A0A096MJF1_RAT Loading...

Dermatopontin (Predicted), isoform CRA_a

AlphaFold DB (B2RZ77), UniProt , Accession A0A096MJF1, Species RAT (Rattus norvegicus, Rat), Gene Dpt, Length 202 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	45.2	Very low	46.5	Very low	222 Å²	222	154 Å²	154	100%	1.094	80%	0.804	S	S	*	*				0	70.9	0	-60.3	-174.5	78.6	0	0	110.5
2	D	43.5	Very low	47	Very low	142 Å²	142	155.8 Å²	155.8	76%	0.759	81%	0.813	S	S	*	*			cis	-154	152	-18.3	-78.8	-40.6	0	0	0	108.7
3	L	38.8	Very low	47.3	Very low	178 Å²	178	153.4 Å²	153.4	93%	0.932	81%	0.809	S	S	*	*			trans	-122.9	115.8	176.2	-95.1	98.8	0	0	0	110.7
4	T	52.6	Low	47.8	Very low	126 Å²	126	151.1 Å²	151.1	77%	0.773	81%	0.812	S	S	*	*			trans	-164.3	153.9	175.2	38.5	0	0	0	0	108
5	L	51.5	Low	47.9	Very low	142 Å²	142	148.3 Å²	148.3	74%	0.743	80%	0.803	S	S	*	*			cis	-138.9	149.9	-21.1	-89.4	146.3	0	0	0	104.7
6	L	42.9	Very low	48.2	Very low	134 Å²	134	145.5 Å²	145.5	70%	0.702	81%	0.806	S	S	*	*			cis	72.4	127.7	46.3	-112.6	-175.8	0	0	0	115.7
7	W	48.2	Very low	47.8	Very low	212 Å²	212	151.4 Å²	151.4	80%	0.803	81%	0.813	S	S	*	*			trans	77.2	144.5	176.8	-55.9	87.4	0	0	0	117.9
8	V	49.4	Very low	47.6	Very low	107 Å²	107	146.2 Å²	146.2	65%	0.648	80%	0.801	S	S	*	*			cis	158	141.8	-26.4	145.7	0	0	0	0	107.4
9	L	47.3	Very low	47.2	Very low	166 Å²	166	148.6 Å²	148.6	87%	0.869	81%	0.806	S	S	*	*			trans	90.1	126.5	170.2	-71.8	159.9	0	0	0	121.8
10	L	45.5	Very low	46.8	Very low	158 Å²	158	152.8 Å²	152.8	83%	0.827	81%	0.811	S	S	*	*			trans	-65.3	-174.3	167.7	-78.4	149.9	0	0	0	114.3
11	P	47.2	Very low	46.3	Very low	107 Å²	107	148.5 Å²	148.5	70%	0.695	80%	0.804	S	S	*	*			cis	-130.3	177	-18	25.4	-4.4	0	0	0	113.4
12	L	51.5	Low	46	Very low	175 Å²	175	145.1 Å²	145.1	92%	0.916	79%	0.79	S	S	*	*			trans	-150.7	136.9	144.8	-113.4	171.3	0	0	0	111.7
13	V	51.2	Low	45.9	Very low	125 Å²	125	149.4 Å²	149.4	76%	0.758	80%	0.797	S	S	*	*			trans	-88.6	138.3	-175.5	173.1	0	0	0	0	110.4
14	S	54.9	Low	45.9	Very low	121 Å²	121	143.2 Å²	143.2	85%	0.846	78%	0.776	S	S	*	*			trans	-140.9	135.3	156.4	45.1	0	0	0	0	110.8
15	T	49.4	Very low	45.2	Very low	110 Å²	110	147.4 Å²	147.4	68%	0.675	78%	0.779	S	S	*	*			trans	-87.7	130.6	-167.3	50.3	0	0	0	0	112.4
16	A	51.8	Low	44.8	Very low	103 Å²	103	147.8 Å²	147.8	85%	0.851	78%	0.777	S	S	*	*			trans	-111.1	109.4	162.6	0	0	0	0	0	109
17	W	41.2	Very low	44.8	Very low	246 Å²	246	144.9 Å²	144.9	93%	0.932	77%	0.767	S	S	*	*			trans	-83	116	173.5	-73	41.4	0	0	0	107.9
18	G	44.2	Very low	44.5	Very low	57 Å²	57	144.1 Å²	144.1	59%	0.588	77%	0.765	S	S	*	*			trans	-157.5	87.9	-171.4	0	0	0	0	0	114	Y20	G18-Y20 PolarHBondContact O-N 2.68Å
19	Q	40.9	Very low	43.9	Very low	192 Å²	192	145.8 Å²	145.8	90%	0.897	77%	0.766	S	S	*	*			trans	37.4	77.6	147.1	-60.5	174.2	-95.4	0	0	118.1
20	Y	39	Very low	43.5	Very low	232 Å²	232	146.4 Å²	146.4	91%	0.91	76%	0.764	S	S	*	*			trans	-135.8	73.2	152.5	-100.4	-85.2	0	0	0	109.8	G18	G18-Y20 PolarHBondContact O-N 2.68Å
21	G	37	Very low	43.4	Very low	64 Å²	64	142.7 Å²	142.7	66%	0.66	74%	0.739	S	S	*	*			trans	-95.6	109.9	173	0	0	0	0	0	111.1
22	D	37.6	Very low	42.9	Very low	151 Å²	151	144.9 Å²	144.9	81%	0.807	74%	0.74	S	S	*	*			trans	49.8	84.9	140.6	-156.7	16.6	0	0	0	118.9	G24	D22-G24 VanDerWaalsContact C-N 3.29Å; D22-G24 PolarHBondContact O-N 2.91Å; D22-G24 PolarHBondContact OD1-N 3.48Å
23	Y	41.7	Very low	42.4	Very low	232 Å²	232	142.7 Å²	142.7	91%	0.91	73%	0.73	S	S	*	*			trans	-86.6	67.2	159.9	-85.5	-85.8	0	0	0	110.8	Y25	Y23-Y25 PolarHBondContact O-N 2.8Å
24	G	39.1	Very low	42.2	Very low	48 Å²	48	139.9 Å²	139.9	50%	0.495	71%	0.706	S	S	.	*			trans	-75.6	96.1	171.8	0	0	0	0	0	112.2	D22 H26	D22-G24 VanDerWaalsContact C-N 3.29Å; D22-G24 PolarHBondContact O-N 2.91Å; D22-G24 PolarHBondContact OD1-N 3.48Å; G24-H26 PolarHBondContact O-N 3.48Å
25	Y	37.9	Very low	41.4	Very low	213 Å²	213	137.2 Å²	137.2	84%	0.835	69%	0.687	S	S	*	*			trans	-73.8	90.8	177.7	-166.5	-91.6	0	0	0	111.3	Y23 P27	Y23-Y25 PolarHBondContact O-N 2.8Å; Y25-P27 HydrophobicContact CD1-CG 4.44Å; Y25-P27 HydrophobicContact CE1-CB 4.3Å; Y25-P27 HydrophobicContact CE1-CG 4.27Å; Y25-P27 WeakPolarHBondContact O-CD 3.46Å
26	H	42.9	Very low	41.4	Very low	150 Å²	150	139.6 Å²	139.6	69%	0.694	70%	0.696	S	S	*	*			trans	-109.2	93.9	177	-97.8	-81.7	0	0	0	111.8	G24 Y28	G24-H26 PolarHBondContact O-N 3.48Å; H26-Y28 PolarHBondContact O-N 2.96Å
27	P	43.3	Very low	41.6	Very low	74 Å²	74	140.9 Å²	140.9	48%	0.481	69%	0.689	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.5	21.2	-174.4	33.8	-37.5	0	0	0	114.8	Y25	Y25-P27 HydrophobicContact CD1-CG 4.44Å; Y25-P27 HydrophobicContact CE1-CB 4.3Å; Y25-P27 HydrophobicContact CE1-CG 4.27Å; Y25-P27 WeakPolarHBondContact O-CD 3.46Å
28	Y	41.7	Very low	43.5	Very low	195 Å²	195	131.2 Å²	131.2	77%	0.765	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	-0.3	-168.5	-79.2	-79.6	0	0	0	115.8	H26	H26-Y28 PolarHBondContact O-N 2.96Å
29	Q	36.5	Very low	45.9	Very low	143 Å²	143	133.5 Å²	133.5	67%	0.668	66%	0.656	S	S	*	*	S	Bend	trans	-104.5	-7.1	-175.9	-76	-176.8	-77.4	0	0	116
30	Q	38.6	Very low	48.5	Very low	179 Å²	179	126.4 Å²	126.4	84%	0.836	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-81	-13.3	-178.8	-164.9	166.2	-7.5	0	0	114.1	Q32	Q30-Q32 PolarHBondContact O-N 2.65Å
31	Y	44.9	Very low	51.2	Low	79 Å²	79	115.5 Å²	115.5	31%	0.31	58%	0.583	S	S	.	*	G	3₁₀ helix	trans	-79	2.2	174.4	-81	-78.9	0	0	0	114.3	D33 Y34 Y165	Y31-D33 PolarHBondContact O-N 3.13Å; Y31-Y34 HydrophobicContact CD1-CD2 4.19Å; Y31-Y34 AromaticContact CD1-CE2 3.86Å; Y31-Y34 HydrophobicContact CD1-CE2 3.86Å; Y31-Y34 HydrophobicContact CE1-CE2 4.25Å; Y31-Y165 WeakPolarHBondContact CE2-OH 3.37Å
32	Q	35.8	Very low	54	Low	153 Å²	153	118 Å²	118	72%	0.715	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-80	3.9	-179.5	-66.2	-162.6	-93.8	0	0	114.7	Q30	Q30-Q32 PolarHBondContact O-N 2.65Å
33	D	40.7	Very low	56.7	Low	130 Å²	130	112.5 Å²	112.5	70%	0.695	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-113.4	38.3	170	-151.2	10.1	0	0	0	112.8	Y31 S35	Y31-D33 PolarHBondContact O-N 3.13Å; D33-S35 PolarHBondContact O-N 3.08Å; D33-S35 WeakPolarHBondContact OD1-CB 3.3Å; D33-S35 PolarHBondContact OD1-OG 3.34Å
34	Y	46.4	Very low	59.3	Low	66 Å²	66	106.4 Å²	106.4	26%	0.259	53%	0.527	S	S	.	.			trans	-77.1	53.8	144	-89.4	-71	0	0	0	109.3	Y31 A59 R61 A77 I161	Y31-Y34 HydrophobicContact CD1-CD2 4.19Å; Y31-Y34 AromaticContact CD1-CE2 3.86Å; Y31-Y34 HydrophobicContact CD1-CE2 3.86Å; Y31-Y34 HydrophobicContact CE1-CE2 4.25Å; Y34-A59 HydrophobicContact CE1-CB 4.47Å; Y34-A59 WeakPolarHBondContact OH-CB 3.31Å; Y34-R61 VanDerWaalsContact CE1-CZ 3.49Å; Y34-A77 HydrophobicContact CD1-CB 4.47Å; Y34-A77 HydrophobicContact CE1-CB 3.62Å; Y34-I161 HydrophobicContact CE2-CD1 4.15Å
35	S	39.8	Very low	62	Low	65 Å²	65	108.6 Å²	108.6	46%	0.455	52%	0.524	S	S	.	.			trans	-71.9	168.8	173.5	60.9	0	0	0	0	110.6	D33 D37	D33-S35 PolarHBondContact O-N 3.08Å; D33-S35 WeakPolarHBondContact OD1-CB 3.3Å; D33-S35 PolarHBondContact OD1-OG 3.34Å; S35-D37 PolarHBondContact O-N 2.75Å
36	D	49.1	Very low	64.9	Low	159 Å²	159	100.3 Å²	100.3	85%	0.85	50%	0.503	S	S	*	.			trans	-74.7	45.8	-168.4	-165	23.3	0	0	0	113.2	G38	D36-G38 VanDerWaalsContact C-N 3.33Å; D36-G38 PolarHBondContact O-N 2.88Å
37	D	55.7	Low	67.5	Low	131 Å²	131	93.9 Å²	93.9	70%	0.701	47%	0.474	S	S	*	.			trans	-67.8	94.9	164.9	-87.9	-6.6	0	0	0	107.3	S35 N75	S35-D37 PolarHBondContact O-N 2.75Å; D37-N75 PolarHBondContact O-ND2 3.29Å
38	G	81.7	Confident	70.1	Confident	43 Å²	43	93.4 Å²	93.4	44%	0.443	47%	0.472	S	S	.	.			trans	-63.5	-178.4	-156.5	0	0	0	0	0	117.4	D36 V40	D36-G38 VanDerWaalsContact C-N 3.33Å; D36-G38 PolarHBondContact O-N 2.88Å; G38-V40 PolarHBondContact O-N 3.46Å
39	W	93.2	Very high	72.8	Confident	105 Å²	105	86.7 Å²	86.7	40%	0.398	45%	0.446	S	S	.	.			trans	-50.2	126.4	177.4	-57.8	103.6	0	0	0	112	N41 I63 Q73 W74 N75	W39-N41 WeakPolarHBondContact CB-O 3.49Å; W39-N41 PolarHBondContact O-N 2.02Å; W39-I63 HydrophobicContact CD2-CD1 4.34Å; W39-I63 HydrophobicContact CD2-CG1 4.37Å; W39-I63 HydrophobicContact CE3-CG1 4.36Å; W39-I63 HydrophobicContact CH2-CB 4.12Å; W39-I63 HydrophobicContact CH2-CD1 4.18Å; W39-I63 HydrophobicContact CH2-CG1 3.72Å; W39-I63 HydrophobicContact CH2-CG2 3.57Å; W39-I63 HydrophobicContact CZ2-CB 4.29Å; W39-I63 HydrophobicContact CZ2-CD1 3.58Å; W39-I63 HydrophobicContact CZ2-CG1 3.66Å; W39-I63 HydrophobicContact CZ2-CG2 3.72Å; W39-I63 HydrophobicContact CZ3-CG1 4.06Å; W39-Q73 HydrophobicContact CB-CB 4.18Å; W39-Q73 HydrophobicContact CD2-CB 3.77Å; W39-Q73 VanDerWaalsContact CE3-C 3.48Å; W39-Q73 HydrophobicContact CE3-CB 3.66Å; W39-Q73 HydrophobicContact CG-CB 3.99Å; W39-Q73 HydrophobicContact CZ3-CB 4.44Å; W39-Q73 WeakPolarHBondContact CZ3-O 3.29Å; W39-W74 CarbonylContact C-O 3.37Å; W39-W74 WeakPolarHBondContact CA-O 3.03Å; W39-N75 HydrophobicContact CE3-CB 4.01Å; W39-N75 HydrophobicContact CZ3-CB 3.95Å
40	V	95.9	Very high	75.7	Confident	43 Å²	43	84.3 Å²	84.3	26%	0.261	43%	0.434	S	S	.	.	S	Bend	trans	-68.9	-7.4	179.9	-51	0	0	0	0	112.7	G38 F47 Y49 W74 Y76	G38-V40 PolarHBondContact O-N 3.46Å; V40-F47 HydrophobicContact CG2-CB 4.19Å; V40-F47 HydrophobicContact CG2-CD1 4.09Å; V40-F47 HydrophobicContact CG2-CD2 3.65Å; V40-F47 HydrophobicContact CG2-CE1 4.33Å; V40-F47 HydrophobicContact CG2-CE2 3.95Å; V40-F47 HydrophobicContact CG2-CG 3.72Å; V40-F47 HydrophobicContact CG2-CZ 4.25Å; V40-Y49 HydrophobicContact CG1-CD2 3.65Å; V40-Y49 HydrophobicContact CG1-CE2 4.16Å; V40-Y49 HydrophobicContact CG1-CG 4.39Å; V40-W74 HydrophobicContact CG2-CB 4.06Å; V40-W74 WeakPolarHBondContact CG2-O 3.06Å; V40-W74 PolarHBondContact N-O 2.79Å; V40-Y76 HydrophobicContact CG1-CD2 4.23Å; V40-Y76 HydrophobicContact CG2-CD2 4.19Å; V40-Y76 HydrophobicContact CG2-CE2 3.97Å
41	N	96	Very high	78.5	Confident	3 Å²	3	76.4 Å²	76.4	2%	0.016	40%	0.399	C	S	.	.			trans	-152	152.8	177.2	71.7	-75	0	0	0	112.8	W39 Q45 F47 R72 Q73 W74 R127	W39-N41 WeakPolarHBondContact CB-O 3.49Å; W39-N41 PolarHBondContact O-N 2.02Å; N41-Q45 HydrophobicContact CB-CB 4.32Å; N41-F47 HydrophobicContact CB-CB 4.2Å; N41-F47 HydrophobicContact CB-CD1 3.68Å; N41-F47 HydrophobicContact CB-CE1 4.48Å; N41-F47 HydrophobicContact CB-CG 4.31Å; N41-R72 PolarHBondContact ND2-O 3.3Å; N41-R72 VanDerWaalsContact ND2-O 3.13Å; N41-Q73 PolarHBondContact O-NE2 2.77Å; N41-W74 PolarHBondContact OD1-N 2.72Å; N41-R127 PolarHBondContact ND2-NH2 3.29Å
42	L	95.8	Very high	80.9	Confident	116 Å²	116	76.2 Å²	76.2	61%	0.607	41%	0.407	S	S	*	.			trans	-81.8	167.3	156.6	-58	178.6	0	0	0	110.6	Q45	L42-Q45 HydrophobicContact CB-CB 4.29Å; L42-Q45 WeakPolarHBondContact O-CB 2.92Å; L42-Q45 PolarHBondContact O-N 3.23Å; L42-Q45 VanDerWaalsContact O-N 3.14Å
43	N	94.3	Very high	83.8	Confident	35 Å²	35	75.6 Å²	75.6	19%	0.187	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	142.5	173.9	-62.9	-56.4	0	0	0	111.2	Q45 E68 D71 Q73	N43-Q45 PolarHBondContact O-N 2.9Å; N43-E68 HydrophobicContact CB-CB 3.58Å; N43-E68 HydrophobicContact CB-CG 4.37Å; N43-D71 WeakPolarHBondContact CA-OD2 3.25Å; N43-Q73 WeakPolarHBondContact OD1-CG 3.41Å
44	R	96.2	Very high	86.4	Confident	105 Å²	105	70 Å²	70	40%	0.396	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	-0.5	-171.6	-47.5	-171.4	-168.7	-169.4	7.1	115.8	E68 G69 D71 Y120 E122	R44-E68 WeakPolarHBondContact CG-O 3Å; R44-E68 PolarHBondContact NE-O 3.45Å; R44-G69 VanDerWaalsContact NH2-CA 3.25Å; R44-D71 PolarHBondContact N-OD2 3.17Å; R44-Y120 HydrophobicContact CB-CD1 3.73Å; R44-Y120 HydrophobicContact CB-CE1 4.04Å; R44-Y120 HydrophobicContact CB-CG 4.03Å; R44-Y120 HydrophobicContact CG-CD1 3.9Å; R44-Y120 HydrophobicContact CG-CD2 4.48Å; R44-Y120 HydrophobicContact CG-CE1 3.68Å; R44-Y120 HydrophobicContact CG-CE2 4.29Å; R44-Y120 HydrophobicContact CG-CG 4.29Å; R44-Y120 WeakPolarHBondContact O-CB 3.43Å; R44-E122 IonicContact NH1-OE1 2.78Å; R44-E122 PolarHBondContact NH1-OE1 3.34Å
45	Q	96.6	Very high	88.7	Confident	94 Å²	94	69.3 Å²	69.3	44%	0.439	38%	0.376	S	S	.	.			trans	-80.6	136.3	174.8	-161	-171.9	-2.3	0	0	110.3	N41 L42 N43 R127	N41-Q45 HydrophobicContact CB-CB 4.32Å; L42-Q45 HydrophobicContact CB-CB 4.29Å; L42-Q45 WeakPolarHBondContact O-CB 2.92Å; L42-Q45 PolarHBondContact O-N 3.23Å; L42-Q45 VanDerWaalsContact O-N 3.14Å; N43-Q45 PolarHBondContact O-N 2.9Å; Q45-R127 PolarHBondContact O-NH1 2.04Å; Q45-R127 PolarHBondContact O-NH2 2.8Å
46	G	97.1	Very high	91.4	Very high	38 Å²	38	66.4 Å²	66.4	39%	0.392	36%	0.355	S	S	.	.			trans	-80	157.5	166.3	0	0	0	0	0	111.8	S118	G46-S118 CarbonylContact C-O 3.53Å; G46-S118 WeakPolarHBondContact CA-O 3.34Å
47	F	98	Very high	93.7	Very high	16 Å²	16	58.9 Å²	58.9	7%	0.07	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	161.5	179.8	63.7	-94.6	0	0	0	111.8	V40 N41 W74 Y76 F116 Q117 S118 W129	V40-F47 HydrophobicContact CG2-CB 4.19Å; V40-F47 HydrophobicContact CG2-CD1 4.09Å; V40-F47 HydrophobicContact CG2-CD2 3.65Å; V40-F47 HydrophobicContact CG2-CE1 4.33Å; V40-F47 HydrophobicContact CG2-CE2 3.95Å; V40-F47 HydrophobicContact CG2-CG 3.72Å; V40-F47 HydrophobicContact CG2-CZ 4.25Å; N41-F47 HydrophobicContact CB-CB 4.2Å; N41-F47 HydrophobicContact CB-CD1 3.68Å; N41-F47 HydrophobicContact CB-CE1 4.48Å; N41-F47 HydrophobicContact CB-CG 4.31Å; F47-W74 HydrophobicContact CE1-CB 4.06Å; F47-W74 AromaticContact CE1-CD1 3.58Å; F47-W74 AromaticContact CE1-CG 3.9Å; F47-W74 HydrophobicContact CE1-CG 3.9Å; F47-W74 HydrophobicContact CZ-CB 3.93Å; F47-W74 AromaticContact CZ-CG 3.89Å; F47-W74 HydrophobicContact CZ-CG 3.89Å; F47-Y76 AromaticContact CE2-CE2 3.65Å; F47-Y76 HydrophobicContact CE2-CE2 3.65Å; F47-Y76 AromaticContact CZ-CE2 3.96Å; F47-Y76 HydrophobicContact CZ-CE2 3.96Å; F47-Y76 WeakPolarHBondContact CZ-OH 3.14Å; F47-F116 HydrophobicContact CE2-CB 4.12Å; F47-Q117 WeakPolarHBondContact O-CA 3.42Å; F47-S118 PolarHBondContact N-O 3.12Å; F47-S118 PolarHBondContact O-N 3.33Å; F47-W129 HydrophobicContact CE1-CH2 4.43Å; F47-W129 HydrophobicContact CZ-CH2 4.06Å; F47-W129 AromaticContact CZ-CZ3 3.81Å; F47-W129 HydrophobicContact CZ-CZ3 3.81Å
48	S	97.8	Very high	95.7	Very high	64 Å²	64	53.8 Å²	53.8	45%	0.448	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	117.2	164.5	-179.9	0	0	0	0	107	W93	S48-W93 WeakPolarHBondContact OG-CH2 3.22Å; S48-W93 VanDerWaalsContact OG-CZ2 3.31Å; S48-W93 WeakPolarHBondContact OG-CZ2 3.41Å
49	Y	97.7	Very high	96.3	Very high	54 Å²	54	51.8 Å²	51.8	21%	0.212	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	133.7	179.2	178.6	-88.7	0	0	0	108.8	V40 Y76 C78 G115 F116	V40-Y49 HydrophobicContact CG1-CD2 3.65Å; V40-Y49 HydrophobicContact CG1-CE2 4.16Å; V40-Y49 HydrophobicContact CG1-CG 4.39Å; Y49-Y76 AromaticContact CD1-CD2 3.91Å; Y49-Y76 HydrophobicContact CD1-CD2 3.91Å; Y49-Y76 AromaticContact CD1-CG 3.92Å; Y49-Y76 HydrophobicContact CD1-CG 3.92Å; Y49-Y76 HydrophobicContact CD2-CD2 4.37Å; Y49-Y76 HydrophobicContact CE1-CD2 4.39Å; Y49-Y76 HydrophobicContact CE1-CG 4.06Å; Y49-Y76 AromaticContact CG-CD2 3.89Å; Y49-Y76 HydrophobicContact CG-CD2 3.89Å; Y49-Y76 HydrophobicContact CG-CG 4.36Å; Y49-Y76 PolarHBondContact OH-O 2.03Å; Y49-C78 PolarHBondContact OH-SG 3.27Å; Y49-G115 CarbonylContact O-C 3.5Å; Y49-G115 WeakPolarHBondContact O-CA 3.44Å; Y49-F116 PolarHBondContact N-O 3.37Å; Y49-F116 PolarHBondContact O-N 2.93Å
50	Q	97.9	Very high	96.5	Very high	93 Å²	93	46.9 Å²	46.9	44%	0.435	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	136.5	178.4	-67.3	171.5	59.3	0	0	108.5	W93 Y132	Q50-W93 HydrophobicContact CG-CH2 4.17Å; Q50-W93 HydrophobicContact CG-CZ2 3.86Å; Q50-Y132 HydrophobicContact CB-CD1 4.26Å; Q50-Y132 HydrophobicContact CB-CE1 4.44Å; Q50-Y132 HydrophobicContact CG-CD1 3.8Å; Q50-Y132 HydrophobicContact CG-CE1 4.14Å; Q50-Y132 HydrophobicContact CG-CG 4.1Å
51	C	97.2	Very high	96.5	Very high	13 Å²	13	47.7 Å²	47.7	9%	0.088	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-67.1	154.3	170.1	-67.9	0	0	0	0	111.1	Q55 V56 C78 A114	C51-Q55 HydrophobicContact CB-CB 3.95Å; C51-V56 VanDerWaalsContact SG-C 3.56Å; C51-C78 WeakPolarHBondContact CA-SG 3.41Å; C51-C78 HydrophobicContact CB-CB 3.7Å; C51-C78 WeakPolarHBondContact CB-SG 3.04Å; C51-C78 WeakPolarHBondContact SG-CB 3Å; C51-C78 CovalentContact SG-SG 2.03Å; C51-C78 PolarHBondContact SG-SG 3.15Å; C51-A114 WeakPolarHBondContact CB-O 3.11Å; C51-A114 PolarHBondContact N-O 2.95Å
52	P	97	Very high	96.6	Very high	75 Å²	75	47.6 Å²	47.6	49%	0.487	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-55.4	157	168.4	-23.2	33.5	0	0	0	112.1	G54 Q55	P52-G54 PolarHBondContact O-N 2.84Å; P52-Q55 HydrophobicContact CB-CG 4.09Å; P52-Q55 HydrophobicContact CG-CG 4.47Å; P52-Q55 VanDerWaalsContact O-CB 3.31Å; P52-Q55 WeakPolarHBondContact O-CB 3.06Å; P52-Q55 PolarHBondContact O-N 3.19Å
53	H	95.4	Very high	96.6	Very high	140 Å²	140	44.5 Å²	44.5	65%	0.648	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	135.9	177.6	-170.8	-82.1	0	0	0	111.6	Q55 E87	H53-Q55 VanDerWaalsContact C-N 3.26Å; H53-Q55 PolarHBondContact O-N 3.32Å; H53-E87 IonicContact CE1-OE2 2.96Å; H53-E87 PolarHBondContact CE1-OE2 3.16Å; H53-E87 IonicContact ND1-OE2 3.09Å; H53-E87 PolarHBondContact ND1-OE2 2.89Å
54	G	95	Very high	96.8	Very high	11 Å²	11	44.2 Å²	44.2	11%	0.113	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	11.6	-175.7	0	0	0	0	0	114.7	P52 P80 T81	P52-G54 PolarHBondContact O-N 2.84Å; G54-P80 WeakPolarHBondContact O-CA 3.07Å; G54-T81 PolarHBondContact O-N 2.82Å; G54-T81 PolarHBondContact O-OG1 2.95Å; G54-T81 VanDerWaalsContact O-OG1 3.07Å
55	Q	96.4	Very high	96.8	Very high	52 Å²	52	41.8 Å²	41.8	24%	0.243	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	157.2	173.9	-50.5	-163	7.2	0	0	112	C51 P52 H53 C78 M79 P80	C51-Q55 HydrophobicContact CB-CB 3.95Å; P52-Q55 HydrophobicContact CB-CG 4.09Å; P52-Q55 HydrophobicContact CG-CG 4.47Å; P52-Q55 VanDerWaalsContact O-CB 3.31Å; P52-Q55 WeakPolarHBondContact O-CB 3.06Å; P52-Q55 PolarHBondContact O-N 3.19Å; H53-Q55 VanDerWaalsContact C-N 3.26Å; H53-Q55 PolarHBondContact O-N 3.32Å; Q55-C78 HydrophobicContact CB-CB 4.2Å; Q55-C78 VanDerWaalsContact OE1-CB 3.29Å; Q55-M79 VanDerWaalsContact CA-O 3.23Å; Q55-M79 WeakPolarHBondContact CA-O 3.41Å; Q55-M79 WeakPolarHBondContact CB-O 3.3Å; Q55-P80 HydrophobicContact CG-CB 4.26Å
56	V	96.5	Very high	96.7	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.024	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	158.4	179.5	-67.8	0	0	0	0	110.8	C51 V58 C78 M79 T81 L112 Y136 Y168	C51-V56 VanDerWaalsContact SG-C 3.56Å; V56-V58 PolarHBondContact O-N 2.95Å; V56-C78 VanDerWaalsContact O-CA 3.3Å; V56-C78 WeakPolarHBondContact O-CA 3.44Å; V56-M79 PolarHBondContact N-O 2.83Å; V56-M79 PolarHBondContact O-N 2.82Å; V56-T81 HydrophobicContact CB-CG2 4.46Å; V56-T81 HydrophobicContact CG1-CG2 3.85Å; V56-T81 HydrophobicContact CG2-CG2 3.78Å; V56-L112 HydrophobicContact CG1-CB 3.89Å; V56-L112 HydrophobicContact CG1-CD1 4.11Å; V56-Y136 HydrophobicContact CG1-CE2 4.14Å; V56-Y168 HydrophobicContact CG2-CD1 3.99Å
57	V	97.3	Very high	96.7	Very high	2 Å²	2	50 Å²	50	1%	0.012	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	123.8	179.5	-179.4	0	0	0	0	109.5	A59 V60 Y76 V113 F116	V57-A59 VanDerWaalsContact CG1-O 3.32Å; V57-A59 WeakPolarHBondContact CG1-O 3.42Å; V57-V60 HydrophobicContact CG1-CG2 4.1Å; V57-Y76 HydrophobicContact CG1-CD1 4.19Å; V57-V113 HydrophobicContact CB-CG1 4.42Å; V57-V113 HydrophobicContact CG2-CG1 4.3Å; V57-V113 PolarHBondContact N-O 2.89Å; V57-F116 HydrophobicContact CB-CE2 4.33Å; V57-F116 HydrophobicContact CG1-CE2 4.02Å; V57-F116 HydrophobicContact CG2-CD2 4.22Å; V57-F116 HydrophobicContact CG2-CE2 4.12Å
58	V	95.9	Very high	96.5	Very high	24 Å²	24	53.8 Å²	53.8	15%	0.145	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	-14.5	176.4	-67.4	0	0	0	0	113.1	V56 A77 M79 S162	V56-V58 PolarHBondContact O-N 2.95Å; V58-A77 HydrophobicContact CG2-CB 4.34Å; V58-A77 WeakPolarHBondContact CG2-O 3.37Å; V58-A77 PolarHBondContact N-O 3.24Å; V58-M79 HydrophobicContact CB-CB 4.36Å; V58-M79 HydrophobicContact CG1-CB 3.51Å; V58-M79 HydrophobicContact CG1-CE 4.39Å; V58-M79 HydrophobicContact CG1-SD 4.48Å; V58-M79 HydrophobicContact CG2-CB 3.93Å; V58-M79 HydrophobicContact CG2-CE 4.28Å; V58-S162 WeakPolarHBondContact O-CB 3.42Å; V58-S162 PolarHBondContact O-N 2.92Å
59	A	95.6	Very high	96.3	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.008	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	151.1	176.2	0	0	0	0	0	113.3	Y34 V57 Y76 A77 M160 I161	Y34-A59 HydrophobicContact CE1-CB 4.47Å; Y34-A59 WeakPolarHBondContact OH-CB 3.31Å; V57-A59 VanDerWaalsContact CG1-O 3.32Å; V57-A59 WeakPolarHBondContact CG1-O 3.42Å; A59-Y76 WeakPolarHBondContact O-CA 3.44Å; A59-A77 HydrophobicContact CB-CB 4.09Å; A59-A77 PolarHBondContact N-O 2.97Å; A59-A77 PolarHBondContact O-N 2.83Å; A59-M160 CarbonylContact C-O 3.46Å; A59-M160 WeakPolarHBondContact CA-O 3.25Å; A59-M160 WeakPolarHBondContact CB-O 3.22Å; A59-I161 HydrophobicContact CB-CB 4.35Å; A59-I161 HydrophobicContact CB-CG1 4.03Å; A59-I161 HydrophobicContact CB-CG2 4.41Å
60	V	97	Very high	96.2	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	121.3	177.4	-170.2	0	0	0	0	108.7	V57 W74 Y76 F116 M158 M160 M169 F187	V57-V60 HydrophobicContact CG1-CG2 4.1Å; V60-W74 HydrophobicContact CG1-CE3 3.86Å; V60-W74 HydrophobicContact CG1-CZ3 3.84Å; V60-Y76 HydrophobicContact CB-CD1 4.33Å; V60-Y76 HydrophobicContact CB-CE1 4.28Å; V60-Y76 HydrophobicContact CG1-CD1 3.98Å; V60-Y76 HydrophobicContact CG1-CE1 3.52Å; V60-Y76 HydrophobicContact CG2-CD1 3.99Å; V60-Y76 HydrophobicContact CG2-CE1 4.01Å; V60-F116 HydrophobicContact CG2-CE2 4.19Å; V60-F116 HydrophobicContact CG2-CZ 3.88Å; V60-M158 HydrophobicContact CB-CE 3.73Å; V60-M158 HydrophobicContact CG1-CE 3.35Å; V60-M158 WeakPolarHBondContact O-CE 3.27Å; V60-M160 PolarHBondContact N-O 2.83Å; V60-M160 PolarHBondContact O-N 3.27Å; V60-M169 HydrophobicContact CG2-CE 3.93Å; V60-F187 HydrophobicContact CB-CZ 4.05Å; V60-F187 HydrophobicContact CG1-CZ 4.36Å; V60-F187 HydrophobicContact CG2-CE1 3.96Å; V60-F187 HydrophobicContact CG2-CZ 4Å
61	R	96.2	Very high	96.2	Very high	60 Å²	60	45 Å²	45	23%	0.226	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	146	178.2	-75.1	176.1	175.5	168.7	1.1	111.2	Y34 W74 N75 M158 D159	Y34-R61 VanDerWaalsContact CE1-CZ 3.49Å; R61-W74 WeakPolarHBondContact O-CA 3.42Å; R61-N75 HydrophobicContact CB-CB 4.16Å; R61-N75 PolarHBondContact N-O 2.63Å; R61-N75 PolarHBondContact O-N 2.83Å; R61-M158 CarbonylContact C-O 3.58Å; R61-M158 WeakPolarHBondContact CA-O 3.35Å; R61-D159 HydrophobicContact CG-CB 4.38Å; R61-D159 VanDerWaalsContact CG-OD1 3.24Å; R61-D159 WeakPolarHBondContact CG-OD1 3.21Å; R61-D159 IonicContact CZ-OD1 3.33Å; R61-D159 IonicContact CZ-OD2 3.55Å; R61-D159 IonicContact NE-OD1 3.62Å; R61-D159 PolarHBondContact NE-OD1 3.13Å; R61-D159 IonicContact NE-OD2 2.76Å; R61-D159 IonicContact NH2-OD1 3.64Å; R61-D159 IonicContact NH2-OD2 2.66Å
62	S	97.3	Very high	96.2	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.007	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	149.4	166.8	68.4	0	0	0	0	113.5	R72 Q73 D157 M158	S62-R72 WeakPolarHBondContact OG-CD 3.42Å; S62-R72 PolarHBondContact OG-NH1 2.88Å; S62-Q73 CarbonylContact C-O 3.42Å; S62-Q73 WeakPolarHBondContact CA-O 3.44Å; S62-Q73 WeakPolarHBondContact CB-O 3.3Å; S62-D157 CarbonylContact O-C 3.51Å; S62-D157 WeakPolarHBondContact O-CA 3.16Å; S62-M158 PolarHBondContact N-O 2.7Å; S62-M158 PolarHBondContact O-N 3.24Å; S62-M158 VanDerWaalsContact OG-CB 3.24Å; S62-M158 WeakPolarHBondContact OG-CB 3.38Å
63	I	96.9	Very high	96.2	Very high	51 Å²	51	42.5 Å²	42.5	26%	0.262	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	139.9	165.3	54.3	171.3	0	0	0	109.9	W39 R72 Q73 D157	W39-I63 HydrophobicContact CD2-CD1 4.34Å; W39-I63 HydrophobicContact CD2-CG1 4.37Å; W39-I63 HydrophobicContact CE3-CG1 4.36Å; W39-I63 HydrophobicContact CH2-CB 4.12Å; W39-I63 HydrophobicContact CH2-CD1 4.18Å; W39-I63 HydrophobicContact CH2-CG1 3.72Å; W39-I63 HydrophobicContact CH2-CG2 3.57Å; W39-I63 HydrophobicContact CZ2-CB 4.29Å; W39-I63 HydrophobicContact CZ2-CD1 3.58Å; W39-I63 HydrophobicContact CZ2-CG1 3.66Å; W39-I63 HydrophobicContact CZ2-CG2 3.72Å; W39-I63 HydrophobicContact CZ3-CG1 4.06Å; I63-R72 VanDerWaalsContact O-CA 3.24Å; I63-R72 WeakPolarHBondContact O-CA 3.23Å; I63-Q73 HydrophobicContact CD1-CB 4.33Å; I63-Q73 HydrophobicContact CG1-CB 3.86Å; I63-Q73 HydrophobicContact CG1-CG 4.41Å; I63-Q73 PolarHBondContact N-O 3.32Å; I63-Q73 VanDerWaalsContact N-O 3.12Å; I63-Q73 PolarHBondContact O-N 3.2Å; I63-Q73 VanDerWaalsContact O-N 3.1Å; I63-D157 VanDerWaalsContact CA-OD1 3.25Å; I63-D157 WeakPolarHBondContact CA-OD1 3.41Å; I63-D157 HydrophobicContact CG2-CB 4.44Å
64	F	97.3	Very high	96.3	Very high	30 Å²	30	36 Å²	36	13%	0.132	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	139.4	-179.6	178.9	-99.9	0	0	0	112.6	K66 R72 G155 D157 D182	F64-K66 HydrophobicContact CE1-CB 3.75Å; F64-K66 HydrophobicContact CE1-CD 4.44Å; F64-K66 HydrophobicContact CE1-CG 4.23Å; F64-K66 HydrophobicContact CZ-CB 4.32Å; F64-K66 HydrophobicContact CZ-CG 4.49Å; F64-R72 HydrophobicContact CB-CG 4.22Å; F64-R72 HydrophobicContact CD2-CG 3.91Å; F64-G155 VanDerWaalsContact CD1-CA 3.42Å; F64-D157 PolarHBondContact N-OD1 2.89Å; F64-D182 HydrophobicContact CD2-CB 4.29Å; F64-D182 HydrophobicContact CE2-CB 3.69Å; F64-D182 HydrophobicContact CZ-CB 4.12Å
65	N	96.4	Very high	96.4	Very high	53 Å²	53	36.8 Å²	36.8	28%	0.283	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	101.4	176.8	-167.1	-28.5	0	0	0	112.8	K67 E68 S70 D71	N65-K67 VanDerWaalsContact C-N 3.27Å; N65-K67 PolarHBondContact O-N 2.86Å; N65-K67 WeakPolarHBondContact OD1-CB 3.31Å; N65-K67 PolarHBondContact OD1-N 2.88Å; N65-E68 HydrophobicContact CB-CB 4.19Å; N65-E68 HydrophobicContact CB-CG 4.44Å; N65-E68 VanDerWaalsContact ND2-CG 3.31Å; N65-E68 WeakPolarHBondContact ND2-CG 3.31Å; N65-E68 PolarHBondContact O-N 3Å; N65-E68 PolarHBondContact OD1-N 3.41Å; N65-E68 VanDerWaalsContact OD1-N 3.12Å; N65-S70 WeakPolarHBondContact O-CA 3.45Å; N65-S70 PolarHBondContact O-N 2.97Å; N65-D71 PolarHBondContact N-O 2.91Å; N65-D71 PolarHBondContact O-N 2.84Å
66	K	95.9	Very high	96.4	Very high	118 Å²	118	34.7 Å²	34.7	51%	0.513	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-28.7	176.6	-155.1	158.3	-170.6	164.1	0	113.8	F64 S70 E180	F64-K66 HydrophobicContact CE1-CB 3.75Å; F64-K66 HydrophobicContact CE1-CD 4.44Å; F64-K66 HydrophobicContact CE1-CG 4.23Å; F64-K66 HydrophobicContact CZ-CB 4.32Å; F64-K66 HydrophobicContact CZ-CG 4.49Å; K66-S70 PolarHBondContact O-N 2.91Å; K66-E180 IonicContact NZ-OE2 2.62Å; K66-E180 PolarHBondContact NZ-OE2 3.12Å
67	K	95.4	Very high	96.3	Very high	187 Å²	187	35.5 Å²	35.5	81%	0.813	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-35.7	-178.9	-64.3	179.2	-178.9	174.1	0	111.9	N65 G69	N65-K67 VanDerWaalsContact C-N 3.27Å; N65-K67 PolarHBondContact O-N 2.86Å; N65-K67 WeakPolarHBondContact OD1-CB 3.31Å; N65-K67 PolarHBondContact OD1-N 2.88Å; K67-G69 PolarHBondContact O-N 3.07Å; K67-G69 VanDerWaalsContact O-N 3.12Å
68	E	93.8	Very high	96.2	Very high	96 Å²	96	36.8 Å²	36.8	45%	0.449	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	25.8	-177.8	-62.1	-57.1	146.6	0	0	113.6	N43 R44 N65	N43-E68 HydrophobicContact CB-CB 3.58Å; N43-E68 HydrophobicContact CB-CG 4.37Å; R44-E68 WeakPolarHBondContact CG-O 3Å; R44-E68 PolarHBondContact NE-O 3.45Å; N65-E68 HydrophobicContact CB-CB 4.19Å; N65-E68 HydrophobicContact CB-CG 4.44Å; N65-E68 VanDerWaalsContact ND2-CG 3.31Å; N65-E68 WeakPolarHBondContact ND2-CG 3.31Å; N65-E68 PolarHBondContact O-N 3Å; N65-E68 PolarHBondContact OD1-N 3.41Å; N65-E68 VanDerWaalsContact OD1-N 3.12Å
69	G	93.7	Very high	96.1	Very high	8 Å²	8	38.1 Å²	38.1	8%	0.082	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.3	23.9	177.6	0	0	0	0	0	115.1	R44 K67 Y120	R44-G69 VanDerWaalsContact NH2-CA 3.25Å; K67-G69 PolarHBondContact O-N 3.07Å; K67-G69 VanDerWaalsContact O-N 3.12Å; G69-Y120 PolarHBondContact O-OH 2.8Å
70	S	96.8	Very high	96	Very high	14 Å²	14	42.1 Å²	42.1	10%	0.098	21%	0.21	C	C	.	.	S	Bend	trans	50	59.8	-171.2	-64.8	0	0	0	0	111.4	N65 K66 R181	N65-S70 WeakPolarHBondContact O-CA 3.45Å; N65-S70 PolarHBondContact O-N 2.97Å; K66-S70 PolarHBondContact O-N 2.91Å; S70-R181 VanDerWaalsContact CB-CB 3.43Å; S70-R181 VanDerWaalsContact CB-O 3.25Å; S70-R181 WeakPolarHBondContact CB-O 3.41Å; S70-R181 VanDerWaalsContact O-O 3.09Å
71	D	97.6	Very high	95.8	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	164.5	-173	-169.8	35.8	0	0	0	111.8	N43 R44 N65 Y120 R127	N43-D71 WeakPolarHBondContact CA-OD2 3.25Å; R44-D71 PolarHBondContact N-OD2 3.17Å; N65-D71 PolarHBondContact N-O 2.91Å; N65-D71 PolarHBondContact O-N 2.84Å; D71-Y120 HydrophobicContact CB-CD2 4.23Å; D71-Y120 HydrophobicContact CB-CE2 3.87Å; D71-R127 IonicContact OD1-CZ 3.8Å; D71-R127 IonicContact OD1-NE 2.72Å; D71-R127 PolarHBondContact OD1-NE 2.8Å; D71-R127 IonicContact OD1-NH2 3.6Å; D71-R127 PolarHBondContact OD1-NH2 3.39Å; D71-R127 IonicContact OD2-CZ 2.75Å; D71-R127 IonicContact OD2-NE 3.41Å; D71-R127 IonicContact OD2-NH2 3.98Å; D71-R127 PolarHBondContact OD2-NH2 2.83Å
72	R	97.3	Very high	95.6	Very high	6 Å²	6	42.6 Å²	42.6	2%	0.023	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	137.3	179	-72.5	178.8	177.1	-81.9	-10.2	112	N41 S62 I63 F64 W74 R127 E156 D182	N41-R72 PolarHBondContact ND2-O 3.3Å; N41-R72 VanDerWaalsContact ND2-O 3.13Å; S62-R72 WeakPolarHBondContact OG-CD 3.42Å; S62-R72 PolarHBondContact OG-NH1 2.88Å; I63-R72 VanDerWaalsContact O-CA 3.24Å; I63-R72 WeakPolarHBondContact O-CA 3.23Å; F64-R72 HydrophobicContact CB-CG 4.22Å; F64-R72 HydrophobicContact CD2-CG 3.91Å; R72-W74 HydrophobicContact CB-CZ2 3.6Å; R72-W74 VanDerWaalsContact CB-NE1 3.28Å; R72-W74 VanDerWaalsContact CD-CZ2 3.45Å; R72-W74 HydrophobicContact CG-CZ2 4.13Å; R72-W74 PolarHBondContact O-NE1 2.94Å; R72-W74 VanDerWaalsContact O-NE1 3.13Å; R72-R127 PolarHBondContact O-NH2 2.86Å; R72-E156 PolarHBondContact NH1-O 3.23Å; R72-E156 PolarHBondContact NH2-O 2.82Å; R72-D182 IonicContact CZ-OD1 3.36Å; R72-D182 IonicContact CZ-OD2 3.73Å; R72-D182 IonicContact NE-OD1 2.73Å; R72-D182 PolarHBondContact NE-OD1 2.78Å; R72-D182 IonicContact NE-OD2 3.87Å; R72-D182 VanDerWaalsContact NH2-CG 3.31Å; R72-D182 IonicContact NH2-OD1 3.15Å; R72-D182 PolarHBondContact NH2-OD1 3.47Å; R72-D182 VanDerWaalsContact NH2-OD1 3.15Å; R72-D182 IonicContact NH2-OD2 2.75Å; R72-D182 PolarHBondContact NH2-OD2 2.75Å
73	Q	97	Very high	95.2	Very high	30 Å²	30	51.7 Å²	51.7	14%	0.14	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	140.9	160.8	-57.2	-172.3	-113.5	0	0	108.7	W39 N41 N43 S62 I63	W39-Q73 HydrophobicContact CB-CB 4.18Å; W39-Q73 HydrophobicContact CD2-CB 3.77Å; W39-Q73 VanDerWaalsContact CE3-C 3.48Å; W39-Q73 HydrophobicContact CE3-CB 3.66Å; W39-Q73 HydrophobicContact CG-CB 3.99Å; W39-Q73 HydrophobicContact CZ3-CB 4.44Å; W39-Q73 WeakPolarHBondContact CZ3-O 3.29Å; N41-Q73 PolarHBondContact O-NE2 2.77Å; N43-Q73 WeakPolarHBondContact OD1-CG 3.41Å; S62-Q73 CarbonylContact C-O 3.42Å; S62-Q73 WeakPolarHBondContact CA-O 3.44Å; S62-Q73 WeakPolarHBondContact CB-O 3.3Å; I63-Q73 HydrophobicContact CD1-CB 4.33Å; I63-Q73 HydrophobicContact CG1-CB 3.86Å; I63-Q73 HydrophobicContact CG1-CG 4.41Å; I63-Q73 PolarHBondContact N-O 3.32Å; I63-Q73 VanDerWaalsContact N-O 3.12Å; I63-Q73 PolarHBondContact O-N 3.2Å; I63-Q73 VanDerWaalsContact O-N 3.1Å
74	W	97.6	Very high	94.8	Very high	3 Å²	3	52.9 Å²	52.9	1%	0.011	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	147.6	-170.5	-62.4	83.2	0	0	0	112.3	W39 V40 N41 F47 V60 R61 R72 Y76 W129 M158 W185	W39-W74 CarbonylContact C-O 3.37Å; W39-W74 WeakPolarHBondContact CA-O 3.03Å; V40-W74 HydrophobicContact CG2-CB 4.06Å; V40-W74 WeakPolarHBondContact CG2-O 3.06Å; V40-W74 PolarHBondContact N-O 2.79Å; N41-W74 PolarHBondContact OD1-N 2.72Å; F47-W74 HydrophobicContact CE1-CB 4.06Å; F47-W74 AromaticContact CE1-CD1 3.58Å; F47-W74 AromaticContact CE1-CG 3.9Å; F47-W74 HydrophobicContact CE1-CG 3.9Å; F47-W74 HydrophobicContact CZ-CB 3.93Å; F47-W74 AromaticContact CZ-CG 3.89Å; F47-W74 HydrophobicContact CZ-CG 3.89Å; V60-W74 HydrophobicContact CG1-CE3 3.86Å; V60-W74 HydrophobicContact CG1-CZ3 3.84Å; R61-W74 WeakPolarHBondContact O-CA 3.42Å; R72-W74 HydrophobicContact CB-CZ2 3.6Å; R72-W74 VanDerWaalsContact CB-NE1 3.28Å; R72-W74 VanDerWaalsContact CD-CZ2 3.45Å; R72-W74 HydrophobicContact CG-CZ2 4.13Å; R72-W74 PolarHBondContact O-NE1 2.94Å; R72-W74 VanDerWaalsContact O-NE1 3.13Å; W74-Y76 HydrophobicContact CB-CE2 3.82Å; W74-W129 AromaticContact CD2-CH2 3.76Å; W74-W129 HydrophobicContact CD2-CH2 3.76Å; W74-W129 AromaticContact CE2-CH2 3.36Å; W74-W129 AromaticContact CE2-CZ2 3.78Å; W74-W129 HydrophobicContact CE3-CH2 4.22Å; W74-W129 HydrophobicContact CG-CH2 4.3Å; W74-W129 HydrophobicContact CH2-CH2 4.03Å; W74-W129 HydrophobicContact CH2-CZ2 4.15Å; W74-W129 AromaticContact CZ2-CH2 3.52Å; W74-W129 HydrophobicContact CZ2-CH2 3.52Å; W74-W129 AromaticContact CZ2-CZ2 3.53Å; W74-W129 HydrophobicContact CZ2-CZ2 3.53Å; W74-W129 HydrophobicContact CZ3-CH2 4.34Å; W74-W129 AromaticContact NE1-CH2 3.63Å; W74-M158 HydrophobicContact CH2-CE 4.46Å; W74-M158 HydrophobicContact CZ3-CE 3.71Å; W74-M158 HydrophobicContact CZ3-SD 4.47Å; W74-W185 AromaticContact CH2-CE2 3.92Å; W74-W185 HydrophobicContact CH2-CZ2 4.09Å; W74-W185 AromaticContact CH2-NE1 3.61Å
75	N	95.9	Very high	94.4	Very high	27 Å²	27	51.9 Å²	51.9	14%	0.144	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	148.9	171.7	173.1	-94.2	0	0	0	108.5	D37 W39 R61	D37-N75 PolarHBondContact O-ND2 3.29Å; W39-N75 HydrophobicContact CE3-CB 4.01Å; W39-N75 HydrophobicContact CZ3-CB 3.95Å; R61-N75 HydrophobicContact CB-CB 4.16Å; R61-N75 PolarHBondContact N-O 2.63Å; R61-N75 PolarHBondContact O-N 2.83Å
76	Y	96.1	Very high	94.1	Very high	9 Å²	9	51 Å²	51	4%	0.035	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	144.7	-172.2	-62.9	-84.8	0	0	0	109.1	V40 F47 Y49 V57 A59 V60 W74 F116	V40-Y76 HydrophobicContact CG1-CD2 4.23Å; V40-Y76 HydrophobicContact CG2-CD2 4.19Å; V40-Y76 HydrophobicContact CG2-CE2 3.97Å; F47-Y76 AromaticContact CE2-CE2 3.65Å; F47-Y76 HydrophobicContact CE2-CE2 3.65Å; F47-Y76 AromaticContact CZ-CE2 3.96Å; F47-Y76 HydrophobicContact CZ-CE2 3.96Å; F47-Y76 WeakPolarHBondContact CZ-OH 3.14Å; Y49-Y76 AromaticContact CD1-CD2 3.91Å; Y49-Y76 HydrophobicContact CD1-CD2 3.91Å; Y49-Y76 AromaticContact CD1-CG 3.92Å; Y49-Y76 HydrophobicContact CD1-CG 3.92Å; Y49-Y76 HydrophobicContact CD2-CD2 4.37Å; Y49-Y76 HydrophobicContact CE1-CD2 4.39Å; Y49-Y76 HydrophobicContact CE1-CG 4.06Å; Y49-Y76 AromaticContact CG-CD2 3.89Å; Y49-Y76 HydrophobicContact CG-CD2 3.89Å; Y49-Y76 HydrophobicContact CG-CG 4.36Å; Y49-Y76 PolarHBondContact OH-O 2.03Å; V57-Y76 HydrophobicContact CG1-CD1 4.19Å; A59-Y76 WeakPolarHBondContact O-CA 3.44Å; V60-Y76 HydrophobicContact CB-CD1 4.33Å; V60-Y76 HydrophobicContact CB-CE1 4.28Å; V60-Y76 HydrophobicContact CG1-CD1 3.98Å; V60-Y76 HydrophobicContact CG1-CE1 3.52Å; V60-Y76 HydrophobicContact CG2-CD1 3.99Å; V60-Y76 HydrophobicContact CG2-CE1 4.01Å; W74-Y76 HydrophobicContact CB-CE2 3.82Å; Y76-F116 AromaticContact CD1-CD2 3.76Å; Y76-F116 HydrophobicContact CD1-CD2 3.76Å; Y76-F116 AromaticContact CD1-CE2 3.97Å; Y76-F116 HydrophobicContact CD1-CE2 3.97Å; Y76-F116 HydrophobicContact CD1-CG 4.28Å; Y76-F116 HydrophobicContact CE1-CB 3.94Å; Y76-F116 AromaticContact CE1-CD1 3.74Å; Y76-F116 HydrophobicContact CE1-CD1 3.74Å; Y76-F116 AromaticContact CE1-CD2 3.28Å; Y76-F116 HydrophobicContact CE1-CD2 3.28Å; Y76-F116 AromaticContact CE1-CE1 3.96Å; Y76-F116 HydrophobicContact CE1-CE1 3.96Å; Y76-F116 AromaticContact CE1-CE2 3.58Å; Y76-F116 HydrophobicContact CE1-CE2 3.58Å; Y76-F116 AromaticContact CE1-CG 3.39Å; Y76-F116 HydrophobicContact CE1-CG 3.39Å; Y76-F116 AromaticContact CE1-CZ 3.9Å; Y76-F116 HydrophobicContact CE1-CZ 3.9Å; Y76-F116 HydrophobicContact CE2-CB 4.23Å; Y76-F116 AromaticContact CZ-CD1 3.9Å; Y76-F116 AromaticContact CZ-CD2 3.94Å; Y76-F116 AromaticContact CZ-CG 3.58Å; Y76-F116 WeakPolarHBondContact OH-CB 3.44Å; Y76-F116 WeakPolarHBondContact OH-CD1 3.14Å; Y76-F116 WeakPolarHBondContact OH-CG 3.26Å
77	A	94.6	Very high	93.9	Very high	21 Å²	21	51.2 Å²	51.2	17%	0.174	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	141.5	169.3	0	0	0	0	0	111	Y34 V58 A59	Y34-A77 HydrophobicContact CD1-CB 4.47Å; Y34-A77 HydrophobicContact CE1-CB 3.62Å; V58-A77 HydrophobicContact CG2-CB 4.34Å; V58-A77 WeakPolarHBondContact CG2-O 3.37Å; V58-A77 PolarHBondContact N-O 3.24Å; A59-A77 HydrophobicContact CB-CB 4.09Å; A59-A77 PolarHBondContact N-O 2.97Å; A59-A77 PolarHBondContact O-N 2.83Å
78	C	95.6	Very high	93.8	Very high	29 Å²	29	42.9 Å²	42.9	20%	0.196	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	151.3	178.7	-60.4	0	0	0	0	110.7	Y49 C51 Q55 V56	Y49-C78 PolarHBondContact OH-SG 3.27Å; C51-C78 WeakPolarHBondContact CA-SG 3.41Å; C51-C78 HydrophobicContact CB-CB 3.7Å; C51-C78 WeakPolarHBondContact CB-SG 3.04Å; C51-C78 WeakPolarHBondContact SG-CB 3Å; C51-C78 CovalentContact SG-SG 2.03Å; C51-C78 PolarHBondContact SG-SG 3.15Å; Q55-C78 HydrophobicContact CB-CB 4.2Å; Q55-C78 VanDerWaalsContact OE1-CB 3.29Å; V56-C78 VanDerWaalsContact O-CA 3.3Å; V56-C78 WeakPolarHBondContact O-CA 3.44Å
79	M	94.1	Very high	93.8	Very high	52 Å²	52	41.7 Å²	41.7	26%	0.256	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	140.2	171.9	-167.1	179	-66.2	0	0	109.7	Q55 V56 V58 T81 Y165	Q55-M79 VanDerWaalsContact CA-O 3.23Å; Q55-M79 WeakPolarHBondContact CA-O 3.41Å; Q55-M79 WeakPolarHBondContact CB-O 3.3Å; V56-M79 PolarHBondContact N-O 2.83Å; V56-M79 PolarHBondContact O-N 2.82Å; V58-M79 HydrophobicContact CB-CB 4.36Å; V58-M79 HydrophobicContact CG1-CB 3.51Å; V58-M79 HydrophobicContact CG1-CE 4.39Å; V58-M79 HydrophobicContact CG1-SD 4.48Å; V58-M79 HydrophobicContact CG2-CB 3.93Å; V58-M79 HydrophobicContact CG2-CE 4.28Å; M79-T81 PolarHBondContact O-N 2.57Å; M79-Y165 HydrophobicContact CE-CD1 4.21Å; M79-Y165 HydrophobicContact CE-CE1 3.73Å; M79-Y165 HydrophobicContact SD-CD1 3.67Å; M79-Y165 HydrophobicContact SD-CE1 3.69Å
80	P	94.4	Very high	93.8	Very high	84 Å²	84	45.5 Å²	45.5	55%	0.545	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	134.4	170.2	25.8	-34.9	0	0	0	111.4	G54 Q55	G54-P80 WeakPolarHBondContact O-CA 3.07Å; Q55-P80 HydrophobicContact CG-CB 4.26Å
81	T	92.7	Very high	93.8	Very high	18 Å²	18	47 Å²	47	11%	0.11	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-67.6	147.7	169.9	47.3	0	0	0	0	110.6	G54 V56 M79 L85 Y136 Y168	G54-T81 PolarHBondContact O-N 2.82Å; G54-T81 PolarHBondContact O-OG1 2.95Å; G54-T81 VanDerWaalsContact O-OG1 3.07Å; V56-T81 HydrophobicContact CB-CG2 4.46Å; V56-T81 HydrophobicContact CG1-CG2 3.85Å; V56-T81 HydrophobicContact CG2-CG2 3.78Å; M79-T81 PolarHBondContact O-N 2.57Å; T81-L85 HydrophobicContact CG2-CD1 4.11Å; T81-Y136 HydrophobicContact CG2-CE1 4.04Å; T81-Y136 HydrophobicContact CG2-CE2 4.15Å; T81-Y136 WeakPolarHBondContact CG2-OH 3.49Å; T81-Y136 VanDerWaalsContact OG1-CE1 3.25Å; T81-Y136 WeakPolarHBondContact OG1-CE1 3.5Å; T81-Y136 PolarHBondContact OG1-OH 3.14Å; T81-Y168 HydrophobicContact CG2-CE1 4.23Å
82	P	91.6	Very high	93.8	Very high	54 Å²	54	48.9 Å²	48.9	35%	0.351	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-64.8	147.9	178.1	28.1	-34.9	0	0	0	110.9	S84 L85 Y168	P82-S84 PolarHBondContact O-N 3.13Å; P82-L85 HydrophobicContact CG-CD1 4.47Å; P82-L85 HydrophobicContact CG-CG 4.23Å; P82-L85 PolarHBondContact O-N 3.43Å; P82-Y168 WeakPolarHBondContact CD-OH 3.07Å; P82-Y168 VanDerWaalsContact CG-OH 3.26Å; P82-Y168 WeakPolarHBondContact CG-OH 3.19Å
83	Q	89	Confident	93.9	Very high	192 Å²	192	52 Å²	52	90%	0.897	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-54.4	-23.7	-179.1	-66.1	179.7	-6.8	0	0	113.6	L85 G86	Q83-L85 VanDerWaalsContact C-N 3.27Å; Q83-L85 PolarHBondContact O-N 2.82Å; Q83-G86 PolarHBondContact O-N 2.88Å; Q83-G86 VanDerWaalsContact O-N 3.12Å
84	S	88	Confident	93.9	Very high	75 Å²	75	51.5 Å²	51.5	52%	0.524	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-62.5	-26.9	175	51	0	0	0	0	113.9	P82 G86 R139	P82-S84 PolarHBondContact O-N 3.13Å; S84-G86 VanDerWaalsContact C-N 3.34Å; S84-R139 PolarHBondContact O-NE 2.86Å; S84-R139 PolarHBondContact O-NH2 2.85Å
85	L	89.9	Confident	93.8	Very high	9 Å²	9	58.9 Å²	58.9	5%	0.047	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-77.8	-21.8	174.1	-62.4	-173	0	0	0	112.7	T81 P82 Q83 Y136 R139 Y168 M192	T81-L85 HydrophobicContact CG2-CD1 4.11Å; P82-L85 HydrophobicContact CG-CD1 4.47Å; P82-L85 HydrophobicContact CG-CG 4.23Å; P82-L85 PolarHBondContact O-N 3.43Å; Q83-L85 VanDerWaalsContact C-N 3.27Å; Q83-L85 PolarHBondContact O-N 2.82Å; L85-Y136 HydrophobicContact CB-CD1 3.92Å; L85-Y136 HydrophobicContact CB-CG 4.3Å; L85-R139 HydrophobicContact CB-CG 4.46Å; L85-R139 HydrophobicContact CD2-CB 4.47Å; L85-R139 HydrophobicContact CD2-CG 4.09Å; L85-R139 PolarHBondContact O-NE 2.8Å; L85-Y168 HydrophobicContact CD1-CE1 4.17Å; L85-Y168 HydrophobicContact CD1-CE2 4.25Å; L85-M192 HydrophobicContact CD1-CB 4.27Å; L85-M192 HydrophobicContact CD1-CG 4.35Å; L85-M192 HydrophobicContact CD2-CB 3.59Å; L85-M192 HydrophobicContact CD2-CG 4.48Å
86	G	89.1	Confident	93.9	Very high	34 Å²	34	60.8 Å²	60.8	35%	0.351	33%	0.329	S	S	.	.			trans	77.5	-166.5	-170.8	0	0	0	0	0	112.5	Q83 S84 Y136	Q83-G86 PolarHBondContact O-N 2.88Å; Q83-G86 VanDerWaalsContact O-N 3.12Å; S84-G86 VanDerWaalsContact C-N 3.34Å; G86-Y136 VanDerWaalsContact O-CD1 3.31Å; G86-Y136 WeakPolarHBondContact O-CD1 3.3Å; G86-Y136 WeakPolarHBondContact O-CE1 3.38Å
87	E	91.5	Very high	93.9	Very high	124 Å²	124	60.9 Å²	60.9	58%	0.579	33%	0.33	S	S	*	.			trans	-81.8	150.8	175.4	-66.7	-60.4	135.9	0	0	111.7	H53 T89	H53-E87 IonicContact CE1-OE2 2.96Å; H53-E87 PolarHBondContact CE1-OE2 3.16Å; H53-E87 IonicContact ND1-OE2 3.09Å; H53-E87 PolarHBondContact ND1-OE2 2.89Å; E87-T89 PolarHBondContact O-N 2.03Å
88	P	94.2	Very high	93.9	Very high	12 Å²	12	69.4 Å²	69.4	8%	0.078	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	135	168.5	29	-33.4	0	0	0	109.7	C134 Y136	P88-C134 HydrophobicContact CB-CB 4Å; P88-Y136 HydrophobicContact CB-CD1 4.5Å; P88-Y136 HydrophobicContact CB-CE1 4.09Å; P88-Y136 HydrophobicContact CB-CE2 4.33Å; P88-Y136 HydrophobicContact CG-CE1 4.33Å
89	T	92.7	Very high	94	Very high	71 Å²	71	68.7 Å²	68.7	44%	0.436	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	-20.9	-172.8	55.5	0	0	0	0	114.3	E87 R135 S137	E87-T89 PolarHBondContact O-N 2.03Å; T89-R135 PolarHBondContact N-O 3.19Å; T89-R135 PolarHBondContact OG1-O 2.99Å; T89-S137 VanDerWaalsContact CG2-OG 3.29Å; T89-S137 WeakPolarHBondContact CG2-OG 3.37Å; T89-S137 WeakPolarHBondContact OG1-CB 3.27Å; T89-S137 PolarHBondContact OG1-N 3.47Å
90	E	94.6	Very high	94.1	Very high	88 Å²	88	67.4 Å²	67.4	41%	0.411	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	137.7	177.8	-169.6	174.6	-169.8	0	0	107.1	W92 C134 R135	E90-W92 HydrophobicContact CB-CE3 4.43Å; E90-W92 HydrophobicContact CB-CZ3 4.32Å; E90-W92 HydrophobicContact CG-CE3 4.01Å; E90-W92 HydrophobicContact CG-CZ3 4.33Å; E90-C134 CarbonylContact O-C 3.57Å; E90-C134 WeakPolarHBondContact O-CA 3.22Å; E90-R135 PolarHBondContact O-N 2.98Å; E90-R135 IonicContact OE2-CZ 3.96Å; E90-R135 IonicContact OE2-NH1 2.68Å; E90-R135 PolarHBondContact OE2-NH1 3Å; E90-R135 IonicContact OE2-NH2 3.53Å; E90-R135 PolarHBondContact OE2-NH2 2.67Å
91	C	97.2	Very high	94.2	Very high	44 Å²	44	69.1 Å²	69.1	30%	0.297	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	142.9	171.7	-56.4	0	0	0	0	109.9	Y132 C133 C134	C91-Y132 HydrophobicContact CB-CE1 4.1Å; C91-Y132 HydrophobicContact CB-CE2 3.93Å; C91-Y132 VanDerWaalsContact CB-CZ 3.49Å; C91-Y132 WeakPolarHBondContact CB-OH 3.4Å; C91-C133 CarbonylContact C-O 3.48Å; C91-C133 WeakPolarHBondContact CA-O 3.43Å; C91-C133 WeakPolarHBondContact CB-O 3.32Å; C91-C134 HydrophobicContact CB-CB 4.13Å; C91-C134 WeakPolarHBondContact CB-SG 3.44Å; C91-C134 WeakPolarHBondContact SG-CB 3.08Å; C91-C134 CovalentContact SG-SG 2.04Å; C91-C134 PolarHBondContact SG-SG 2.97Å
92	W	97.7	Very high	94.3	Very high	44 Å²	44	75.2 Å²	75.2	17%	0.167	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	169	-175.2	65.3	94.9	0	0	0	110.8	E90 E94 S108 N109 Y132 C133 R135	E90-W92 HydrophobicContact CB-CE3 4.43Å; E90-W92 HydrophobicContact CB-CZ3 4.32Å; E90-W92 HydrophobicContact CG-CE3 4.01Å; E90-W92 HydrophobicContact CG-CZ3 4.33Å; W92-E94 PolarHBondContact NE1-OE1 2.95Å; W92-S108 VanDerWaalsContact CZ2-O 3.27Å; W92-S108 WeakPolarHBondContact CZ2-O 3.43Å; W92-S108 WeakPolarHBondContact CZ2-OG 3.2Å; W92-S108 PolarHBondContact NE1-OG 3.4Å; W92-N109 HydrophobicContact CH2-CB 3.84Å; W92-N109 HydrophobicContact CZ2-CB 4.07Å; W92-Y132 VanDerWaalsContact O-CD2 3.3Å; W92-Y132 WeakPolarHBondContact O-CD2 3.47Å; W92-C133 HydrophobicContact CD2-CB 4.37Å; W92-C133 HydrophobicContact CH2-CB 4.45Å; W92-C133 HydrophobicContact CZ2-CB 3.86Å; W92-C133 PolarHBondContact N-O 3.2Å; W92-C133 PolarHBondContact O-N 2.89Å; W92-R135 HydrophobicContact CH2-CB 3.85Å; W92-R135 HydrophobicContact CZ3-CB 3.69Å
93	W	98.1	Very high	94.5	Very high	73 Å²	73	73.5 Å²	73.5	28%	0.277	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	132.8	169.8	-69	94.7	0	0	0	109.9	S48 Q50 Q117 Q130 F131 Y132	S48-W93 WeakPolarHBondContact OG-CH2 3.22Å; S48-W93 VanDerWaalsContact OG-CZ2 3.31Å; S48-W93 WeakPolarHBondContact OG-CZ2 3.41Å; Q50-W93 HydrophobicContact CG-CH2 4.17Å; Q50-W93 HydrophobicContact CG-CZ2 3.86Å; W93-Q117 HydrophobicContact CE3-CB 3.98Å; W93-Q117 HydrophobicContact CH2-CB 3.58Å; W93-Q117 HydrophobicContact CZ2-CB 4.47Å; W93-Q117 HydrophobicContact CZ3-CB 3.29Å; W93-Q130 HydrophobicContact CB-CG 4.43Å; W93-Q130 HydrophobicContact CE3-CB 4.46Å; W93-Q130 HydrophobicContact CE3-CG 4.1Å; W93-F131 WeakPolarHBondContact CA-O 3.47Å; W93-F131 VanDerWaalsContact CE3-C 3.49Å; W93-Y132 AromaticContact CD1-CD2 3.98Å; W93-Y132 AromaticContact CD2-CD2 3.87Å; W93-Y132 HydrophobicContact CD2-CD2 3.87Å; W93-Y132 HydrophobicContact CD2-CG 4.43Å; W93-Y132 AromaticContact CE2-CD2 3.62Å; W93-Y132 HydrophobicContact CE3-CD2 4.46Å; W93-Y132 HydrophobicContact CG-CD2 4.11Å; W93-Y132 HydrophobicContact CH2-CG 4.37Å; W93-Y132 HydrophobicContact CZ2-CD2 4.04Å; W93-Y132 HydrophobicContact CZ2-CG 4.17Å; W93-Y132 AromaticContact NE1-CD2 3.67Å
94	E	97.6	Very high	94.9	Very high	18 Å²	18	70.3 Å²	70.3	8%	0.084	35%	0.35	C	S	.	.			trans	-67.6	179.9	171.2	-74.3	-65	150.1	0	0	111.7	W92 Q105 S108 Q130 F131 C133	W92-E94 PolarHBondContact NE1-OE1 2.95Å; E94-Q105 HydrophobicContact CB-CG 4.27Å; E94-Q105 HydrophobicContact CG-CG 4.39Å; E94-Q105 PolarHBondContact OE2-NE2 3.03Å; E94-S108 WeakPolarHBondContact OE1-CB 2.98Å; E94-S108 PolarHBondContact OE1-N 3.02Å; E94-S108 PolarHBondContact OE1-OG 2.75Å; E94-Q130 WeakPolarHBondContact O-CG 3.18Å; E94-Q130 PolarHBondContact O-NE2 2.6Å; E94-F131 HydrophobicContact CB-CB 4.44Å; E94-F131 HydrophobicContact CG-CB 4.33Å; E94-F131 PolarHBondContact N-O 3.05Å; E94-C133 HydrophobicContact CG-CB 4.49Å; E94-C133 WeakPolarHBondContact CG-SG 3.14Å
95	E	96.3	Very high	95.3	Very high	158 Å²	158	68.8 Å²	68.8	74%	0.738	34%	0.335	S	S	*	.			trans	-68.8	145.9	171.3	-66.2	-167.8	173.3	0	0	112
96	I	96.2	Very high	95.6	Very high	68 Å²	68	70.8 Å²	70.8	35%	0.349	34%	0.343	S	S	.	.			trans	-79.2	135.1	173.7	-167.9	171.6	0	0	0	110.2	R119 E128 W129 Q130	I96-R119 HydrophobicContact CD1-CG 4.4Å; I96-E128 HydrophobicContact CD1-CB 3.88Å; I96-E128 HydrophobicContact CG1-CB 4Å; I96-W129 WeakPolarHBondContact CA-O 3.41Å; I96-Q130 HydrophobicContact CB-CB 4.29Å; I96-Q130 HydrophobicContact CB-CG 4.34Å; I96-Q130 HydrophobicContact CG1-CB 4.33Å
97	N	96.1	Very high	96	Very high	11 Å²	11	69.2 Å²	69.2	6%	0.059	33%	0.327	C	S	.	.			trans	-73.7	-178.3	176.9	89	-25.9	0	0	0	112.6	W103 E128 W129	N97-W103 HydrophobicContact CB-CB 3.98Å; N97-W103 HydrophobicContact CB-CD2 3.75Å; N97-W103 HydrophobicContact CB-CG 3.4Å; N97-W103 WeakPolarHBondContact ND2-CB 3.05Å; N97-E128 WeakPolarHBondContact OD1-CA 3.45Å; N97-W129 PolarHBondContact N-O 2.89Å; N97-W129 PolarHBondContact OD1-N 2.98Å
98	R	96.4	Very high	96.1	Very high	200 Å²	200	65.4 Å²	65.4	76%	0.755	31%	0.314	S	S	*	.			trans	-107.2	130.2	168.7	-61.3	-176.6	-175.4	-171.3	1.7	110	M101	R98-M101 HydrophobicContact CB-CG 4.23Å; R98-M101 PolarHBondContact O-N 2.93Å
99	A	96.8	Very high	95.9	Very high	14 Å²	14	67.3 Å²	67.3	12%	0.116	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	151.1	172.3	0	0	0	0	0	111.9	M101 F121 V124 D126 E128	A99-M101 PolarHBondContact O-N 2.85Å; A99-F121 HydrophobicContact CB-CB 3.64Å; A99-F121 HydrophobicContact CB-CD1 3.8Å; A99-F121 HydrophobicContact CB-CG 4.05Å; A99-V124 HydrophobicContact CB-CG2 3.76Å; A99-D126 HydrophobicContact CB-CB 4.17Å; A99-E128 HydrophobicContact CB-CG 3.76Å
100	G	96.2	Very high	95.9	Very high	25 Å²	25	64.5 Å²	64.5	26%	0.258	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	-4.6	-177.3	0	0	0	0	0	115	D126 F176	G100-D126 PolarHBondContact N-OD2 3.23Å; G100-F176 WeakPolarHBondContact O-CD1 3.42Å
101	M	95.9	Very high	95.9	Very high	119 Å²	119	60.3 Å²	60.3	59%	0.586	29%	0.286	S	S	*	.	S	Bend	trans	-108.8	154.4	-179.1	-59.4	-61.3	-62.5	0	0	111.8	R98 A99 R183	R98-M101 HydrophobicContact CB-CG 4.23Å; R98-M101 PolarHBondContact O-N 2.93Å; A99-M101 PolarHBondContact O-N 2.85Å; M101-R183 VanDerWaalsContact O-CZ 3.3Å; M101-R183 PolarHBondContact O-NH1 3.1Å; M101-R183 PolarHBondContact O-NH2 3.2Å
102	E	95.3	Very high	95.9	Very high	146 Å²	146	58.2 Å²	58.2	68%	0.682	27%	0.272	S	S	*	.			trans	-59.8	145.8	161.4	-60.9	-169.4	155.8	0	0	110	T174	E102-T174 WeakPolarHBondContact CA-O 3.32Å
103	W	95.6	Very high	95.9	Very high	19 Å²	19	56.1 Å²	56.1	7%	0.072	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	126.2	-179.1	172.1	58.6	0	0	0	110.7	N97 Q105 W129 F131 T173 T174 W185	N97-W103 HydrophobicContact CB-CB 3.98Å; N97-W103 HydrophobicContact CB-CD2 3.75Å; N97-W103 HydrophobicContact CB-CG 3.4Å; N97-W103 WeakPolarHBondContact ND2-CB 3.05Å; W103-Q105 HydrophobicContact CD2-CB 4.42Å; W103-Q105 VanDerWaalsContact CE2-CB 3.46Å; W103-Q105 HydrophobicContact CH2-CB 4.36Å; W103-Q105 HydrophobicContact CZ2-CB 3.45Å; W103-Q105 VanDerWaalsContact CZ2-CB 3.45Å; W103-Q105 HydrophobicContact CZ2-CG 3.94Å; W103-W129 HydrophobicContact CD2-CB 4.49Å; W103-W129 HydrophobicContact CE3-CB 3.88Å; W103-W129 HydrophobicContact CE3-CG 4.44Å; W103-W129 HydrophobicContact CH2-CB 3.7Å; W103-W129 HydrophobicContact CZ2-CB 4.31Å; W103-W129 HydrophobicContact CZ3-CB 3.46Å; W103-W129 VanDerWaalsContact CZ3-CB 3.46Å; W103-W129 HydrophobicContact CZ3-CG 4.14Å; W103-F131 HydrophobicContact CH2-CD1 4.36Å; W103-F131 AromaticContact CH2-CD2 3.78Å; W103-F131 HydrophobicContact CH2-CD2 3.78Å; W103-F131 AromaticContact CH2-CE1 3.99Å; W103-F131 HydrophobicContact CH2-CE1 3.99Å; W103-F131 AromaticContact CH2-CE2 3.36Å; W103-F131 HydrophobicContact CH2-CE2 3.36Å; W103-F131 HydrophobicContact CH2-CG 4.25Å; W103-F131 AromaticContact CH2-CZ 3.47Å; W103-F131 HydrophobicContact CH2-CZ 3.47Å; W103-F131 VanDerWaalsContact CH2-CZ 3.47Å; W103-F131 AromaticContact CZ2-CD2 3.99Å; W103-F131 HydrophobicContact CZ2-CD2 3.99Å; W103-F131 AromaticContact CZ2-CE2 3.78Å; W103-F131 HydrophobicContact CZ2-CE2 3.78Å; W103-F131 HydrophobicContact CZ2-CZ 4.34Å; W103-F131 HydrophobicContact CZ3-CE1 4.44Å; W103-F131 HydrophobicContact CZ3-CE2 4.09Å; W103-F131 AromaticContact CZ3-CZ 3.84Å; W103-F131 HydrophobicContact CZ3-CZ 3.84Å; W103-T173 CarbonylContact O-C 3.59Å; W103-T173 VanDerWaalsContact O-CA 3.24Å; W103-T173 WeakPolarHBondContact O-CA 3.39Å; W103-T174 WeakPolarHBondContact CB-OG1 3.3Å; W103-T174 HydrophobicContact CE3-CG2 4.28Å; W103-T174 PolarHBondContact N-O 2.98Å; W103-T174 PolarHBondContact N-OG1 2.79Å; W103-T174 PolarHBondContact O-N 2.84Å; W103-T174 PolarHBondContact O-OG1 2.76Å; W103-W185 HydrophobicContact CE3-CH2 4.4Å; W103-W185 HydrophobicContact CE3-CZ3 4.37Å; W103-W185 AromaticContact CZ3-CH2 3.9Å; W103-W185 HydrophobicContact CZ3-CH2 3.9Å; W103-W185 AromaticContact CZ3-CZ3 3.79Å; W103-W185 HydrophobicContact CZ3-CZ3 3.79Å
104	Y	97	Very high	95.9	Very high	124 Å²	124	52.7 Å²	52.7	49%	0.486	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	125.5	170.8	175	-80.9	0	0	0	107.5	K106 I188	Y104-K106 HydrophobicContact CE1-CG 4.33Å; Y104-K106 WeakPolarHBondContact OH-CD 3.41Å; Y104-K106 WeakPolarHBondContact OH-CE 3.29Å; Y104-I188 HydrophobicContact CE2-CD1 3.89Å
105	Q	96.9	Very high	95.9	Very high	43 Å²	43	51.9 Å²	51.9	20%	0.201	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	138.9	173.8	-175.3	71.4	47.9	0	0	110.2	E94 W103 F131 G171 A172	E94-Q105 HydrophobicContact CB-CG 4.27Å; E94-Q105 HydrophobicContact CG-CG 4.39Å; E94-Q105 PolarHBondContact OE2-NE2 3.03Å; W103-Q105 HydrophobicContact CD2-CB 4.42Å; W103-Q105 VanDerWaalsContact CE2-CB 3.46Å; W103-Q105 HydrophobicContact CH2-CB 4.36Å; W103-Q105 HydrophobicContact CZ2-CB 3.45Å; W103-Q105 VanDerWaalsContact CZ2-CB 3.45Å; W103-Q105 HydrophobicContact CZ2-CG 3.94Å; Q105-F131 HydrophobicContact CB-CD2 4.1Å; Q105-F131 HydrophobicContact CB-CE2 3.88Å; Q105-F131 HydrophobicContact CG-CD2 3.86Å; Q105-F131 HydrophobicContact CG-CE2 4.17Å; Q105-G171 VanDerWaalsContact O-CA 3.29Å; Q105-G171 WeakPolarHBondContact O-CA 3.44Å; Q105-A172 PolarHBondContact N-O 2.98Å; Q105-A172 PolarHBondContact O-N 3.06Å
106	K	96.5	Very high	96	Very high	52 Å²	52	44.4 Å²	44.4	23%	0.226	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	152.2	162.8	-74.1	179.5	-69	-173.3	0	108.7	Y104 S108 R170 I188 V202	Y104-K106 HydrophobicContact CE1-CG 4.33Å; Y104-K106 WeakPolarHBondContact OH-CD 3.41Å; Y104-K106 WeakPolarHBondContact OH-CE 3.29Å; K106-S108 PolarHBondContact O-N 2.78Å; K106-R170 CarbonylContact C-O 3.6Å; K106-R170 VanDerWaalsContact CA-O 3.27Å; K106-R170 WeakPolarHBondContact CA-O 3.37Å; K106-I188 HydrophobicContact CD-CD1 4.18Å; K106-I188 HydrophobicContact CG-CD1 3.39Å; K106-V202 PolarHBondContact NZ-OXT 3.49Å
107	C	96.6	Very high	96.1	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.007	21%	0.212	C	C	.	.			trans	-58.3	122.2	155.9	-68	0	0	0	0	109.1	G111 L112 C133 R170	C107-G111 VanDerWaalsContact CB-C 3.47Å; C107-G111 WeakPolarHBondContact CB-O 3.05Å; C107-L112 VanDerWaalsContact SG-C 3.59Å; C107-C133 WeakPolarHBondContact CA-SG 3.13Å; C107-C133 HydrophobicContact CB-CB 3.63Å; C107-C133 WeakPolarHBondContact CB-SG 3.49Å; C107-C133 WeakPolarHBondContact SG-CB 3.47Å; C107-C133 CovalentContact SG-SG 2.03Å; C107-C133 PolarHBondContact SG-SG 3.34Å; C107-R170 PolarHBondContact N-O 2.86Å; C107-R170 PolarHBondContact O-NH1 2.89Å; C107-R170 VanDerWaalsContact O-NH1 3.15Å
108	S	93.9	Very high	96.2	Very high	43 Å²	43	44.2 Å²	44.2	30%	0.301	21%	0.21	S	C	.	.	S	Bend	trans	-62.2	177.2	169.9	56.6	0	0	0	0	111.2	W92 E94 K106 N110 G111	W92-S108 VanDerWaalsContact CZ2-O 3.27Å; W92-S108 WeakPolarHBondContact CZ2-O 3.43Å; W92-S108 WeakPolarHBondContact CZ2-OG 3.2Å; W92-S108 PolarHBondContact NE1-OG 3.4Å; E94-S108 WeakPolarHBondContact OE1-CB 2.98Å; E94-S108 PolarHBondContact OE1-N 3.02Å; E94-S108 PolarHBondContact OE1-OG 2.75Å; K106-S108 PolarHBondContact O-N 2.78Å; S108-N110 PolarHBondContact O-N 3.33Å; S108-G111 PolarHBondContact O-N 2.87Å
109	N	90.9	Very high	96.3	Very high	53 Å²	53	41 Å²	41	28%	0.283	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	39.3	168.5	-48.5	-4.6	0	0	0	114.8	W92 G111 R135 E200	W92-N109 HydrophobicContact CH2-CB 3.84Å; W92-N109 HydrophobicContact CZ2-CB 4.07Å; N109-G111 PolarHBondContact O-N 3.26Å; N109-G111 VanDerWaalsContact O-N 3.16Å; N109-R135 WeakPolarHBondContact O-CD 2.96Å; N109-R135 VanDerWaalsContact O-CG 3.25Å; N109-R135 WeakPolarHBondContact O-CG 3.45Å; N109-E200 WeakPolarHBondContact CA-OE1 3.44Å; N109-E200 PolarHBondContact OD1-OE1 2.88Å
110	N	91.8	Very high	96.3	Very high	11 Å²	11	41.7 Å²	41.7	6%	0.059	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	18.1	-175.6	-66.4	-19.4	0	0	0	116.2	S108 C140 P141 F199 N201	S108-N110 PolarHBondContact O-N 3.33Å; N110-C140 PolarHBondContact ND2-SG 2.91Å; N110-P141 HydrophobicContact CB-CG 4.19Å; N110-P141 VanDerWaalsContact CG-CD 3.44Å; N110-P141 WeakPolarHBondContact OD1-CD 3.46Å; N110-F199 PolarHBondContact ND2-O 2.04Å; N110-N201 PolarHBondContact OD1-N 2.94Å
111	G	94.9	Very high	96.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	20%	0.204	C	C	.	.			trans	-68.8	159.8	-176.8	0	0	0	0	0	115.3	C107 S108 N109 C134 R170	C107-G111 VanDerWaalsContact CB-C 3.47Å; C107-G111 WeakPolarHBondContact CB-O 3.05Å; S108-G111 PolarHBondContact O-N 2.87Å; N109-G111 PolarHBondContact O-N 3.26Å; N109-G111 VanDerWaalsContact O-N 3.16Å; G111-C134 WeakPolarHBondContact CA-O 3.37Å; G111-R170 WeakPolarHBondContact O-CD 3.21Å
112	L	96.8	Very high	96.4	Very high	0 Å²	0	45 Å²	45	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	148.9	171.9	-61.2	-177.4	0	0	0	110.5	V56 C107 A114 C133 C134 Y136 Y168 R170 M192	V56-L112 HydrophobicContact CG1-CB 3.89Å; V56-L112 HydrophobicContact CG1-CD1 4.11Å; C107-L112 VanDerWaalsContact SG-C 3.59Å; L112-A114 PolarHBondContact O-N 3.23Å; L112-C133 CarbonylContact O-C 3.57Å; L112-C133 VanDerWaalsContact O-CA 3.3Å; L112-C133 WeakPolarHBondContact O-CA 3.39Å; L112-C134 PolarHBondContact N-O 3.47Å; L112-C134 PolarHBondContact O-N 3.34Å; L112-Y136 HydrophobicContact CD1-CD2 3.95Å; L112-Y136 HydrophobicContact CD1-CE2 3.95Å; L112-Y136 HydrophobicContact CG-CD2 4.35Å; L112-Y136 HydrophobicContact CG-CE2 4.48Å; L112-Y168 HydrophobicContact CD1-CD1 3.97Å; L112-Y168 HydrophobicContact CD1-CG 3.86Å; L112-Y168 HydrophobicContact CD2-CG 4.39Å; L112-R170 HydrophobicContact CD2-CG 3.99Å; L112-M192 HydrophobicContact CD1-CG 4.2Å; L112-M192 HydrophobicContact CD2-CE 4.31Å; L112-M192 HydrophobicContact CD2-CG 4.17Å; L112-M192 HydrophobicContact CD2-SD 3.69Å; L112-M192 HydrophobicContact CG-CE 4.42Å; L112-M192 HydrophobicContact CG-SD 4.38Å
113	V	98.3	Very high	96.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	111.6	177.7	179.3	0	0	0	0	109.6	V57 F116 F131 M169	V57-V113 HydrophobicContact CB-CG1 4.42Å; V57-V113 HydrophobicContact CG2-CG1 4.3Å; V57-V113 PolarHBondContact N-O 2.89Å; V113-F116 HydrophobicContact CG1-CD2 4.11Å; V113-F116 HydrophobicContact CG1-CE2 3.58Å; V113-F116 HydrophobicContact CG1-CZ 4.22Å; V113-F131 HydrophobicContact CG1-CD1 3.87Å; V113-F131 HydrophobicContact CG1-CE1 4.4Å; V113-F131 HydrophobicContact CG2-CD1 4.05Å; V113-F131 HydrophobicContact CG2-CE1 4.39Å; V113-F131 HydrophobicContact CG2-CG 4.17Å; V113-M169 HydrophobicContact CB-CB 4.19Å; V113-M169 HydrophobicContact CB-CG 4.04Å; V113-M169 HydrophobicContact CB-SD 4.24Å; V113-M169 HydrophobicContact CG1-SD 4.19Å; V113-M169 HydrophobicContact CG2-CB 4.46Å; V113-M169 HydrophobicContact CG2-CG 3.94Å; V113-M169 HydrophobicContact CG2-SD 4.4Å; V113-M169 PolarHBondContact N-O 2.99Å
114	A	98.2	Very high	96.4	Very high	2 Å²	2	43.1 Å²	43.1	2%	0.017	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	6.2	177	0	0	0	0	0	112.4	C51 L112 Y132 C134	C51-A114 WeakPolarHBondContact CB-O 3.11Å; C51-A114 PolarHBondContact N-O 2.95Å; L112-A114 PolarHBondContact O-N 3.23Å; A114-Y132 HydrophobicContact CB-CD1 3.95Å; A114-Y132 HydrophobicContact CB-CE1 4.43Å; A114-Y132 PolarHBondContact N-O 2.88Å; A114-C134 HydrophobicContact CB-CB 4.12Å
115	G	98.4	Very high	96.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.9	173.3	177.5	0	0	0	0	0	114.1	Y49 Y132	Y49-G115 CarbonylContact O-C 3.5Å; Y49-G115 WeakPolarHBondContact O-CA 3.44Å; G115-Y132 PolarHBondContact N-O 2.81Å; G115-Y132 PolarHBondContact O-N 3.28Å
116	F	98.3	Very high	96.4	Very high	1 Å²	1	38.3 Å²	38.3	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	136.5	-175.7	-76.5	-111.7	0	0	0	109.5	F47 Y49 V57 V60 Y76 V113 W129 F131 M169 W185 F187	F47-F116 HydrophobicContact CE2-CB 4.12Å; Y49-F116 PolarHBondContact N-O 3.37Å; Y49-F116 PolarHBondContact O-N 2.93Å; V57-F116 HydrophobicContact CB-CE2 4.33Å; V57-F116 HydrophobicContact CG1-CE2 4.02Å; V57-F116 HydrophobicContact CG2-CD2 4.22Å; V57-F116 HydrophobicContact CG2-CE2 4.12Å; V60-F116 HydrophobicContact CG2-CE2 4.19Å; V60-F116 HydrophobicContact CG2-CZ 3.88Å; Y76-F116 AromaticContact CD1-CD2 3.76Å; Y76-F116 HydrophobicContact CD1-CD2 3.76Å; Y76-F116 AromaticContact CD1-CE2 3.97Å; Y76-F116 HydrophobicContact CD1-CE2 3.97Å; Y76-F116 HydrophobicContact CD1-CG 4.28Å; Y76-F116 HydrophobicContact CE1-CB 3.94Å; Y76-F116 AromaticContact CE1-CD1 3.74Å; Y76-F116 HydrophobicContact CE1-CD1 3.74Å; Y76-F116 AromaticContact CE1-CD2 3.28Å; Y76-F116 HydrophobicContact CE1-CD2 3.28Å; Y76-F116 AromaticContact CE1-CE1 3.96Å; Y76-F116 HydrophobicContact CE1-CE1 3.96Å; Y76-F116 AromaticContact CE1-CE2 3.58Å; Y76-F116 HydrophobicContact CE1-CE2 3.58Å; Y76-F116 AromaticContact CE1-CG 3.39Å; Y76-F116 HydrophobicContact CE1-CG 3.39Å; Y76-F116 AromaticContact CE1-CZ 3.9Å; Y76-F116 HydrophobicContact CE1-CZ 3.9Å; Y76-F116 HydrophobicContact CE2-CB 4.23Å; Y76-F116 AromaticContact CZ-CD1 3.9Å; Y76-F116 AromaticContact CZ-CD2 3.94Å; Y76-F116 AromaticContact CZ-CG 3.58Å; Y76-F116 WeakPolarHBondContact OH-CB 3.44Å; Y76-F116 WeakPolarHBondContact OH-CD1 3.14Å; Y76-F116 WeakPolarHBondContact OH-CG 3.26Å; V113-F116 HydrophobicContact CG1-CD2 4.11Å; V113-F116 HydrophobicContact CG1-CE2 3.58Å; V113-F116 HydrophobicContact CG1-CZ 4.22Å; F116-W129 HydrophobicContact CD1-CE3 4.32Å; F116-W129 HydrophobicContact CD1-CZ3 4.26Å; F116-F131 HydrophobicContact CD1-CD1 4.23Å; F116-F131 HydrophobicContact CD1-CE1 4.07Å; F116-F131 HydrophobicContact CE1-CD1 4.07Å; F116-F131 AromaticContact CE1-CE1 3.51Å; F116-F131 HydrophobicContact CE1-CE1 3.51Å; F116-F131 HydrophobicContact CE2-CE1 4.44Å; F116-F131 HydrophobicContact CZ-CD1 4.19Å; F116-F131 AromaticContact CZ-CE1 3.71Å; F116-F131 HydrophobicContact CZ-CE1 3.71Å; F116-M169 HydrophobicContact CE2-SD 4.26Å; F116-M169 HydrophobicContact CZ-SD 3.96Å; F116-W185 HydrophobicContact CE1-CZ3 4.36Å; F116-F187 HydrophobicContact CZ-CE1 4.35Å
117	Q	98.3	Very high	96.4	Very high	72 Å²	72	36 Å²	36	34%	0.336	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	139.4	166	172.1	163.9	37.4	0	0	108.8	F47 W93 Q130	F47-Q117 WeakPolarHBondContact O-CA 3.42Å; W93-Q117 HydrophobicContact CE3-CB 3.98Å; W93-Q117 HydrophobicContact CH2-CB 3.58Å; W93-Q117 HydrophobicContact CZ2-CB 4.47Å; W93-Q117 HydrophobicContact CZ3-CB 3.29Å; Q117-Q130 HydrophobicContact CB-CB 4.32Å; Q117-Q130 PolarHBondContact N-O 2.83Å; Q117-Q130 PolarHBondContact O-N 3.16Å
118	S	98.2	Very high	96.5	Very high	4 Å²	4	36.8 Å²	36.8	3%	0.028	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	146.8	179.3	-177.9	0	0	0	0	112	G46 F47 R127 E128	G46-S118 CarbonylContact C-O 3.53Å; G46-S118 WeakPolarHBondContact CA-O 3.34Å; F47-S118 PolarHBondContact N-O 3.12Å; F47-S118 PolarHBondContact O-N 3.33Å; S118-R127 WeakPolarHBondContact OG-CB 3.49Å; S118-R127 WeakPolarHBondContact OG-CD 3.4Å; S118-R127 PolarHBondContact OG-NH1 3.23Å; S118-E128 WeakPolarHBondContact CA-O 3.3Å; S118-E128 WeakPolarHBondContact CB-O 3.22Å; S118-E128 PolarHBondContact OG-O 2.85Å
119	R	97.4	Very high	96.7	Very high	131 Å²	131	34.9 Å²	34.9	49%	0.494	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	141	169.1	64.3	-177.5	-167.5	173.4	3.6	109.6	I96 R127 E128	I96-R119 HydrophobicContact CD1-CG 4.4Å; R119-R127 CarbonylContact O-C 3.46Å; R119-R127 WeakPolarHBondContact O-CA 3.11Å; R119-E128 HydrophobicContact CG-CB 3.96Å; R119-E128 IonicContact CZ-OE1 3.17Å; R119-E128 IonicContact CZ-OE2 2.65Å; R119-E128 PolarHBondContact N-O 3.22Å; R119-E128 IonicContact NE-OE1 3.2Å; R119-E128 IonicContact NE-OE2 3.23Å; R119-E128 PolarHBondContact NE-OE2 2.88Å; R119-E128 IonicContact NH2-OE1 2.67Å; R119-E128 PolarHBondContact NH2-OE1 3.41Å; R119-E128 IonicContact NH2-OE2 3.65Å; R119-E128 PolarHBondContact NH2-OE2 2.92Å; R119-E128 PolarHBondContact O-N 3.38Å
120	Y	97.8	Very high	97	Very high	30 Å²	30	34 Å²	34	12%	0.118	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	136.8	177.9	-179.1	-99	0	0	0	110.7	R44 G69 D71 E122 L125 R127	R44-Y120 HydrophobicContact CB-CD1 3.73Å; R44-Y120 HydrophobicContact CB-CE1 4.04Å; R44-Y120 HydrophobicContact CB-CG 4.03Å; R44-Y120 HydrophobicContact CG-CD1 3.9Å; R44-Y120 HydrophobicContact CG-CD2 4.48Å; R44-Y120 HydrophobicContact CG-CE1 3.68Å; R44-Y120 HydrophobicContact CG-CE2 4.29Å; R44-Y120 HydrophobicContact CG-CG 4.29Å; R44-Y120 WeakPolarHBondContact O-CB 3.43Å; G69-Y120 PolarHBondContact O-OH 2.8Å; D71-Y120 HydrophobicContact CB-CD2 4.23Å; D71-Y120 HydrophobicContact CB-CE2 3.87Å; Y120-E122 HydrophobicContact CD1-CB 4.36Å; Y120-E122 HydrophobicContact CE1-CB 3.9Å; Y120-E122 HydrophobicContact CE1-CG 4.29Å; Y120-L125 WeakPolarHBondContact OH-CD2 3.46Å; Y120-R127 HydrophobicContact CD2-CG 4.29Å
121	F	97	Very high	97.4	Very high	87 Å²	87	33.4 Å²	33.4	38%	0.382	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	94.6	-177.4	-165.7	-116.8	0	0	0	110.8	A99 S123 V124 L125 D126	A99-F121 HydrophobicContact CB-CB 3.64Å; A99-F121 HydrophobicContact CB-CD1 3.8Å; A99-F121 HydrophobicContact CB-CG 4.05Å; F121-S123 VanDerWaalsContact C-N 3.27Å; F121-S123 WeakPolarHBondContact CE1-OG 3.46Å; F121-S123 WeakPolarHBondContact CZ-OG 3.36Å; F121-S123 PolarHBondContact O-N 3.5Å; F121-S123 VanDerWaalsContact O-N 3.14Å; F121-V124 HydrophobicContact CD1-CG1 4.32Å; F121-V124 HydrophobicContact CD1-CG2 3.93Å; F121-V124 HydrophobicContact CE1-CG1 4.39Å; F121-V124 PolarHBondContact O-N 2.78Å; F121-L125 PolarHBondContact O-N 2.78Å; F121-D126 PolarHBondContact N-O 3.24Å
122	E	96	Very high	97.5	Very high	125 Å²	125	35.5 Å²	35.5	58%	0.584	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-28	-166.7	-173.7	162.7	-129.6	0	0	114.6	R44 Y120 V124 L125	R44-E122 IonicContact NH1-OE1 2.78Å; R44-E122 PolarHBondContact NH1-OE1 3.34Å; Y120-E122 HydrophobicContact CD1-CB 4.36Å; Y120-E122 HydrophobicContact CE1-CB 3.9Å; Y120-E122 HydrophobicContact CE1-CG 4.29Å; E122-V124 PolarHBondContact O-N 2.84Å; E122-L125 WeakPolarHBondContact O-CD2 3.45Å; E122-L125 PolarHBondContact O-N 3.47Å
123	S	95.4	Very high	97.6	Very high	93 Å²	93	35.5 Å²	35.5	65%	0.65	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-19.2	-176.7	71	0	0	0	0	114.4	F121	F121-S123 VanDerWaalsContact C-N 3.27Å; F121-S123 WeakPolarHBondContact CE1-OG 3.46Å; F121-S123 WeakPolarHBondContact CZ-OG 3.36Å; F121-S123 PolarHBondContact O-N 3.5Å; F121-S123 VanDerWaalsContact O-N 3.14Å
124	V	95	Very high	97.5	Very high	34 Å²	34	35.9 Å²	35.9	21%	0.206	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.9	-6.4	176.9	-50.7	0	0	0	0	113.6	A99 F121 E122 D126 R181	A99-V124 HydrophobicContact CB-CG2 3.76Å; F121-V124 HydrophobicContact CD1-CG1 4.32Å; F121-V124 HydrophobicContact CD1-CG2 3.93Å; F121-V124 HydrophobicContact CE1-CG1 4.39Å; F121-V124 PolarHBondContact O-N 2.78Å; E122-V124 PolarHBondContact O-N 2.84Å; V124-D126 HydrophobicContact CG2-CB 3.75Å; V124-R181 WeakPolarHBondContact O-CD 3.2Å; V124-R181 PolarHBondContact O-NH1 2.91Å
125	L	97.1	Very high	97.4	Very high	55 Å²	55	38.8 Å²	38.8	29%	0.288	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	63.3	-173.5	-48	174.2	0	0	0	111.4	Y120 F121 E122 R181	Y120-L125 WeakPolarHBondContact OH-CD2 3.46Å; F121-L125 PolarHBondContact O-N 2.78Å; E122-L125 WeakPolarHBondContact O-CD2 3.45Å; E122-L125 PolarHBondContact O-N 3.47Å; L125-R181 HydrophobicContact CB-CB 4.06Å; L125-R181 HydrophobicContact CB-CG 4.19Å; L125-R181 HydrophobicContact CD1-CG 4.16Å
126	D	97.4	Very high	97	Very high	11 Å²	11	38.9 Å²	38.9	6%	0.059	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	178.2	178.2	-174.7	23.2	0	0	0	109.2	A99 G100 F121 V124 F176 R183	A99-D126 HydrophobicContact CB-CB 4.17Å; G100-D126 PolarHBondContact N-OD2 3.23Å; F121-D126 PolarHBondContact N-O 3.24Å; V124-D126 HydrophobicContact CG2-CB 3.75Å; D126-F176 HydrophobicContact CB-CD2 4.14Å; D126-F176 HydrophobicContact CB-CE2 3.52Å; D126-F176 HydrophobicContact CB-CZ 3.93Å; D126-R183 IonicContact OD1-NE 2.95Å; D126-R183 PolarHBondContact OD1-NE 3.03Å; D126-R183 IonicContact OD1-NH2 3.57Å; D126-R183 IonicContact OD2-CZ 3.32Å; D126-R183 IonicContact OD2-NE 2.7Å; D126-R183 IonicContact OD2-NH2 3.66Å; D126-R183 PolarHBondContact OD2-NH2 3.15Å
127	R	97.7	Very high	96.2	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.015	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	145.3	177.6	-77.3	173.6	175	-83.4	-9.8	112.3	N41 Q45 D71 R72 S118 R119 Y120 W129	N41-R127 PolarHBondContact ND2-NH2 3.29Å; Q45-R127 PolarHBondContact O-NH1 2.04Å; Q45-R127 PolarHBondContact O-NH2 2.8Å; D71-R127 IonicContact OD1-CZ 3.8Å; D71-R127 IonicContact OD1-NE 2.72Å; D71-R127 PolarHBondContact OD1-NE 2.8Å; D71-R127 IonicContact OD1-NH2 3.6Å; D71-R127 PolarHBondContact OD1-NH2 3.39Å; D71-R127 IonicContact OD2-CZ 2.75Å; D71-R127 IonicContact OD2-NE 3.41Å; D71-R127 IonicContact OD2-NH2 3.98Å; D71-R127 PolarHBondContact OD2-NH2 2.83Å; R72-R127 PolarHBondContact O-NH2 2.86Å; S118-R127 WeakPolarHBondContact OG-CB 3.49Å; S118-R127 WeakPolarHBondContact OG-CD 3.4Å; S118-R127 PolarHBondContact OG-NH1 3.23Å; R119-R127 CarbonylContact O-C 3.46Å; R119-R127 WeakPolarHBondContact O-CA 3.11Å; Y120-R127 HydrophobicContact CD2-CG 4.29Å; R127-W129 HydrophobicContact CB-CZ2 3.65Å; R127-W129 VanDerWaalsContact CB-NE1 3.34Å; R127-W129 VanDerWaalsContact CD-CZ2 3.49Å; R127-W129 HydrophobicContact CG-CZ2 4.2Å; R127-W129 PolarHBondContact O-NE1 3.27Å
128	E	97.9	Very high	95.1	Very high	17 Å²	17	43.4 Å²	43.4	8%	0.079	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	153.4	158.8	-70.5	161.1	113.7	0	0	110.1	I96 N97 A99 S118 R119	I96-E128 HydrophobicContact CD1-CB 3.88Å; I96-E128 HydrophobicContact CG1-CB 4Å; N97-E128 WeakPolarHBondContact OD1-CA 3.45Å; A99-E128 HydrophobicContact CB-CG 3.76Å; S118-E128 WeakPolarHBondContact CA-O 3.3Å; S118-E128 WeakPolarHBondContact CB-O 3.22Å; S118-E128 PolarHBondContact OG-O 2.85Å; R119-E128 HydrophobicContact CG-CB 3.96Å; R119-E128 IonicContact CZ-OE1 3.17Å; R119-E128 IonicContact CZ-OE2 2.65Å; R119-E128 PolarHBondContact N-O 3.22Å; R119-E128 IonicContact NE-OE1 3.2Å; R119-E128 IonicContact NE-OE2 3.23Å; R119-E128 PolarHBondContact NE-OE2 2.88Å; R119-E128 IonicContact NH2-OE1 2.67Å; R119-E128 PolarHBondContact NH2-OE1 3.41Å; R119-E128 IonicContact NH2-OE2 3.65Å; R119-E128 PolarHBondContact NH2-OE2 2.92Å; R119-E128 PolarHBondContact O-N 3.38Å
129	W	98.2	Very high	94.7	Very high	3 Å²	3	45.1 Å²	45.1	1%	0.011	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	141.3	-163.9	-66.9	100.6	0	0	0	112.2	F47 W74 I96 N97 W103 F116 R127 W185	F47-W129 HydrophobicContact CE1-CH2 4.43Å; F47-W129 HydrophobicContact CZ-CH2 4.06Å; F47-W129 AromaticContact CZ-CZ3 3.81Å; F47-W129 HydrophobicContact CZ-CZ3 3.81Å; W74-W129 AromaticContact CD2-CH2 3.76Å; W74-W129 HydrophobicContact CD2-CH2 3.76Å; W74-W129 AromaticContact CE2-CH2 3.36Å; W74-W129 AromaticContact CE2-CZ2 3.78Å; W74-W129 HydrophobicContact CE3-CH2 4.22Å; W74-W129 HydrophobicContact CG-CH2 4.3Å; W74-W129 HydrophobicContact CH2-CH2 4.03Å; W74-W129 HydrophobicContact CH2-CZ2 4.15Å; W74-W129 AromaticContact CZ2-CH2 3.52Å; W74-W129 HydrophobicContact CZ2-CH2 3.52Å; W74-W129 AromaticContact CZ2-CZ2 3.53Å; W74-W129 HydrophobicContact CZ2-CZ2 3.53Å; W74-W129 HydrophobicContact CZ3-CH2 4.34Å; W74-W129 AromaticContact NE1-CH2 3.63Å; I96-W129 WeakPolarHBondContact CA-O 3.41Å; N97-W129 PolarHBondContact N-O 2.89Å; N97-W129 PolarHBondContact OD1-N 2.98Å; W103-W129 HydrophobicContact CD2-CB 4.49Å; W103-W129 HydrophobicContact CE3-CB 3.88Å; W103-W129 HydrophobicContact CE3-CG 4.44Å; W103-W129 HydrophobicContact CH2-CB 3.7Å; W103-W129 HydrophobicContact CZ2-CB 4.31Å; W103-W129 HydrophobicContact CZ3-CB 3.46Å; W103-W129 VanDerWaalsContact CZ3-CB 3.46Å; W103-W129 HydrophobicContact CZ3-CG 4.14Å; F116-W129 HydrophobicContact CD1-CE3 4.32Å; F116-W129 HydrophobicContact CD1-CZ3 4.26Å; R127-W129 HydrophobicContact CB-CZ2 3.65Å; R127-W129 VanDerWaalsContact CB-NE1 3.34Å; R127-W129 VanDerWaalsContact CD-CZ2 3.49Å; R127-W129 HydrophobicContact CG-CZ2 4.2Å; R127-W129 PolarHBondContact O-NE1 3.27Å; W129-W185 AromaticContact CD2-CH2 3.51Å; W129-W185 HydrophobicContact CD2-CH2 3.51Å; W129-W185 AromaticContact CD2-CZ2 3.8Å; W129-W185 HydrophobicContact CD2-CZ2 3.8Å; W129-W185 AromaticContact CE2-CH2 3.77Å; W129-W185 AromaticContact CE2-CZ2 3.51Å; W129-W185 AromaticContact CE3-CH2 3.79Å; W129-W185 HydrophobicContact CE3-CH2 3.79Å; W129-W185 HydrophobicContact CE3-CZ2 4.26Å; W129-W185 AromaticContact CG-CH2 3.82Å; W129-W185 HydrophobicContact CG-CH2 3.82Å; W129-W185 HydrophobicContact CG-CZ2 4.26Å; W129-W185 HydrophobicContact CH2-CZ2 4.24Å; W129-W185 HydrophobicContact CZ2-CH2 4.28Å; W129-W185 AromaticContact CZ2-CZ2 3.76Å; W129-W185 HydrophobicContact CZ2-CZ2 3.76Å; W129-W185 HydrophobicContact CZ3-CH2 4.28Å; W129-W185 HydrophobicContact CZ3-CZ2 4.46Å; W129-W185 AromaticContact NE1-CZ2 3.77Å
130	Q	97.7	Very high	94.5	Very high	33 Å²	33	39 Å²	39	15%	0.154	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	136.1	-179.6	-163.9	176.1	5.7	0	0	108.9	W93 E94 I96 Q117	W93-Q130 HydrophobicContact CB-CG 4.43Å; W93-Q130 HydrophobicContact CE3-CB 4.46Å; W93-Q130 HydrophobicContact CE3-CG 4.1Å; E94-Q130 WeakPolarHBondContact O-CG 3.18Å; E94-Q130 PolarHBondContact O-NE2 2.6Å; I96-Q130 HydrophobicContact CB-CB 4.29Å; I96-Q130 HydrophobicContact CB-CG 4.34Å; I96-Q130 HydrophobicContact CG1-CB 4.33Å; Q117-Q130 HydrophobicContact CB-CB 4.32Å; Q117-Q130 PolarHBondContact N-O 2.83Å; Q117-Q130 PolarHBondContact O-N 3.16Å
131	F	98.5	Very high	94.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	141.4	175.5	-65.6	-55.8	0	0	0	111.2	W93 E94 W103 Q105 V113 F116 A172	W93-F131 WeakPolarHBondContact CA-O 3.47Å; W93-F131 VanDerWaalsContact CE3-C 3.49Å; E94-F131 HydrophobicContact CB-CB 4.44Å; E94-F131 HydrophobicContact CG-CB 4.33Å; E94-F131 PolarHBondContact N-O 3.05Å; W103-F131 HydrophobicContact CH2-CD1 4.36Å; W103-F131 AromaticContact CH2-CD2 3.78Å; W103-F131 HydrophobicContact CH2-CD2 3.78Å; W103-F131 AromaticContact CH2-CE1 3.99Å; W103-F131 HydrophobicContact CH2-CE1 3.99Å; W103-F131 AromaticContact CH2-CE2 3.36Å; W103-F131 HydrophobicContact CH2-CE2 3.36Å; W103-F131 HydrophobicContact CH2-CG 4.25Å; W103-F131 AromaticContact CH2-CZ 3.47Å; W103-F131 HydrophobicContact CH2-CZ 3.47Å; W103-F131 VanDerWaalsContact CH2-CZ 3.47Å; W103-F131 AromaticContact CZ2-CD2 3.99Å; W103-F131 HydrophobicContact CZ2-CD2 3.99Å; W103-F131 AromaticContact CZ2-CE2 3.78Å; W103-F131 HydrophobicContact CZ2-CE2 3.78Å; W103-F131 HydrophobicContact CZ2-CZ 4.34Å; W103-F131 HydrophobicContact CZ3-CE1 4.44Å; W103-F131 HydrophobicContact CZ3-CE2 4.09Å; W103-F131 AromaticContact CZ3-CZ 3.84Å; W103-F131 HydrophobicContact CZ3-CZ 3.84Å; Q105-F131 HydrophobicContact CB-CD2 4.1Å; Q105-F131 HydrophobicContact CB-CE2 3.88Å; Q105-F131 HydrophobicContact CG-CD2 3.86Å; Q105-F131 HydrophobicContact CG-CE2 4.17Å; V113-F131 HydrophobicContact CG1-CD1 3.87Å; V113-F131 HydrophobicContact CG1-CE1 4.4Å; V113-F131 HydrophobicContact CG2-CD1 4.05Å; V113-F131 HydrophobicContact CG2-CE1 4.39Å; V113-F131 HydrophobicContact CG2-CG 4.17Å; F116-F131 HydrophobicContact CD1-CD1 4.23Å; F116-F131 HydrophobicContact CD1-CE1 4.07Å; F116-F131 HydrophobicContact CE1-CD1 4.07Å; F116-F131 AromaticContact CE1-CE1 3.51Å; F116-F131 HydrophobicContact CE1-CE1 3.51Å; F116-F131 HydrophobicContact CE2-CE1 4.44Å; F116-F131 HydrophobicContact CZ-CD1 4.19Å; F116-F131 AromaticContact CZ-CE1 3.71Å; F116-F131 HydrophobicContact CZ-CE1 3.71Å; F131-A172 HydrophobicContact CZ-CB 3.81Å
132	Y	98.6	Very high	94.1	Very high	44 Å²	44	37.7 Å²	37.7	17%	0.173	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	124.5	158	-172.7	-122.5	0	0	0	107.9	Q50 C91 W92 W93 A114 G115	Q50-Y132 HydrophobicContact CB-CD1 4.26Å; Q50-Y132 HydrophobicContact CB-CE1 4.44Å; Q50-Y132 HydrophobicContact CG-CD1 3.8Å; Q50-Y132 HydrophobicContact CG-CE1 4.14Å; Q50-Y132 HydrophobicContact CG-CG 4.1Å; C91-Y132 HydrophobicContact CB-CE1 4.1Å; C91-Y132 HydrophobicContact CB-CE2 3.93Å; C91-Y132 VanDerWaalsContact CB-CZ 3.49Å; C91-Y132 WeakPolarHBondContact CB-OH 3.4Å; W92-Y132 VanDerWaalsContact O-CD2 3.3Å; W92-Y132 WeakPolarHBondContact O-CD2 3.47Å; W93-Y132 AromaticContact CD1-CD2 3.98Å; W93-Y132 AromaticContact CD2-CD2 3.87Å; W93-Y132 HydrophobicContact CD2-CD2 3.87Å; W93-Y132 HydrophobicContact CD2-CG 4.43Å; W93-Y132 AromaticContact CE2-CD2 3.62Å; W93-Y132 HydrophobicContact CE3-CD2 4.46Å; W93-Y132 HydrophobicContact CG-CD2 4.11Å; W93-Y132 HydrophobicContact CH2-CG 4.37Å; W93-Y132 HydrophobicContact CZ2-CD2 4.04Å; W93-Y132 HydrophobicContact CZ2-CG 4.17Å; W93-Y132 AromaticContact NE1-CD2 3.67Å; A114-Y132 HydrophobicContact CB-CD1 3.95Å; A114-Y132 HydrophobicContact CB-CE1 4.43Å; A114-Y132 PolarHBondContact N-O 2.88Å; G115-Y132 PolarHBondContact N-O 2.81Å; G115-Y132 PolarHBondContact O-N 3.28Å
133	C	98.1	Very high	94.1	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	138.4	-172.4	-68.3	0	0	0	0	110.1	C91 W92 E94 C107 L112	C91-C133 CarbonylContact C-O 3.48Å; C91-C133 WeakPolarHBondContact CA-O 3.43Å; C91-C133 WeakPolarHBondContact CB-O 3.32Å; W92-C133 HydrophobicContact CD2-CB 4.37Å; W92-C133 HydrophobicContact CH2-CB 4.45Å; W92-C133 HydrophobicContact CZ2-CB 3.86Å; W92-C133 PolarHBondContact N-O 3.2Å; W92-C133 PolarHBondContact O-N 2.89Å; E94-C133 HydrophobicContact CG-CB 4.49Å; E94-C133 WeakPolarHBondContact CG-SG 3.14Å; C107-C133 WeakPolarHBondContact CA-SG 3.13Å; C107-C133 HydrophobicContact CB-CB 3.63Å; C107-C133 WeakPolarHBondContact CB-SG 3.49Å; C107-C133 WeakPolarHBondContact SG-CB 3.47Å; C107-C133 CovalentContact SG-SG 2.03Å; C107-C133 PolarHBondContact SG-SG 3.34Å; L112-C133 CarbonylContact O-C 3.57Å; L112-C133 VanDerWaalsContact O-CA 3.3Å; L112-C133 WeakPolarHBondContact O-CA 3.39Å
134	C	97.2	Very high	94.1	Very high	7 Å²	7	34.2 Å²	34.2	5%	0.047	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	129.4	175.8	-74.6	0	0	0	0	111	P88 E90 C91 G111 L112 A114 Y136	P88-C134 HydrophobicContact CB-CB 4Å; E90-C134 CarbonylContact O-C 3.57Å; E90-C134 WeakPolarHBondContact O-CA 3.22Å; C91-C134 HydrophobicContact CB-CB 4.13Å; C91-C134 WeakPolarHBondContact CB-SG 3.44Å; C91-C134 WeakPolarHBondContact SG-CB 3.08Å; C91-C134 CovalentContact SG-SG 2.04Å; C91-C134 PolarHBondContact SG-SG 2.97Å; G111-C134 WeakPolarHBondContact CA-O 3.37Å; L112-C134 PolarHBondContact N-O 3.47Å; L112-C134 PolarHBondContact O-N 3.34Å; A114-C134 HydrophobicContact CB-CB 4.12Å; C134-Y136 HydrophobicContact CB-CE2 4.43Å
135	R	94.2	Very high	94.1	Very high	64 Å²	64	38.5 Å²	38.5	24%	0.242	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	121	176.2	-176.5	-178	71.1	-141.5	-12.9	111.5	T89 E90 W92 N109	T89-R135 PolarHBondContact N-O 3.19Å; T89-R135 PolarHBondContact OG1-O 2.99Å; E90-R135 PolarHBondContact O-N 2.98Å; E90-R135 IonicContact OE2-CZ 3.96Å; E90-R135 IonicContact OE2-NH1 2.68Å; E90-R135 PolarHBondContact OE2-NH1 3Å; E90-R135 IonicContact OE2-NH2 3.53Å; E90-R135 PolarHBondContact OE2-NH2 2.67Å; W92-R135 HydrophobicContact CH2-CB 3.85Å; W92-R135 HydrophobicContact CZ3-CB 3.69Å; N109-R135 WeakPolarHBondContact O-CD 2.96Å; N109-R135 VanDerWaalsContact O-CG 3.25Å; N109-R135 WeakPolarHBondContact O-CG 3.45Å
136	Y	91.4	Very high	94.1	Very high	1 Å²	1	39.5 Å²	39.5	0%	0.004	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	112.1	167	-65.6	-95.7	0	0	0	107.6	V56 T81 L85 G86 P88 L112 C134 K138 R139	V56-Y136 HydrophobicContact CG1-CE2 4.14Å; T81-Y136 HydrophobicContact CG2-CE1 4.04Å; T81-Y136 HydrophobicContact CG2-CE2 4.15Å; T81-Y136 WeakPolarHBondContact CG2-OH 3.49Å; T81-Y136 VanDerWaalsContact OG1-CE1 3.25Å; T81-Y136 WeakPolarHBondContact OG1-CE1 3.5Å; T81-Y136 PolarHBondContact OG1-OH 3.14Å; L85-Y136 HydrophobicContact CB-CD1 3.92Å; L85-Y136 HydrophobicContact CB-CG 4.3Å; G86-Y136 VanDerWaalsContact O-CD1 3.31Å; G86-Y136 WeakPolarHBondContact O-CD1 3.3Å; G86-Y136 WeakPolarHBondContact O-CE1 3.38Å; P88-Y136 HydrophobicContact CB-CD1 4.5Å; P88-Y136 HydrophobicContact CB-CE1 4.09Å; P88-Y136 HydrophobicContact CB-CE2 4.33Å; P88-Y136 HydrophobicContact CG-CE1 4.33Å; L112-Y136 HydrophobicContact CD1-CD2 3.95Å; L112-Y136 HydrophobicContact CD1-CE2 3.95Å; L112-Y136 HydrophobicContact CG-CD2 4.35Å; L112-Y136 HydrophobicContact CG-CE2 4.48Å; C134-Y136 HydrophobicContact CB-CE2 4.43Å; Y136-K138 PolarHBondContact O-N 2.96Å; Y136-R139 WeakPolarHBondContact O-CB 3.13Å; Y136-R139 PolarHBondContact O-N 3.13Å; Y136-R139 VanDerWaalsContact O-N 3.08Å
137	S	81	Confident	94.1	Very high	51 Å²	51	39.5 Å²	39.5	36%	0.357	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	135	-166.8	55.7	0	0	0	0	111.8	T89 R139	T89-S137 VanDerWaalsContact CG2-OG 3.29Å; T89-S137 WeakPolarHBondContact CG2-OG 3.37Å; T89-S137 WeakPolarHBondContact OG1-CB 3.27Å; T89-S137 PolarHBondContact OG1-N 3.47Å; S137-R139 PolarHBondContact O-N 3.08Å; S137-R139 VanDerWaalsContact O-N 3.13Å
138	K	75.9	Confident	94	Very high	117 Å²	117	44 Å²	44	51%	0.509	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	3.4	179.8	-38.7	177.1	-178.5	173.8	0	115	Y136 D196 C197	Y136-K138 PolarHBondContact O-N 2.96Å; K138-D196 HydrophobicContact CB-CB 3.88Å; K138-D196 HydrophobicContact CD-CB 3.81Å; K138-D196 VanDerWaalsContact CD-OD1 3.3Å; K138-D196 WeakPolarHBondContact CD-OD1 3.27Å; K138-D196 WeakPolarHBondContact CD-OD2 3.27Å; K138-D196 WeakPolarHBondContact CE-OD2 3.43Å; K138-D196 IonicContact NZ-OD2 3.62Å; K138-D196 PolarHBondContact NZ-OD2 3.31Å; K138-D196 CarbonylContact O-C 3.49Å; K138-D196 WeakPolarHBondContact O-CA 3.44Å; K138-C197 PolarHBondContact O-N 2.98Å; K138-C197 PolarHBondContact O-SG 3.23Å
139	R	89.8	Confident	93.9	Very high	40 Å²	40	46.8 Å²	46.8	15%	0.151	23%	0.233	C	C	.	.			trans	-85.6	127.7	172.9	-54.8	-63.7	171.6	-174.1	-8.6	109.2	S84 L85 Y136 S137 M192 T193 D194	S84-R139 PolarHBondContact O-NE 2.86Å; S84-R139 PolarHBondContact O-NH2 2.85Å; L85-R139 HydrophobicContact CB-CG 4.46Å; L85-R139 HydrophobicContact CD2-CB 4.47Å; L85-R139 HydrophobicContact CD2-CG 4.09Å; L85-R139 PolarHBondContact O-NE 2.8Å; Y136-R139 WeakPolarHBondContact O-CB 3.13Å; Y136-R139 PolarHBondContact O-N 3.13Å; Y136-R139 VanDerWaalsContact O-N 3.08Å; S137-R139 PolarHBondContact O-N 3.08Å; S137-R139 VanDerWaalsContact O-N 3.13Å; R139-M192 HydrophobicContact CB-CE 3.67Å; R139-T193 WeakPolarHBondContact CD-O 3.36Å; R139-T193 PolarHBondContact NH1-O 3.04Å; R139-D194 VanDerWaalsContact NH1-CA 3.31Å; R139-D194 PolarHBondContact NH1-O 3.38Å
140	C	91.7	Very high	93.9	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.014	24%	0.243	C	C	.	.			trans	-105.3	132.6	179.3	-98.1	0	0	0	0	112	N110 M192 T193 C197 F199	N110-C140 PolarHBondContact ND2-SG 2.91Å; C140-M192 CarbonylContact O-C 3.56Å; C140-M192 WeakPolarHBondContact O-CA 3.24Å; C140-T193 HydrophobicContact CB-CG2 3.86Å; C140-T193 PolarHBondContact N-OG1 2.94Å; C140-T193 WeakPolarHBondContact O-CG2 3.19Å; C140-T193 PolarHBondContact O-N 3.05Å; C140-C197 VanDerWaalsContact CA-SG 3.58Å; C140-C197 HydrophobicContact CB-CB 3.63Å; C140-C197 WeakPolarHBondContact CB-SG 3.25Å; C140-C197 WeakPolarHBondContact SG-CB 3.37Å; C140-C197 CovalentContact SG-SG 2.02Å; C140-C197 PolarHBondContact SG-SG 3.46Å; C140-F199 PolarHBondContact SG-O 3.31Å
141	P	94.1	Very high	93.9	Very high	3 Å²	3	48 Å²	48	2%	0.019	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	134.1	168.2	25.2	-30.1	0	0	0	110.9	N110 R170 C190 R191 M192 N201	N110-P141 HydrophobicContact CB-CG 4.19Å; N110-P141 VanDerWaalsContact CG-CD 3.44Å; N110-P141 WeakPolarHBondContact OD1-CD 3.46Å; P141-R170 HydrophobicContact CB-CG 4.17Å; P141-R170 VanDerWaalsContact CG-NE 3.34Å; P141-R170 VanDerWaalsContact CG-NH2 3.27Å; P141-C190 HydrophobicContact CB-CB 3.9Å; P141-R191 CarbonylContact C-O 3.57Å; P141-R191 WeakPolarHBondContact CA-O 3.47Å; P141-M192 VanDerWaalsContact CA-SD 3.53Å; P141-M192 HydrophobicContact CB-SD 3.71Å; P141-M192 HydrophobicContact CG-SD 4.42Å; P141-N201 HydrophobicContact CG-CB 4.44Å; P141-N201 PolarHBondContact O-ND2 2.62Å
142	Y	93.6	Very high	93.8	Very high	88 Å²	88	50 Å²	50	35%	0.345	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	171.3	177.9	76.5	-77.5	0	0	0	111.5	C144 R191 T193	Y142-C144 PolarHBondContact O-N 3.02Å; Y142-C144 VanDerWaalsContact O-N 3.13Å; Y142-R191 HydrophobicContact CD1-CB 3.92Å; Y142-R191 WeakPolarHBondContact CD1-O 3.14Å; Y142-R191 HydrophobicContact CE1-CB 3.5Å; Y142-R191 VanDerWaalsContact CE1-CB 3.5Å; Y142-R191 HydrophobicContact CE2-CB 4.17Å; Y142-R191 HydrophobicContact CG-CB 4.41Å; Y142-R191 PolarHBondContact N-O 3.12Å; Y142-R191 PolarHBondContact O-N 3.12Å; Y142-T193 HydrophobicContact CD1-CG2 3.74Å; Y142-T193 HydrophobicContact CE1-CG2 4.12Å; Y142-T193 HydrophobicContact CG-CG2 4.48Å
143	S	94.9	Very high	93.7	Very high	80 Å²	80	54 Å²	54	56%	0.559	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	49.7	38.9	-179.7	-68.3	0	0	0	0	114
144	C	95.5	Very high	93.7	Very high	64 Å²	64	57.4 Å²	57.4	43%	0.432	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	143.6	-176.2	-58.2	0	0	0	0	112.8	Y142 M189 C190	Y142-C144 PolarHBondContact O-N 3.02Å; Y142-C144 VanDerWaalsContact O-N 3.13Å; C144-M189 CarbonylContact C-O 3.49Å; C144-M189 WeakPolarHBondContact CA-O 3.43Å; C144-C190 HydrophobicContact CB-CB 4.11Å; C144-C190 WeakPolarHBondContact CB-SG 3.23Å; C144-C190 WeakPolarHBondContact SG-CB 3.36Å; C144-C190 CovalentContact SG-SG 2.04Å; C144-C190 PolarHBondContact SG-SG 3.24Å
145	W	96.2	Very high	93.7	Very high	124 Å²	124	58.6 Å²	58.6	47%	0.47	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	166.5	173.4	62.9	-76.4	0	0	0	111.4	T147 F167 M189	W145-T147 HydrophobicContact CH2-CG2 4.21Å; W145-T147 HydrophobicContact CZ3-CG2 4.22Å; W145-F167 AromaticContact CD1-CD1 3.69Å; W145-F167 AromaticContact CD1-CE1 3.3Å; W145-F167 AromaticContact CD1-CZ 3.97Å; W145-F167 AromaticContact NE1-CD1 3.2Å; W145-F167 AromaticContact NE1-CE1 3.15Å; W145-F167 AromaticContact NE1-CG 3.78Å; W145-F167 AromaticContact NE1-CZ 3.67Å; W145-M189 HydrophobicContact CD2-CB 4.35Å; W145-M189 HydrophobicContact CZ2-CB 4.02Å; W145-M189 HydrophobicContact CZ2-CG 4.14Å; W145-M189 PolarHBondContact N-O 3.43Å; W145-M189 PolarHBondContact O-N 2.92Å
146	M	96.5	Very high	93.8	Very high	76 Å²	76	59.7 Å²	59.7	37%	0.374	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	135	176.6	-65.7	-57.4	-48.8	0	0	110.3	T173 K186 F187 I188	M146-T173 HydrophobicContact CE-CG2 3.68Å; M146-K186 HydrophobicContact CE-CB 3.48Å; M146-K186 VanDerWaalsContact CE-CB 3.48Å; M146-K186 VanDerWaalsContact CE-O 3.27Å; M146-K186 WeakPolarHBondContact CE-O 3.24Å; M146-F187 WeakPolarHBondContact CA-O 3.4Å; M146-I188 HydrophobicContact CE-CG1 3.82Å; M146-I188 HydrophobicContact SD-CB 4.26Å; M146-I188 HydrophobicContact SD-CG1 3.49Å; M146-I188 WeakPolarHBondContact SD-CG1 3.25Å
147	T	96.9	Very high	94.1	Very high	11 Å²	11	64.5 Å²	64.5	7%	0.067	34%	0.337	C	S	.	.			trans	-64.2	167.9	169.1	71.6	0	0	0	0	112.3	W145 M160 K186 F187 M189	W145-T147 HydrophobicContact CH2-CG2 4.21Å; W145-T147 HydrophobicContact CZ3-CG2 4.22Å; T147-M160 HydrophobicContact CG2-CE 4.27Å; T147-K186 WeakPolarHBondContact O-CG 3.41Å; T147-K186 WeakPolarHBondContact OG1-CA 3.07Å; T147-F187 HydrophobicContact CG2-CB 3.94Å; T147-F187 PolarHBondContact N-O 3.19Å; T147-F187 PolarHBondContact OG1-N 3.47Å; T147-M189 HydrophobicContact CG2-CG 3.79Å
148	T	95.8	Very high	94.8	Very high	98 Å²	98	62.4 Å²	62.4	60%	0.601	32%	0.322	S	S	*	.			trans	-61.8	175.2	159.7	49.9	0	0	0	0	111.5	Y150	T148-Y150 WeakPolarHBondContact O-CD2 3.43Å
149	E	96.9	Very high	95.7	Very high	76 Å²	76	60.7 Å²	60.7	36%	0.355	32%	0.318	S	S	.	.			trans	-74.4	135.9	177.5	-73.7	169.4	154.4	0	0	111.8	P151 W185 K186	E149-P151 CarbonylContact C-O 3.57Å; E149-P151 CarbonylContact O-C 3.54Å; E149-W185 CarbonylContact C-O 3.53Å; E149-W185 WeakPolarHBondContact CA-O 3.18Å; E149-K186 HydrophobicContact CG-CD 4.17Å; E149-K186 HydrophobicContact CG-CG 3.86Å; E149-K186 WeakPolarHBondContact OE1-CE 3.24Å; E149-K186 IonicContact OE1-NZ 3.79Å; E149-K186 PolarHBondContact OE1-NZ 2.8Å
150	Y	97.4	Very high	95.9	Very high	59 Å²	59	59 Å²	59	23%	0.231	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-131.5	118.9	179.4	-77	-79.6	0	0	0	108.9	T148 M158 D159 M160 W185 F187	T148-Y150 WeakPolarHBondContact O-CD2 3.43Å; Y150-M158 HydrophobicContact CD1-CG 4.43Å; Y150-M158 HydrophobicContact CG-CG 4.49Å; Y150-M158 VanDerWaalsContact O-SD 3.37Å; Y150-D159 WeakPolarHBondContact CE1-O 3.37Å; Y150-M160 HydrophobicContact CD1-CB 3.88Å; Y150-M160 HydrophobicContact CD2-CB 4.18Å; Y150-M160 HydrophobicContact CD2-CG 4.11Å; Y150-M160 HydrophobicContact CE1-CB 4.06Å; Y150-M160 HydrophobicContact CE1-CG 4.49Å; Y150-M160 HydrophobicContact CE2-CB 4.36Å; Y150-M160 HydrophobicContact CE2-CG 4.03Å; Y150-M160 HydrophobicContact CG-CB 3.95Å; Y150-M160 HydrophobicContact CG-CG 4.38Å; Y150-W185 PolarHBondContact N-O 2.83Å; Y150-W185 WeakPolarHBondContact O-CB 3.15Å; Y150-W185 PolarHBondContact O-N 2.78Å; Y150-F187 HydrophobicContact CD2-CD2 4.49Å
151	P	97.7	Very high	96	Very high	4 Å²	4	59.8 Å²	59.8	3%	0.026	32%	0.316	C	S	.	.	S	Bend	cis	-60.7	170.3	-16.3	32	-39.9	0	0	0	112.7	E149 H153 E156 Q184	E149-P151 CarbonylContact C-O 3.57Å; E149-P151 CarbonylContact O-C 3.54Å; P151-H153 VanDerWaalsContact C-N 3.34Å; P151-H153 WeakPolarHBondContact CB-O 3.43Å; P151-H153 WeakPolarHBondContact CG-O 3.21Å; P151-E156 HydrophobicContact CB-CB 3.83Å; P151-E156 HydrophobicContact CG-CB 4.49Å; P151-Q184 HydrophobicContact CG-CG 4.4Å; P151-Q184 PolarHBondContact O-NE2 2.83Å
152	G	96.3	Very high	95.8	Very high	40 Å²	40	60.3 Å²	60.3	41%	0.412	32%	0.319	S	S	.	.	S	Bend	trans	-65.9	-35.5	175	0	0	0	0	0	112.9	Q184	G152-Q184 VanDerWaalsContact C-NE2 3.31Å; G152-Q184 PolarHBondContact O-NE2 2.87Å
153	H	97.3	Very high	95	Very high	129 Å²	129	64.1 Å²	64.1	60%	0.597	33%	0.334	S	S	*	.	S	Bend	trans	-132.2	152.5	172.4	-54.9	-55.8	0	0	0	112.5	P151 E156	P151-H153 VanDerWaalsContact C-N 3.34Å; P151-H153 WeakPolarHBondContact CB-O 3.43Å; P151-H153 WeakPolarHBondContact CG-O 3.21Å; H153-E156 HydrophobicContact CB-CG 4.21Å; H153-E156 IonicContact CD2-OE1 3.49Å; H153-E156 PolarHBondContact CD2-OE1 2.72Å; H153-E156 IonicContact CD2-OE2 3.82Å; H153-E156 IonicContact CG-OE2 3.98Å; H153-E156 PolarHBondContact N-OE2 3.32Å; H153-E156 WeakPolarHBondContact O-CB 3.41Å; H153-E156 PolarHBondContact O-N 2.81Å
154	Y	97.1	Very high	94.4	Very high	72 Å²	72	63.5 Å²	63.5	28%	0.282	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	140.7	174.8	-64.3	-76.4	0	0	0	111.7	E156 E180 D182 Q184	Y154-E156 VanDerWaalsContact C-N 3.27Å; Y154-E156 PolarHBondContact O-N 3.47Å; Y154-E180 HydrophobicContact CG-CB 4.25Å; Y154-E180 HydrophobicContact CG-CG 4.37Å; Y154-D182 WeakPolarHBondContact CA-OD2 3.48Å; Y154-D182 HydrophobicContact CD1-CB 3.88Å; Y154-D182 WeakPolarHBondContact CD1-O 3.02Å; Y154-D182 VanDerWaalsContact CE1-O 3.25Å; Y154-D182 WeakPolarHBondContact CE1-O 3.49Å; Y154-Q184 HydrophobicContact CD1-CG 3.9Å; Y154-Q184 HydrophobicContact CE1-CB 4.48Å; Y154-Q184 HydrophobicContact CE1-CG 3.7Å; Y154-Q184 HydrophobicContact CG-CG 4.42Å; Y154-Q184 PolarHBondContact OH-OE1 3.04Å
155	G	96.8	Very high	93.7	Very high	31 Å²	31	66.4 Å²	66.4	32%	0.32	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	-6.7	-179.4	0	0	0	0	0	115.4	F64 D182	F64-G155 VanDerWaalsContact CD1-CA 3.42Å; G155-D182 PolarHBondContact N-OD2 2.77Å
156	E	97.6	Very high	93.5	Very high	87 Å²	87	64.8 Å²	64.8	41%	0.407	33%	0.328	S	S	.	.	S	Bend	trans	-82.3	159.7	172.4	-61	177.7	152.5	0	0	111.8	R72 P151 H153 Y154	R72-E156 PolarHBondContact NH1-O 3.23Å; R72-E156 PolarHBondContact NH2-O 2.82Å; P151-E156 HydrophobicContact CB-CB 3.83Å; P151-E156 HydrophobicContact CG-CB 4.49Å; H153-E156 HydrophobicContact CB-CG 4.21Å; H153-E156 IonicContact CD2-OE1 3.49Å; H153-E156 PolarHBondContact CD2-OE1 2.72Å; H153-E156 IonicContact CD2-OE2 3.82Å; H153-E156 IonicContact CG-OE2 3.98Å; H153-E156 PolarHBondContact N-OE2 3.32Å; H153-E156 WeakPolarHBondContact O-CB 3.41Å; H153-E156 PolarHBondContact O-N 2.81Å; Y154-E156 VanDerWaalsContact C-N 3.27Å; Y154-E156 PolarHBondContact O-N 3.47Å
157	D	96.4	Very high	93.4	Very high	103 Å²	103	62.5 Å²	62.5	55%	0.551	32%	0.316	S	S	*	.			trans	-72.2	151.1	172.7	-62.8	-23.5	0	0	0	110.9	S62 I63 F64	S62-D157 CarbonylContact O-C 3.51Å; S62-D157 WeakPolarHBondContact O-CA 3.16Å; I63-D157 VanDerWaalsContact CA-OD1 3.25Å; I63-D157 WeakPolarHBondContact CA-OD1 3.41Å; I63-D157 HydrophobicContact CG2-CB 4.44Å; F64-D157 PolarHBondContact N-OD1 2.89Å
158	M	96.1	Very high	93.4	Very high	6 Å²	6	63 Å²	63	3%	0.03	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	128.8	-177.1	-160.2	-178.3	83.6	0	0	110.1	V60 R61 S62 W74 Y150 W185 F187	V60-M158 HydrophobicContact CB-CE 3.73Å; V60-M158 HydrophobicContact CG1-CE 3.35Å; V60-M158 WeakPolarHBondContact O-CE 3.27Å; R61-M158 CarbonylContact C-O 3.58Å; R61-M158 WeakPolarHBondContact CA-O 3.35Å; S62-M158 PolarHBondContact N-O 2.7Å; S62-M158 PolarHBondContact O-N 3.24Å; S62-M158 VanDerWaalsContact OG-CB 3.24Å; S62-M158 WeakPolarHBondContact OG-CB 3.38Å; W74-M158 HydrophobicContact CH2-CE 4.46Å; W74-M158 HydrophobicContact CZ3-CE 3.71Å; W74-M158 HydrophobicContact CZ3-SD 4.47Å; Y150-M158 HydrophobicContact CD1-CG 4.43Å; Y150-M158 HydrophobicContact CG-CG 4.49Å; Y150-M158 VanDerWaalsContact O-SD 3.37Å; M158-W185 HydrophobicContact SD-CB 4.31Å; M158-W185 HydrophobicContact SD-CG 4.18Å; M158-F187 HydrophobicContact CE-CE2 4.4Å; M158-F187 HydrophobicContact CE-CZ 4.06Å
159	D	94.4	Very high	93.4	Very high	82 Å²	82	58.5 Å²	58.5	44%	0.439	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	94.9	167.8	-168.2	12.2	0	0	0	109	R61 Y150 I161	R61-D159 HydrophobicContact CG-CB 4.38Å; R61-D159 VanDerWaalsContact CG-OD1 3.24Å; R61-D159 WeakPolarHBondContact CG-OD1 3.21Å; R61-D159 IonicContact CZ-OD1 3.33Å; R61-D159 IonicContact CZ-OD2 3.55Å; R61-D159 IonicContact NE-OD1 3.62Å; R61-D159 PolarHBondContact NE-OD1 3.13Å; R61-D159 IonicContact NE-OD2 2.76Å; R61-D159 IonicContact NH2-OD1 3.64Å; R61-D159 IonicContact NH2-OD2 2.66Å; Y150-D159 WeakPolarHBondContact CE1-O 3.37Å; D159-I161 WeakPolarHBondContact OD1-CG1 2.93Å
160	M	94.7	Very high	93.4	Very high	4 Å²	4	55.4 Å²	55.4	2%	0.02	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	126.6	172.3	179	-87	169.8	0	0	108.9	A59 V60 T147 Y150 M169 F187 M189	A59-M160 CarbonylContact C-O 3.46Å; A59-M160 WeakPolarHBondContact CA-O 3.25Å; A59-M160 WeakPolarHBondContact CB-O 3.22Å; V60-M160 PolarHBondContact N-O 2.83Å; V60-M160 PolarHBondContact O-N 3.27Å; T147-M160 HydrophobicContact CG2-CE 4.27Å; Y150-M160 HydrophobicContact CD1-CB 3.88Å; Y150-M160 HydrophobicContact CD2-CB 4.18Å; Y150-M160 HydrophobicContact CD2-CG 4.11Å; Y150-M160 HydrophobicContact CE1-CB 4.06Å; Y150-M160 HydrophobicContact CE1-CG 4.49Å; Y150-M160 HydrophobicContact CE2-CB 4.36Å; Y150-M160 HydrophobicContact CE2-CG 4.03Å; Y150-M160 HydrophobicContact CG-CB 3.95Å; Y150-M160 HydrophobicContact CG-CG 4.38Å; M160-M169 HydrophobicContact CE-CE 4.1Å; M160-M169 HydrophobicContact SD-CE 3.85Å; M160-F187 HydrophobicContact CB-CD2 4.26Å; M160-F187 HydrophobicContact CB-CE2 3.85Å; M160-F187 HydrophobicContact CE-CB 4.41Å; M160-F187 HydrophobicContact CE-CD2 4.39Å; M160-F187 HydrophobicContact CG-CD2 3.61Å; M160-F187 HydrophobicContact CG-CE2 3.73Å; M160-F187 HydrophobicContact SD-CD2 4Å; M160-F187 HydrophobicContact SD-CE2 4.27Å; M160-F187 HydrophobicContact SD-CG 4.39Å; M160-M189 HydrophobicContact CE-CE 4.24Å; M160-M189 HydrophobicContact CE-SD 3.9Å
161	I	93.6	Very high	93.4	Very high	18 Å²	18	52.6 Å²	52.6	9%	0.092	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	130.4	176.5	-52.7	178.6	0	0	0	108.2	Y34 A59 D159 Y163	Y34-I161 HydrophobicContact CE2-CD1 4.15Å; A59-I161 HydrophobicContact CB-CB 4.35Å; A59-I161 HydrophobicContact CB-CG1 4.03Å; A59-I161 HydrophobicContact CB-CG2 4.41Å; D159-I161 WeakPolarHBondContact OD1-CG1 2.93Å; I161-Y163 HydrophobicContact CB-CE1 4.36Å; I161-Y163 HydrophobicContact CB-CE2 4.09Å; I161-Y163 HydrophobicContact CG2-CD1 4.36Å; I161-Y163 HydrophobicContact CG2-CE1 4.18Å; I161-Y163 WeakPolarHBondContact O-CD2 3.4Å; I161-Y163 PolarHBondContact O-N 2.89Å
162	S	89.3	Confident	93.5	Very high	14 Å²	14	52.4 Å²	52.4	10%	0.098	26%	0.262	C	S	.	.			trans	-77.7	101.7	167.4	-164.3	0	0	0	0	109.4	V58 D164 F167 M189	V58-S162 WeakPolarHBondContact O-CB 3.42Å; V58-S162 PolarHBondContact O-N 2.92Å; S162-D164 VanDerWaalsContact C-N 3.32Å; S162-D164 PolarHBondContact OG-O 2.98Å; S162-F167 PolarHBondContact OG-O 3.25Å; S162-M189 VanDerWaalsContact OG-CE 3.3Å; S162-M189 WeakPolarHBondContact OG-CE 3.33Å
163	Y	77.3	Confident	93.5	Very high	168 Å²	168	52.4 Å²	52.4	66%	0.659	25%	0.254	S	S	*	.			trans	-79.1	-14.2	177.1	-65	-76.8	0	0	0	113.8	I161	I161-Y163 HydrophobicContact CB-CE1 4.36Å; I161-Y163 HydrophobicContact CB-CE2 4.09Å; I161-Y163 HydrophobicContact CG2-CD1 4.36Å; I161-Y163 HydrophobicContact CG2-CE1 4.18Å; I161-Y163 WeakPolarHBondContact O-CD2 3.4Å; I161-Y163 PolarHBondContact O-N 2.89Å
164	D	82.4	Confident	93.5	Very high	67 Å²	67	46.4 Å²	46.4	36%	0.358	23%	0.227	S	C	.	.			trans	-101.8	112.3	-179.1	-168.9	-24.6	0	0	0	109.8	S162 D166 F167 R191	S162-D164 VanDerWaalsContact C-N 3.32Å; S162-D164 PolarHBondContact OG-O 2.98Å; D164-D166 PolarHBondContact O-N 3.29Å; D164-D166 WeakPolarHBondContact OD1-CB 3.49Å; D164-D166 PolarHBondContact OD1-N 3.22Å; D164-F167 HydrophobicContact CB-CD2 3.9Å; D164-F167 VanDerWaalsContact CG-CD2 3.44Å; D164-F167 PolarHBondContact O-N 3.14Å; D164-F167 VanDerWaalsContact O-N 3.1Å; D164-F167 WeakPolarHBondContact OD2-CD2 3.4Å; D164-F167 VanDerWaalsContact OD2-CE2 3.3Å; D164-F167 WeakPolarHBondContact OD2-CE2 3.32Å; D164-R191 IonicContact OD2-NH2 3.02Å
165	Y	81.1	Confident	93.5	Very high	125 Å²	125	44.7 Å²	44.7	49%	0.49	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-15	-178.3	-62.8	-85.4	0	0	0	113.7	Y31 M79 Y168	Y31-Y165 WeakPolarHBondContact CE2-OH 3.37Å; M79-Y165 HydrophobicContact CE-CD1 4.21Å; M79-Y165 HydrophobicContact CE-CE1 3.73Å; M79-Y165 HydrophobicContact SD-CD1 3.67Å; M79-Y165 HydrophobicContact SD-CE1 3.69Å; Y165-Y168 PolarHBondContact O-OH 3.28Å
166	D	91	Very high	93.5	Very high	91 Å²	91	44.7 Å²	44.7	49%	0.487	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-8	175.6	-69.6	-22.6	0	0	0	113	D164 Y168 R191	D164-D166 PolarHBondContact O-N 3.29Å; D164-D166 WeakPolarHBondContact OD1-CB 3.49Å; D164-D166 PolarHBondContact OD1-N 3.22Å; D166-Y168 WeakPolarHBondContact O-CE2 3.15Å; D166-R191 WeakPolarHBondContact O-CA 3.25Å; D166-R191 IonicContact OD2-NH2 3.7Å
167	F	95.4	Very high	93.5	Very high	27 Å²	27	41.6 Å²	41.6	12%	0.118	20%	0.203	C	C	.	.			trans	-113.2	129.1	-178.4	-74.8	-90.1	0	0	0	113.7	W145 S162 D164 M189 C190 R191	W145-F167 AromaticContact CD1-CD1 3.69Å; W145-F167 AromaticContact CD1-CE1 3.3Å; W145-F167 AromaticContact CD1-CZ 3.97Å; W145-F167 AromaticContact NE1-CD1 3.2Å; W145-F167 AromaticContact NE1-CE1 3.15Å; W145-F167 AromaticContact NE1-CG 3.78Å; W145-F167 AromaticContact NE1-CZ 3.67Å; S162-F167 PolarHBondContact OG-O 3.25Å; D164-F167 HydrophobicContact CB-CD2 3.9Å; D164-F167 VanDerWaalsContact CG-CD2 3.44Å; D164-F167 PolarHBondContact O-N 3.14Å; D164-F167 VanDerWaalsContact O-N 3.1Å; D164-F167 WeakPolarHBondContact OD2-CD2 3.4Å; D164-F167 VanDerWaalsContact OD2-CE2 3.3Å; D164-F167 WeakPolarHBondContact OD2-CE2 3.32Å; F167-M189 HydrophobicContact CB-CB 4.4Å; F167-M189 HydrophobicContact CB-CE 4.37Å; F167-M189 HydrophobicContact CD1-CB 4.33Å; F167-C190 WeakPolarHBondContact CA-O 3.26Å; F167-R191 HydrophobicContact CD1-CG 3.81Å; F167-R191 HydrophobicContact CD2-CG 4.24Å; F167-R191 HydrophobicContact CE1-CG 3.51Å; F167-R191 HydrophobicContact CE2-CG 4.03Å; F167-R191 HydrophobicContact CG-CG 4.19Å; F167-R191 HydrophobicContact CZ-CG 3.66Å; F167-R191 VanDerWaalsContact CZ-NE 3.25Å
168	Y	96.1	Very high	93.4	Very high	23 Å²	23	39.4 Å²	39.4	9%	0.09	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	143	-174.6	-54.5	-85.6	0	0	0	110.7	V56 T81 P82 L85 L112 Y165 D166 R170 M189 C190 M192	V56-Y168 HydrophobicContact CG2-CD1 3.99Å; T81-Y168 HydrophobicContact CG2-CE1 4.23Å; P82-Y168 WeakPolarHBondContact CD-OH 3.07Å; P82-Y168 VanDerWaalsContact CG-OH 3.26Å; P82-Y168 WeakPolarHBondContact CG-OH 3.19Å; L85-Y168 HydrophobicContact CD1-CE1 4.17Å; L85-Y168 HydrophobicContact CD1-CE2 4.25Å; L112-Y168 HydrophobicContact CD1-CD1 3.97Å; L112-Y168 HydrophobicContact CD1-CG 3.86Å; L112-Y168 HydrophobicContact CD2-CG 4.39Å; Y165-Y168 PolarHBondContact O-OH 3.28Å; D166-Y168 WeakPolarHBondContact O-CE2 3.15Å; Y168-R170 PolarHBondContact O-N 2.75Å; Y168-M189 WeakPolarHBondContact O-CA 3.38Å; Y168-C190 PolarHBondContact N-O 3.33Å; Y168-C190 PolarHBondContact O-N 3.49Å; Y168-M192 HydrophobicContact CD2-CB 4.31Å; Y168-M192 HydrophobicContact CD2-CG 3.62Å; Y168-M192 HydrophobicContact CE2-CB 4.33Å; Y168-M192 HydrophobicContact CE2-CG 4.1Å; Y168-M192 HydrophobicContact CG-CG 4.29Å
169	M	97.5	Very high	93.4	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.01	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	119.8	176.1	-170.4	178	-63.9	0	0	110.1	V60 V113 F116 M160 F187 M189	V60-M169 HydrophobicContact CG2-CE 3.93Å; V113-M169 HydrophobicContact CB-CB 4.19Å; V113-M169 HydrophobicContact CB-CG 4.04Å; V113-M169 HydrophobicContact CB-SD 4.24Å; V113-M169 HydrophobicContact CG1-SD 4.19Å; V113-M169 HydrophobicContact CG2-CB 4.46Å; V113-M169 HydrophobicContact CG2-CG 3.94Å; V113-M169 HydrophobicContact CG2-SD 4.4Å; V113-M169 PolarHBondContact N-O 2.99Å; F116-M169 HydrophobicContact CE2-SD 4.26Å; F116-M169 HydrophobicContact CZ-SD 3.96Å; M160-M169 HydrophobicContact CE-CE 4.1Å; M160-M169 HydrophobicContact SD-CE 3.85Å; M169-F187 HydrophobicContact CE-CB 4.08Å; M169-F187 HydrophobicContact CE-CD1 3.39Å; M169-F187 HydrophobicContact CE-CE1 3.94Å; M169-F187 HydrophobicContact CE-CG 3.74Å; M169-F187 HydrophobicContact CG-CB 4.49Å; M169-F187 HydrophobicContact CG-CD1 4.34Å; M169-F187 HydrophobicContact SD-CD1 3.5Å; M169-F187 VanDerWaalsContact SD-CD1 3.5Å; M169-F187 HydrophobicContact SD-CE1 4.05Å; M169-F187 HydrophobicContact SD-CG 4.33Å; M169-M189 HydrophobicContact CB-CE 4.38Å; M169-M189 HydrophobicContact CB-SD 4.04Å; M169-M189 HydrophobicContact CG-SD 4.32Å
170	R	96.5	Very high	93.5	Very high	11 Å²	11	44 Å²	44	4%	0.042	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	-5.8	176.5	-104.7	-103	-80.2	-175.3	-11.6	113.2	K106 C107 G111 L112 P141 Y168 I188 C190 N201	K106-R170 CarbonylContact C-O 3.6Å; K106-R170 VanDerWaalsContact CA-O 3.27Å; K106-R170 WeakPolarHBondContact CA-O 3.37Å; C107-R170 PolarHBondContact N-O 2.86Å; C107-R170 PolarHBondContact O-NH1 2.89Å; C107-R170 VanDerWaalsContact O-NH1 3.15Å; G111-R170 WeakPolarHBondContact O-CD 3.21Å; L112-R170 HydrophobicContact CD2-CG 3.99Å; P141-R170 HydrophobicContact CB-CG 4.17Å; P141-R170 VanDerWaalsContact CG-NE 3.34Å; P141-R170 VanDerWaalsContact CG-NH2 3.27Å; Y168-R170 PolarHBondContact O-N 2.75Å; R170-I188 HydrophobicContact CB-CB 4.47Å; R170-I188 HydrophobicContact CB-CG2 4.04Å; R170-I188 PolarHBondContact N-O 2.82Å; R170-C190 HydrophobicContact CG-CB 4.14Å; R170-N201 PolarHBondContact NH2-O 3.37Å
171	G	97.8	Very high	93.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151	-159.5	179.8	0	0	0	0	0	112	Q105 I188	Q105-G171 VanDerWaalsContact O-CA 3.29Å; Q105-G171 WeakPolarHBondContact O-CA 3.44Å; G171-I188 PolarHBondContact O-N 2.66Å
172	A	98.2	Very high	93.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	165.5	176.8	0	0	0	0	0	112.5	Q105 F131 W185 K186 F187	Q105-A172 PolarHBondContact N-O 2.98Å; Q105-A172 PolarHBondContact O-N 3.06Å; F131-A172 HydrophobicContact CZ-CB 3.81Å; A172-W185 HydrophobicContact CB-CE3 3.9Å; A172-W185 HydrophobicContact CB-CZ3 4.2Å; A172-K186 CarbonylContact C-O 3.51Å; A172-K186 VanDerWaalsContact CA-O 3.27Å; A172-K186 WeakPolarHBondContact CA-O 3.24Å; A172-K186 WeakPolarHBondContact CB-O 3.48Å; A172-F187 HydrophobicContact CB-CD1 3.88Å; A172-F187 HydrophobicContact CB-CE1 4.25Å
173	T	97.9	Very high	94.1	Very high	41 Å²	41	46.8 Å²	46.8	25%	0.252	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	152.5	158	-166.2	0	0	0	0	110.1	W103 M146 K186	W103-T173 CarbonylContact O-C 3.59Å; W103-T173 VanDerWaalsContact O-CA 3.24Å; W103-T173 WeakPolarHBondContact O-CA 3.39Å; M146-T173 HydrophobicContact CE-CG2 3.68Å; T173-K186 HydrophobicContact CG2-CB 3.9Å; T173-K186 HydrophobicContact CG2-CD 4.25Å; T173-K186 HydrophobicContact CG2-CG 4.48Å; T173-K186 PolarHBondContact N-O 2.91Å; T173-K186 PolarHBondContact O-N 2.93Å
174	T	97.5	Very high	95.1	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.018	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	141.9	-172.1	58.8	0	0	0	0	112.8	E102 W103 R183 Q184 W185	E102-T174 WeakPolarHBondContact CA-O 3.32Å; W103-T174 WeakPolarHBondContact CB-OG1 3.3Å; W103-T174 HydrophobicContact CE3-CG2 4.28Å; W103-T174 PolarHBondContact N-O 2.98Å; W103-T174 PolarHBondContact N-OG1 2.79Å; W103-T174 PolarHBondContact O-N 2.84Å; W103-T174 PolarHBondContact O-OG1 2.76Å; T174-R183 HydrophobicContact CG2-CG 4.27Å; T174-R183 PolarHBondContact OG1-NH1 2.98Å; T174-Q184 WeakPolarHBondContact CA-O 3.35Å; T174-Q184 VanDerWaalsContact CB-O 3.32Å; T174-Q184 WeakPolarHBondContact CB-O 3.4Å; T174-W185 HydrophobicContact CG2-CB 4.44Å; T174-W185 HydrophobicContact CG2-CD2 3.37Å; T174-W185 HydrophobicContact CG2-CE3 3.29Å; T174-W185 HydrophobicContact CG2-CG 3.93Å; T174-W185 HydrophobicContact CG2-CH2 3.97Å; T174-W185 HydrophobicContact CG2-CZ2 4.05Å; T174-W185 HydrophobicContact CG2-CZ3 3.62Å
175	T	96.9	Very high	95.9	Very high	36 Å²	36	36.3 Å²	36.3	22%	0.221	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	143.2	174.8	49.1	0	0	0	0	109.4	R183 Q184	T175-R183 CarbonylContact O-C 3.6Å; T175-R183 VanDerWaalsContact O-CA 3.26Å; T175-R183 WeakPolarHBondContact O-CA 3.26Å; T175-R183 WeakPolarHBondContact O-CG 3.34Å; T175-Q184 PolarHBondContact N-O 2.73Å; T175-Q184 PolarHBondContact O-N 2.69Å
176	F	96.8	Very high	96.7	Very high	31 Å²	31	33.5 Å²	33.5	14%	0.136	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130	-177	173.5	-102.3	0	0	0	111.4	G100 D126 A178 D182 R183	G100-F176 WeakPolarHBondContact O-CD1 3.42Å; D126-F176 HydrophobicContact CB-CD2 4.14Å; D126-F176 HydrophobicContact CB-CE2 3.52Å; D126-F176 HydrophobicContact CB-CZ 3.93Å; F176-A178 HydrophobicContact CE1-CB 4.12Å; F176-D182 VanDerWaalsContact CD2-O 3.23Å; F176-D182 WeakPolarHBondContact CD2-O 3.48Å; F176-R183 HydrophobicContact CD2-CB 4.47Å
177	S	96.8	Very high	97	Very high	21 Å²	21	29.2 Å²	29.2	15%	0.147	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	110.7	174.3	177.8	0	0	0	0	110.8	V179 E180 R181 D182	S177-V179 PolarHBondContact O-N 2.95Å; S177-V179 PolarHBondContact OG-N 2.82Å; S177-E180 PolarHBondContact O-N 2.76Å; S177-E180 PolarHBondContact OG-N 3.22Å; S177-R181 VanDerWaalsContact O-CA 3.26Å; S177-R181 WeakPolarHBondContact O-CA 3.4Å; S177-R181 PolarHBondContact O-N 2.89Å; S177-D182 PolarHBondContact N-O 2.82Å
178	A	95.4	Very high	97.1	Very high	58 Å²	58	28.2 Å²	28.2	48%	0.479	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-7.9	171.5	0	0	0	0	0	113.8	F176 R181	F176-A178 HydrophobicContact CE1-CB 4.12Å; A178-R181 PolarHBondContact O-NE 3.1Å; A178-R181 PolarHBondContact O-NH2 2.92Å
179	V	95.5	Very high	97.2	Very high	118 Å²	118	27.2 Å²	27.2	72%	0.715	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-50.4	174.1	177.4	0	0	0	0	110.5	S177	S177-V179 PolarHBondContact O-N 2.95Å; S177-V179 PolarHBondContact OG-N 2.82Å
180	E	96.3	Very high	97.1	Very high	67 Å²	67	27.1 Å²	27.1	31%	0.313	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-19.9	-178.7	-63.3	-53.5	143.6	0	0	113.5	K66 Y154 S177 D182	K66-E180 IonicContact NZ-OE2 2.62Å; K66-E180 PolarHBondContact NZ-OE2 3.12Å; Y154-E180 HydrophobicContact CG-CB 4.25Å; Y154-E180 HydrophobicContact CG-CG 4.37Å; S177-E180 PolarHBondContact O-N 2.76Å; S177-E180 PolarHBondContact OG-N 3.22Å; E180-D182 HydrophobicContact CB-CB 4.42Å
181	R	96.8	Very high	97	Very high	82 Å²	82	30.4 Å²	30.4	31%	0.309	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	53.8	-174.9	-57.4	-65.8	169.5	159.3	-8.3	111.1	S70 V124 L125 S177 A178	S70-R181 VanDerWaalsContact CB-CB 3.43Å; S70-R181 VanDerWaalsContact CB-O 3.25Å; S70-R181 WeakPolarHBondContact CB-O 3.41Å; S70-R181 VanDerWaalsContact O-O 3.09Å; V124-R181 WeakPolarHBondContact O-CD 3.2Å; V124-R181 PolarHBondContact O-NH1 2.91Å; L125-R181 HydrophobicContact CB-CB 4.06Å; L125-R181 HydrophobicContact CB-CG 4.19Å; L125-R181 HydrophobicContact CD1-CG 4.16Å; S177-R181 VanDerWaalsContact O-CA 3.26Å; S177-R181 WeakPolarHBondContact O-CA 3.4Å; S177-R181 PolarHBondContact O-N 2.89Å; A178-R181 PolarHBondContact O-NE 3.1Å; A178-R181 PolarHBondContact O-NH2 2.92Å
182	D	97.5	Very high	96.8	Very high	6 Å²	6	31.1 Å²	31.1	3%	0.032	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	161.2	-172.4	-173.6	32.2	0	0	0	111.2	F64 R72 Y154 G155 F176 S177 E180	F64-D182 HydrophobicContact CD2-CB 4.29Å; F64-D182 HydrophobicContact CE2-CB 3.69Å; F64-D182 HydrophobicContact CZ-CB 4.12Å; R72-D182 IonicContact CZ-OD1 3.36Å; R72-D182 IonicContact CZ-OD2 3.73Å; R72-D182 IonicContact NE-OD1 2.73Å; R72-D182 PolarHBondContact NE-OD1 2.78Å; R72-D182 IonicContact NE-OD2 3.87Å; R72-D182 VanDerWaalsContact NH2-CG 3.31Å; R72-D182 IonicContact NH2-OD1 3.15Å; R72-D182 PolarHBondContact NH2-OD1 3.47Å; R72-D182 VanDerWaalsContact NH2-OD1 3.15Å; R72-D182 IonicContact NH2-OD2 2.75Å; R72-D182 PolarHBondContact NH2-OD2 2.75Å; Y154-D182 WeakPolarHBondContact CA-OD2 3.48Å; Y154-D182 HydrophobicContact CD1-CB 3.88Å; Y154-D182 WeakPolarHBondContact CD1-O 3.02Å; Y154-D182 VanDerWaalsContact CE1-O 3.25Å; Y154-D182 WeakPolarHBondContact CE1-O 3.49Å; G155-D182 PolarHBondContact N-OD2 2.77Å; F176-D182 VanDerWaalsContact CD2-O 3.23Å; F176-D182 WeakPolarHBondContact CD2-O 3.48Å; S177-D182 PolarHBondContact N-O 2.82Å; E180-D182 HydrophobicContact CB-CB 4.42Å
183	R	97	Very high	96.5	Very high	6 Å²	6	31.1 Å²	31.1	2%	0.023	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	129.4	-170.8	-176.7	175.8	-69.3	-85.4	-1.5	111.7	M101 D126 T174 T175 F176 W185	M101-R183 VanDerWaalsContact O-CZ 3.3Å; M101-R183 PolarHBondContact O-NH1 3.1Å; M101-R183 PolarHBondContact O-NH2 3.2Å; D126-R183 IonicContact OD1-NE 2.95Å; D126-R183 PolarHBondContact OD1-NE 3.03Å; D126-R183 IonicContact OD1-NH2 3.57Å; D126-R183 IonicContact OD2-CZ 3.32Å; D126-R183 IonicContact OD2-NE 2.7Å; D126-R183 IonicContact OD2-NH2 3.66Å; D126-R183 PolarHBondContact OD2-NH2 3.15Å; T174-R183 HydrophobicContact CG2-CG 4.27Å; T174-R183 PolarHBondContact OG1-NH1 2.98Å; T175-R183 CarbonylContact O-C 3.6Å; T175-R183 VanDerWaalsContact O-CA 3.26Å; T175-R183 WeakPolarHBondContact O-CA 3.26Å; T175-R183 WeakPolarHBondContact O-CG 3.34Å; F176-R183 HydrophobicContact CD2-CB 4.47Å; R183-W185 HydrophobicContact CG-CZ2 4.46Å
184	Q	97.9	Very high	95.9	Very high	14 Å²	14	35.5 Å²	35.5	7%	0.065	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	155.4	170.1	-61.6	179.1	-84.3	0	0	110.7	P151 G152 Y154 T174 T175	P151-Q184 HydrophobicContact CG-CG 4.4Å; P151-Q184 PolarHBondContact O-NE2 2.83Å; G152-Q184 VanDerWaalsContact C-NE2 3.31Å; G152-Q184 PolarHBondContact O-NE2 2.87Å; Y154-Q184 HydrophobicContact CD1-CG 3.9Å; Y154-Q184 HydrophobicContact CE1-CB 4.48Å; Y154-Q184 HydrophobicContact CE1-CG 3.7Å; Y154-Q184 HydrophobicContact CG-CG 4.42Å; Y154-Q184 PolarHBondContact OH-OE1 3.04Å; T174-Q184 WeakPolarHBondContact CA-O 3.35Å; T174-Q184 VanDerWaalsContact CB-O 3.32Å; T174-Q184 WeakPolarHBondContact CB-O 3.4Å; T175-Q184 PolarHBondContact N-O 2.73Å; T175-Q184 PolarHBondContact O-N 2.69Å
185	W	98.2	Very high	95.3	Very high	1 Å²	1	42.2 Å²	42.2	0%	0.004	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	141.7	-169.8	-63.1	74.1	0	0	0	111.4	W74 W103 F116 W129 E149 Y150 M158 A172 T174 R183 F187	W74-W185 AromaticContact CH2-CE2 3.92Å; W74-W185 HydrophobicContact CH2-CZ2 4.09Å; W74-W185 AromaticContact CH2-NE1 3.61Å; W103-W185 HydrophobicContact CE3-CH2 4.4Å; W103-W185 HydrophobicContact CE3-CZ3 4.37Å; W103-W185 AromaticContact CZ3-CH2 3.9Å; W103-W185 HydrophobicContact CZ3-CH2 3.9Å; W103-W185 AromaticContact CZ3-CZ3 3.79Å; W103-W185 HydrophobicContact CZ3-CZ3 3.79Å; F116-W185 HydrophobicContact CE1-CZ3 4.36Å; W129-W185 AromaticContact CD2-CH2 3.51Å; W129-W185 HydrophobicContact CD2-CH2 3.51Å; W129-W185 AromaticContact CD2-CZ2 3.8Å; W129-W185 HydrophobicContact CD2-CZ2 3.8Å; W129-W185 AromaticContact CE2-CH2 3.77Å; W129-W185 AromaticContact CE2-CZ2 3.51Å; W129-W185 AromaticContact CE3-CH2 3.79Å; W129-W185 HydrophobicContact CE3-CH2 3.79Å; W129-W185 HydrophobicContact CE3-CZ2 4.26Å; W129-W185 AromaticContact CG-CH2 3.82Å; W129-W185 HydrophobicContact CG-CH2 3.82Å; W129-W185 HydrophobicContact CG-CZ2 4.26Å; W129-W185 HydrophobicContact CH2-CZ2 4.24Å; W129-W185 HydrophobicContact CZ2-CH2 4.28Å; W129-W185 AromaticContact CZ2-CZ2 3.76Å; W129-W185 HydrophobicContact CZ2-CZ2 3.76Å; W129-W185 HydrophobicContact CZ3-CH2 4.28Å; W129-W185 HydrophobicContact CZ3-CZ2 4.46Å; W129-W185 AromaticContact NE1-CZ2 3.77Å; E149-W185 CarbonylContact C-O 3.53Å; E149-W185 WeakPolarHBondContact CA-O 3.18Å; Y150-W185 PolarHBondContact N-O 2.83Å; Y150-W185 WeakPolarHBondContact O-CB 3.15Å; Y150-W185 PolarHBondContact O-N 2.78Å; M158-W185 HydrophobicContact SD-CB 4.31Å; M158-W185 HydrophobicContact SD-CG 4.18Å; A172-W185 HydrophobicContact CB-CE3 3.9Å; A172-W185 HydrophobicContact CB-CZ3 4.2Å; T174-W185 HydrophobicContact CG2-CB 4.44Å; T174-W185 HydrophobicContact CG2-CD2 3.37Å; T174-W185 HydrophobicContact CG2-CE3 3.29Å; T174-W185 HydrophobicContact CG2-CG 3.93Å; T174-W185 HydrophobicContact CG2-CH2 3.97Å; T174-W185 HydrophobicContact CG2-CZ2 4.05Å; T174-W185 HydrophobicContact CG2-CZ3 3.62Å; R183-W185 HydrophobicContact CG-CZ2 4.46Å; W185-F187 HydrophobicContact CB-CE2 3.87Å; W185-F187 HydrophobicContact CB-CZ 3.85Å; W185-F187 HydrophobicContact CD2-CZ 4.35Å; W185-F187 AromaticContact CE3-CE1 3.93Å; W185-F187 HydrophobicContact CE3-CE1 3.93Å; W185-F187 HydrophobicContact CE3-CZ 4.1Å; W185-F187 HydrophobicContact CG-CZ 4.27Å
186	K	98.1	Very high	94.5	Very high	66 Å²	66	44.7 Å²	44.7	29%	0.287	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	126.9	159.9	-59.5	169.8	-178.9	154.2	0	107.7	M146 T147 E149 A172 T173	M146-K186 HydrophobicContact CE-CB 3.48Å; M146-K186 VanDerWaalsContact CE-CB 3.48Å; M146-K186 VanDerWaalsContact CE-O 3.27Å; M146-K186 WeakPolarHBondContact CE-O 3.24Å; T147-K186 WeakPolarHBondContact O-CG 3.41Å; T147-K186 WeakPolarHBondContact OG1-CA 3.07Å; E149-K186 HydrophobicContact CG-CD 4.17Å; E149-K186 HydrophobicContact CG-CG 3.86Å; E149-K186 WeakPolarHBondContact OE1-CE 3.24Å; E149-K186 IonicContact OE1-NZ 3.79Å; E149-K186 PolarHBondContact OE1-NZ 2.8Å; A172-K186 CarbonylContact C-O 3.51Å; A172-K186 VanDerWaalsContact CA-O 3.27Å; A172-K186 WeakPolarHBondContact CA-O 3.24Å; A172-K186 WeakPolarHBondContact CB-O 3.48Å; T173-K186 HydrophobicContact CG2-CB 3.9Å; T173-K186 HydrophobicContact CG2-CD 4.25Å; T173-K186 HydrophobicContact CG2-CG 4.48Å; T173-K186 PolarHBondContact N-O 2.91Å; T173-K186 PolarHBondContact O-N 2.93Å
187	F	97.9	Very high	93.8	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	144.9	-178.2	-59.3	-84.4	0	0	0	110.9	V60 F116 M146 T147 Y150 M158 M160 M169 A172 W185 M189	V60-F187 HydrophobicContact CB-CZ 4.05Å; V60-F187 HydrophobicContact CG1-CZ 4.36Å; V60-F187 HydrophobicContact CG2-CE1 3.96Å; V60-F187 HydrophobicContact CG2-CZ 4Å; F116-F187 HydrophobicContact CZ-CE1 4.35Å; M146-F187 WeakPolarHBondContact CA-O 3.4Å; T147-F187 HydrophobicContact CG2-CB 3.94Å; T147-F187 PolarHBondContact N-O 3.19Å; T147-F187 PolarHBondContact OG1-N 3.47Å; Y150-F187 HydrophobicContact CD2-CD2 4.49Å; M158-F187 HydrophobicContact CE-CE2 4.4Å; M158-F187 HydrophobicContact CE-CZ 4.06Å; M160-F187 HydrophobicContact CB-CD2 4.26Å; M160-F187 HydrophobicContact CB-CE2 3.85Å; M160-F187 HydrophobicContact CE-CB 4.41Å; M160-F187 HydrophobicContact CE-CD2 4.39Å; M160-F187 HydrophobicContact CG-CD2 3.61Å; M160-F187 HydrophobicContact CG-CE2 3.73Å; M160-F187 HydrophobicContact SD-CD2 4Å; M160-F187 HydrophobicContact SD-CE2 4.27Å; M160-F187 HydrophobicContact SD-CG 4.39Å; M169-F187 HydrophobicContact CE-CB 4.08Å; M169-F187 HydrophobicContact CE-CD1 3.39Å; M169-F187 HydrophobicContact CE-CE1 3.94Å; M169-F187 HydrophobicContact CE-CG 3.74Å; M169-F187 HydrophobicContact CG-CB 4.49Å; M169-F187 HydrophobicContact CG-CD1 4.34Å; M169-F187 HydrophobicContact SD-CD1 3.5Å; M169-F187 VanDerWaalsContact SD-CD1 3.5Å; M169-F187 HydrophobicContact SD-CE1 4.05Å; M169-F187 HydrophobicContact SD-CG 4.33Å; A172-F187 HydrophobicContact CB-CD1 3.88Å; A172-F187 HydrophobicContact CB-CE1 4.25Å; W185-F187 HydrophobicContact CB-CE2 3.87Å; W185-F187 HydrophobicContact CB-CZ 3.85Å; W185-F187 HydrophobicContact CD2-CZ 4.35Å; W185-F187 AromaticContact CE3-CE1 3.93Å; W185-F187 HydrophobicContact CE3-CE1 3.93Å; W185-F187 HydrophobicContact CE3-CZ 4.1Å; W185-F187 HydrophobicContact CG-CZ 4.27Å; F187-M189 HydrophobicContact CB-SD 4.04Å
188	I	97.3	Very high	92.5	Very high	6 Å²	6	51.8 Å²	51.8	3%	0.031	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	109.5	176.9	-58.1	166.2	0	0	0	106.5	Y104 K106 M146 R170 G171	Y104-I188 HydrophobicContact CE2-CD1 3.89Å; K106-I188 HydrophobicContact CD-CD1 4.18Å; K106-I188 HydrophobicContact CG-CD1 3.39Å; M146-I188 HydrophobicContact CE-CG1 3.82Å; M146-I188 HydrophobicContact SD-CB 4.26Å; M146-I188 HydrophobicContact SD-CG1 3.49Å; M146-I188 WeakPolarHBondContact SD-CG1 3.25Å; R170-I188 HydrophobicContact CB-CB 4.47Å; R170-I188 HydrophobicContact CB-CG2 4.04Å; R170-I188 PolarHBondContact N-O 2.82Å; G171-I188 PolarHBondContact O-N 2.66Å
189	M	97.3	Very high	91.3	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.015	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	125.5	-176.8	-57.4	-53.5	-64.6	0	0	109.7	C144 W145 T147 M160 S162 F167 Y168 M169 F187	C144-M189 CarbonylContact C-O 3.49Å; C144-M189 WeakPolarHBondContact CA-O 3.43Å; W145-M189 HydrophobicContact CD2-CB 4.35Å; W145-M189 HydrophobicContact CZ2-CB 4.02Å; W145-M189 HydrophobicContact CZ2-CG 4.14Å; W145-M189 PolarHBondContact N-O 3.43Å; W145-M189 PolarHBondContact O-N 2.92Å; T147-M189 HydrophobicContact CG2-CG 3.79Å; M160-M189 HydrophobicContact CE-CE 4.24Å; M160-M189 HydrophobicContact CE-SD 3.9Å; S162-M189 VanDerWaalsContact OG-CE 3.3Å; S162-M189 WeakPolarHBondContact OG-CE 3.33Å; F167-M189 HydrophobicContact CB-CB 4.4Å; F167-M189 HydrophobicContact CB-CE 4.37Å; F167-M189 HydrophobicContact CD1-CB 4.33Å; Y168-M189 WeakPolarHBondContact O-CA 3.38Å; M169-M189 HydrophobicContact CB-CE 4.38Å; M169-M189 HydrophobicContact CB-SD 4.04Å; M169-M189 HydrophobicContact CG-SD 4.32Å; F187-M189 HydrophobicContact CB-SD 4.04Å
190	C	96.2	Very high	90	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	150.7	-177.9	-59	0	0	0	0	111.7	P141 C144 F167 Y168 R170	P141-C190 HydrophobicContact CB-CB 3.9Å; C144-C190 HydrophobicContact CB-CB 4.11Å; C144-C190 WeakPolarHBondContact CB-SG 3.23Å; C144-C190 WeakPolarHBondContact SG-CB 3.36Å; C144-C190 CovalentContact SG-SG 2.04Å; C144-C190 PolarHBondContact SG-SG 3.24Å; F167-C190 WeakPolarHBondContact CA-O 3.26Å; Y168-C190 PolarHBondContact N-O 3.33Å; Y168-C190 PolarHBondContact O-N 3.49Å; R170-C190 HydrophobicContact CG-CB 4.14Å
191	R	94.9	Very high	88.3	Confident	79 Å²	79	55.9 Å²	55.9	30%	0.298	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	159.2	163.4	-62.1	-168.5	164	-165.3	-14.9	110.1	P141 Y142 D164 D166 F167	P141-R191 CarbonylContact C-O 3.57Å; P141-R191 WeakPolarHBondContact CA-O 3.47Å; Y142-R191 HydrophobicContact CD1-CB 3.92Å; Y142-R191 WeakPolarHBondContact CD1-O 3.14Å; Y142-R191 HydrophobicContact CE1-CB 3.5Å; Y142-R191 VanDerWaalsContact CE1-CB 3.5Å; Y142-R191 HydrophobicContact CE2-CB 4.17Å; Y142-R191 HydrophobicContact CG-CB 4.41Å; Y142-R191 PolarHBondContact N-O 3.12Å; Y142-R191 PolarHBondContact O-N 3.12Å; D164-R191 IonicContact OD2-NH2 3.02Å; D166-R191 WeakPolarHBondContact O-CA 3.25Å; D166-R191 IonicContact OD2-NH2 3.7Å; F167-R191 HydrophobicContact CD1-CG 3.81Å; F167-R191 HydrophobicContact CD2-CG 4.24Å; F167-R191 HydrophobicContact CE1-CG 3.51Å; F167-R191 HydrophobicContact CE2-CG 4.03Å; F167-R191 HydrophobicContact CG-CG 4.19Å; F167-R191 HydrophobicContact CZ-CG 3.66Å; F167-R191 VanDerWaalsContact CZ-NE 3.25Å
192	M	93.5	Very high	86.3	Confident	15 Å²	15	59.8 Å²	59.8	7%	0.074	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	136.5	178	-64.9	-60.3	-72.3	0	0	111	L85 L112 R139 C140 P141 Y168	L85-M192 HydrophobicContact CD1-CB 4.27Å; L85-M192 HydrophobicContact CD1-CG 4.35Å; L85-M192 HydrophobicContact CD2-CB 3.59Å; L85-M192 HydrophobicContact CD2-CG 4.48Å; L112-M192 HydrophobicContact CD1-CG 4.2Å; L112-M192 HydrophobicContact CD2-CE 4.31Å; L112-M192 HydrophobicContact CD2-CG 4.17Å; L112-M192 HydrophobicContact CD2-SD 3.69Å; L112-M192 HydrophobicContact CG-CE 4.42Å; L112-M192 HydrophobicContact CG-SD 4.38Å; R139-M192 HydrophobicContact CB-CE 3.67Å; C140-M192 CarbonylContact O-C 3.56Å; C140-M192 WeakPolarHBondContact O-CA 3.24Å; P141-M192 VanDerWaalsContact CA-SD 3.53Å; P141-M192 HydrophobicContact CB-SD 3.71Å; P141-M192 HydrophobicContact CG-SD 4.42Å; Y168-M192 HydrophobicContact CD2-CB 4.31Å; Y168-M192 HydrophobicContact CD2-CG 3.62Å; Y168-M192 HydrophobicContact CE2-CB 4.33Å; Y168-M192 HydrophobicContact CE2-CG 4.1Å; Y168-M192 HydrophobicContact CG-CG 4.29Å
193	T	91.7	Very high	85.7	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.006	30%	0.304	C	S	.	.			trans	-65	141.1	-174.8	55.4	0	0	0	0	113.3	R139 C140 Y142 Y195	R139-T193 WeakPolarHBondContact CD-O 3.36Å; R139-T193 PolarHBondContact NH1-O 3.04Å; C140-T193 HydrophobicContact CB-CG2 3.86Å; C140-T193 PolarHBondContact N-OG1 2.94Å; C140-T193 WeakPolarHBondContact O-CG2 3.19Å; C140-T193 PolarHBondContact O-N 3.05Å; Y142-T193 HydrophobicContact CD1-CG2 3.74Å; Y142-T193 HydrophobicContact CE1-CG2 4.12Å; Y142-T193 HydrophobicContact CG-CG2 4.48Å; T193-Y195 VanDerWaalsContact C-N 3.28Å; T193-Y195 WeakPolarHBondContact CB-O 3.44Å; T193-Y195 HydrophobicContact CG2-CD1 4.26Å; T193-Y195 HydrophobicContact CG2-CD2 4.33Å; T193-Y195 HydrophobicContact CG2-CE1 3.63Å; T193-Y195 HydrophobicContact CG2-CE2 3.71Å; T193-Y195 WeakPolarHBondContact CG2-OH 3.31Å; T193-Y195 PolarHBondContact OG1-O 2.94Å
194	D	85.1	Confident	85.1	Confident	133 Å²	133	65.4 Å²	65.4	71%	0.711	32%	0.319	S	S	*	.	S	Bend	trans	-78.7	-12.3	168.5	65.3	-26.1	0	0	0	112.8	R139	R139-D194 VanDerWaalsContact NH1-CA 3.31Å; R139-D194 PolarHBondContact NH1-O 3.38Å
195	Y	83.9	Confident	84.4	Confident	143 Å²	143	68.3 Å²	68.3	56%	0.561	33%	0.333	S	S	*	.	S	Bend	trans	-104	157.7	171	58.9	-91.9	0	0	0	114	T193	T193-Y195 VanDerWaalsContact C-N 3.28Å; T193-Y195 WeakPolarHBondContact CB-O 3.44Å; T193-Y195 HydrophobicContact CG2-CD1 4.26Å; T193-Y195 HydrophobicContact CG2-CD2 4.33Å; T193-Y195 HydrophobicContact CG2-CE1 3.63Å; T193-Y195 HydrophobicContact CG2-CE2 3.71Å; T193-Y195 WeakPolarHBondContact CG2-OH 3.31Å; T193-Y195 PolarHBondContact OG1-O 2.94Å
196	D	81.2	Confident	83.6	Confident	88 Å²	88	72.2 Å²	72.2	47%	0.471	35%	0.352	S	S	.	.			trans	-68.7	126.3	172	-73.9	-4.9	0	0	0	110.9	K138	K138-D196 HydrophobicContact CB-CB 3.88Å; K138-D196 HydrophobicContact CD-CB 3.81Å; K138-D196 VanDerWaalsContact CD-OD1 3.3Å; K138-D196 WeakPolarHBondContact CD-OD1 3.27Å; K138-D196 WeakPolarHBondContact CD-OD2 3.27Å; K138-D196 WeakPolarHBondContact CE-OD2 3.43Å; K138-D196 IonicContact NZ-OD2 3.62Å; K138-D196 PolarHBondContact NZ-OD2 3.31Å; K138-D196 CarbonylContact O-C 3.49Å; K138-D196 WeakPolarHBondContact O-CA 3.44Å
197	C	80.7	Confident	82.7	Confident	28 Å²	28	72.6 Å²	72.6	19%	0.189	36%	0.356	C	S	.	.			trans	-107.5	142	172.5	71.9	0	0	0	0	112.8	K138 C140	K138-C197 PolarHBondContact O-N 2.98Å; K138-C197 PolarHBondContact O-SG 3.23Å; C140-C197 VanDerWaalsContact CA-SG 3.58Å; C140-C197 HydrophobicContact CB-CB 3.63Å; C140-C197 WeakPolarHBondContact CB-SG 3.25Å; C140-C197 WeakPolarHBondContact SG-CB 3.37Å; C140-C197 CovalentContact SG-SG 2.02Å; C140-C197 PolarHBondContact SG-SG 3.46Å
198	E	71.1	Confident	81.7	Confident	173 Å²	173	77.5 Å²	77.5	81%	0.808	38%	0.38	S	S	*	.	S	Bend	trans	-87.5	-12.5	-176.3	-61.9	-174.6	155.3	0	0	113.8
199	F	69.5	Low	80.6	Confident	154 Å²	154	82.6 Å²	82.6	68%	0.675	41%	0.405	S	S	*	.	S	Bend	trans	-135.7	159.7	-170	-53.9	-72.3	0	0	0	112.6	N110 C140	N110-F199 PolarHBondContact ND2-O 2.04Å; C140-F199 PolarHBondContact SG-O 3.31Å
200	E	67.7	Low	79.3	Confident	107 Å²	107	88.7 Å²	88.7	50%	0.5	44%	0.435	S	S	.	.			trans	-80.4	130.7	172.4	-64.1	-176.7	173.6	0	0	111	N109 V202	N109-E200 WeakPolarHBondContact CA-OE1 3.44Å; N109-E200 PolarHBondContact OD1-OE1 2.88Å; E200-V202 PolarHBondContact O-N 3.05Å
201	N	61.4	Low	77.9	Confident	68 Å²	68	96.1 Å²	96.1	36%	0.364	47%	0.471	S	S	.	.			trans	-87.7	95.8	174.4	-77.1	-10.1	0	0	0	109	N110 P141 R170	N110-N201 PolarHBondContact OD1-N 2.94Å; P141-N201 HydrophobicContact CG-CB 4.44Å; P141-N201 PolarHBondContact O-ND2 2.62Å; R170-N201 PolarHBondContact NH2-O 3.37Å
202	V	53.6	Low	76.3	Confident	164 Å²	164	97.6 Å²	97.6	99%	0.994	49%	0.487	S	S	*	.			trans	-59	0	177	-174.9	0	0	0	0	111.4	K106 E200	K106-V202 PolarHBondContact NZ-OXT 3.49Å; E200-V202 PolarHBondContact O-N 3.05Å

Retrieved 202 of 202 residues in 135.2 ms (Link to these results)

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