F187 WeakPolarHBondContact CE1-O 3.15Å; F154-F187 HydrophobicContact CE2-CB 3.72Å; F154-F187 HydrophobicContact CZ-CB 3.8Å; F154-F187 PolarHBondContact N-O 3.03Å; F154-F187 PolarHBondContact O-N 3.34Å; F154-I189 HydrophobicContact CE1-CG2 4.07Å; F154-I189 HydrophobicContact CZ-CG2 4.05Å; F154-H209 AromaticContact CD2-CD2 3.89Å; F154-H209 AromaticContact CD2-NE2 3.71Å
155	Y	98.5	Very high	96.5	Very high	31 Å²	31	36.8 Å²	36.8	12%	0.122	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-155.3	135.7	172.4	-173.1	-82	0	0	0	110.3	T122 R125 R126 V127 W185 F187 H209	T122-Y155 WeakPolarHBondContact CG2-OH 3.44Å; R125-Y155 HydrophobicContact CB-CD1 3.87Å; R125-Y155 HydrophobicContact CB-CE1 3.84Å; R125-Y155 HydrophobicContact CG-CD1 3.71Å; R125-Y155 HydrophobicContact CG-CE1 4.13Å; R125-Y155 HydrophobicContact CG-CG 4.35Å; R125-Y155 WeakPolarHBondContact O-CD1 2.98Å; R126-Y155 CarbonylContact C-O 3.49Å; R126-Y155 WeakPolarHBondContact CA-O 3.47Å; V127-Y155 PolarHBondContact N-O 2.98Å; V127-Y155 PolarHBondContact O-N 3.29Å; V127-Y155 VanDerWaalsContact O-N 3.16Å; Y155-W185 WeakPolarHBondContact CD2-O 3.48Å; Y155-W185 HydrophobicContact CE2-CE3 4.24Å; Y155-F187 HydrophobicContact CD2-CD2 4.1Å; Y155-F187 AromaticContact CD2-CE2 3.64Å; Y155-F187 HydrophobicContact CD2-CE2 3.64Å; Y155-F187 AromaticContact CE2-CE2 3.89Å; Y155-F187 HydrophobicContact CE2-CE2 3.89Å; Y155-H209 VanDerWaalsContact C-CE1 3.41Å; Y155-H209 PolarHBondContact O-CE1 3.05Å
156	P	98.3	Very high	97.2	Very high	26 Å²	26	39.2 Å²	39.2	17%	0.169	20%	0.197	C	C	.	.	S	Bend	cis	-80.1	-177.9	10.6	34.2	-39	0	0	0	114.6	F154 Q158 H209 P210	F154-P156 WeakPolarHBondContact CD2-O 3.31Å; P156-Q158 VanDerWaalsContact C-N 3.27Å; P156-Q158 PolarHBondContact O-N 2.85Å; P156-H209 PolarHBondContact O-NE2 2.93Å; P156-P210 HydrophobicContact CG-CG 4.4Å
157	A	98.1	Very high	97.3	Very high	40 Å²	40	44.8 Å²	44.8	33%	0.331	23%	0.226	S	C	.	.	S	Bend	trans	-61.1	-29	-178.4	0	0	0	0	0	114.9	I159 L179 F187	A157-I159 PolarHBondContact O-N 3.15Å; A157-L179 HydrophobicContact CB-CD2 3.5Å; A157-F187 HydrophobicContact CB-CD1 4.43Å; A157-F187 HydrophobicContact CB-CD2 4.11Å; A157-F187 HydrophobicContact CB-CE1 4.09Å; A157-F187 HydrophobicContact CB-CE2 3.75Å; A157-F187 HydrophobicContact CB-CG 4.44Å; A157-F187 HydrophobicContact CB-CZ 3.74Å
158	Q	97.6	Very high	97.4	Very high	149 Å²	149	51.7 Å²	51.7	70%	0.696	26%	0.259	S	S	*	.			trans	-70.8	118.8	-176.6	-178.8	-175.2	12.4	0	0	110.3	P156 H209 P210	P156-Q158 VanDerWaalsContact C-N 3.27Å; P156-Q158 PolarHBondContact O-N 2.85Å; Q158-H209 PolarHBondContact O-CD2 3.07Å; Q158-P210 WeakPolarHBondContact O-CD 3.46Å
159	I	98.5	Very high	97.5	Very high	35 Å²	35	55.4 Å²	55.4	18%	0.179	28%	0.275	C	S	.	.			trans	-145.2	153.4	179.4	-165.4	159.8	0	0	0	110.3	V151 F154 A157 V161 I189 V207 H209	V151-I159 HydrophobicContact CG1-CD1 3.49Å; V151-I159 VanDerWaalsContact CG1-CD1 3.49Å; F154-I159 HydrophobicContact CD1-CD1 3.86Å; F154-I159 HydrophobicContact CD2-CB 4.44Å; F154-I159 HydrophobicContact CD2-CD1 3.83Å; F154-I159 HydrophobicContact CE1-CD1 3.68Å; F154-I159 HydrophobicContact CE2-CB 3.8Å; F154-I159 HydrophobicContact CE2-CD1 3.66Å; F154-I159 HydrophobicContact CE2-CG1 4.35Å; F154-I159 HydrophobicContact CE2-CG2 3.83Å; F154-I159 HydrophobicContact CG-CD1 3.94Å; F154-I159 HydrophobicContact CZ-CB 4.13Å; F154-I159 HydrophobicContact CZ-CD1 3.58Å; F154-I159 HydrophobicContact CZ-CG1 4.47Å; F154-I159 HydrophobicContact CZ-CG2 3.76Å; A157-I159 PolarHBondContact O-N 3.15Å; I159-V161 HydrophobicContact CD1-CG2 4.39Å; I159-V161 HydrophobicContact CG1-CG2 4.13Å; I159-I189 HydrophobicContact CG2-CG2 4.18Å; I159-V207 HydrophobicContact CD1-CG1 3.9Å; I159-V207 HydrophobicContact CG1-CG1 4.15Å; I159-H209 HydrophobicContact CD1-CB 4.49Å; I159-H209 HydrophobicContact CG1-CB 4.32Å
160	K	98.4	Very high	97.4	Very high	96 Å²	96	57.2 Å²	57.2	42%	0.417	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	124.1	172.8	177.9	-179.2	168.4	-151.8	0	109.2	E208	K160-E208 HydrophobicContact CB-CB 4.23Å; K160-E208 WeakPolarHBondContact CD-OE2 3.15Å; K160-E208 PolarHBondContact N-O 2.86Å; K160-E208 IonicContact NZ-OE1 2.91Å; K160-E208 PolarHBondContact NZ-OE1 3.24Å; K160-E208 VanDerWaalsContact NZ-OE1 3.12Å; K160-E208 IonicContact NZ-OE2 2.76Å; K160-E208 PolarHBondContact NZ-OE2 3.39Å; K160-E208 PolarHBondContact O-N 2.89Å
161	V	98.6	Very high	97.2	Very high	27 Å²	27	61.1 Å²	61.1	16%	0.164	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	129.7	-176.8	-177	0	0	0	0	107.9	V151 I159 I189 V191 H206 V207	V151-V161 HydrophobicContact CG2-CG1 4.31Å; V151-V161 HydrophobicContact CG2-CG2 4.01Å; I159-V161 HydrophobicContact CD1-CG2 4.39Å; I159-V161 HydrophobicContact CG1-CG2 4.13Å; V161-I189 HydrophobicContact CG2-CG2 4.22Å; V161-V191 HydrophobicContact CB-CG2 3.78Å; V161-V191 HydrophobicContact CG1-CB 3.87Å; V161-V191 HydrophobicContact CG1-CG1 4.29Å; V161-V191 HydrophobicContact CG1-CG2 3.61Å; V161-V191 HydrophobicContact CG2-CG2 4.29Å; V161-H206 CarbonylContact C-O 3.57Å; V161-H206 WeakPolarHBondContact CA-O 3.47Å; V161-V207 HydrophobicContact CG1-CG2 4.23Å; V161-V207 HydrophobicContact CG2-CG1 4.43Å; V161-V207 HydrophobicContact CG2-CG2 4.27Å
162	R	98.4	Very high	97	Very high	53 Å²	53	66.5 Å²	66.5	20%	0.2	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	147.1	-178.1	-69.4	-176.9	-73.5	159.4	1.1	110.7	F164 E169 H206 E208	R162-F164 HydrophobicContact CB-CD2 4.32Å; R162-F164 HydrophobicContact CB-CE2 3.74Å; R162-E169 WeakPolarHBondContact CD-OE1 3.49Å; R162-E169 IonicContact CZ-OE2 3.93Å; R162-E169 IonicContact NH1-OE2 3.98Å; R162-E169 PolarHBondContact NH1-OE2 2.92Å; R162-H206 HydrophobicContact CB-CB 4.43Å; R162-H206 PolarHBondContact N-O 2.87Å; R162-H206 PolarHBondContact NH2-CE1 3.01Å; R162-H206 PolarHBondContact O-N 3.26Å; R162-E208 IonicContact CZ-OE1 3.5Å; R162-E208 IonicContact NE-OE1 3.2Å; R162-E208 IonicContact NH2-OE1 2.75Å; R162-E208 PolarHBondContact NH2-OE1 2.72Å
163	W	98.1	Very high	96.6	Very high	2 Å²	2	66.6 Å²	66.6	1%	0.008	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	145.3	171.8	-83.4	108.3	0	0	0	110.6	I133 L147 C149 E170 V174 V191 L193 T204 C205	I133-W163 HydrophobicContact CD1-CH2 3.86Å; I133-W163 HydrophobicContact CD1-CZ3 3.9Å; I133-W163 HydrophobicContact CG1-CH2 3.99Å; I133-W163 HydrophobicContact CG2-CH2 3.85Å; L147-W163 HydrophobicContact CB-CH2 3.77Å; L147-W163 HydrophobicContact CB-CZ2 4Å; L147-W163 HydrophobicContact CB-CZ3 4.5Å; L147-W163 HydrophobicContact CD1-CH2 4.32Å; L147-W163 HydrophobicContact CD1-CZ3 4.32Å; C149-W163 HydrophobicContact CB-CH2 4.07Å; C149-W163 HydrophobicContact CB-CZ2 3.45Å; C149-W163 VanDerWaalsContact CB-CZ2 3.45Å; W163-E170 HydrophobicContact CB-CB 4.35Å; W163-E170 PolarHBondContact O-N 3.26Å; W163-V174 HydrophobicContact CB-CG2 4.2Å; W163-V174 HydrophobicContact CG-CG2 4.44Å; W163-V191 PolarHBondContact NE1-O 2.91Å; W163-L193 HydrophobicContact CB-CD2 4.19Å; W163-L193 HydrophobicContact CD2-CB 3.97Å; W163-L193 HydrophobicContact CD2-CD2 3.98Å; W163-L193 HydrophobicContact CE3-CD2 4.04Å; W163-L193 HydrophobicContact CG-CB 3.96Å; W163-L193 HydrophobicContact CG-CD2 4.08Å; W163-L193 HydrophobicContact CG-CG 4.49Å; W163-L193 HydrophobicContact CZ2-CB 4.38Å; W163-T204 CarbonylContact C-O 3.6Å; W163-T204 WeakPolarHBondContact CA-O 3.07Å; W163-T204 VanDerWaalsContact CE3-O 3.27Å; W163-C205 HydrophobicContact CE3-CB 4.34Å; W163-C205 HydrophobicContact CH2-CB 4.19Å; W163-C205 HydrophobicContact CZ2-CB 4.5Å; W163-C205 HydrophobicContact CZ3-CB 4.1Å
164	F	97.4	Very high	96.6	Very high	33 Å²	33	65.5 Å²	65.5	15%	0.145	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	146.3	173.9	-73.2	-103.4	0	0	0	108.7	R162 Q168 E169 Y203 T204 H206	R162-F164 HydrophobicContact CB-CD2 4.32Å; R162-F164 HydrophobicContact CB-CE2 3.74Å; F164-Q168 CarbonylContact C-O 3.59Å; F164-Q168 WeakPolarHBondContact CA-O 3.43Å; F164-E169 HydrophobicContact CD1-CB 4.01Å; F164-E169 HydrophobicContact CE1-CB 3.64Å; F164-E169 HydrophobicContact CE1-CG 4.24Å; F164-E169 HydrophobicContact CE2-CG 4.33Å; F164-E169 HydrophobicContact CZ-CB 3.94Å; F164-E169 HydrophobicContact CZ-CG 4.03Å; F164-Y203 CarbonylContact O-C 3.59Å; F164-Y203 WeakPolarHBondContact O-CA 3.16Å; F164-T204 WeakPolarHBondContact CB-OG1 3.33Å; F164-T204 PolarHBondContact N-O 3.23Å; F164-T204 PolarHBondContact O-N 3.38Å; F164-T204 PolarHBondContact O-OG1 3.25Å; F164-H206 HydrophobicContact CD2-CB 3.94Å; F164-H206 HydrophobicContact CE2-CB 3.8Å; F164-H206 AromaticContact CE2-ND1 3.57Å
165	R	95.2	Very high	96.4	Very high	89 Å²	89	69.8 Å²	69.8	34%	0.336	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	121	170.6	178.2	176.8	59.8	149.9	-2.8	108	D167 Q168 E170 V202 Y203	R165-D167 PolarHBondContact O-N 3.29Å; R165-Q168 PolarHBondContact N-O 2.85Å; R165-Q168 PolarHBondContact O-N 2.93Å; R165-E170 HydrophobicContact CB-CG 3.68Å; R165-E170 IonicContact CZ-OE1 3.59Å; R165-E170 IonicContact NE-OE1 2.75Å; R165-E170 PolarHBondContact NE-OE1 2.97Å; R165-E170 IonicContact NH2-OE1 3.85Å; R165-E170 PolarHBondContact NH2-OE1 2.54Å; R165-V202 WeakPolarHBondContact CA-O 3.31Å; R165-Y203 HydrophobicContact CB-CD1 4.2Å; R165-Y203 HydrophobicContact CB-CE1 4.17Å; R165-Y203 HydrophobicContact CG-CD1 4.28Å; R165-Y203 HydrophobicContact CG-CE1 3.92Å
166	N	93.5	Very high	96.4	Very high	76 Å²	76	71.8 Å²	71.8	41%	0.406	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	48.3	-178.2	-54.3	-35.1	0	0	0	111.7	Q168 D201 V202	N166-Q168 PolarHBondContact O-N 2.86Å; N166-D201 PolarHBondContact ND2-OD1 2.03Å; N166-D201 VanDerWaalsContact ND2-OD1 3.1Å; N166-V202 PolarHBondContact N-O 2.89Å; N166-V202 PolarHBondContact OD1-N 3.14Å
167	D	92.6	Very high	96.3	Very high	146 Å²	146	72.1 Å²	72.1	78%	0.781	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	8.3	-178.6	-54.7	-46.4	0	0	0	116.8	R165	R165-D167 PolarHBondContact O-N 3.29Å
168	Q	96	Very high	96.3	Very high	145 Å²	145	75.5 Å²	75.5	68%	0.678	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	131.8	172.4	-62.3	-169.3	-11.4	0	0	110.8	F164 R165 N166 E170	F164-Q168 CarbonylContact C-O 3.59Å; F164-Q168 WeakPolarHBondContact CA-O 3.43Å; R165-Q168 PolarHBondContact N-O 2.85Å; R165-Q168 PolarHBondContact O-N 2.93Å; N166-Q168 PolarHBondContact O-N 2.86Å; Q168-E170 PolarHBondContact O-N 3.12Å
169	E	97.3	Very high	96.3	Very high	95 Å²	95	71.8 Å²	71.8	44%	0.444	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	124.2	-179.5	-170.1	166.7	159.6	0	0	110.4	R162 F164 T171	R162-E169 WeakPolarHBondContact CD-OE1 3.49Å; R162-E169 IonicContact CZ-OE2 3.93Å; R162-E169 IonicContact NH1-OE2 3.98Å; R162-E169 PolarHBondContact NH1-OE2 2.92Å; F164-E169 HydrophobicContact CD1-CB 4.01Å; F164-E169 HydrophobicContact CE1-CB 3.64Å; F164-E169 HydrophobicContact CE1-CG 4.24Å; F164-E169 HydrophobicContact CE2-CG 4.33Å; F164-E169 HydrophobicContact CZ-CB 3.94Å; F164-E169 HydrophobicContact CZ-CG 4.03Å; E169-T171 HydrophobicContact CG-CG2 4.46Å
170	E	95.5	Very high	96.3	Very high	38 Å²	38	73.1 Å²	73.1	18%	0.178	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	125.1	177.1	-79	-69.2	-176.4	0	0	109.8	W163 R165 Q168 V174 L193	W163-E170 HydrophobicContact CB-CB 4.35Å; W163-E170 PolarHBondContact O-N 3.26Å; R165-E170 HydrophobicContact CB-CG 3.68Å; R165-E170 IonicContact CZ-OE1 3.59Å; R165-E170 IonicContact NE-OE1 2.75Å; R165-E170 PolarHBondContact NE-OE1 2.97Å; R165-E170 IonicContact NH2-OE1 3.85Å; R165-E170 PolarHBondContact NH2-OE1 2.54Å; Q168-E170 PolarHBondContact O-N 3.12Å; E170-V174 WeakPolarHBondContact O-CG2 3.38Å; E170-L193 HydrophobicContact CB-CD1 4.3Å
171	T	96	Very high	96.3	Very high	101 Å²	101	77.3 Å²	77.3	62%	0.62	41%	0.411	S	S	*	.			trans	-121.9	-21.3	177.8	54.7	0	0	0	0	112.2	E169	E169-T171 HydrophobicContact CG-CG2 4.46Å
172	T	94	Very high	96.2	Very high	114 Å²	114	78.6 Å²	78.6	70%	0.699	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	133.2	177.7	-58.8	0	0	0	0	109.2	V174	T172-V174 PolarHBondContact O-N 3.13Å
173	G	90.7	Very high	96.1	Very high	31 Å²	31	79.3 Å²	79.3	32%	0.32	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	8.8	-178	0	0	0	0	0	114.4	E194	G173-E194 PolarHBondContact O-N 2.82Å
174	V	96.2	Very high	96.1	Very high	48 Å²	48	83.4 Å²	83.4	29%	0.291	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	127.1	173.9	179.4	0	0	0	0	110.4	W163 E170 T172 V191 M192 L193	W163-V174 HydrophobicContact CB-CG2 4.2Å; W163-V174 HydrophobicContact CG-CG2 4.44Å; E170-V174 WeakPolarHBondContact O-CG2 3.38Å; T172-V174 PolarHBondContact O-N 3.13Å; V174-V191 HydrophobicContact CG1-CG1 3.7Å; V174-M192 CarbonylContact C-O 3.57Å; V174-M192 VanDerWaalsContact CA-O 3.27Å; V174-M192 WeakPolarHBondContact CA-O 3.34Å; V174-L193 HydrophobicContact CG2-CD1 3.64Å
175	V	95.9	Very high	96	Very high	90 Å²	90	89 Å²	89	55%	0.545	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	132.6	176.4	-178.1	0	0	0	0	109.2	M192	V175-M192 HydrophobicContact CB-CE 4.23Å; V175-M192 HydrophobicContact CG1-CE 4.01Å; V175-M192 PolarHBondContact N-O 3.18Å; V175-M192 PolarHBondContact O-N 2.92Å
176	S	97.1	Very high	96.2	Very high	74 Å²	74	85.4 Å²	85.4	52%	0.517	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	149.2	175.2	59.8	0	0	0	0	111.9	L190	S176-L190 WeakPolarHBondContact CA-O 3.43Å
177	T	97.1	Very high	96.4	Very high	33 Å²	33	82.2 Å²	82.2	20%	0.202	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-71.2	159.3	164.9	61.8	0	0	0	0	110.2	L190 M192	T177-L190 HydrophobicContact CG2-CB 3.82Å; T177-L190 HydrophobicContact CG2-CD1 4.12Å; T177-L190 PolarHBondContact N-O 3.12Å; T177-L190 PolarHBondContact OG1-N 2.73Å; T177-L190 VanDerWaalsContact OG1-N 3.14Å; T177-M192 HydrophobicContact CG2-CE 4.4Å
178	P	97.8	Very high	96.7	Very high	111 Å²	111	78 Å²	78	72%	0.721	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-53.7	156.9	158.3	-21.5	33.4	0	0	0	110.5	I180	P178-I180 PolarHBondContact O-N 2.91Å
179	L	97.8	Very high	96.8	Very high	70 Å²	70	72.1 Å²	72.1	37%	0.366	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-64	123.6	172.7	-171.6	73.2	0	0	0	109.6	F154 A157 F187 I189	F154-L179 HydrophobicContact CE2-CD1 4.02Å; F154-L179 HydrophobicContact CZ-CD1 3.61Å; A157-L179 HydrophobicContact CB-CD2 3.5Å; L179-F187 HydrophobicContact CD1-CB 3.96Å; L179-F187 HydrophobicContact CD1-CD1 4.45Å; L179-F187 HydrophobicContact CD1-CG 4.46Å; L179-F187 HydrophobicContact CD2-CB 4.45Å; L179-F187 HydrophobicContact CD2-CD1 3.57Å; L179-F187 HydrophobicContact CD2-CE1 3.97Å; L179-F187 HydrophobicContact CD2-CG 4.07Å; L179-F187 HydrophobicContact CG-CB 4.23Å; L179-F187 HydrophobicContact CG-CD1 3.81Å; L179-F187 HydrophobicContact CG-CG 4.29Å; L179-I189 HydrophobicContact CD1-CB 4.37Å
180	I	98.4	Very high	96.9	Very high	64 Å²	64	70 Å²	70	33%	0.328	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	129.5	-178.4	-61.5	159.1	0	0	0	108.3	P178 F187 Q188	P178-I180 PolarHBondContact O-N 2.91Å; I180-F187 VanDerWaalsContact O-CA 3.25Å; I180-F187 WeakPolarHBondContact O-CA 3.49Å; I180-Q188 HydrophobicContact CB-CG 3.57Å; I180-Q188 HydrophobicContact CD1-CG 4.01Å; I180-Q188 HydrophobicContact CG1-CG 4.38Å; I180-Q188 HydrophobicContact CG2-CG 3.75Å; I180-Q188 PolarHBondContact N-O 3.41Å; I180-Q188 PolarHBondContact O-N 3.38Å
181	R	98	Very high	97	Very high	183 Å²	183	68.4 Å²	68.4	69%	0.691	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	119.9	174.4	-176.8	-174.6	-65.1	-92.6	0.5	109.1	F187	R181-F187 HydrophobicContact CB-CD1 4.2Å; R181-F187 HydrophobicContact CB-CE1 4.05Å; R181-F187 HydrophobicContact CG-CE1 4.07Å
182	N	97.4	Very high	97	Very high	54 Å²	54	65.9 Å²	65.9	29%	0.289	37%	0.369	S	S	.	.			trans	-77	-23.5	-175.3	-66.9	-20.3	0	0	0	113.4	D184 T186 Q188	N182-D184 VanDerWaalsContact CB-OD1 3.24Å; N182-D184 WeakPolarHBondContact CB-OD1 3.29Å; N182-T186 PolarHBondContact N-O 3.04Å; N182-T186 VanDerWaalsContact N-O 3.17Å; N182-T186 PolarHBondContact ND2-OG1 2.82Å; N182-Q188 PolarHBondContact OD1-NE2 2.81Å
183	G	96.4	Very high	97.1	Very high	68 Å²	68	60.6 Å²	60.6	70%	0.701	34%	0.336	S	S	*	.	S	Bend	trans	92.7	-2.6	-178	0	0	0	0	0	114.3
184	D	97.3	Very high	97.2	Very high	89 Å²	89	65.1 Å²	65.1	48%	0.476	35%	0.349	S	S	.	.	S	Bend	trans	-112.9	24	179.9	67	-7.7	0	0	0	112.7	N182 T186	N182-D184 VanDerWaalsContact CB-OD1 3.24Å; N182-D184 WeakPolarHBondContact CB-OD1 3.29Å; D184-T186 VanDerWaalsContact C-N 3.29Å; D184-T186 PolarHBondContact O-N 3.47Å; D184-T186 WeakPolarHBondContact OD1-CB 3.05Å; D184-T186 PolarHBondContact OD1-N 3.32Å; D184-T186 PolarHBondContact OD1-OG1 3.41Å
185	W	96.8	Very high	96.7	Very high	151 Å²	151	63.3 Å²	63.3	57%	0.572	34%	0.338	S	S	*	.	S	Bend	trans	67.5	22.5	-173.8	-59.9	75.3	0	0	0	115.2	T122 Y155	T122-W185 HydrophobicContact CG2-CH2 4.33Å; T122-W185 HydrophobicContact CG2-CZ3 3.62Å; Y155-W185 WeakPolarHBondContact CD2-O 3.48Å; Y155-W185 HydrophobicContact CE2-CE3 4.24Å
186	T	98.3	Very high	96.2	Very high	12 Å²	12	63.8 Å²	63.8	7%	0.074	34%	0.341	C	S	.	.			trans	-120.7	163	167.8	70.9	0	0	0	0	112	F154 N182 D184	F154-T186 WeakPolarHBondContact O-CA 3.22Å; N182-T186 PolarHBondContact N-O 3.04Å; N182-T186 VanDerWaalsContact N-O 3.17Å; N182-T186 PolarHBondContact ND2-OG1 2.82Å; D184-T186 VanDerWaalsContact C-N 3.29Å; D184-T186 PolarHBondContact O-N 3.47Å; D184-T186 WeakPolarHBondContact OD1-CB 3.05Å; D184-T186 PolarHBondContact OD1-N 3.32Å; D184-T186 PolarHBondContact OD1-OG1 3.41Å
187	F	98.7	Very high	95.5	Very high	9 Å²	9	63 Å²	63	4%	0.039	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	160.2	175.2	-61.9	-86.1	0	0	0	110.6	D153 F154 Y155 A157 L179 I180 R181	D153-F187 PolarHBondContact N-O 3.06Å; D153-F187 VanDerWaalsContact N-O 3.08Å; F154-F187 VanDerWaalsContact CD1-O 3.25Å; F154-F187 WeakPolarHBondContact CD1-O 3.34Å; F154-F187 HydrophobicContact CD2-CB 4.16Å; F154-F187 HydrophobicContact CE1-CB 4.31Å; F154-F187 WeakPolarHBondContact CE1-O 3.15Å; F154-F187 HydrophobicContact CE2-CB 3.72Å; F154-F187 HydrophobicContact CZ-CB 3.8Å; F154-F187 PolarHBondContact N-O 3.03Å; F154-F187 PolarHBondContact O-N 3.34Å; Y155-F187 HydrophobicContact CD2-CD2 4.1Å; Y155-F187 AromaticContact CD2-CE2 3.64Å; Y155-F187 HydrophobicContact CD2-CE2 3.64Å; Y155-F187 AromaticContact CE2-CE2 3.89Å; Y155-F187 HydrophobicContact CE2-CE2 3.89Å; A157-F187 HydrophobicContact CB-CD1 4.43Å; A157-F187 HydrophobicContact CB-CD2 4.11Å; A157-F187 HydrophobicContact CB-CE1 4.09Å; A157-F187 HydrophobicContact CB-CE2 3.75Å; A157-F187 HydrophobicContact CB-CG 4.44Å; A157-F187 HydrophobicContact CB-CZ 3.74Å; L179-F187 HydrophobicContact CD1-CB 3.96Å; L179-F187 HydrophobicContact CD1-CD1 4.45Å; L179-F187 HydrophobicContact CD1-CG 4.46Å; L179-F187 HydrophobicContact CD2-CB 4.45Å; L179-F187 HydrophobicContact CD2-CD1 3.57Å; L179-F187 HydrophobicContact CD2-CE1 3.97Å; L179-F187 HydrophobicContact CD2-CG 4.07Å; L179-F187 HydrophobicContact CG-CB 4.23Å; L179-F187 HydrophobicContact CG-CD1 3.81Å; L179-F187 HydrophobicContact CG-CG 4.29Å; I180-F187 VanDerWaalsContact O-CA 3.25Å; I180-F187 WeakPolarHBondContact O-CA 3.49Å; R181-F187 HydrophobicContact CB-CD1 4.2Å; R181-F187 HydrophobicContact CB-CE1 4.05Å; R181-F187 HydrophobicContact CG-CE1 4.07Å
188	Q	98.5	Very high	94.8	Very high	57 Å²	57	67.8 Å²	67.8	27%	0.266	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	154.1	169.3	64.8	-178.9	-51.5	0	0	110.9	V151 T152 I180 N182	V151-Q188 CarbonylContact O-C 3.58Å; V151-Q188 VanDerWaalsContact O-CA 3.27Å; V151-Q188 WeakPolarHBondContact O-CA 3.3Å; T152-Q188 HydrophobicContact CG2-CB 4.16Å; I180-Q188 HydrophobicContact CB-CG 3.57Å; I180-Q188 HydrophobicContact CD1-CG 4.01Å; I180-Q188 HydrophobicContact CG1-CG 4.38Å; I180-Q188 HydrophobicContact CG2-CG 3.75Å; I180-Q188 PolarHBondContact N-O 3.41Å; I180-Q188 PolarHBondContact O-N 3.38Å; N182-Q188 PolarHBondContact OD1-NE2 2.81Å
189	I	98.7	Very high	94.1	Very high	22 Å²	22	70.9 Å²	70.9	11%	0.113	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	140	174.4	-170.8	170.3	0	0	0	109.6	V151 F154 I159 V161 L179 V191	V151-I189 HydrophobicContact CB-CG2 3.91Å; V151-I189 HydrophobicContact CG2-CG2 4.5Å; V151-I189 PolarHBondContact N-O 2.74Å; V151-I189 PolarHBondContact O-N 2.8Å; F154-I189 HydrophobicContact CE1-CG2 4.07Å; F154-I189 HydrophobicContact CZ-CG2 4.05Å; I159-I189 HydrophobicContact CG2-CG2 4.18Å; V161-I189 HydrophobicContact CG2-CG2 4.22Å; L179-I189 HydrophobicContact CD1-CB 4.37Å; I189-V191 HydrophobicContact CD1-CG2 4.41Å; I189-V191 HydrophobicContact CG1-CG2 4.25Å
190	L	98.2	Very high	93.5	Very high	50 Å²	50	69.9 Å²	69.9	26%	0.262	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.5	175.4	-64.3	156.4	0	0	0	108	V148 S150 S176 T177	V148-L190 HydrophobicContact CG1-CB 4.37Å; V148-L190 HydrophobicContact CG1-CD2 3.8Å; S150-L190 VanDerWaalsContact OG-CD2 3.27Å; S150-L190 WeakPolarHBondContact OG-CD2 3.36Å; S176-L190 WeakPolarHBondContact CA-O 3.43Å; T177-L190 HydrophobicContact CG2-CB 3.82Å; T177-L190 HydrophobicContact CG2-CD1 4.12Å; T177-L190 PolarHBondContact N-O 3.12Å; T177-L190 PolarHBondContact OG1-N 2.73Å; T177-L190 VanDerWaalsContact OG1-N 3.14Å
191	V	98.1	Very high	93.1	Very high	6 Å²	6	67.6 Å²	67.6	4%	0.036	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	111.6	176.8	-172.6	0	0	0	0	109.1	C149 V161 W163 V174 I189	C149-V191 PolarHBondContact N-O 3.38Å; C149-V191 PolarHBondContact O-N 2.75Å; V161-V191 HydrophobicContact CB-CG2 3.78Å; V161-V191 HydrophobicContact CG1-CB 3.87Å; V161-V191 HydrophobicContact CG1-CG1 4.29Å; V161-V191 HydrophobicContact CG1-CG2 3.61Å; V161-V191 HydrophobicContact CG2-CG2 4.29Å; W163-V191 PolarHBondContact NE1-O 2.91Å; V174-V191 HydrophobicContact CG1-CG1 3.7Å; I189-V191 HydrophobicContact CD1-CG2 4.41Å; I189-V191 HydrophobicContact CG1-CG2 4.25Å
192	M	96.3	Very high	92.9	Very high	47 Å²	47	60 Å²	60	23%	0.232	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	142.1	-172.3	-58.4	166	-76.8	0	0	109.8	L146 L147 V148 V174 V175 T177	L146-M192 HydrophobicContact CD1-CB 4.03Å; L146-M192 HydrophobicContact CD2-CB 4.49Å; L146-M192 HydrophobicContact CD2-SD 4.44Å; L146-M192 HydrophobicContact CG-CB 4.37Å; L147-M192 CarbonylContact O-C 3.57Å; L147-M192 VanDerWaalsContact O-CA 3.23Å; L147-M192 WeakPolarHBondContact O-CA 3.38Å; V148-M192 HydrophobicContact CB-CG 4.5Å; V148-M192 HydrophobicContact CG1-CG 4.09Å; V148-M192 HydrophobicContact CG2-CG 4.09Å; V174-M192 CarbonylContact C-O 3.57Å; V174-M192 VanDerWaalsContact CA-O 3.27Å; V174-M192 WeakPolarHBondContact CA-O 3.34Å; V175-M192 HydrophobicContact CB-CE 4.23Å; V175-M192 HydrophobicContact CG1-CE 4.01Å; V175-M192 PolarHBondContact N-O 3.18Å; V175-M192 PolarHBondContact O-N 2.92Å; T177-M192 HydrophobicContact CG2-CE 4.4Å
193	L	95.3	Very high	92.7	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.016	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	117.1	175.4	171.9	67.4	0	0	0	109.1	L146 L147 W163 E170 V174 M195 Y203	L146-L193 WeakPolarHBondContact CA-O 3Å; L147-L193 PolarHBondContact N-O 3.04Å; L147-L193 PolarHBondContact O-N 2.89Å; W163-L193 HydrophobicContact CB-CD2 4.19Å; W163-L193 HydrophobicContact CD2-CB 3.97Å; W163-L193 HydrophobicContact CD2-CD2 3.98Å; W163-L193 HydrophobicContact CE3-CD2 4.04Å; W163-L193 HydrophobicContact CG-CB 3.96Å; W163-L193 HydrophobicContact CG-CD2 4.08Å; W163-L193 HydrophobicContact CG-CG 4.49Å; W163-L193 HydrophobicContact CZ2-CB 4.38Å; E170-L193 HydrophobicContact CB-CD1 4.3Å; V174-L193 HydrophobicContact CG2-CD1 3.64Å; L193-M195 HydrophobicContact CG-CB 4.45Å; L193-Y203 HydrophobicContact CD2-CD1 3.64Å; L193-Y203 HydrophobicContact CD2-CE1 3.99Å
194	E	92.4	Very high	92.8	Very high	127 Å²	127	54.8 Å²	54.8	59%	0.593	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	128.1	167	-172.6	172.6	-168.3	0	0	109.5	N145 L146 G173	N145-E194 CarbonylContact O-C 3.56Å; N145-E194 WeakPolarHBondContact O-CA 3.43Å; L146-E194 HydrophobicContact CD1-CB 4.48Å; G173-E194 PolarHBondContact O-N 2.82Å
195	M	87.2	Confident	92.8	Very high	10 Å²	10	50.6 Å²	50.6	5%	0.049	26%	0.261	C	S	.	.			trans	-145.2	156.4	-172.8	64.2	83.3	163.5	0	0	112.6	H144 N145 L147 L193 P197 Y203 W220	H144-M195 WeakPolarHBondContact O-CE 3.33Å; N145-M195 CarbonylContact C-O 3.56Å; N145-M195 VanDerWaalsContact CA-O 3.27Å; N145-M195 WeakPolarHBondContact CA-O 3.31Å; N145-M195 WeakPolarHBondContact CB-O 3.36Å; N145-M195 PolarHBondContact O-N 2.89Å; L147-M195 HydrophobicContact CD1-CE 4.1Å; L147-M195 HydrophobicContact CD1-CG 4.21Å; L147-M195 HydrophobicContact CD2-CE 3.88Å; L147-M195 HydrophobicContact CG-CE 3.67Å; L147-M195 HydrophobicContact CG-CG 4.04Å; L193-M195 HydrophobicContact CG-CB 4.45Å; M195-P197 HydrophobicContact CE-CB 4Å; M195-P197 HydrophobicContact CE-CG 3.96Å; M195-P197 HydrophobicContact SD-CB 3.58Å; M195-P197 VanDerWaalsContact SD-CB 3.58Å; M195-P197 WeakPolarHBondContact SD-CD 3.04Å; M195-P197 HydrophobicContact SD-CG 3.57Å; M195-P197 VanDerWaalsContact SD-CG 3.57Å; M195-Y203 HydrophobicContact CB-CE1 3.86Å; M195-Y203 HydrophobicContact CG-CE1 4.41Å; M195-W220 HydrophobicContact CE-CH2 3.61Å; M195-W220 HydrophobicContact CE-CZ2 4.45Å; M195-W220 HydrophobicContact CE-CZ3 3.73Å
196	T	85.6	Confident	92.9	Very high	99 Å²	99	44.8 Å²	44.8	61%	0.607	24%	0.24	S	C	*	.			trans	-122.1	94.4	171.5	53.2	0	0	0	0	107.5	Q198	T196-Q198 PolarHBondContact O-N 2.8Å
197	P	81.5	Confident	92.9	Very high	57 Å²	57	44.2 Å²	44.2	37%	0.37	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-72.2	125.6	-163.8	25.9	-26.1	0	0	0	110.3	M195 A222	M195-P197 HydrophobicContact CE-CB 4Å; M195-P197 HydrophobicContact CE-CG 3.96Å; M195-P197 HydrophobicContact SD-CB 3.58Å; M195-P197 VanDerWaalsContact SD-CB 3.58Å; M195-P197 WeakPolarHBondContact SD-CD 3.04Å; M195-P197 HydrophobicContact SD-CG 3.57Å; M195-P197 VanDerWaalsContact SD-CG 3.57Å; P197-A222 HydrophobicContact CB-CB 3.83Å
198	Q	82.6	Confident	92.9	Very high	135 Å²	135	46.7 Å²	46.7	63%	0.631	25%	0.249	S	C	*	.	P	Polyproline II helix	trans	-100.2	154	168.9	-60	-159.5	6.4	0	0	111.2	T196 G200 D201 A222	T196-Q198 PolarHBondContact O-N 2.8Å; Q198-G200 PolarHBondContact O-N 2.85Å; Q198-D201 WeakPolarHBondContact CB-OD2 3.35Å; Q198-D201 PolarHBondContact N-OD2 2.88Å; Q198-D201 WeakPolarHBondContact O-CB 3.45Å; Q198-D201 PolarHBondContact O-N 2.58Å; Q198-A222 WeakPolarHBondContact O-CB 3.47Å
199	H	82.4	Confident	92.9	Very high	175 Å²	175	44.6 Å²	44.6	81%	0.81	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	122.2	178.5	177.6	-80.8	0	0	0	110.5
200	G	84.6	Confident	92.9	Very high	50 Å²	50	46.5 Å²	46.5	52%	0.515	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	96	-7.6	-178.8	0	0	0	0	0	114.3	Q198 V202	Q198-G200 PolarHBondContact O-N 2.85Å; G200-V202 PolarHBondContact O-N 3.3Å
201	D	90.2	Very high	92.9	Very high	15 Å²	15	45 Å²	45	8%	0.08	25%	0.246	C	C	.	.			trans	-61.8	136.4	172.5	-79.1	-22.1	0	0	0	111.2	N166 Q198 Y203 A222	N166-D201 PolarHBondContact ND2-OD1 2.03Å; N166-D201 VanDerWaalsContact ND2-OD1 3.1Å; Q198-D201 WeakPolarHBondContact CB-OD2 3.35Å; Q198-D201 PolarHBondContact N-OD2 2.88Å; Q198-D201 WeakPolarHBondContact O-CB 3.45Å; Q198-D201 PolarHBondContact O-N 2.58Å; D201-Y203 HydrophobicContact CB-CD2 4.21Å; D201-Y203 HydrophobicContact CB-CE2 3.5Å; D201-Y203 PolarHBondContact OD2-OH 2.96Å; D201-A222 HydrophobicContact CB-CB 4.48Å; D201-A222 PolarHBondContact O-N 3.48Å
202	V	93.7	Very high	92.9	Very high	23 Å²	23	46.1 Å²	46.1	14%	0.139	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	119.4	172.4	-171.3	0	0	0	0	108.2	R165 N166 G200 E219 R221	R165-V202 WeakPolarHBondContact CA-O 3.31Å; N166-V202 PolarHBondContact N-O 2.89Å; N166-V202 PolarHBondContact OD1-N 3.14Å; G200-V202 PolarHBondContact O-N 3.3Å; V202-E219 HydrophobicContact CG1-CB 4.44Å; V202-E219 HydrophobicContact CG1-CG 4.41Å; V202-R221 HydrophobicContact CG1-CG 4.31Å; V202-R221 HydrophobicContact CG2-CG 4.28Å
203	Y	94.9	Very high	92.9	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.016	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	136.1	175.1	-64.5	-94.2	0	0	0	109	L147 F164 R165 L193 M195 D201 E219 W220	L147-Y203 HydrophobicContact CD1-CD1 3.91Å; L147-Y203 HydrophobicContact CD1-CD2 3.95Å; L147-Y203 HydrophobicContact CD1-CG 3.53Å; F164-Y203 CarbonylContact O-C 3.59Å; F164-Y203 WeakPolarHBondContact O-CA 3.16Å; R165-Y203 HydrophobicContact CB-CD1 4.2Å; R165-Y203 HydrophobicContact CB-CE1 4.17Å; R165-Y203 HydrophobicContact CG-CD1 4.28Å; R165-Y203 HydrophobicContact CG-CE1 3.92Å; L193-Y203 HydrophobicContact CD2-CD1 3.64Å; L193-Y203 HydrophobicContact CD2-CE1 3.99Å; M195-Y203 HydrophobicContact CB-CE1 3.86Å; M195-Y203 HydrophobicContact CG-CE1 4.41Å; D201-Y203 HydrophobicContact CB-CD2 4.21Å; D201-Y203 HydrophobicContact CB-CE2 3.5Å; D201-Y203 PolarHBondContact OD2-OH 2.96Å; Y203-E219 CarbonylContact O-C 3.56Å; Y203-E219 WeakPolarHBondContact O-CA 3.4Å; Y203-W220 AromaticContact CD2-CE3 3.7Å; Y203-W220 HydrophobicContact CD2-CE3 3.7Å; Y203-W220 AromaticContact CD2-CZ3 3.83Å; Y203-W220 HydrophobicContact CD2-CZ3 3.83Å; Y203-W220 HydrophobicContact CE2-CE3 4.46Å; Y203-W220 HydrophobicContact CE2-CZ3 4.14Å; Y203-W220 HydrophobicContact CG-CE3 4.37Å; Y203-W220 PolarHBondContact N-O 3.05Å; Y203-W220 PolarHBondContact O-N 3.35Å
204	T	97.4	Very high	93	Very high	10 Å²	10	58.7 Å²	58.7	6%	0.061	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	129.2	-178.1	28.9	0	0	0	0	111.1	W163 F164 I217 V218 E219	W163-T204 CarbonylContact C-O 3.6Å; W163-T204 WeakPolarHBondContact CA-O 3.07Å; W163-T204 VanDerWaalsContact CE3-O 3.27Å; F164-T204 WeakPolarHBondContact CB-OG1 3.33Å; F164-T204 PolarHBondContact N-O 3.23Å; F164-T204 PolarHBondContact O-N 3.38Å; F164-T204 PolarHBondContact O-OG1 3.25Å; T204-I217 HydrophobicContact CG2-CG2 3.88Å; T204-V218 VanDerWaalsContact CA-O 3.31Å; T204-V218 WeakPolarHBondContact CA-O 3.36Å; T204-E219 HydrophobicContact CG2-CB 4.25Å; T204-E219 HydrophobicContact CG2-CG 3.56Å
205	C	98.1	Very high	93.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	119.6	167.5	-175.4	0	0	0	0	108.9	I133 C149 W163 I217 V218	I133-C205 HydrophobicContact CD1-CB 3.71Å; I133-C205 HydrophobicContact CG1-CB 3.99Å; C149-C205 HydrophobicContact CB-CB 3.67Å; C149-C205 WeakPolarHBondContact CB-SG 3.38Å; C149-C205 WeakPolarHBondContact SG-CB 3.37Å; C149-C205 CovalentContact SG-SG 2.03Å; C149-C205 PolarHBondContact SG-SG 2.94Å; W163-C205 HydrophobicContact CE3-CB 4.34Å; W163-C205 HydrophobicContact CH2-CB 4.19Å; W163-C205 HydrophobicContact CZ2-CB 4.5Å; W163-C205 HydrophobicContact CZ3-CB 4.1Å; C205-I217 WeakPolarHBondContact O-CA 3.46Å; C205-V218 PolarHBondContact N-O 2.94Å; C205-V218 PolarHBondContact O-N 3.3Å
206	H	98.4	Very high	93.8	Very high	30 Å²	30	57 Å²	57	14%	0.139	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	117.1	-177.2	-174.1	171.5	0	0	0	109.1	V161 R162 F164 P215 I216	V161-H206 CarbonylContact C-O 3.57Å; V161-H206 WeakPolarHBondContact CA-O 3.47Å; R162-H206 HydrophobicContact CB-CB 4.43Å; R162-H206 PolarHBondContact N-O 2.87Å; R162-H206 PolarHBondContact NH2-CE1 3.01Å; R162-H206 PolarHBondContact O-N 3.26Å; F164-H206 HydrophobicContact CD2-CB 3.94Å; F164-H206 HydrophobicContact CE2-CB 3.8Å; F164-H206 AromaticContact CE2-ND1 3.57Å; H206-P215 WeakPolarHBondContact CD2-CB 3.23Å; H206-P215 WeakPolarHBondContact NE2-CB 3.46Å; H206-P215 VanDerWaalsContact NE2-CG 3.3Å; H206-P215 WeakPolarHBondContact NE2-CG 3.24Å; H206-I216 WeakPolarHBondContact CA-O 3.27Å
207	V	98.7	Very high	94.4	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	119.4	-176.7	-177.7	0	0	0	0	110.8	P129 V131 V151 I159 V161 P215 I216	P129-V207 HydrophobicContact CG-CG1 3.99Å; V131-V207 HydrophobicContact CG1-CG2 3.97Å; V131-V207 HydrophobicContact CG2-CB 4.13Å; V131-V207 HydrophobicContact CG2-CG1 4.39Å; V131-V207 HydrophobicContact CG2-CG2 3.73Å; V151-V207 HydrophobicContact CG1-CG1 4.02Å; V151-V207 HydrophobicContact CG1-CG2 4.46Å; V151-V207 HydrophobicContact CG2-CG2 3.82Å; I159-V207 HydrophobicContact CD1-CG1 3.9Å; I159-V207 HydrophobicContact CG1-CG1 4.15Å; V161-V207 HydrophobicContact CG1-CG2 4.23Å; V161-V207 HydrophobicContact CG2-CG1 4.43Å; V161-V207 HydrophobicContact CG2-CG2 4.27Å; V207-P215 WeakPolarHBondContact O-CA 3.28Å; V207-P215 WeakPolarHBondContact O-CB 3.44Å; V207-I216 HydrophobicContact CB-CB 4.42Å; V207-I216 PolarHBondContact N-O 2.97Å; V207-I216 PolarHBondContact O-N 3.48Å
208	E	98.7	Very high	95.1	Very high	61 Å²	61	56.3 Å²	56.3	29%	0.285	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	131	170.1	-66.7	167.7	-140.2	0	0	109.3	K160 R162 P215	K160-E208 HydrophobicContact CB-CB 4.23Å; K160-E208 WeakPolarHBondContact CD-OE2 3.15Å; K160-E208 PolarHBondContact N-O 2.86Å; K160-E208 IonicContact NZ-OE1 2.91Å; K160-E208 PolarHBondContact NZ-OE1 3.24Å; K160-E208 VanDerWaalsContact NZ-OE1 3.12Å; K160-E208 IonicContact NZ-OE2 2.76Å; K160-E208 PolarHBondContact NZ-OE2 3.39Å; K160-E208 PolarHBondContact O-N 2.89Å; R162-E208 IonicContact CZ-OE1 3.5Å; R162-E208 IonicContact NE-OE1 3.2Å; R162-E208 IonicContact NH2-OE1 2.75Å; R162-E208 PolarHBondContact NH2-OE1 2.72Å; E208-P215 HydrophobicContact CG-CB 4.2Å; E208-P215 HydrophobicContact CG-CG 4.16Å
209	H	98.7	Very high	95.8	Very high	12 Å²	12	55.1 Å²	55.1	6%	0.056	30%	0.296	C	S	.	.			trans	-151.5	143.1	-179.7	180	-104.8	0	0	0	110.4	V127 P129 F154 Y155 P156 Q158 I159 S211 L212	V127-H209 PolarHBondContact O-CE1 3.41Å; V127-H209 VanDerWaalsContact O-CE1 3.24Å; P129-H209 HydrophobicContact CG-CB 4.31Å; F154-H209 AromaticContact CD2-CD2 3.89Å; F154-H209 AromaticContact CD2-NE2 3.71Å; Y155-H209 VanDerWaalsContact C-CE1 3.41Å; Y155-H209 PolarHBondContact O-CE1 3.05Å; P156-H209 PolarHBondContact O-NE2 2.93Å; Q158-H209 PolarHBondContact O-CD2 3.07Å; I159-H209 HydrophobicContact CD1-CB 4.49Å; I159-H209 HydrophobicContact CG1-CB 4.32Å; H209-S211 PolarHBondContact CE1-OG 3.21Å; H209-S211 VanDerWaalsContact ND1-CB 3.32Å; H209-S211 WeakPolarHBondContact ND1-CB 3.35Å; H209-S211 PolarHBondContact ND1-N 3.31Å; H209-S211 PolarHBondContact ND1-OG 3.32Å; H209-S211 PolarHBondContact O-N 3.32Å; H209-L212 HydrophobicContact CB-CD1 3.97Å; H209-L212 HydrophobicContact CB-CG 4.27Å; H209-L212 WeakPolarHBondContact O-CB 3.41Å; H209-L212 PolarHBondContact O-N 3.3Å
210	P	98	Very high	96.3	Very high	62 Å²	62	49.3 Å²	49.3	40%	0.403	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-10.4	-176.5	-26.3	36.1	0	0	0	116.5	P156 Q158 L212	P156-P210 HydrophobicContact CG-CG 4.4Å; Q158-P210 WeakPolarHBondContact O-CD 3.46Å; P210-L212 VanDerWaalsContact C-N 3.34Å
211	S	98	Very high	96.5	Very high	19 Å²	19	53.4 Å²	53.4	13%	0.133	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-16.5	171.7	72.3	0	0	0	0	113.1	V127 E128 H209	V127-S211 PolarHBondContact O-OG 3.25Å; E128-S211 VanDerWaalsContact CA-OG 3.26Å; E128-S211 WeakPolarHBondContact CA-OG 3.49Å; E128-S211 WeakPolarHBondContact CG-OG 3.35Å; H209-S211 PolarHBondContact CE1-OG 3.21Å; H209-S211 VanDerWaalsContact ND1-CB 3.32Å; H209-S211 WeakPolarHBondContact ND1-CB 3.35Å; H209-S211 PolarHBondContact ND1-N 3.31Å; H209-S211 PolarHBondContact ND1-OG 3.32Å; H209-S211 PolarHBondContact O-N 3.32Å
212	L	98.1	Very high	96.1	Very high	29 Å²	29	53.4 Å²	53.4	15%	0.152	27%	0.269	C	S	.	.			trans	-98.9	138	-171.5	-61.1	172	0	0	0	110.4	E128 P129 H209 P210 N214 I216	E128-L212 HydrophobicContact CB-CD2 3.98Å; E128-L212 HydrophobicContact CG-CD2 3.71Å; P129-L212 HydrophobicContact CG-CD1 4.11Å; H209-L212 HydrophobicContact CB-CD1 3.97Å; H209-L212 HydrophobicContact CB-CG 4.27Å; H209-L212 WeakPolarHBondContact O-CB 3.41Å; H209-L212 PolarHBondContact O-N 3.3Å; P210-L212 VanDerWaalsContact C-N 3.34Å; L212-N214 WeakPolarHBondContact CB-O 3.45Å; L212-I216 HydrophobicContact CD1-CB 4.5Å; L212-I216 HydrophobicContact CD1-CD1 3.83Å; L212-I216 HydrophobicContact CD1-CG1 3.84Å; L212-I216 HydrophobicContact CD2-CD1 3.8Å; L212-I216 HydrophobicContact CD2-CG1 4.11Å; L212-I216 HydrophobicContact CG-CD1 4.49Å
213	Q	96.9	Very high	94.9	Very high	190 Å²	190	59.7 Å²	59.7	89%	0.888	30%	0.297	S	S	*	.	S	Bend	trans	-76.6	-39.3	170.5	-64.7	179.9	25	0	0	111.6
214	N	97.5	Very high	92.7	Very high	124 Å²	124	62.5 Å²	62.5	66%	0.663	32%	0.317	S	S	*	.	S	Bend	trans	-126.8	150.3	176.9	-62.6	-64.2	0	0	0	109.1	L212	L212-N214 WeakPolarHBondContact CB-O 3.45Å
215	P	97.6	Very high	90.6	Very high	57 Å²	57	68.9 Å²	68.9	37%	0.37	35%	0.346	S	S	.	.			trans	-63.2	147.2	178.8	-17.2	29.9	0	0	0	112.4	H206 V207 E208	H206-P215 WeakPolarHBondContact CD2-CB 3.23Å; H206-P215 WeakPolarHBondContact NE2-CB 3.46Å; H206-P215 VanDerWaalsContact NE2-CG 3.3Å; H206-P215 WeakPolarHBondContact NE2-CG 3.24Å; V207-P215 WeakPolarHBondContact O-CA 3.28Å; V207-P215 WeakPolarHBondContact O-CB 3.44Å; E208-P215 HydrophobicContact CG-CB 4.2Å; E208-P215 HydrophobicContact CG-CG 4.16Å
216	I	98.2	Very high	88.4	Confident	46 Å²	46	70.8 Å²	70.8	24%	0.236	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	129.7	170	-68.6	170	0	0	0	108.1	P129 V131 H206 V207 L212 V218	P129-I216 HydrophobicContact CG-CD1 4.2Å; V131-I216 HydrophobicContact CB-CG2 3.96Å; V131-I216 HydrophobicContact CG2-CB 4.26Å; V131-I216 HydrophobicContact CG2-CD1 4.21Å; V131-I216 HydrophobicContact CG2-CG2 3.74Å; H206-I216 WeakPolarHBondContact CA-O 3.27Å; V207-I216 HydrophobicContact CB-CB 4.42Å; V207-I216 PolarHBondContact N-O 2.97Å; V207-I216 PolarHBondContact O-N 3.48Å; L212-I216 HydrophobicContact CD1-CB 4.5Å; L212-I216 HydrophobicContact CD1-CD1 3.83Å; L212-I216 HydrophobicContact CD1-CG1 3.84Å; L212-I216 HydrophobicContact CD2-CD1 3.8Å; L212-I216 HydrophobicContact CD2-CG1 4.11Å; L212-I216 HydrophobicContact CG-CD1 4.49Å; I216-V218 HydrophobicContact CG2-CG2 3.91Å
217	I	97.7	Very high	86.2	Confident	105 Å²	105	72.4 Å²	72.4	54%	0.538	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	116.6	176.5	-57.1	171.6	0	0	0	107.4	T204 C205	T204-I217 HydrophobicContact CG2-CG2 3.88Å; C205-I217 WeakPolarHBondContact O-CA 3.46Å
218	V	97.5	Very high	84	Confident	36 Å²	36	78.8 Å²	78.8	22%	0.218	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	128.2	175	-177.3	0	0	0	0	108.4	V131 I133 T204 C205 I216	V131-V218 HydrophobicContact CB-CG2 3.8Å; V131-V218 HydrophobicContact CG1-CB 4.24Å; V131-V218 HydrophobicContact CG1-CG2 3.59Å; I133-V218 HydrophobicContact CB-CG1 4.5Å; I133-V218 HydrophobicContact CD1-CB 3.98Å; I133-V218 HydrophobicContact CD1-CG1 3.83Å; I133-V218 WeakPolarHBondContact CD1-O 3.3Å; I133-V218 HydrophobicContact CG1-CB 4.25Å; I133-V218 HydrophobicContact CG1-CG1 3.91Å; T204-V218 VanDerWaalsContact CA-O 3.31Å; T204-V218 WeakPolarHBondContact CA-O 3.36Å; C205-V218 PolarHBondContact N-O 2.94Å; C205-V218 PolarHBondContact O-N 3.3Å; I216-V218 HydrophobicContact CG2-CG2 3.91Å
219	E	95.9	Very high	82	Confident	110 Å²	110	79.4 Å²	79.4	51%	0.514	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	143.1	177.8	-63	-171.8	176.4	0	0	111.4	V202 Y203 T204 R221	V202-E219 HydrophobicContact CG1-CB 4.44Å; V202-E219 HydrophobicContact CG1-CG 4.41Å; Y203-E219 CarbonylContact O-C 3.56Å; Y203-E219 WeakPolarHBondContact O-CA 3.4Å; T204-E219 HydrophobicContact CG2-CB 4.25Å; T204-E219 HydrophobicContact CG2-CG 3.56Å; E219-R221 IonicContact OE2-CZ 2.74Å; E219-R221 IonicContact OE2-NE 3.48Å; E219-R221 PolarHBondContact OE2-NE 3.35Å; E219-R221 IonicContact OE2-NH2 2.73Å; E219-R221 PolarHBondContact OE2-NH2 2.93Å
220	W	93.3	Very high	80.1	Confident	52 Å²	52	85.7 Å²	85.7	20%	0.197	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	132.1	164.2	-176.7	93	0	0	0	109.1	I133 P135 L147 M195 Y203 A222	I133-W220 HydrophobicContact CB-CB 4.22Å; I133-W220 HydrophobicContact CD1-CB 4.11Å; I133-W220 HydrophobicContact CG2-CB 3.65Å; I133-W220 HydrophobicContact CG2-CG 3.93Å; P135-W220 HydrophobicContact CB-CZ2 4.49Å; L147-W220 HydrophobicContact CD1-CD2 4.12Å; L147-W220 HydrophobicContact CD1-CE3 3.63Å; L147-W220 HydrophobicContact CD1-CZ3 4.07Å; L147-W220 HydrophobicContact CD2-CD2 3.58Å; L147-W220 HydrophobicContact CD2-CE3 3.81Å; L147-W220 HydrophobicContact CD2-CG 4.02Å; L147-W220 HydrophobicContact CD2-CH2 4.24Å; L147-W220 HydrophobicContact CD2-CZ2 4.05Å; L147-W220 HydrophobicContact CD2-CZ3 4.12Å; L147-W220 HydrophobicContact CG-CE3 4.32Å; M195-W220 HydrophobicContact CE-CH2 3.61Å; M195-W220 HydrophobicContact CE-CZ2 4.45Å; M195-W220 HydrophobicContact CE-CZ3 3.73Å; Y203-W220 AromaticContact CD2-CE3 3.7Å; Y203-W220 HydrophobicContact CD2-CE3 3.7Å; Y203-W220 AromaticContact CD2-CZ3 3.83Å; Y203-W220 HydrophobicContact CD2-CZ3 3.83Å; Y203-W220 HydrophobicContact CE2-CE3 4.46Å; Y203-W220 HydrophobicContact CE2-CZ3 4.14Å; Y203-W220 HydrophobicContact CG-CE3 4.37Å; Y203-W220 PolarHBondContact N-O 3.05Å; Y203-W220 PolarHBondContact O-N 3.35Å; W220-A222 HydrophobicContact CH2-CB 4.2Å; W220-A222 HydrophobicContact CZ3-CB 3.95Å
221	R	89.9	Confident	78.3	Confident	136 Å²	136	89.1 Å²	89.1	51%	0.513	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	136.4	-178.8	-64.7	-180	-178.3	-96.3	-6.9	109.2	V202 E219 Q223	V202-R221 HydrophobicContact CG1-CG 4.31Å; V202-R221 HydrophobicContact CG2-CG 4.28Å; E219-R221 IonicContact OE2-CZ 2.74Å; E219-R221 IonicContact OE2-NE 3.48Å; E219-R221 PolarHBondContact OE2-NE 3.35Å; E219-R221 IonicContact OE2-NH2 2.73Å; E219-R221 PolarHBondContact OE2-NH2 2.93Å; R221-Q223 VanDerWaalsContact C-N 3.32Å; R221-Q223 PolarHBondContact O-N 2.87Å
222	A	80.4	Confident	76.7	Confident	15 Å²	15	94.3 Å²	94.3	12%	0.124	48%	0.484	C	S	.	.			trans	-65.1	92.9	171.7	0	0	0	0	0	109.5	P197 Q198 D201 W220	P197-A222 HydrophobicContact CB-CB 3.83Å; Q198-A222 WeakPolarHBondContact O-CB 3.47Å; D201-A222 HydrophobicContact CB-CB 4.48Å; D201-A222 PolarHBondContact O-N 3.48Å; W220-A222 HydrophobicContact CH2-CB 4.2Å; W220-A222 HydrophobicContact CZ3-CB 3.95Å
223	Q	68.6	Low	75.5	Confident	155 Å²	155	97.1 Å²	97.1	72%	0.724	51%	0.506	S	S	*	.			trans	-78	135.7	172.4	-68.7	-171.6	-5.2	0	0	109.3	R221 E225	R221-Q223 VanDerWaalsContact C-N 3.32Å; R221-Q223 PolarHBondContact O-N 2.87Å; Q223-E225 PolarHBondContact O-N 2.96Å
224	S	49.8	Very low	74.4	Confident	63 Å²	63	90.2 Å²	90.2	44%	0.441	49%	0.486	S	S	.	.			trans	-70.2	120.7	166.5	-174.2	0	0	0	0	108.3	S226 A227	S224-S226 PolarHBondContact O-N 2.65Å; S224-S226 WeakPolarHBondContact OG-CB 3.5Å; S224-S226 PolarHBondContact OG-N 2.78Å; S224-A227 WeakPolarHBondContact O-CB 3.23Å; S224-A227 PolarHBondContact O-N 3.48Å
225	E	53.7	Low	73.5	Confident	145 Å²	145	88.9 Å²	88.9	68%	0.678	48%	0.478	S	S	*	.	H	α-helix	trans	-51.7	-22.7	168.4	-73.4	-168	156.3	0	0	112	Q223 A227 Q228 S229	Q223-E225 PolarHBondContact O-N 2.96Å; E225-A227 VanDerWaalsContact C-N 3.25Å; E225-A227 PolarHBondContact O-N 2.93Å; E225-Q228 PolarHBondContact O-N 3.28Å; E225-S229 PolarHBondContact O-N 3.45Å; E225-S229 VanDerWaalsContact O-N 3.15Å
226	S	51.7	Low	72.7	Confident	39 Å²	39	87.9 Å²	87.9	27%	0.273	48%	0.478	S	S	.	.	H	α-helix	trans	-59.9	-30.8	172.4	-176.4	0	0	0	0	113.4	S224 K230	S224-S226 PolarHBondContact O-N 2.65Å; S224-S226 WeakPolarHBondContact OG-CB 3.5Å; S224-S226 PolarHBondContact OG-N 2.78Å; S226-K230 WeakPolarHBondContact O-CB 3.23Å; S226-K230 WeakPolarHBondContact O-CD 3.48Å; S226-K230 WeakPolarHBondContact O-CG 3.38Å; S226-K230 PolarHBondContact O-N 2.95Å; S226-K230 VanDerWaalsContact OG-CD 3.29Å; S226-K230 WeakPolarHBondContact OG-CD 3.42Å; S226-K230 WeakPolarHBondContact OG-CE 3.36Å; S226-K230 PolarHBondContact OG-NZ 2.92Å
227	A	51.4	Low	72	Confident	65 Å²	65	87.7 Å²	87.7	54%	0.537	49%	0.487	S	S	.	.	H	α-helix	trans	-72.5	-41.9	-178	0	0	0	0	0	111.1	S224 E225 M231	S224-A227 WeakPolarHBondContact O-CB 3.23Å; S224-A227 PolarHBondContact O-N 3.48Å; E225-A227 VanDerWaalsContact C-N 3.25Å; E225-A227 PolarHBondContact O-N 2.93Å; A227-M231 WeakPolarHBondContact O-CB 3.4Å; A227-M231 PolarHBondContact O-N 3.23Å
228	Q	53	Low	71.5	Confident	133 Å²	133	89.5 Å²	89.5	62%	0.621	49%	0.492	S	S	*	.	H	α-helix	trans	-71.6	-39.1	179.5	-136.4	174.5	3.6	0	0	111.6	E225 M231 L232	E225-Q228 PolarHBondContact O-N 3.28Å; Q228-M231 PolarHBondContact O-N 2.79Å; Q228-L232 WeakPolarHBondContact O-CD1 3.23Å; Q228-L232 PolarHBondContact O-N 3.49Å; Q228-L232 VanDerWaalsContact O-N 3.13Å
229	S	56.8	Low	71.2	Confident	74 Å²	74	91.3 Å²	91.3	52%	0.517	50%	0.503	S	S	.	.	H	α-helix	trans	-71.8	-37.2	176.5	84	0	0	0	0	113	E225 L232 S233	E225-S229 PolarHBondContact O-N 3.45Å; E225-S229 VanDerWaalsContact O-N 3.15Å; S229-L232 PolarHBondContact O-N 2.82Å; S229-S233 WeakPolarHBondContact O-CB 3.45Å; S229-S233 PolarHBondContact O-N 2.91Å
230	K	59	Low	70.9	Confident	144 Å²	144	91 Å²	91	63%	0.626	50%	0.504	S	S	*	.	H	α-helix	trans	-67.3	-35.9	174.1	-75.6	172.5	177.1	160	0	112	S226 G234	S226-K230 WeakPolarHBondContact O-CB 3.23Å; S226-K230 WeakPolarHBondContact O-CD 3.48Å; S226-K230 WeakPolarHBondContact O-CG 3.38Å; S226-K230 PolarHBondContact O-N 2.95Å; S226-K230 VanDerWaalsContact OG-CD 3.29Å; S226-K230 WeakPolarHBondContact OG-CD 3.42Å; S226-K230 WeakPolarHBondContact OG-CE 3.36Å; S226-K230 PolarHBondContact OG-NZ 2.92Å; K230-G234 PolarHBondContact O-N 3.16Å
231	M	59.5	Low	70.7	Confident	134 Å²	134	90.3 Å²	90.3	66%	0.66	51%	0.513	S	S	*	.	H	α-helix	trans	-66.3	-43.2	175.2	-140	-178.8	97.7	0	0	111.4	A227 Q228 G234 I235	A227-M231 WeakPolarHBondContact O-CB 3.4Å; A227-M231 PolarHBondContact O-N 3.23Å; Q228-M231 PolarHBondContact O-N 2.79Å; M231-G234 PolarHBondContact O-N 3.37Å; M231-I235 HydrophobicContact CE-CD1 4.35Å; M231-I235 VanDerWaalsContact O-CG1 3.31Å; M231-I235 WeakPolarHBondContact O-CG1 3.41Å; M231-I235 PolarHBondContact O-N 2.76Å
232	L	63.5	Low	70.9	Confident	128 Å²	128	88.5 Å²	88.5	67%	0.67	51%	0.513	S	S	*	.	H	α-helix	trans	-64.8	-41.2	175.2	-102.2	105.3	0	0	0	112.8	Q228 S229 G234 I235 G236	Q228-L232 WeakPolarHBondContact O-CD1 3.23Å; Q228-L232 PolarHBondContact O-N 3.49Å; Q228-L232 VanDerWaalsContact O-N 3.13Å; S229-L232 PolarHBondContact O-N 2.82Å; L232-G234 VanDerWaalsContact C-N 3.33Å; L232-I235 PolarHBondContact O-N 3.13Å; L232-G236 PolarHBondContact O-N 3.26Å
233	S	72.7	Confident	71.4	Confident	89 Å²	89	92 Å²	92	62%	0.622	53%	0.528	S	S	*	.	H	α-helix	trans	-66.3	-36.2	175.8	-171.8	0	0	0	0	112.1	S229 G236 G237	S229-S233 WeakPolarHBondContact O-CB 3.45Å; S229-S233 PolarHBondContact O-N 2.91Å; S233-G236 PolarHBondContact O-N 3.07Å; S233-G237 PolarHBondContact O-N 2.95Å
234	G	74.4	Confident	72.5	Confident	45 Å²	45	91.6 Å²	91.6	46%	0.464	53%	0.525	S	S	.	.	H	α-helix	trans	-65.6	-42.8	175.7	0	0	0	0	0	112.6	K230 M231 L232 G237 F238	K230-G234 PolarHBondContact O-N 3.16Å; M231-G234 PolarHBondContact O-N 3.37Å; L232-G234 VanDerWaalsContact C-N 3.33Å; G234-G237 PolarHBondContact O-N 3.39Å; G234-F238 WeakPolarHBondContact O-CB 3.38Å; G234-F238 PolarHBondContact O-N 3.37Å
235	I	79.9	Confident	74.4	Confident	96 Å²	96	93.9 Å²	93.9	49%	0.492	53%	0.531	S	S	.	.	H	α-helix	trans	-63.9	-44.5	175	-67	165.2	0	0	0	110.4	M231 L232 G237 F238 V239	M231-I235 HydrophobicContact CE-CD1 4.35Å; M231-I235 VanDerWaalsContact O-CG1 3.31Å; M231-I235 WeakPolarHBondContact O-CG1 3.41Å; M231-I235 PolarHBondContact O-N 2.76Å; L232-I235 PolarHBondContact O-N 3.13Å; I235-G237 PolarHBondContact O-N 3.22Å; I235-F238 PolarHBondContact O-N 3.02Å; I235-V239 HydrophobicContact CG2-CG2 4.45Å; I235-V239 WeakPolarHBondContact O-CG2 3.43Å; I235-V239 PolarHBondContact O-N 3.5Å
236	G	79.3	Confident	76.2	Confident	35 Å²	35	88.5 Å²	88.5	36%	0.361	51%	0.514	S	S	.	.	H	α-helix	trans	-59.2	-44.3	176.1	0	0	0	0	0	112.9	L232 S233 L240	L232-G236 PolarHBondContact O-N 3.26Å; S233-G236 PolarHBondContact O-N 3.07Å; G236-L240 WeakPolarHBondContact O-CG 3.26Å; G236-L240 PolarHBondContact O-N 3.1Å; G236-L240 VanDerWaalsContact O-N 3.09Å
237	G	84.6	Confident	78.1	Confident	43 Å²	43	90.9 Å²	90.9	44%	0.443	52%	0.524	S	S	.	.	H	α-helix	trans	-64.8	-39.8	176.4	0	0	0	0	0	113.4	S233 G234 I235 L240 G241	S233-G237 PolarHBondContact O-N 2.95Å; G234-G237 PolarHBondContact O-N 3.39Å; I235-G237 PolarHBondContact O-N 3.22Å; G237-L240 PolarHBondContact O-N 2.98Å; G237-G241 PolarHBondContact O-N 2.79Å
238	F	86.4	Confident	79.8	Confident	143 Å²	143	89.7 Å²	89.7	63%	0.627	52%	0.517	S	S	*	.	H	α-helix	trans	-66.6	-43	178.3	-173.3	-102.9	0	0	0	112.3	G234 I235 G241 L242	G234-F238 WeakPolarHBondContact O-CB 3.38Å; G234-F238 PolarHBondContact O-N 3.37Å; I235-F238 PolarHBondContact O-N 3.02Å; F238-G241 PolarHBondContact O-N 3.04Å; F238-L242 HydrophobicContact CD1-CD1 3.94Å; F238-L242 HydrophobicContact CD1-CG 4.42Å; F238-L242 HydrophobicContact CE1-CD1 3.49Å; F238-L242 VanDerWaalsContact CE1-CD1 3.49Å; F238-L242 HydrophobicContact CE1-CG 4.11Å; F238-L242 HydrophobicContact CZ-CD1 4.08Å; F238-L242 HydrophobicContact CZ-CD2 4.44Å; F238-L242 HydrophobicContact CZ-CG 4.33Å; F238-L242 PolarHBondContact O-N 2.91Å
239	V	90.6	Very high	81.4	Confident	74 Å²	74	87.7 Å²	87.7	45%	0.448	51%	0.511	S	S	.	.	H	α-helix	trans	-63.2	-44.8	176.5	173.2	0	0	0	0	110.9	I235 G241 L242 I243	I235-V239 HydrophobicContact CG2-CG2 4.45Å; I235-V239 WeakPolarHBondContact O-CG2 3.43Å; I235-V239 PolarHBondContact O-N 3.5Å; V239-G241 VanDerWaalsContact C-N 3.33Å; V239-G241 PolarHBondContact O-N 2.89Å; V239-L242 PolarHBondContact O-N 3.2Å; V239-I243 HydrophobicContact CG1-CD1 4.14Å; V239-I243 WeakPolarHBondContact O-CG1 3.4Å; V239-I243 PolarHBondContact O-N 3.22Å; V239-I243 VanDerWaalsContact O-N 3.13Å
240	L	90.3	Very high	82.8	Confident	104 Å²	104	88.6 Å²	88.6	55%	0.545	51%	0.509	S	S	.	.	H	α-helix	trans	-60.4	-43.3	174.6	-74.7	167.8	0	0	0	111.5	G236 G237 L242 I243 F244	G236-L240 WeakPolarHBondContact O-CG 3.26Å; G236-L240 PolarHBondContact O-N 3.1Å; G236-L240 VanDerWaalsContact O-N 3.09Å; G237-L240 PolarHBondContact O-N 2.98Å; L240-L242 PolarHBondContact O-N 3.44Å; L240-I243 PolarHBondContact O-N 2.95Å; L240-F244 WeakPolarHBondContact O-CD2 3.41Å; L240-F244 PolarHBondContact O-N 3.42Å; L240-F244 VanDerWaalsContact O-N 3.11Å
241	G	89.8	Confident	84	Confident	37 Å²	37	87.2 Å²	87.2	38%	0.381	51%	0.507	S	S	.	.	H	α-helix	trans	-57.6	-45.6	175.9	0	0	0	0	0	113.2	G237 F238 V239 I243 F244 L245	G237-G241 PolarHBondContact O-N 2.79Å; F238-G241 PolarHBondContact O-N 3.04Å; V239-G241 VanDerWaalsContact C-N 3.33Å; V239-G241 PolarHBondContact O-N 2.89Å; G241-I243 VanDerWaalsContact C-N 3.34Å; G241-I243 PolarHBondContact O-N 3.13Å; G241-F244 PolarHBondContact O-N 3.28Å; G241-L245 WeakPolarHBondContact O-CB 3.45Å; G241-L245 PolarHBondContact O-N 2.74Å
242	L	92.9	Very high	85	Confident	97 Å²	97	85.7 Å²	85.7	51%	0.508	50%	0.498	S	S	.	.	H	α-helix	trans	-63.9	-37	177.3	-72.3	177.7	0	0	0	112.8	F238 V239 L240 L245 G246	F238-L242 HydrophobicContact CD1-CD1 3.94Å; F238-L242 HydrophobicContact CD1-CG 4.42Å; F238-L242 HydrophobicContact CE1-CD1 3.49Å; F238-L242 VanDerWaalsContact CE1-CD1 3.49Å; F238-L242 HydrophobicContact CE1-CG 4.11Å; F238-L242 HydrophobicContact CZ-CD1 4.08Å; F238-L242 HydrophobicContact CZ-CD2 4.44Å; F238-L242 HydrophobicContact CZ-CG 4.33Å; F238-L242 PolarHBondContact O-N 2.91Å; V239-L242 PolarHBondContact O-N 3.2Å; L240-L242 PolarHBondContact O-N 3.44Å; L242-L245 PolarHBondContact O-N 3.41Å; L242-G246 PolarHBondContact O-N 2.68Å
243	I	92.1	Very high	85.6	Confident	88 Å²	88	85 Å²	85	45%	0.451	49%	0.491	S	S	.	.	H	α-helix	trans	-63	-47.7	176.1	-67.7	165.7	0	0	0	110.4	V239 L240 G241 L245 G246 L247	V239-I243 HydrophobicContact CG1-CD1 4.14Å; V239-I243 WeakPolarHBondContact O-CG1 3.4Å; V239-I243 PolarHBondContact O-N 3.22Å; V239-I243 VanDerWaalsContact O-N 3.13Å; L240-I243 PolarHBondContact O-N 2.95Å; G241-I243 VanDerWaalsContact C-N 3.34Å; G241-I243 PolarHBondContact O-N 3.13Å; I243-L245 VanDerWaalsContact C-N 3.33Å; I243-L245 PolarHBondContact O-N 3.34Å; I243-G246 PolarHBondContact O-N 3.16Å; I243-L247 HydrophobicContact CG2-CD1 3.94Å; I243-L247 WeakPolarHBondContact O-CB 3.2Å; I243-L247 WeakPolarHBondContact O-CG 3.48Å; I243-L247 PolarHBondContact O-N 3.42Å
244	F	90.9	Very high	85.6	Confident	148 Å²	148	89.9 Å²	89.9	65%	0.649	50%	0.496	S	S	*	.	H	α-helix	trans	-64.1	-37.9	178	-78.9	-69	0	0	0	112.5	L240 G241 L247 G248	L240-F244 WeakPolarHBondContact O-CD2 3.41Å; L240-F244 PolarHBondContact O-N 3.42Å; L240-F244 VanDerWaalsContact O-N 3.11Å; G241-F244 PolarHBondContact O-N 3.28Å; F244-L247 PolarHBondContact O-N 2.72Å; F244-G248 PolarHBondContact O-N 3.45Å
245	L	90.8	Very high	85.3	Confident	110 Å²	110	92.1 Å²	92.1	58%	0.576	51%	0.505	S	S	*	.	H	α-helix	trans	-68.6	-41.4	179	-145.1	150.4	0	0	0	111.4	G241 L242 I243 G248 L249	G241-L245 WeakPolarHBondContact O-CB 3.45Å; G241-L245 PolarHBondContact O-N 2.74Å; L242-L245 PolarHBondContact O-N 3.41Å; I243-L245 VanDerWaalsContact C-N 3.33Å; I243-L245 PolarHBondContact O-N 3.34Å; L245-G248 PolarHBondContact O-N 3.17Å; L245-L249 HydrophobicContact CD2-CD1 3.84Å; L245-L249 HydrophobicContact CD2-CG 4.34Å; L245-L249 WeakPolarHBondContact O-CG 3.48Å; L245-L249 PolarHBondContact O-N 3.15Å
246	G	89.9	Confident	84.7	Confident	32 Å²	32	94.1 Å²	94.1	33%	0.33	51%	0.512	S	S	.	.	H	α-helix	trans	-62.3	-46.2	172.7	0	0	0	0	0	112.8	L242 I243 G248 L249 I250	L242-G246 PolarHBondContact O-N 2.68Å; I243-G246 PolarHBondContact O-N 3.16Å; G246-G248 VanDerWaalsContact C-N 3.35Å; G246-G248 PolarHBondContact O-N 3.46Å; G246-L249 PolarHBondContact O-N 2.9Å; G246-I250 VanDerWaalsContact O-CG1 3.32Å; G246-I250 WeakPolarHBondContact O-CG1 3.34Å; G246-I250 PolarHBondContact O-N 2.8Å
247	L	91.5	Very high	83.8	Confident	90 Å²	90	100.5 Å²	100.5	47%	0.471	53%	0.53	S	S	.	.	H	α-helix	trans	-61.5	-42.7	175.2	-74.7	168.6	0	0	0	111.8	I243 F244 I250 I251	I243-L247 HydrophobicContact CG2-CD1 3.94Å; I243-L247 WeakPolarHBondContact O-CB 3.2Å; I243-L247 WeakPolarHBondContact O-CG 3.48Å; I243-L247 PolarHBondContact O-N 3.42Å; F244-L247 PolarHBondContact O-N 2.72Å; L247-I250 PolarHBondContact O-N 3.03Å; L247-I251 VanDerWaalsContact O-CG1 3.32Å; L247-I251 WeakPolarHBondContact O-CG1 3.48Å; L247-I251 PolarHBondContact O-N 3.02Å
248	G	87.4	Confident	82.1	Confident	39 Å²	39	101 Å²	101	40%	0.402	54%	0.535	S	S	.	.	H	α-helix	trans	-59.9	-44.7	175.8	0	0	0	0	0	112.6	F244 L245 G246 I251 H252	F244-G248 PolarHBondContact O-N 3.45Å; L245-G248 PolarHBondContact O-N 3.17Å; G246-G248 VanDerWaalsContact C-N 3.35Å; G246-G248 PolarHBondContact O-N 3.46Å; G248-I251 PolarHBondContact O-N 3.44Å; G248-H252 VanDerWaalsContact O-CB 3.31Å; G248-H252 WeakPolarHBondContact O-CB 3.18Å; G248-H252 PolarHBondContact O-N 2.95Å
249	L	87.5	Confident	80.5	Confident	92 Å²	92	100.5 Å²	100.5	48%	0.482	55%	0.546	S	S	.	.	H	α-helix	trans	-64.6	-39.7	176.2	-76	169.3	0	0	0	112.5	L245 G246 H252 H253	L245-L249 HydrophobicContact CD2-CD1 3.84Å; L245-L249 HydrophobicContact CD2-CG 4.34Å; L245-L249 WeakPolarHBondContact O-CG 3.48Å; L245-L249 PolarHBondContact O-N 3.15Å; G246-L249 PolarHBondContact O-N 2.9Å; L249-H252 PolarHBondContact O-N 2.96Å; L249-H253 WeakPolarHBondContact O-CB 3.46Å; L249-H253 PolarHBondContact O-CD2 3.29Å; L249-H253 PolarHBondContact O-N 3.39Å
250	I	85.3	Confident	78.7	Confident	92 Å²	92	106.5 Å²	106.5	47%	0.472	57%	0.569	S	S	.	*	H	α-helix	trans	-64.1	-45.8	176.4	-69.5	166.5	0	0	0	110.8	G246 L247 H252 H253 R254	G246-I250 VanDerWaalsContact O-CG1 3.32Å; G246-I250 WeakPolarHBondContact O-CG1 3.34Å; G246-I250 PolarHBondContact O-N 2.8Å; L247-I250 PolarHBondContact O-N 3.03Å; I250-H252 VanDerWaalsContact C-N 3.35Å; I250-H253 PolarHBondContact O-N 3.31Å; I250-R254 WeakPolarHBondContact O-CB 3.01Å; I250-R254 WeakPolarHBondContact O-CG 3.37Å; I250-R254 PolarHBondContact O-N 3.36Å
251	I	84.3	Confident	76.9	Confident	115 Å²	115	104.4 Å²	104.4	59%	0.59	57%	0.573	S	S	*	*	H	α-helix	trans	-63.9	-43.1	177.7	-67	167.9	0	0	0	110.1	L247 G248 R254 S255	L247-I251 VanDerWaalsContact O-CG1 3.32Å; L247-I251 WeakPolarHBondContact O-CG1 3.48Å; L247-I251 PolarHBondContact O-N 3.02Å; G248-I251 PolarHBondContact O-N 3.44Å; I251-R254 PolarHBondContact O-N 3.13Å; I251-S255 WeakPolarHBondContact O-CB 3.32Å; I251-S255 PolarHBondContact O-N 3.35Å
252	H	81.5	Confident	75.4	Confident	103 Å²	103	108.5 Å²	108.5	48%	0.477	59%	0.593	S	S	.	*	H	α-helix	trans	-62.1	-45.8	177.5	-171.2	70.9	0	0	0	112.1	G248 L249 I250 R254 S255 Q256	G248-H252 VanDerWaalsContact O-CB 3.31Å; G248-H252 WeakPolarHBondContact O-CB 3.18Å; G248-H252 PolarHBondContact O-N 2.95Å; L249-H252 PolarHBondContact O-N 2.96Å; I250-H252 VanDerWaalsContact C-N 3.35Å; H252-R254 VanDerWaalsContact C-N 3.34Å; H252-R254 PolarHBondContact O-N 3.16Å; H252-S255 WeakPolarHBondContact O-CB 3.45Å; H252-S255 PolarHBondContact O-N 2.61Å; H252-Q256 PolarHBondContact NE2-NE2 2.97Å; H252-Q256 PolarHBondContact O-N 2.7Å
253	H	75.8	Confident	73.6	Confident	114 Å²	114	109.6 Å²	109.6	53%	0.528	61%	0.606	S	S	.	*	H	α-helix	trans	-65.9	-33.8	175.8	-91.7	-73.3	0	0	0	113.3	L249 I250 K257	L249-H253 WeakPolarHBondContact O-CB 3.46Å; L249-H253 PolarHBondContact O-CD2 3.29Å; L249-H253 PolarHBondContact O-N 3.39Å; I250-H253 PolarHBondContact O-N 3.31Å; H253-K257 PolarHBondContact O-N 3.23Å
254	R	73.2	Confident	71.6	Confident	191 Å²	191	111.5 Å²	111.5	72%	0.721	62%	0.624	S	S	*	*	H	α-helix	trans	-71.6	-35.7	172.9	-77.7	-173	173	178.4	-0.5	112.1	I250 I251 H252 Q256 K257	I250-R254 WeakPolarHBondContact O-CB 3.01Å; I250-R254 WeakPolarHBondContact O-CG 3.37Å; I250-R254 PolarHBondContact O-N 3.36Å; I251-R254 PolarHBondContact O-N 3.13Å; H252-R254 VanDerWaalsContact C-N 3.34Å; H252-R254 PolarHBondContact O-N 3.16Å; R254-Q256 VanDerWaalsContact C-N 3.32Å; R254-Q256 PolarHBondContact O-N 3Å; R254-K257 CarbonylContact O-C 3.41Å; R254-K257 PolarHBondContact O-N 3.48Å; R254-K257 VanDerWaalsContact O-N 3.14Å; R254-K257 VanDerWaalsContact O-O 3.08Å
255	S	68.3	Low	69.6	Low	92 Å²	92	109.3 Å²	109.3	64%	0.643	63%	0.633	S	S	*	*	H	α-helix	trans	-65	-34.1	174.1	172.7	0	0	0	0	112.6	I251 H252 K257	I251-S255 WeakPolarHBondContact O-CB 3.32Å; I251-S255 PolarHBondContact O-N 3.35Å; H252-S255 WeakPolarHBondContact O-CB 3.45Å; H252-S255 PolarHBondContact O-N 2.61Å; S255-K257 VanDerWaalsContact C-N 3.26Å
256	Q	66.1	Low	67.3	Low	138 Å²	138	108 Å²	108	65%	0.645	65%	0.646	S	S	*	*	H	α-helix	trans	-75.2	-16.3	174.6	-69.3	-162.5	7.9	0	0	113	H252 R254 G258	H252-Q256 PolarHBondContact NE2-NE2 2.97Å; H252-Q256 PolarHBondContact O-N 2.7Å; R254-Q256 VanDerWaalsContact C-N 3.32Å; R254-Q256 PolarHBondContact O-N 3Å; Q256-G258 PolarHBondContact O-N 2.93Å
257	K	59.8	Low	65	Low	169 Å²	169	114.3 Å²	114.3	74%	0.735	67%	0.671	S	S	*	*	S	Bend	trans	-96.8	75.1	170.2	-67.1	-177	-179.2	-175.4	0	109.6	H253 R254 S255	H253-K257 PolarHBondContact O-N 3.23Å; R254-K257 CarbonylContact O-C 3.41Å; R254-K257 PolarHBondContact O-N 3.48Å; R254-K257 VanDerWaalsContact O-N 3.14Å; R254-K257 VanDerWaalsContact O-O 3.08Å; S255-K257 VanDerWaalsContact C-N 3.26Å
258	G	49.7	Very low	62.7	Low	54 Å²	54	117.8 Å²	117.8	56%	0.557	69%	0.689	S	S	*	*			trans	-57.1	152.3	171.9	0	0	0	0	0	112.4	Q256 Q260	Q256-G258 PolarHBondContact O-N 2.93Å; G258-Q260 PolarHBondContact O-N 2.95Å
259	P	53.5	Low	60.7	Low	131 Å²	131	127.9 Å²	127.9	85%	0.851	73%	0.725	S	S	*	*			trans	-67.5	125.9	-172.9	26	-32	0	0	0	111.7	G261	P259-G261 PolarHBondContact O-N 3.38Å; P259-G261 VanDerWaalsContact O-N 3.13Å
260	Q	53.2	Low	59.4	Low	200 Å²	200	129.7 Å²	129.7	94%	0.935	74%	0.738	S	S	*	*			trans	-67.7	105.8	161.3	-78.3	-177.2	-17.6	0	0	107.9	G258	G258-Q260 PolarHBondContact O-N 2.95Å
261	G	51.8	Low	58	Low	61 Å²	61	131.6 Å²	131.6	63%	0.629	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-63.5	151.8	173.8	0	0	0	0	0	111.9	P259	P259-G261 PolarHBondContact O-N 3.38Å; P259-G261 VanDerWaalsContact O-N 3.13Å
262	P	57.6	Low	56.6	Low	123 Å²	123	132.6 Å²	132.6	80%	0.799	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-70.9	153.1	-176.7	29.8	-33.4	0	0	0	111.9
263	P	56	Low	55.1	Low	120 Å²	120	134.3 Å²	134.3	78%	0.779	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-74.6	151.6	-176.7	30.8	-32.8	0	0	0	111.6
264	P	49.3	Very low	53.8	Low	128 Å²	128	135.6 Å²	135.6	83%	0.831	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-72	135.9	-179.6	27.7	-31.1	0	0	0	111.5	G266	P264-G266 PolarHBondContact O-N 2.67Å
265	A	49	Very low	52.5	Low	102 Å²	102	131.9 Å²	131.9	84%	0.843	80%	0.798	S	S	*	*			trans	-69.6	115.6	168.2	0	0	0	0	0	109.6
266	G	42.8	Very low	51.4	Low	82 Å²	82	134.7 Å²	134.7	85%	0.845	81%	0.809	S	S	*	*			trans	-80.3	129.7	166.4	0	0	0	0	0	110.3	P264	P264-G266 PolarHBondContact O-N 2.67Å
267	L	42.4	Very low	50.3	Low	164 Å²	164	134.5 Å²	134.5	86%	0.859	82%	0.821	S	S	*	*			trans	-115	115.9	172.7	-122.6	146.2	0	0	0	107.2
268	L	41.9	Very low	49.5	Very low	163 Å²	163	131.6 Å²	131.6	85%	0.853	83%	0.829	S	S	*	*			trans	-139.2	123.3	159.8	-88.1	174.9	0	0	0	108.7
269	H	46.9	Very low	49.5	Very low	251 Å²	251	138.6 Å²	138.6	100%	1.162	85%	0.853	S	S	*	*			trans	74.3	0	174.6	-80	-71.2	0	0	0	119.5

Retrieved 269 of 269 residues in 128.2 ms (Link to these results)

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