A0A077ZJY0_TRITR Loading...

Cleft lip and palate transmembrane protein homolo g cleft lip and palate associated transmembrane protein

AlphaFold DB , UniProt , Accession A0A077ZJY0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 303 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	40.5	Very low	36.1	Very low	239 Å²	239	153.5 Å²	153.5	100%	1.177	85%	0.85	S	S	*	*				0	119.7	0	-76.2	175.5	166.9	0	0	104.5
2	E	37.3	Very low	35.7	Very low	183 Å²	183	147.2 Å²	147.2	86%	0.855	85%	0.845	S	S	*	*			cis	-132.9	138.2	34.2	-71.7	143.7	121	0	0	109.9
3	R	35.8	Very low	35.4	Very low	229 Å²	229	143.6 Å²	143.6	86%	0.864	84%	0.844	S	S	*	*				45.9	97	84.1	-73	-169	177.3	-178.5	-0.7	112.7
4	E	30.8	Very low	35.5	Very low	175 Å²	175	145.6 Å²	145.6	82%	0.818	85%	0.85	S	S	*	*				68.8	117.6	89.7	-166.2	179.5	-165.9	0	0	112.8
5	V	36.6	Very low	35	Very low	141 Å²	141	142.3 Å²	142.3	86%	0.855	85%	0.845	S	S	*	*			trans	172.5	127.4	134.5	160.7	0	0	0	0	109.5
6	A	32.7	Very low	34.7	Very low	82 Å²	82	139.4 Å²	139.4	68%	0.678	84%	0.843	S	S	*	*			trans	-83.6	-155.1	172.4	0	0	0	0	0	111
7	P	46.6	Very low	35.1	Very low	115 Å²	115	138.4 Å²	138.4	75%	0.747	84%	0.839	S	S	*	*				-118.9	171.2	-69	33.6	-19	0	0	0	111.5
8	T	34.8	Very low	35	Very low	145 Å²	145	141.6 Å²	141.6	89%	0.89	84%	0.843	S	S	*	*			trans	-169.7	118.1	139.9	2.9	0	0	0	0	111.3
9	V	27.1	Very low	35.1	Very low	141 Å²	141	142.2 Å²	142.2	86%	0.855	84%	0.842	S	S	*	*			trans	-125.8	114	168.2	171.7	0	0	0	0	107.4
10	S	31.4	Very low	35.3	Very low	113 Å²	113	141.1 Å²	141.1	79%	0.79	84%	0.839	S	S	*	*			trans	170.4	159.6	152.5	-86.9	0	0	0	0	110.2
11	P	43.9	Very low	35.5	Very low	126 Å²	126	145.6 Å²	145.6	82%	0.818	84%	0.842	S	S	*	*				-131.2	156.5	-51.2	33.5	-16.2	0	0	0	111.3
12	G	31.5	Very low	35.7	Very low	77 Å²	77	140.2 Å²	140.2	79%	0.794	82%	0.818	S	S	*	*			trans	-140.8	93.3	176.6	0	0	0	0	0	111.5	N14	G12-N14 PolarHBondContact O-N 3.38Å
13	A	30.8	Very low	36.2	Very low	101 Å²	101	139.9 Å²	139.9	84%	0.835	82%	0.816	S	S	*	*			trans	-62.5	120.1	169.4	0	0	0	0	0	110
14	N	36.7	Very low	37.1	Very low	172 Å²	172	133.4 Å²	133.4	92%	0.92	81%	0.806	S	S	*	*			trans	-126.4	104.7	156.7	-106.3	-15.2	0	0	0	107.8	G12	G12-N14 PolarHBondContact O-N 3.38Å
15	A	27.9	Very low	38.4	Very low	95 Å²	95	128.4 Å²	128.4	79%	0.785	79%	0.79	S	S	*	*			trans	-80.1	152	170.9	0	0	0	0	0	110.4
16	A	30.6	Very low	39.9	Very low	97 Å²	97	124.4 Å²	124.4	80%	0.802	77%	0.769	S	S	*	*			trans	96.2	147.3	160.9	0	0	0	0	0	118.3
17	P	42.5	Very low	41.8	Very low	121 Å²	121	122.4 Å²	122.4	79%	0.786	76%	0.755	S	S	*	*			cis	-123.1	149.7	-14.5	28.1	-8.1	0	0	0	114	N19	P17-N19 PolarHBondContact O-N 3.49Å
18	E	32.6	Very low	43.2	Very low	196 Å²	196	124.8 Å²	124.8	92%	0.916	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-69.4	123.4	169.2	-68.3	-178	145.3	0	0	110.4
19	N	37.7	Very low	45.1	Very low	153 Å²	153	126.3 Å²	126.3	82%	0.818	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-71	134.4	167.9	-100.8	-24.2	0	0	0	109.9	P17 R21	P17-N19 PolarHBondContact O-N 3.49Å; N19-R21 PolarHBondContact O-N 3.2Å
20	P	38.7	Very low	47.6	Very low	120 Å²	120	126.2 Å²	126.2	78%	0.779	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-64.5	125.2	-180	12.7	-13	0	0	0	110.9
21	R	38.2	Very low	50	Low	237 Å²	237	126.9 Å²	126.9	89%	0.894	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-70.2	133.6	176.7	-71.4	175.9	170.3	162.9	-1.4	110.2	N19 E23	N19-R21 PolarHBondContact O-N 3.2Å; R21-E23 PolarHBondContact O-N 2.92Å
22	D	46.7	Very low	51.8	Low	126 Å²	126	126.2 Å²	126.2	67%	0.674	70%	0.704	S	S	*	*			trans	-54.3	87.7	-178.1	-68.3	-61.6	0	0	0	115.2	S24 S25	D22-S24 PolarHBondContact O-N 2.95Å; D22-S25 PolarHBondContact O-OG 3.32Å
23	E	47.8	Very low	54	Low	176 Å²	176	127.7 Å²	127.7	82%	0.822	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-17.4	166.1	-85.6	-164.3	134	0	0	113.2	R21 S25 S26	R21-E23 PolarHBondContact O-N 2.92Å; E23-S25 VanDerWaalsContact C-N 3.26Å; E23-S25 PolarHBondContact O-N 3.19Å; E23-S26 PolarHBondContact O-N 2.91Å
24	S	53	Low	56.5	Low	93 Å²	93	128.7 Å²	128.7	65%	0.65	68%	0.676	S	S	*	*	H	α-helix	trans	-65.3	-27.4	-178	68.6	0	0	0	0	113.4	D22	D22-S24 PolarHBondContact O-N 2.95Å
25	S	57.7	Low	58.8	Low	69 Å²	69	122.9 Å²	122.9	48%	0.483	65%	0.651	S	S	.	*	H	α-helix	trans	-74.6	-30.1	-178.8	70	0	0	0	0	113.2	D22 E23 R29	D22-S25 PolarHBondContact O-OG 3.32Å; E23-S25 VanDerWaalsContact C-N 3.26Å; E23-S25 PolarHBondContact O-N 3.19Å; S25-R29 WeakPolarHBondContact O-CG 3.33Å; S25-R29 PolarHBondContact O-N 3.5Å
26	S	68.9	Low	61.5	Low	58 Å²	58	122.2 Å²	122.2	41%	0.406	64%	0.637	S	S	.	*	H	α-helix	trans	-71.3	-50.3	-178.2	-176.1	0	0	0	0	110.8	E23 W28 R29 F30	E23-S26 PolarHBondContact O-N 2.91Å; S26-W28 VanDerWaalsContact C-N 3.31Å; S26-W28 PolarHBondContact O-N 2.95Å; S26-R29 PolarHBondContact O-N 3.08Å; S26-R29 VanDerWaalsContact O-N 3.09Å; S26-F30 VanDerWaalsContact O-CD2 3.23Å; S26-F30 WeakPolarHBondContact O-CD2 3.44Å; S26-F30 PolarHBondContact O-N 3.2Å; S26-F30 WeakPolarHBondContact OG-CE2 3.45Å
27	G	72.2	Confident	63.7	Low	39 Å²	39	125.6 Å²	125.6	40%	0.402	63%	0.629	S	S	.	*	H	α-helix	trans	-57.8	-40.4	-179.6	0	0	0	0	0	113.2	F30 M31	G27-F30 PolarHBondContact O-N 3.41Å; G27-M31 WeakPolarHBondContact O-CB 3.36Å; G27-M31 WeakPolarHBondContact O-CG 3.35Å; G27-M31 PolarHBondContact O-N 2.93Å
28	W	75.9	Confident	65.9	Low	165 Å²	165	124.2 Å²	124.2	63%	0.625	62%	0.615	S	S	*	*	H	α-helix	trans	-67.6	-35.6	177.6	-175.1	-123.6	0	0	0	113.3	S26 K32	S26-W28 VanDerWaalsContact C-N 3.31Å; S26-W28 PolarHBondContact O-N 2.95Å; W28-K32 VanDerWaalsContact NE1-NZ 3.11Å; W28-K32 WeakPolarHBondContact O-CB 3.42Å; W28-K32 WeakPolarHBondContact O-CG 3.23Å; W28-K32 PolarHBondContact O-N 3.43Å
29	R	75.8	Confident	68.4	Low	178 Å²	178	119.7 Å²	119.7	67%	0.672	60%	0.597	S	S	*	*	H	α-helix	trans	-69.5	-41.6	175.6	-70	177.2	78.8	-173.3	4.4	111.6	S25 S26 K32 Q33	S25-R29 WeakPolarHBondContact O-CG 3.33Å; S25-R29 PolarHBondContact O-N 3.5Å; S26-R29 PolarHBondContact O-N 3.08Å; S26-R29 VanDerWaalsContact O-N 3.09Å; R29-K32 PolarHBondContact O-N 3.3Å; R29-Q33 PolarHBondContact O-N 3.21Å
30	F	78.8	Confident	70.4	Confident	139 Å²	139	116.7 Å²	116.7	61%	0.61	58%	0.58	S	S	*	*	H	α-helix	trans	-64.3	-45.5	174.5	-80.3	-72.7	0	0	0	112	S26 G27 K32 Q33 F34	S26-F30 VanDerWaalsContact O-CD2 3.23Å; S26-F30 WeakPolarHBondContact O-CD2 3.44Å; S26-F30 PolarHBondContact O-N 3.2Å; S26-F30 WeakPolarHBondContact OG-CE2 3.45Å; G27-F30 PolarHBondContact O-N 3.41Å; F30-K32 PolarHBondContact O-N 2.95Å; F30-Q33 PolarHBondContact O-N 2.84Å; F30-F34 WeakPolarHBondContact O-CB 3.47Å; F30-F34 PolarHBondContact O-N 3.37Å
31	M	82.8	Confident	72.3	Confident	126 Å²	126	114.8 Å²	114.8	62%	0.621	57%	0.566	S	S	*	*	H	α-helix	trans	-60.7	-42.1	176.5	-80	-67.4	-73.9	0	0	112.4	G27 F34 A35	G27-M31 WeakPolarHBondContact O-CB 3.36Å; G27-M31 WeakPolarHBondContact O-CG 3.35Å; G27-M31 PolarHBondContact O-N 2.93Å; M31-F34 PolarHBondContact O-N 3.04Å; M31-A35 WeakPolarHBondContact O-CB 3.34Å; M31-A35 PolarHBondContact O-N 3.14Å
32	K	80.5	Confident	74.3	Confident	112 Å²	112	110 Å²	110	49%	0.487	55%	0.549	S	S	.	.	H	α-helix	trans	-62	-46.1	174.4	-82.2	178.8	167.8	176.2	0	112.5	W28 R29 F30 F34 A35 V36	W28-K32 VanDerWaalsContact NE1-NZ 3.11Å; W28-K32 WeakPolarHBondContact O-CB 3.42Å; W28-K32 WeakPolarHBondContact O-CG 3.23Å; W28-K32 PolarHBondContact O-N 3.43Å; R29-K32 PolarHBondContact O-N 3.3Å; F30-K32 PolarHBondContact O-N 2.95Å; K32-F34 VanDerWaalsContact C-N 3.3Å; K32-F34 PolarHBondContact O-N 2.97Å; K32-A35 PolarHBondContact O-N 3.34Å; K32-V36 VanDerWaalsContact O-CG2 3.31Å; K32-V36 WeakPolarHBondContact O-CG2 3.33Å; K32-V36 PolarHBondContact O-N 2.94Å
33	Q	78.4	Confident	75.7	Confident	108 Å²	108	110.1 Å²	110.1	51%	0.505	54%	0.543	S	S	.	.	H	α-helix	trans	-62.5	-39.1	177	-76.2	-175.1	-4.3	0	0	111.8	R29 F30 R37	R29-Q33 PolarHBondContact O-N 3.21Å; F30-Q33 PolarHBondContact O-N 2.84Å; Q33-R37 WeakPolarHBondContact O-CB 3.43Å; Q33-R37 VanDerWaalsContact O-CG 3.26Å; Q33-R37 WeakPolarHBondContact O-CG 3.19Å; Q33-R37 PolarHBondContact O-N 3.41Å
34	F	83.7	Confident	76.8	Confident	123 Å²	123	105.4 Å²	105.4	54%	0.539	52%	0.523	S	S	.	.	H	α-helix	trans	-66	-44.6	176.1	-169.7	-105	0	0	0	112	F30 M31 K32 R37 L38	F30-F34 WeakPolarHBondContact O-CB 3.47Å; F30-F34 PolarHBondContact O-N 3.37Å; M31-F34 PolarHBondContact O-N 3.04Å; K32-F34 VanDerWaalsContact C-N 3.3Å; K32-F34 PolarHBondContact O-N 2.97Å; F34-R37 PolarHBondContact O-N 3.28Å; F34-L38 HydrophobicContact CD1-CD1 3.86Å; F34-L38 HydrophobicContact CD1-CG 4.37Å; F34-L38 HydrophobicContact CE1-CD1 3.51Å; F34-L38 HydrophobicContact CE1-CG 4.12Å; F34-L38 HydrophobicContact CZ-CD1 4.2Å; F34-L38 HydrophobicContact CZ-CG 4.43Å; F34-L38 WeakPolarHBondContact O-CG 3.2Å; F34-L38 PolarHBondContact O-N 3Å
35	A	83.6	Confident	77.5	Confident	49 Å²	49	103.1 Å²	103.1	41%	0.405	51%	0.507	S	S	.	.	H	α-helix	trans	-63.9	-41.8	177.1	0	0	0	0	0	112.7	M31 K32 L38 L39	M31-A35 WeakPolarHBondContact O-CB 3.34Å; M31-A35 PolarHBondContact O-N 3.14Å; K32-A35 PolarHBondContact O-N 3.34Å; A35-L38 PolarHBondContact O-N 3.07Å; A35-L39 PolarHBondContact O-N 3.44Å
36	V	84.7	Confident	78	Confident	81 Å²	81	102.1 Å²	102.1	49%	0.491	50%	0.5	S	S	.	.	H	α-helix	trans	-64.2	-41.1	174.7	172.2	0	0	0	0	110.9	K32 L39 I40	K32-V36 VanDerWaalsContact O-CG2 3.31Å; K32-V36 WeakPolarHBondContact O-CG2 3.33Å; K32-V36 PolarHBondContact O-N 2.94Å; V36-L39 PolarHBondContact O-N 3.13Å; V36-I40 HydrophobicContact CG1-CD1 3.88Å; V36-I40 HydrophobicContact CG1-CG1 4.44Å; V36-I40 VanDerWaalsContact O-CG1 3.3Å; V36-I40 WeakPolarHBondContact O-CG1 3.38Å; V36-I40 PolarHBondContact O-N 3.4Å
37	R	78	Confident	77.9	Confident	168 Å²	168	105.8 Å²	105.8	63%	0.634	51%	0.512	S	S	*	.	H	α-helix	trans	-61.8	-42.3	173.5	-75.5	175.7	-176.6	-177.3	2.7	111.8	Q33 F34 I40 V41	Q33-R37 WeakPolarHBondContact O-CB 3.43Å; Q33-R37 VanDerWaalsContact O-CG 3.26Å; Q33-R37 WeakPolarHBondContact O-CG 3.19Å; Q33-R37 PolarHBondContact O-N 3.41Å; F34-R37 PolarHBondContact O-N 3.28Å; R37-I40 PolarHBondContact O-N 3.38Å; R37-V41 WeakPolarHBondContact O-CB 3.39Å; R37-V41 VanDerWaalsContact O-CG2 3.23Å; R37-V41 WeakPolarHBondContact O-CG2 3.31Å; R37-V41 PolarHBondContact O-N 2.97Å
38	L	88.4	Confident	77.3	Confident	93 Å²	93	108.9 Å²	108.9	49%	0.487	52%	0.515	S	S	.	.	H	α-helix	trans	-65.1	-37.3	174.9	-74.5	178.2	0	0	0	112.5	F34 A35 V41 Y42	F34-L38 HydrophobicContact CD1-CD1 3.86Å; F34-L38 HydrophobicContact CD1-CG 4.37Å; F34-L38 HydrophobicContact CE1-CD1 3.51Å; F34-L38 HydrophobicContact CE1-CG 4.12Å; F34-L38 HydrophobicContact CZ-CD1 4.2Å; F34-L38 HydrophobicContact CZ-CG 4.43Å; F34-L38 WeakPolarHBondContact O-CG 3.2Å; F34-L38 PolarHBondContact O-N 3Å; A35-L38 PolarHBondContact O-N 3.07Å; L38-V41 PolarHBondContact O-N 3.04Å; L38-Y42 WeakPolarHBondContact O-CB 3.37Å; L38-Y42 PolarHBondContact O-N 3.28Å
39	L	85.7	Confident	76.4	Confident	100 Å²	100	110 Å²	110	52%	0.524	52%	0.519	S	S	.	.	H	α-helix	trans	-65.7	-43.4	173.9	-82.2	172.1	0	0	0	111.9	A35 V36 Y42 F43	A35-L39 PolarHBondContact O-N 3.44Å; V36-L39 PolarHBondContact O-N 3.13Å; L39-Y42 PolarHBondContact O-N 2.92Å; L39-F43 WeakPolarHBondContact O-CB 3.44Å; L39-F43 WeakPolarHBondContact O-CD2 3.39Å; L39-F43 PolarHBondContact O-N 3.33Å
40	I	79.6	Confident	75.4	Confident	90 Å²	90	104.8 Å²	104.8	46%	0.462	52%	0.521	S	S	.	.	H	α-helix	trans	-62.5	-48.4	175.1	-68.5	165.9	0	0	0	109.7	V36 R37 Y42 F43 I44	V36-I40 HydrophobicContact CG1-CD1 3.88Å; V36-I40 HydrophobicContact CG1-CG1 4.44Å; V36-I40 VanDerWaalsContact O-CG1 3.3Å; V36-I40 WeakPolarHBondContact O-CG1 3.38Å; V36-I40 PolarHBondContact O-N 3.4Å; R37-I40 PolarHBondContact O-N 3.38Å; I40-Y42 VanDerWaalsContact C-N 3.28Å; I40-Y42 PolarHBondContact O-N 3.38Å; I40-F43 PolarHBondContact O-N 2.79Å; I40-I44 HydrophobicContact CG2-CD1 3.54Å; I40-I44 HydrophobicContact CG2-CG1 4.18Å; I40-I44 VanDerWaalsContact O-CB 3.27Å; I40-I44 WeakPolarHBondContact O-CB 3.48Å; I40-I44 WeakPolarHBondContact O-CG1 3.23Å; I40-I44 PolarHBondContact O-N 3.11Å
41	V	78.7	Confident	73.7	Confident	81 Å²	81	101.8 Å²	101.8	49%	0.491	51%	0.506	S	S	.	.	H	α-helix	trans	-60.9	-38.6	176	171.7	0	0	0	0	110.9	R37 L38 S45	R37-V41 WeakPolarHBondContact O-CB 3.39Å; R37-V41 VanDerWaalsContact O-CG2 3.23Å; R37-V41 WeakPolarHBondContact O-CG2 3.31Å; R37-V41 PolarHBondContact O-N 2.97Å; L38-V41 PolarHBondContact O-N 3.04Å; V41-S45 WeakPolarHBondContact O-CA 3.42Å; V41-S45 WeakPolarHBondContact O-CB 3.39Å; V41-S45 PolarHBondContact O-N 3.19Å; V41-S45 PolarHBondContact O-OG 3.34Å
42	Y	79.5	Confident	72.1	Confident	137 Å²	137	104 Å²	104	54%	0.537	51%	0.511	S	S	.	.	H	α-helix	trans	-65.5	-45	175.4	175	-96.4	0	0	0	111.9	L38 L39 I40 S45 S46	L38-Y42 WeakPolarHBondContact O-CB 3.37Å; L38-Y42 PolarHBondContact O-N 3.28Å; L39-Y42 PolarHBondContact O-N 2.92Å; I40-Y42 VanDerWaalsContact C-N 3.28Å; I40-Y42 PolarHBondContact O-N 3.38Å; Y42-S45 CarbonylContact O-C 3.57Å; Y42-S45 PolarHBondContact O-N 3.11Å; Y42-S46 VanDerWaalsContact O-CB 3.3Å; Y42-S46 WeakPolarHBondContact O-CB 3.49Å; Y42-S46 PolarHBondContact O-N 3.29Å
43	F	76.1	Confident	70.7	Confident	128 Å²	128	103.9 Å²	103.9	56%	0.561	51%	0.513	S	S	*	.	H	α-helix	trans	-65.7	-44.4	176.9	-100.2	-83	0	0	0	112.2	L39 I40 S45 S46 M47	L39-F43 WeakPolarHBondContact O-CB 3.44Å; L39-F43 WeakPolarHBondContact O-CD2 3.39Å; L39-F43 PolarHBondContact O-N 3.33Å; I40-F43 PolarHBondContact O-N 2.79Å; F43-S45 VanDerWaalsContact C-N 3.35Å; F43-S46 PolarHBondContact O-N 3.26Å; F43-S46 PolarHBondContact O-OG 3.03Å; F43-M47 WeakPolarHBondContact O-CG 3.09Å; F43-M47 PolarHBondContact O-N 3.09Å
44	I	71.6	Confident	69.4	Low	77 Å²	77	100.1 Å²	100.1	40%	0.395	50%	0.497	S	S	.	.	H	α-helix	trans	-58.1	-51.3	172.4	-70.4	176	0	0	0	108.5	I40 S46 M47 F48	I40-I44 HydrophobicContact CG2-CD1 3.54Å; I40-I44 HydrophobicContact CG2-CG1 4.18Å; I40-I44 VanDerWaalsContact O-CB 3.27Å; I40-I44 WeakPolarHBondContact O-CB 3.48Å; I40-I44 WeakPolarHBondContact O-CG1 3.23Å; I40-I44 PolarHBondContact O-N 3.11Å; I44-S46 VanDerWaalsContact C-N 3.35Å; I44-S46 PolarHBondContact O-N 3.5Å; I44-M47 PolarHBondContact O-N 3.28Å; I44-F48 HydrophobicContact CG2-CD2 3.72Å; I44-F48 HydrophobicContact CG2-CE2 3.42Å; I44-F48 VanDerWaalsContact CG2-CE2 3.42Å; I44-F48 WeakPolarHBondContact O-CD2 3.43Å; I44-F48 PolarHBondContact O-N 3.31Å
45	S	68.1	Low	67.9	Low	44 Å²	44	97.2 Å²	97.2	31%	0.308	49%	0.492	S	S	.	.	H	α-helix	trans	-63.8	-34.9	178.8	-60	0	0	0	0	113.1	V41 Y42 F43 F48 R49	V41-S45 WeakPolarHBondContact O-CA 3.42Å; V41-S45 WeakPolarHBondContact O-CB 3.39Å; V41-S45 PolarHBondContact O-N 3.19Å; V41-S45 PolarHBondContact O-OG 3.34Å; Y42-S45 CarbonylContact O-C 3.57Å; Y42-S45 PolarHBondContact O-N 3.11Å; F43-S45 VanDerWaalsContact C-N 3.35Å; S45-F48 CarbonylContact O-C 3.56Å; S45-F48 PolarHBondContact O-N 2.92Å; S45-R49 VanDerWaalsContact O-CG 3.28Å; S45-R49 WeakPolarHBondContact O-CG 3.3Å; S45-R49 PolarHBondContact O-N 3.15Å
46	S	66.7	Low	66.4	Low	48 Å²	48	104.6 Å²	104.6	34%	0.336	51%	0.51	S	S	.	.	H	α-helix	trans	-74.9	-35.7	-179.8	86.9	0	0	0	0	111.5	Y42 F43 I44 F48 R49	Y42-S46 VanDerWaalsContact O-CB 3.3Å; Y42-S46 WeakPolarHBondContact O-CB 3.49Å; Y42-S46 PolarHBondContact O-N 3.29Å; F43-S46 PolarHBondContact O-N 3.26Å; F43-S46 PolarHBondContact O-OG 3.03Å; I44-S46 VanDerWaalsContact C-N 3.35Å; I44-S46 PolarHBondContact O-N 3.5Å; S46-F48 VanDerWaalsContact C-N 3.25Å; S46-F48 PolarHBondContact O-N 3.44Å; S46-R49 PolarHBondContact O-N 2.93Å
47	M	67.1	Low	65	Low	135 Å²	135	108 Å²	108	67%	0.665	53%	0.525	S	S	*	.	H	α-helix	trans	-62	-35.9	168.4	-74.8	-172.3	-75.6	0	0	111.1	F43 I44	F43-M47 WeakPolarHBondContact O-CG 3.09Å; F43-M47 PolarHBondContact O-N 3.09Å; I44-M47 PolarHBondContact O-N 3.28Å
48	F	60.5	Low	63.9	Low	105 Å²	105	106 Å²	106	46%	0.461	53%	0.527	S	S	.	.	H	α-helix	trans	-81.7	-20.2	175.8	-67.4	-59.8	0	0	0	115	I44 S45 S46 G50 W51	I44-F48 HydrophobicContact CG2-CD2 3.72Å; I44-F48 HydrophobicContact CG2-CE2 3.42Å; I44-F48 VanDerWaalsContact CG2-CE2 3.42Å; I44-F48 WeakPolarHBondContact O-CD2 3.43Å; I44-F48 PolarHBondContact O-N 3.31Å; S45-F48 CarbonylContact O-C 3.56Å; S45-F48 PolarHBondContact O-N 2.92Å; S46-F48 VanDerWaalsContact C-N 3.25Å; S46-F48 PolarHBondContact O-N 3.44Å; F48-G50 PolarHBondContact O-N 3.05Å; F48-W51 CarbonylContact O-C 3.58Å; F48-W51 WeakPolarHBondContact O-CA 3.26Å; F48-W51 VanDerWaalsContact O-CB 3.28Å; F48-W51 WeakPolarHBondContact O-CB 3.44Å; F48-W51 PolarHBondContact O-N 3.48Å
49	R	57.4	Low	62.1	Low	187 Å²	187	103 Å²	103	71%	0.706	51%	0.513	S	S	*	.	H	α-helix	trans	-66	-25.3	177.5	-84.7	173.4	-174.6	-151.4	1.8	113.3	S45 S46 W51	S45-R49 VanDerWaalsContact O-CG 3.28Å; S45-R49 WeakPolarHBondContact O-CG 3.3Å; S45-R49 PolarHBondContact O-N 3.15Å; S46-R49 PolarHBondContact O-N 2.93Å; R49-W51 VanDerWaalsContact C-N 3.28Å
50	G	53.6	Low	60.4	Low	69 Å²	69	102.6 Å²	102.6	71%	0.711	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-21	169.6	0	0	0	0	0	113.3	F48 K52	F48-G50 PolarHBondContact O-N 3.05Å; G50-K52 VanDerWaalsContact C-N 3.31Å; G50-K52 PolarHBondContact O-N 3.01Å; G50-K52 VanDerWaalsContact O-N 3.14Å
51	W	42.9	Very low	59.3	Low	77 Å²	77	108.8 Å²	108.8	29%	0.292	54%	0.539	S	S	.	.			trans	-85.6	72	173.4	-168.4	-74.9	0	0	0	109.2	F48 R49 Q53 F224 P230 F233 L282	F48-W51 CarbonylContact O-C 3.58Å; F48-W51 WeakPolarHBondContact O-CA 3.26Å; F48-W51 VanDerWaalsContact O-CB 3.28Å; F48-W51 WeakPolarHBondContact O-CB 3.44Å; F48-W51 PolarHBondContact O-N 3.48Å; R49-W51 VanDerWaalsContact C-N 3.28Å; W51-Q53 PolarHBondContact O-N 3.44Å; W51-F224 HydrophobicContact CH2-CE1 4.25Å; W51-F224 HydrophobicContact CZ2-CE1 4.48Å; W51-P230 HydrophobicContact CE3-CG 4.23Å; W51-P230 HydrophobicContact CZ3-CG 3.94Å; W51-F233 HydrophobicContact CH2-CE2 4.36Å; W51-F233 AromaticContact CH2-CZ 3.81Å; W51-F233 HydrophobicContact CH2-CZ 3.81Å; W51-F233 HydrophobicContact CZ3-CE2 4.06Å; W51-F233 AromaticContact CZ3-CZ 3.99Å; W51-F233 HydrophobicContact CZ3-CZ 3.99Å; W51-L282 HydrophobicContact CH2-CD2 3.87Å; W51-L282 HydrophobicContact CZ2-CD2 4.16Å
52	K	48.7	Very low	58.2	Low	171 Å²	171	112.2 Å²	112.2	74%	0.743	56%	0.555	S	S	*	*			trans	-78.5	98.6	154.4	-70.3	-170.7	-179.4	-174.9	0	105.9	G50 T54	G50-K52 VanDerWaalsContact C-N 3.31Å; G50-K52 PolarHBondContact O-N 3.01Å; G50-K52 VanDerWaalsContact O-N 3.14Å; K52-T54 VanDerWaalsContact C-N 3.3Å; K52-T54 PolarHBondContact O-N 3.35Å
53	Q	51	Low	57.1	Low	110 Å²	110	111.1 Å²	111.1	51%	0.514	56%	0.555	S	S	.	*			trans	-56.3	106.9	156.7	-113.2	168.5	-27.4	0	0	105	W51 S55 S222	W51-Q53 PolarHBondContact O-N 3.44Å; Q53-S55 PolarHBondContact O-N 2.93Å; Q53-S222 PolarHBondContact NE2-OG 2.76Å
54	T	52.1	Low	56.4	Low	29 Å²	29	112.8 Å²	112.8	18%	0.178	56%	0.562	C	S	.	*			trans	-68.3	110.4	175.6	39.5	0	0	0	0	106.3	K52 R56 V59	K52-T54 VanDerWaalsContact C-N 3.3Å; K52-T54 PolarHBondContact O-N 3.35Å; T54-R56 PolarHBondContact O-N 2.87Å; T54-V59 VanDerWaalsContact CB-CG2 3.47Å; T54-V59 HydrophobicContact CG2-CG2 3.56Å
55	S	53	Low	56	Low	63 Å²	63	111.9 Å²	111.9	44%	0.441	56%	0.556	S	S	.	*			trans	-54.8	142.6	165	-55.9	0	0	0	0	107.1	Q53 D57 D58	Q53-S55 PolarHBondContact O-N 2.93Å; S55-D57 PolarHBondContact O-N 2.96Å; S55-D58 WeakPolarHBondContact CB-OD2 3.46Å; S55-D58 PolarHBondContact O-N 3.05Å; S55-D58 PolarHBondContact OG-OD2 3.35Å
56	R	51.9	Low	56.4	Low	203 Å²	203	112.5 Å²	112.5	77%	0.766	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.6	-23.3	179.7	-148.9	175.3	-176	166.8	-1.1	112.3	T54 M65	T54-R56 PolarHBondContact O-N 2.87Å; R56-M65 HydrophobicContact CG-SD 3.89Å
57	D	55.2	Low	57.4	Low	154 Å²	154	110.9 Å²	110.9	82%	0.824	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-17.4	-179.1	-56.9	-37.9	0	0	0	114.7	S55	S55-D57 PolarHBondContact O-N 2.96Å
58	D	54.3	Low	58.6	Low	126 Å²	126	104.6 Å²	104.6	67%	0.674	51%	0.513	S	S	*	.	S	Bend	trans	-94.1	2.5	-170.5	-76.8	-34.9	0	0	0	114.6	S55	S55-D58 WeakPolarHBondContact CB-OD2 3.46Å; S55-D58 PolarHBondContact O-N 3.05Å; S55-D58 PolarHBondContact OG-OD2 3.35Å
59	V	50.2	Low	60.2	Low	30 Å²	30	99.9 Å²	99.9	18%	0.182	49%	0.492	C	S	.	.	S	Bend	trans	-116.8	133.6	-174.7	-172.9	0	0	0	0	111.3	T54 K61 H63 M65	T54-V59 VanDerWaalsContact CB-CG2 3.47Å; T54-V59 HydrophobicContact CG2-CG2 3.56Å; V59-K61 PolarHBondContact O-N 3.38Å; V59-H63 HydrophobicContact CG1-CB 3.97Å; V59-M65 HydrophobicContact CB-CE 3.55Å; V59-M65 HydrophobicContact CG1-CE 4.38Å; V59-M65 HydrophobicContact CG2-CE 3.42Å; V59-M65 VanDerWaalsContact CG2-CE 3.42Å
60	P	50.8	Low	62	Low	90 Å²	90	91 Å²	91	58%	0.584	46%	0.458	S	S	*	.			trans	-52.5	134.9	172.4	-25.3	33.8	0	0	0	111.7	D62 H63	P60-D62 PolarHBondContact O-N 3.46Å; P60-H63 PolarHBondContact O-N 3.31Å
61	K	56.6	Low	63.9	Low	221 Å²	221	92.1 Å²	92.1	96%	0.961	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-7.5	-171	-69.8	-178.2	177.3	177.8	0	116.5	V59	V59-K61 PolarHBondContact O-N 3.38Å
62	D	56.1	Low	66.3	Low	153 Å²	153	91.9 Å²	91.9	82%	0.818	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-13	-174.1	-149.5	25	0	0	0	113.9	P60	P60-D62 PolarHBondContact O-N 3.46Å
63	H	55.6	Low	68.5	Low	114 Å²	114	85.9 Å²	85.9	53%	0.528	44%	0.44	S	S	.	.	S	Bend	trans	-85.4	119.9	174.8	-67.4	-59.3	0	0	0	111.1	V59 P60 M65	V59-H63 HydrophobicContact CG1-CB 3.97Å; P60-H63 PolarHBondContact O-N 3.31Å; H63-M65 PolarHBondContact O-N 3.46Å
64	K	60.5	Low	70.7	Confident	163 Å²	163	82 Å²	82	71%	0.709	42%	0.422	S	S	*	.			trans	-58.2	105.1	170.9	-72.7	-177.9	-179.5	176.9	0	109.7	Y66 P226	K64-Y66 HydrophobicContact CB-CE1 4.37Å; K64-P226 WeakPolarHBondContact O-CD 2.77Å
65	M	63.2	Low	72.9	Confident	57 Å²	57	85.3 Å²	85.3	28%	0.281	43%	0.434	S	S	.	.			trans	-72.5	133.7	171.3	-80.5	179.2	155.4	0	0	110.9	R56 V59 H63 V223	R56-M65 HydrophobicContact CG-SD 3.89Å; V59-M65 HydrophobicContact CB-CE 3.55Å; V59-M65 HydrophobicContact CG1-CE 4.38Å; V59-M65 HydrophobicContact CG2-CE 3.42Å; V59-M65 VanDerWaalsContact CG2-CE 3.42Å; H63-M65 PolarHBondContact O-N 3.46Å; M65-V223 HydrophobicContact CB-CG1 3.6Å; M65-V223 HydrophobicContact CE-CG1 4.19Å; M65-V223 HydrophobicContact CG-CG1 3.64Å; M65-V223 HydrophobicContact SD-CG1 3.88Å
66	Y	76.8	Confident	75	Confident	57 Å²	57	82.6 Å²	82.6	22%	0.224	42%	0.415	C	S	.	.	B	Isolated β-bridge	trans	-100.8	96	174.8	-57.4	-33.5	0	0	0	110.1	K64 F224 P226 F239 G243 Y245	K64-Y66 HydrophobicContact CB-CE1 4.37Å; Y66-F224 WeakPolarHBondContact CB-O 3.47Å; Y66-F224 PolarHBondContact N-O 3.03Å; Y66-F224 PolarHBondContact O-N 3.07Å; Y66-P226 HydrophobicContact CD2-CB 4.44Å; Y66-P226 HydrophobicContact CD2-CG 4.14Å; Y66-P226 HydrophobicContact CE1-CG 4.3Å; Y66-P226 HydrophobicContact CE2-CB 3.55Å; Y66-P226 HydrophobicContact CE2-CG 3.45Å; Y66-P226 VanDerWaalsContact CE2-CG 3.45Å; Y66-F239 HydrophobicContact CD2-CD1 4.22Å; Y66-F239 AromaticContact CD2-CE1 3.73Å; Y66-F239 HydrophobicContact CD2-CE1 3.73Å; Y66-F239 HydrophobicContact CD2-CZ 4.41Å; Y66-F239 HydrophobicContact CE2-CE1 4.43Å; Y66-F239 HydrophobicContact CG-CD1 4.19Å; Y66-F239 AromaticContact CG-CE1 3.89Å; Y66-F239 HydrophobicContact CG-CE1 3.89Å; Y66-G243 VanDerWaalsContact CB-O 3.26Å; Y66-G243 WeakPolarHBondContact CB-O 3.44Å; Y66-G243 VanDerWaalsContact CD1-C 3.43Å; Y66-G243 WeakPolarHBondContact CD1-O 3.42Å; Y66-Y245 WeakPolarHBondContact O-CE1 3.39Å
67	G	87.5	Confident	77.2	Confident	15 Å²	15	73.1 Å²	73.1	16%	0.155	38%	0.379	C	S	.	.			trans	-95.6	171.2	171	0	0	0	0	0	112.5	K244 Y245	G67-K244 CarbonylContact O-C 3.51Å; G67-K244 WeakPolarHBondContact O-CA 3.07Å; G67-K244 VanDerWaalsContact O-CB 3.31Å; G67-K244 WeakPolarHBondContact O-CB 3.31Å; G67-Y245 VanDerWaalsContact C-CD1 3.46Å; G67-Y245 VanDerWaalsContact O-CD1 3.3Å; G67-Y245 WeakPolarHBondContact O-CD1 3.31Å; G67-Y245 PolarHBondContact O-N 2.87Å
68	N	92.7	Very high	79.2	Confident	3 Å²	3	65.8 Å²	65.8	2%	0.016	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-64.6	140.5	175.5	-161.5	-33.6	0	0	0	110.7	F70 Y106 D220 K244 Y245 P247	N68-F70 VanDerWaalsContact C-N 3.34Å; N68-F70 PolarHBondContact OD1-N 3.08Å; N68-Y106 PolarHBondContact ND2-OH 2.75Å; N68-D220 PolarHBondContact ND2-O 3.02Å; N68-K244 PolarHBondContact O-NZ 2.99Å; N68-Y245 HydrophobicContact CB-CD2 4.43Å; N68-Y245 HydrophobicContact CB-CE1 4.37Å; N68-Y245 HydrophobicContact CB-CE2 3.71Å; N68-Y245 VanDerWaalsContact N-CE1 3.3Å; N68-Y245 PolarHBondContact OD1-O 2.81Å; N68-P247 WeakPolarHBondContact OD1-CD 3.29Å
69	L	93.9	Very high	81.3	Confident	5 Å²	5	60.4 Å²	60.4	3%	0.026	31%	0.311	C	S	.	.	S	Bend	trans	-71.7	-31.4	173.8	-172.2	67.2	0	0	0	112	W161 K244 Y245 Y246	L69-W161 HydrophobicContact CD1-CH2 4.28Å; L69-W161 HydrophobicContact CD1-CZ3 4.3Å; L69-W161 HydrophobicContact CD2-CE3 4.34Å; L69-W161 HydrophobicContact CD2-CZ3 4.26Å; L69-W161 HydrophobicContact CG-CE3 4.38Å; L69-W161 HydrophobicContact CG-CH2 4.29Å; L69-W161 HydrophobicContact CG-CZ3 3.81Å; L69-K244 HydrophobicContact CB-CB 4.18Å; L69-K244 HydrophobicContact CD1-CB 4.04Å; L69-K244 HydrophobicContact CD1-CD 4Å; L69-Y245 VanDerWaalsContact CB-O 3.27Å; L69-Y245 WeakPolarHBondContact CB-O 3.39Å; L69-Y245 PolarHBondContact N-O 3.03Å; L69-Y246 HydrophobicContact CD2-CD1 3.76Å; L69-Y246 HydrophobicContact CD2-CE1 3.29Å
70	F	94.8	Very high	83.6	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.302	C	S	.	.	S	Bend	trans	-94.7	115.4	178.4	-76.9	-127.5	0	0	0	109.2	N68 M74 M76 Y106 V143 W161 I163 Q221 P247	N68-F70 VanDerWaalsContact C-N 3.34Å; N68-F70 PolarHBondContact OD1-N 3.08Å; F70-M74 HydrophobicContact CB-SD 4.19Å; F70-M74 HydrophobicContact CD1-CE 4.4Å; F70-M74 HydrophobicContact CD1-SD 3.95Å; F70-M74 HydrophobicContact CE1-CE 4.36Å; F70-M74 HydrophobicContact CE1-SD 4.49Å; F70-M74 HydrophobicContact CG-SD 3.97Å; F70-M76 HydrophobicContact CD1-SD 4.5Å; F70-M76 HydrophobicContact CE1-CB 4.2Å; F70-M76 HydrophobicContact CE1-SD 4.4Å; F70-Y106 HydrophobicContact CB-CD1 3.67Å; F70-Y106 HydrophobicContact CB-CE1 3.9Å; F70-Y106 HydrophobicContact CB-CG 4.1Å; F70-Y106 HydrophobicContact CD1-CG 4.5Å; F70-Y106 WeakPolarHBondContact O-CE1 3.35Å; F70-V143 HydrophobicContact CE1-CG1 4.15Å; F70-V143 HydrophobicContact CZ-CG1 4.46Å; F70-W161 HydrophobicContact CE2-CE3 4.28Å; F70-I163 HydrophobicContact CE2-CD1 3.98Å; F70-I163 HydrophobicContact CE2-CG1 4.49Å; F70-I163 HydrophobicContact CZ-CD1 4.03Å; F70-Q221 PolarHBondContact O-NE2 3.08Å; F70-P247 HydrophobicContact CB-CG 3.91Å; F70-P247 HydrophobicContact CD1-CG 4.21Å; F70-P247 HydrophobicContact CD2-CG 3.72Å; F70-P247 HydrophobicContact CE2-CG 4.3Å; F70-P247 HydrophobicContact CG-CG 3.69Å
71	E	93.7	Very high	85.9	Confident	94 Å²	94	55.5 Å²	55.5	44%	0.439	28%	0.278	S	S	.	.			trans	-76.7	154.3	176.8	-54.9	-64.9	158.7	0	0	110.3	G73 M74 K244	E71-G73 PolarHBondContact O-N 2.92Å; E71-M74 WeakPolarHBondContact O-CB 3.47Å; E71-M74 PolarHBondContact O-N 3.44Å; E71-M74 VanDerWaalsContact O-N 3.08Å; E71-K244 IonicContact OE1-NZ 2.66Å; E71-K244 PolarHBondContact OE1-NZ 2.82Å
72	P	93.8	Very high	87.8	Confident	71 Å²	71	45.7 Å²	45.7	46%	0.461	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	135.3	175.7	-25.4	35.6	0	0	0	112.2	M74 Q221	P72-M74 PolarHBondContact O-N 2.89Å; P72-Q221 HydrophobicContact CG-CG 3.92Å
73	G	94.7	Very high	89.8	Confident	45 Å²	45	39.3 Å²	39.3	46%	0.464	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	-2.2	-179.3	0	0	0	0	0	114.8	E71 K75 Y106	E71-G73 PolarHBondContact O-N 2.92Å; G73-K75 PolarHBondContact O-N 3.27Å; G73-Y106 PolarHBondContact N-O 3.06Å
74	M	96.8	Very high	91.7	Very high	28 Å²	28	37.2 Å²	37.2	14%	0.138	19%	0.193	C	C	.	.			trans	-55.6	128.6	175	179.6	176	170.1	0	0	110.4	F70 E71 P72 Y106 K145 W161	F70-M74 HydrophobicContact CB-SD 4.19Å; F70-M74 HydrophobicContact CD1-CE 4.4Å; F70-M74 HydrophobicContact CD1-SD 3.95Å; F70-M74 HydrophobicContact CE1-CE 4.36Å; F70-M74 HydrophobicContact CE1-SD 4.49Å; F70-M74 HydrophobicContact CG-SD 3.97Å; E71-M74 WeakPolarHBondContact O-CB 3.47Å; E71-M74 PolarHBondContact O-N 3.44Å; E71-M74 VanDerWaalsContact O-N 3.08Å; P72-M74 PolarHBondContact O-N 2.89Å; M74-Y106 PolarHBondContact O-N 3.47Å; M74-K145 HydrophobicContact CE-CB 3.66Å; M74-K145 HydrophobicContact CE-CD 3.77Å; M74-K145 HydrophobicContact CE-CG 3.53Å; M74-W161 HydrophobicContact CE-CD2 4.38Å; M74-W161 HydrophobicContact CE-CE3 3.56Å; M74-W161 HydrophobicContact CE-CH2 4.24Å; M74-W161 HydrophobicContact CE-CZ3 3.47Å; M74-W161 VanDerWaalsContact CE-CZ3 3.47Å; M74-W161 HydrophobicContact SD-CZ3 3.93Å
75	K	98	Very high	93.4	Very high	100 Å²	100	34.2 Å²	34.2	44%	0.435	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	131.4	178.7	-63.6	-59.1	-166.5	172.5	0	111.4	G73 N103 L104 S105 S146	G73-K75 PolarHBondContact O-N 3.27Å; K75-N103 PolarHBondContact NZ-O 3Å; K75-N103 VanDerWaalsContact NZ-O 3.15Å; K75-L104 CarbonylContact C-O 3.51Å; K75-L104 VanDerWaalsContact CA-O 3.31Å; K75-L104 WeakPolarHBondContact CA-O 2.91Å; K75-S105 PolarHBondContact NZ-OG 3.37Å; K75-S146 PolarHBondContact O-N 3.27Å
76	M	97.8	Very high	94.9	Very high	5 Å²	5	36.5 Å²	36.5	3%	0.025	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	152.8	-179.4	63.4	-175.8	-177.7	0	0	111.3	F70 N103 L104 Y106 V143 T144 M217 F277	F70-M76 HydrophobicContact CD1-SD 4.5Å; F70-M76 HydrophobicContact CE1-CB 4.2Å; F70-M76 HydrophobicContact CE1-SD 4.4Å; M76-N103 PolarHBondContact O-N 2.86Å; M76-L104 HydrophobicContact CE-CB 4.2Å; M76-L104 HydrophobicContact CG-CB 4.13Å; M76-L104 WeakPolarHBondContact CG-O 3.44Å; M76-L104 PolarHBondContact N-O 2.84Å; M76-L104 PolarHBondContact O-N 3.26Å; M76-Y106 HydrophobicContact CE-CD2 4.41Å; M76-Y106 HydrophobicContact SD-CD2 4.34Å; M76-V143 HydrophobicContact CB-CG1 4.11Å; M76-V143 HydrophobicContact CG-CG1 4.35Å; M76-V143 HydrophobicContact SD-CG1 3.77Å; M76-T144 CarbonylContact C-O 3.47Å; M76-T144 WeakPolarHBondContact CA-O 3.22Å; M76-T144 WeakPolarHBondContact CB-O 3.41Å; M76-M217 HydrophobicContact CE-CG 4.2Å; M76-F277 HydrophobicContact CE-CZ 4.3Å
77	D	98.1	Very high	95.8	Very high	4 Å²	4	42.6 Å²	42.6	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	151.3	169.5	-56.2	-21.3	0	0	0	108.9	L101 E102 N103 V143 T144 S146 G147	D77-L101 CarbonylContact C-O 3.56Å; D77-L101 VanDerWaalsContact CA-O 3.28Å; D77-L101 WeakPolarHBondContact CA-O 3.26Å; D77-E102 WeakPolarHBondContact OD1-CA 3.3Å; D77-N103 PolarHBondContact OD1-N 2.83Å; D77-V143 WeakPolarHBondContact O-CA 3.37Å; D77-T144 PolarHBondContact N-O 3.02Å; D77-T144 PolarHBondContact O-N 3.41Å; D77-S146 WeakPolarHBondContact OD1-CB 3.22Å; D77-S146 PolarHBondContact OD1-OG 3.45Å; D77-S146 WeakPolarHBondContact OD2-CA 3.41Å; D77-S146 PolarHBondContact OD2-OG 3.32Å; D77-G147 PolarHBondContact OD2-N 3.29Å
78	I	98	Very high	96.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	125.7	-179.6	-55.7	-175.7	0	0	0	108.4	M80 K100 L101 L104 V141 F142 V143 F277	I78-M80 HydrophobicContact CG2-CE 3.81Å; I78-M80 HydrophobicContact CG2-CG 4.2Å; I78-K100 CarbonylContact O-C 3.5Å; I78-K100 VanDerWaalsContact O-CA 3.29Å; I78-K100 WeakPolarHBondContact O-CA 3.17Å; I78-L101 HydrophobicContact CB-CB 4.26Å; I78-L101 PolarHBondContact N-O 2.91Å; I78-L101 PolarHBondContact O-N 3.28Å; I78-L104 HydrophobicContact CD1-CD1 3.66Å; I78-L104 HydrophobicContact CG1-CD1 4.05Å; I78-V141 HydrophobicContact CG2-CG1 3.83Å; I78-F142 CarbonylContact C-O 3.52Å; I78-F142 VanDerWaalsContact CA-O 3.31Å; I78-F142 WeakPolarHBondContact CA-O 3.18Å; I78-V143 HydrophobicContact CG1-CG2 4.29Å; I78-F277 HydrophobicContact CD1-CD1 4.16Å; I78-F277 HydrophobicContact CD1-CD2 3.71Å; I78-F277 HydrophobicContact CD1-CE1 3.61Å; I78-F277 HydrophobicContact CD1-CE2 3.1Å; I78-F277 HydrophobicContact CD1-CG 4.21Å; I78-F277 HydrophobicContact CD1-CZ 3.02Å
79	H	98.2	Very high	96.3	Very high	13 Å²	13	44.6 Å²	44.6	6%	0.06	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	125.4	177	-60.4	-119.4	0	0	0	109.1	Y81 K100 F142 P150	H79-Y81 HydrophobicContact CB-CD2 4.37Å; H79-Y81 HydrophobicContact CB-CE2 3.59Å; H79-K100 WeakPolarHBondContact CE1-CE 3.16Å; H79-K100 WeakPolarHBondContact NE2-CE 3.48Å; H79-F142 HydrophobicContact CB-CB 4.29Å; H79-F142 PolarHBondContact N-O 3.16Å; H79-F142 PolarHBondContact O-N 3.14Å; H79-P150 HydrophobicContact CB-CG 4.07Å
80	M	98.3	Very high	96.2	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.6	179.3	-56.2	-172	178.4	0	0	109.5	I78 F98 L99 M139 H140 V141 V215 V275 F277	I78-M80 HydrophobicContact CG2-CE 3.81Å; I78-M80 HydrophobicContact CG2-CG 4.2Å; M80-F98 HydrophobicContact CB-CB 4.38Å; M80-F98 HydrophobicContact CB-CD1 4.15Å; M80-F98 WeakPolarHBondContact O-CB 3.09Å; M80-F98 PolarHBondContact O-N 2.88Å; M80-L99 HydrophobicContact CB-CB 4.31Å; M80-L99 PolarHBondContact N-O 3.27Å; M80-L99 PolarHBondContact O-N 3.39Å; M80-L99 HydrophobicContact SD-CD2 4.25Å; M80-M139 HydrophobicContact SD-SD 4.39Å; M80-H140 CarbonylContact C-O 3.56Å; M80-H140 VanDerWaalsContact CA-O 3.31Å; M80-H140 WeakPolarHBondContact CA-O 3.37Å; M80-V141 HydrophobicContact CE-CG2 4.49Å; M80-V141 HydrophobicContact CG-CG2 4.19Å; M80-V215 HydrophobicContact CE-CB 4.18Å; M80-V215 HydrophobicContact CE-CG1 4.3Å; M80-V215 HydrophobicContact CE-CG2 4.21Å; M80-V275 HydrophobicContact CE-CG1 4.11Å; M80-V275 HydrophobicContact SD-CG1 3.86Å; M80-F277 HydrophobicContact CE-CD2 4.3Å
81	Y	98.2	Very high	96.2	Very high	17 Å²	17	50.6 Å²	50.6	7%	0.067	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	153.2	177	-59.9	-92.3	0	0	0	110.6	H79 F88 F91 A96 F97 M139 H140 F142 P150	H79-Y81 HydrophobicContact CB-CD2 4.37Å; H79-Y81 HydrophobicContact CB-CE2 3.59Å; Y81-F88 HydrophobicContact CD1-CE1 4.04Å; Y81-F88 HydrophobicContact CD1-CE2 4.3Å; Y81-F88 AromaticContact CD1-CZ 3.47Å; Y81-F88 HydrophobicContact CD1-CZ 3.47Å; Y81-F88 VanDerWaalsContact CD1-CZ 3.47Å; Y81-F88 AromaticContact CD2-CE1 3.97Å; Y81-F88 HydrophobicContact CD2-CE1 3.97Å; Y81-F88 HydrophobicContact CD2-CZ 4.08Å; Y81-F88 HydrophobicContact CE1-CE1 4.45Å; Y81-F88 HydrophobicContact CE1-CZ 4.19Å; Y81-F88 HydrophobicContact CE2-CE1 4.36Å; Y81-F88 AromaticContact CG-CE1 3.79Å; Y81-F88 HydrophobicContact CG-CE1 3.79Å; Y81-F88 HydrophobicContact CG-CE2 4.03Å; Y81-F88 AromaticContact CG-CZ 3.42Å; Y81-F88 HydrophobicContact CG-CZ 3.42Å; Y81-F88 VanDerWaalsContact CG-CZ 3.42Å; Y81-F91 HydrophobicContact CE2-CD1 4.12Å; Y81-F91 HydrophobicContact CE2-CE1 4.24Å; Y81-A96 CarbonylContact C-O 3.56Å; Y81-A96 WeakPolarHBondContact CA-O 3.36Å; Y81-A96 WeakPolarHBondContact CB-O 3.47Å; Y81-A96 HydrophobicContact CD1-CB 4.49Å; Y81-F97 HydrophobicContact CD1-CB 4.3Å; Y81-F97 HydrophobicContact CD1-CD2 4.44Å; Y81-F97 HydrophobicContact CE1-CB 4.21Å; Y81-F97 AromaticContact CE1-CD2 3.9Å; Y81-F97 HydrophobicContact CE1-CD2 3.9Å; Y81-M139 CarbonylContact O-C 3.57Å; Y81-M139 WeakPolarHBondContact O-CA 3.28Å; Y81-H140 PolarHBondContact N-O 3.14Å; Y81-H140 PolarHBondContact O-N 3.47Å; Y81-F142 AromaticContact CD2-CD2 3.77Å; Y81-F142 HydrophobicContact CD2-CD2 3.77Å; Y81-F142 AromaticContact CD2-CE2 3.84Å; Y81-F142 HydrophobicContact CD2-CE2 3.84Å; Y81-F142 AromaticContact CE2-CD2 3.98Å; Y81-F142 HydrophobicContact CE2-CD2 3.98Å; Y81-F142 HydrophobicContact CE2-CE2 4.27Å; Y81-P150 HydrophobicContact CE2-CG 4.43Å
82	L	97.9	Very high	96.2	Very high	15 Å²	15	50 Å²	50	8%	0.079	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	135.9	173.5	-60.3	177.3	0	0	0	109.2	A96 F98 I125 L137 F138 M139 L169 L273	L82-A96 PolarHBondContact N-O 2.81Å; L82-A96 WeakPolarHBondContact O-CA 3.27Å; L82-A96 WeakPolarHBondContact O-CB 3.35Å; L82-F98 HydrophobicContact CD1-CB 4.41Å; L82-F98 HydrophobicContact CD1-CD2 3.83Å; L82-F98 HydrophobicContact CD1-CG 4.37Å; L82-F98 HydrophobicContact CG-CB 4.14Å; L82-F98 HydrophobicContact CG-CD2 4.37Å; L82-F98 HydrophobicContact CG-CG 4.43Å; L82-I125 HydrophobicContact CD1-CD1 3.43Å; L82-I125 VanDerWaalsContact CD1-CD1 3.43Å; L82-I125 HydrophobicContact CD1-CG2 4.01Å; L82-L137 HydrophobicContact CB-CD1 4.4Å; L82-F138 VanDerWaalsContact CA-O 3.31Å; L82-F138 WeakPolarHBondContact CA-O 3.45Å; L82-M139 HydrophobicContact CD2-CB 4.13Å; L82-M139 HydrophobicContact CD2-CE 4.15Å; L82-M139 HydrophobicContact CD2-CG 4.34Å; L82-L169 HydrophobicContact CD2-CD1 3.72Å; L82-L273 HydrophobicContact CD1-CD2 4.05Å; L82-L273 HydrophobicContact CD2-CD2 3.98Å
83	S	97	Very high	96.2	Very high	19 Å²	19	49.8 Å²	49.8	13%	0.133	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	160	175.6	102.3	0	0	0	0	111.7	N85 F138 H140	S83-N85 VanDerWaalsContact C-N 3.27Å; S83-N85 PolarHBondContact OG-N 3.28Å; S83-N85 VanDerWaalsContact OG-N 3.14Å; S83-N85 PolarHBondContact OG-O 2.96Å; S83-F138 PolarHBondContact N-O 2.8Å; S83-F138 WeakPolarHBondContact O-CA 3.28Å; S83-F138 WeakPolarHBondContact O-CB 3.43Å; S83-F138 PolarHBondContact O-N 2.78Å; S83-H140 PolarHBondContact OG-NE2 3.18Å
84	E	96.8	Very high	96	Very high	69 Å²	69	54.5 Å²	54.5	32%	0.322	29%	0.287	S	S	.	.	S	Bend	trans	-84.5	0.3	176.5	-61.6	177.9	-136.8	0	0	113.2	P128 N130 V131 S136 F138	E84-P128 HydrophobicContact CG-CB 4.4Å; E84-P128 VanDerWaalsContact OE1-CB 3.22Å; E84-P128 WeakPolarHBondContact OE1-CB 3.4Å; E84-N130 WeakPolarHBondContact OE2-CB 3.33Å; E84-N130 PolarHBondContact OE2-ND2 2.79Å; E84-V131 HydrophobicContact CG-CG2 4.39Å; E84-S136 WeakPolarHBondContact CA-O 3.28Å; E84-F138 WeakPolarHBondContact O-CE2 3.33Å
85	N	96.4	Very high	95.7	Very high	100 Å²	100	62.3 Å²	62.3	54%	0.535	32%	0.316	S	S	.	.	S	Bend	trans	-119.5	145.9	-175.3	-63.1	-69.4	0	0	0	111.2	S83 Y87 H140	S83-N85 VanDerWaalsContact C-N 3.27Å; S83-N85 PolarHBondContact OG-N 3.28Å; S83-N85 VanDerWaalsContact OG-N 3.14Å; S83-N85 PolarHBondContact OG-O 2.96Å; N85-Y87 VanDerWaalsContact C-N 3.27Å; N85-Y87 WeakPolarHBondContact CB-O 3.23Å; N85-Y87 PolarHBondContact O-N 3.2Å; N85-H140 PolarHBondContact O-CE1 2.89Å; N85-H140 PolarHBondContact O-NE2 3.36Å
86	E	94.7	Very high	95.6	Very high	105 Å²	105	57.8 Å²	57.8	49%	0.491	30%	0.298	S	S	.	.	S	Bend	trans	-68.4	-29.4	173.6	-65.3	-175.1	175.3	0	0	112.4	F138 H140 W166	E86-F138 HydrophobicContact CG-CD1 4.25Å; E86-F138 HydrophobicContact CG-CE1 3.63Å; E86-F138 HydrophobicContact CG-CE2 4.12Å; E86-F138 HydrophobicContact CG-CZ 3.56Å; E86-H140 PolarHBondContact O-CE1 3.28Å; E86-H140 VanDerWaalsContact O-CE1 3.26Å; E86-W166 HydrophobicContact CB-CD2 4.32Å; E86-W166 HydrophobicContact CB-CH2 4.23Å; E86-W166 HydrophobicContact CB-CZ2 3.94Å; E86-W166 VanDerWaalsContact CD-CZ2 3.49Å; E86-W166 HydrophobicContact CG-CD2 4.45Å; E86-W166 HydrophobicContact CG-CE3 4.23Å; E86-W166 HydrophobicContact CG-CH2 3.64Å; E86-W166 HydrophobicContact CG-CZ2 3.87Å; E86-W166 HydrophobicContact CG-CZ3 3.83Å; E86-W166 VanDerWaalsContact OE1-CH2 3.24Å; E86-W166 WeakPolarHBondContact OE1-CH2 3.15Å; E86-W166 WeakPolarHBondContact OE2-CH2 3.48Å; E86-W166 VanDerWaalsContact OE2-CZ2 3.31Å; E86-W166 WeakPolarHBondContact OE2-CZ2 3.28Å
87	Y	94.6	Very high	95.6	Very high	185 Å²	185	61.7 Å²	61.7	73%	0.725	32%	0.315	S	S	*	.	S	Bend	trans	-90.9	128.8	172.6	179.7	-102.2	0	0	0	110.7	N85 A89	N85-Y87 VanDerWaalsContact C-N 3.27Å; N85-Y87 WeakPolarHBondContact CB-O 3.23Å; N85-Y87 PolarHBondContact O-N 3.2Å; Y87-A89 HydrophobicContact CD1-CB 4.4Å; Y87-A89 HydrophobicContact CE1-CB 3.65Å
88	F	96.1	Very high	95.5	Very high	11 Å²	11	61.7 Å²	61.7	5%	0.048	32%	0.315	C	S	.	.			trans	-113.5	124.2	-179	-172.5	-94.4	0	0	0	111.5	Y81 F91 A96 H140 F142	Y81-F88 HydrophobicContact CD1-CE1 4.04Å; Y81-F88 HydrophobicContact CD1-CE2 4.3Å; Y81-F88 AromaticContact CD1-CZ 3.47Å; Y81-F88 HydrophobicContact CD1-CZ 3.47Å; Y81-F88 VanDerWaalsContact CD1-CZ 3.47Å; Y81-F88 AromaticContact CD2-CE1 3.97Å; Y81-F88 HydrophobicContact CD2-CE1 3.97Å; Y81-F88 HydrophobicContact CD2-CZ 4.08Å; Y81-F88 HydrophobicContact CE1-CE1 4.45Å; Y81-F88 HydrophobicContact CE1-CZ 4.19Å; Y81-F88 HydrophobicContact CE2-CE1 4.36Å; Y81-F88 AromaticContact CG-CE1 3.79Å; Y81-F88 HydrophobicContact CG-CE1 3.79Å; Y81-F88 HydrophobicContact CG-CE2 4.03Å; Y81-F88 AromaticContact CG-CZ 3.42Å; Y81-F88 HydrophobicContact CG-CZ 3.42Å; Y81-F88 VanDerWaalsContact CG-CZ 3.42Å; F88-F91 HydrophobicContact CD1-CD1 4.24Å; F88-F91 HydrophobicContact CD1-CD2 4.36Å; F88-F91 AromaticContact CD1-CE1 3.83Å; F88-F91 HydrophobicContact CD1-CE1 3.83Å; F88-F91 AromaticContact CD1-CE2 3.97Å; F88-F91 HydrophobicContact CD1-CE2 3.97Å; F88-F91 HydrophobicContact CD1-CG 4.48Å; F88-F91 AromaticContact CD1-CZ 3.69Å; F88-F91 HydrophobicContact CD1-CZ 3.69Å; F88-F91 AromaticContact CE1-CD1 3.59Å; F88-F91 HydrophobicContact CE1-CD1 3.59Å; F88-F91 HydrophobicContact CE1-CD2 4.1Å; F88-F91 AromaticContact CE1-CE1 3.63Å; F88-F91 HydrophobicContact CE1-CE1 3.63Å; F88-F91 HydrophobicContact CE1-CE2 4.13Å; F88-F91 AromaticContact CE1-CG 3.82Å; F88-F91 HydrophobicContact CE1-CG 3.82Å; F88-F91 AromaticContact CE1-CZ 3.92Å; F88-F91 HydrophobicContact CE1-CZ 3.92Å; F88-A96 HydrophobicContact CE2-CB 4.03Å; F88-A96 HydrophobicContact CZ-CB 4.24Å; F88-H140 HydrophobicContact CB-CB 4.41Å; F88-H140 AromaticContact CD2-CD2 3.67Å; F88-H140 HydrophobicContact CG-CB 4.43Å; F88-F142 HydrophobicContact CB-CZ 4.2Å; F88-F142 AromaticContact CD1-CE2 3.67Å; F88-F142 HydrophobicContact CD1-CE2 3.67Å; F88-F142 AromaticContact CD1-CZ 3.69Å; F88-F142 HydrophobicContact CD1-CZ 3.69Å; F88-F142 HydrophobicContact CE1-CE2 4.21Å; F88-F142 HydrophobicContact CG-CE2 4.25Å; F88-F142 HydrophobicContact CG-CZ 4.26Å
89	A	93.8	Very high	95.5	Very high	50 Å²	50	62.6 Å²	62.6	41%	0.413	32%	0.32	S	S	.	.			trans	-135	-9.4	174.3	0	0	0	0	0	114.1	Y87 F91	Y87-A89 HydrophobicContact CD1-CB 4.4Å; Y87-A89 HydrophobicContact CE1-CB 3.65Å; A89-F91 VanDerWaalsContact C-N 3.27Å; A89-F91 WeakPolarHBondContact O-CD2 3.4Å; A89-F91 PolarHBondContact O-N 3.13Å
90	N	92.8	Very high	95.4	Very high	101 Å²	101	65.7 Å²	65.7	54%	0.54	33%	0.333	S	S	.	.			trans	-88.3	56.3	-170.5	-64.7	-14.3	0	0	0	112.1	G92 D93	N90-G92 PolarHBondContact O-N 3.46Å; N90-D93 HydrophobicContact CB-CB 4.22Å; N90-D93 PolarHBondContact O-N 3.18Å; N90-D93 VanDerWaalsContact O-N 3.16Å
91	F	95.5	Very high	95.4	Very high	29 Å²	29	67 Å²	67	13%	0.127	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-19.9	-177.9	-67.6	-86.3	0	0	0	114.4	Y81 F88 A89 F142 P150 N151 P152	Y81-F91 HydrophobicContact CE2-CD1 4.12Å; Y81-F91 HydrophobicContact CE2-CE1 4.24Å; F88-F91 HydrophobicContact CD1-CD1 4.24Å; F88-F91 HydrophobicContact CD1-CD2 4.36Å; F88-F91 AromaticContact CD1-CE1 3.83Å; F88-F91 HydrophobicContact CD1-CE1 3.83Å; F88-F91 AromaticContact CD1-CE2 3.97Å; F88-F91 HydrophobicContact CD1-CE2 3.97Å; F88-F91 HydrophobicContact CD1-CG 4.48Å; F88-F91 AromaticContact CD1-CZ 3.69Å; F88-F91 HydrophobicContact CD1-CZ 3.69Å; F88-F91 AromaticContact CE1-CD1 3.59Å; F88-F91 HydrophobicContact CE1-CD1 3.59Å; F88-F91 HydrophobicContact CE1-CD2 4.1Å; F88-F91 AromaticContact CE1-CE1 3.63Å; F88-F91 HydrophobicContact CE1-CE1 3.63Å; F88-F91 HydrophobicContact CE1-CE2 4.13Å; F88-F91 AromaticContact CE1-CG 3.82Å; F88-F91 HydrophobicContact CE1-CG 3.82Å; F88-F91 AromaticContact CE1-CZ 3.92Å; F88-F91 HydrophobicContact CE1-CZ 3.92Å; A89-F91 VanDerWaalsContact C-N 3.27Å; A89-F91 WeakPolarHBondContact O-CD2 3.4Å; A89-F91 PolarHBondContact O-N 3.13Å; F91-F142 HydrophobicContact CE1-CD2 4.37Å; F91-F142 HydrophobicContact CE1-CE1 4.24Å; F91-F142 AromaticContact CE1-CE2 3.93Å; F91-F142 HydrophobicContact CE1-CE2 3.93Å; F91-F142 AromaticContact CE1-CZ 3.86Å; F91-F142 HydrophobicContact CE1-CZ 3.86Å; F91-F142 AromaticContact CZ-CE1 3.93Å; F91-F142 HydrophobicContact CZ-CE1 3.93Å; F91-F142 HydrophobicContact CZ-CE2 4.2Å; F91-F142 AromaticContact CZ-CZ 3.66Å; F91-F142 HydrophobicContact CZ-CZ 3.66Å; F91-P150 HydrophobicContact CD1-CG 4.21Å; F91-P150 HydrophobicContact CE1-CB 3.93Å; F91-P150 HydrophobicContact CE1-CG 3.93Å; F91-P150 WeakPolarHBondContact CZ-O 3.25Å; F91-N151 HydrophobicContact CB-CB 3.84Å; F91-N151 HydrophobicContact CD1-CB 3.85Å; F91-N151 HydrophobicContact CD2-CB 3.85Å; F91-N151 HydrophobicContact CE1-CB 4.39Å; F91-N151 HydrophobicContact CE2-CB 4.39Å; F91-N151 HydrophobicContact CG-CB 3.56Å; F91-P152 VanDerWaalsContact CE2-CD 3.49Å
92	G	93	Very high	95.3	Very high	81 Å²	81	71.4 Å²	71.4	84%	0.835	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-6	177.5	0	0	0	0	0	114.6	N90 Q94	N90-G92 PolarHBondContact O-N 3.46Å; G92-Q94 PolarHBondContact O-N 3.43Å
93	D	93.2	Very high	95.2	Very high	67 Å²	67	75.6 Å²	75.6	36%	0.358	38%	0.383	S	S	.	.			trans	-80.8	113.7	179.1	-178.1	6.2	0	0	0	110.7	N90 Y95 A96 F97	N90-D93 HydrophobicContact CB-CB 4.22Å; N90-D93 PolarHBondContact O-N 3.18Å; N90-D93 VanDerWaalsContact O-N 3.16Å; D93-Y95 PolarHBondContact O-N 3.41Å; D93-Y95 WeakPolarHBondContact OD1-CB 3.16Å; D93-Y95 PolarHBondContact OD1-N 3.18Å; D93-A96 HydrophobicContact CB-CB 3.91Å; D93-A96 WeakPolarHBondContact O-CB 3.49Å; D93-A96 PolarHBondContact O-N 3.45Å; D93-A96 VanDerWaalsContact O-N 3.17Å; D93-F97 PolarHBondContact O-N 3.37Å
94	Q	91.3	Very high	95.1	Very high	145 Å²	145	75.8 Å²	75.8	68%	0.678	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-27.7	177.6	65.7	179.6	-13.2	0	0	113.3	G92 F97	G92-Q94 PolarHBondContact O-N 3.43Å; Q94-F97 PolarHBondContact O-N 3.11Å
95	Y	91.1	Very high	95.1	Very high	191 Å²	191	73.8 Å²	73.8	75%	0.749	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-25.3	178.4	-62.6	-72	0	0	0	111.8	D93	D93-Y95 PolarHBondContact O-N 3.41Å; D93-Y95 WeakPolarHBondContact OD1-CB 3.16Å; D93-Y95 PolarHBondContact OD1-N 3.18Å
96	A	95.7	Very high	95.1	Very high	6 Å²	6	69.1 Å²	69.1	5%	0.05	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-28.7	172.1	0	0	0	0	0	112.1	Y81 L82 F88 D93 F98	Y81-A96 CarbonylContact C-O 3.56Å; Y81-A96 WeakPolarHBondContact CA-O 3.36Å; Y81-A96 WeakPolarHBondContact CB-O 3.47Å; Y81-A96 HydrophobicContact CD1-CB 4.49Å; L82-A96 PolarHBondContact N-O 2.81Å; L82-A96 WeakPolarHBondContact O-CA 3.27Å; L82-A96 WeakPolarHBondContact O-CB 3.35Å; F88-A96 HydrophobicContact CE2-CB 4.03Å; F88-A96 HydrophobicContact CZ-CB 4.24Å; D93-A96 HydrophobicContact CB-CB 3.91Å; D93-A96 WeakPolarHBondContact O-CB 3.49Å; D93-A96 PolarHBondContact O-N 3.45Å; D93-A96 VanDerWaalsContact O-N 3.17Å; A96-F98 PolarHBondContact O-N 2.86Å
97	F	96.7	Very high	95	Very high	87 Å²	87	65.1 Å²	65.1	38%	0.382	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	124.8	179.4	177.5	-101.8	0	0	0	112.3	Y81 D93 Q94 K100	Y81-F97 HydrophobicContact CD1-CB 4.3Å; Y81-F97 HydrophobicContact CD1-CD2 4.44Å; Y81-F97 HydrophobicContact CE1-CB 4.21Å; Y81-F97 AromaticContact CE1-CD2 3.9Å; Y81-F97 HydrophobicContact CE1-CD2 3.9Å; D93-F97 PolarHBondContact O-N 3.37Å; Q94-F97 PolarHBondContact O-N 3.11Å; F97-K100 HydrophobicContact CE2-CB 3.98Å; F97-K100 HydrophobicContact CZ-CB 3.94Å
98	F	97.4	Very high	94.9	Very high	3 Å²	3	58.8 Å²	58.8	1%	0.013	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-58.9	178.1	-177.2	-103.9	0	0	0	112.6	M80 L82 A96 Y121 K123 I125 L273 V275	M80-F98 HydrophobicContact CB-CB 4.38Å; M80-F98 HydrophobicContact CB-CD1 4.15Å; M80-F98 WeakPolarHBondContact O-CB 3.09Å; M80-F98 PolarHBondContact O-N 2.88Å; L82-F98 HydrophobicContact CD1-CB 4.41Å; L82-F98 HydrophobicContact CD1-CD2 3.83Å; L82-F98 HydrophobicContact CD1-CG 4.37Å; L82-F98 HydrophobicContact CG-CB 4.14Å; L82-F98 HydrophobicContact CG-CD2 4.37Å; L82-F98 HydrophobicContact CG-CG 4.43Å; A96-F98 PolarHBondContact O-N 2.86Å; F98-Y121 AromaticContact CE1-CD1 3.74Å; F98-Y121 HydrophobicContact CE1-CD1 3.74Å; F98-Y121 HydrophobicContact CE1-CE1 4.11Å; F98-Y121 HydrophobicContact CE2-CE1 4.37Å; F98-Y121 AromaticContact CZ-CD1 3.8Å; F98-Y121 HydrophobicContact CZ-CD1 3.8Å; F98-Y121 AromaticContact CZ-CE1 3.98Å; F98-Y121 HydrophobicContact CZ-CE1 3.98Å; F98-K123 HydrophobicContact CD2-CD 4.38Å; F98-K123 HydrophobicContact CE2-CB 3.91Å; F98-K123 HydrophobicContact CE2-CD 4.32Å; F98-K123 HydrophobicContact CZ-CB 4.36Å; F98-I125 HydrophobicContact CD2-CG2 4.23Å; F98-I125 HydrophobicContact CE2-CG2 4.21Å; F98-L273 HydrophobicContact CD2-CD2 4.24Å; F98-L273 HydrophobicContact CE1-CD2 4.47Å; F98-L273 HydrophobicContact CE2-CB 4.13Å; F98-L273 HydrophobicContact CE2-CD2 3.72Å; F98-L273 HydrophobicContact CE2-CG 4.07Å; F98-L273 HydrophobicContact CZ-CB 4.26Å; F98-L273 HydrophobicContact CZ-CD2 3.85Å; F98-L273 HydrophobicContact CZ-CG 3.89Å; F98-V275 HydrophobicContact CD1-CG2 4.4Å; F98-V275 HydrophobicContact CE1-CB 4.14Å; F98-V275 HydrophobicContact CE1-CG2 3.43Å; F98-V275 VanDerWaalsContact CE1-CG2 3.43Å; F98-V275 HydrophobicContact CZ-CG2 3.85Å
99	L	96.8	Very high	94.8	Very high	20 Å²	20	64 Å²	64	11%	0.105	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	144.8	-173.4	179	64.1	0	0	0	110.8	M80 L101 Y121	M80-L99 HydrophobicContact CB-CB 4.31Å; M80-L99 PolarHBondContact N-O 3.27Å; M80-L99 PolarHBondContact O-N 3.39Å; M80-L99 HydrophobicContact SD-CD2 4.25Å; L99-L101 HydrophobicContact CD1-CD2 4.13Å; L99-L101 HydrophobicContact CD2-CD1 4.4Å; L99-L101 HydrophobicContact CD2-CD2 3.97Å; L99-L101 HydrophobicContact CD2-CG 4.1Å; L99-L101 HydrophobicContact CG-CD2 4.09Å; L99-L101 HydrophobicContact CG-CG 4.22Å; L99-Y121 HydrophobicContact CB-CD1 4.26Å; L99-Y121 HydrophobicContact CB-CE1 4.4Å; L99-Y121 HydrophobicContact CD1-CD1 4.01Å; L99-Y121 HydrophobicContact CD1-CD2 3.88Å; L99-Y121 HydrophobicContact CD1-CE1 4.22Å; L99-Y121 HydrophobicContact CD1-CE2 4.12Å; L99-Y121 HydrophobicContact CD1-CG 3.82Å; L99-Y121 HydrophobicContact CD2-CD1 3.98Å; L99-Y121 HydrophobicContact CD2-CG 3.9Å; L99-Y121 HydrophobicContact CG-CD1 4.31Å; L99-Y121 HydrophobicContact CG-CG 4.39Å
100	K	97.2	Very high	94.8	Very high	78 Å²	78	67.3 Å²	67.3	34%	0.339	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	131.5	165.2	-169.5	-174.1	-178.8	-170	0	108.9	I78 H79 F97 E102	I78-K100 CarbonylContact O-C 3.5Å; I78-K100 VanDerWaalsContact O-CA 3.29Å; I78-K100 WeakPolarHBondContact O-CA 3.17Å; H79-K100 WeakPolarHBondContact CE1-CE 3.16Å; H79-K100 WeakPolarHBondContact NE2-CE 3.48Å; F97-K100 HydrophobicContact CE2-CB 3.98Å; F97-K100 HydrophobicContact CZ-CB 3.94Å; K100-E102 HydrophobicContact CD-CG 3.86Å; K100-E102 VanDerWaalsContact CE-CG 3.48Å; K100-E102 WeakPolarHBondContact CE-OE1 3.33Å; K100-E102 HydrophobicContact CG-CG 4.01Å; K100-E102 IonicContact NZ-OE1 2.63Å; K100-E102 PolarHBondContact NZ-OE1 2.94Å
101	L	96.8	Very high	94.6	Very high	27 Å²	27	63.3 Å²	63.3	14%	0.141	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	128.5	169.7	-55.5	174.8	0	0	0	108.1	D77 I78 L99 L104 L119 F277	D77-L101 CarbonylContact C-O 3.56Å; D77-L101 VanDerWaalsContact CA-O 3.28Å; D77-L101 WeakPolarHBondContact CA-O 3.26Å; I78-L101 HydrophobicContact CB-CB 4.26Å; I78-L101 PolarHBondContact N-O 2.91Å; I78-L101 PolarHBondContact O-N 3.28Å; L99-L101 HydrophobicContact CD1-CD2 4.13Å; L99-L101 HydrophobicContact CD2-CD1 4.4Å; L99-L101 HydrophobicContact CD2-CD2 3.97Å; L99-L101 HydrophobicContact CD2-CG 4.1Å; L99-L101 HydrophobicContact CG-CD2 4.09Å; L99-L101 HydrophobicContact CG-CG 4.22Å; L101-L104 HydrophobicContact CB-CD1 3.73Å; L101-L104 HydrophobicContact CB-CG 4.25Å; L101-L104 HydrophobicContact CD1-CD1 4.09Å; L101-L119 HydrophobicContact CD1-CD1 3.99Å; L101-L119 HydrophobicContact CD2-CD1 4.33Å; L101-F277 HydrophobicContact CD1-CB 3.89Å; L101-F277 HydrophobicContact CD1-CD1 4.13Å; L101-F277 HydrophobicContact CD1-CG 3.99Å
102	E	96.6	Very high	94.2	Very high	111 Å²	111	63.1 Å²	63.1	52%	0.519	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	152.1	-172.3	-68.7	179.4	118.2	0	0	111.8	D77 K100 L104	D77-E102 WeakPolarHBondContact OD1-CA 3.3Å; K100-E102 HydrophobicContact CD-CG 3.86Å; K100-E102 VanDerWaalsContact CE-CG 3.48Å; K100-E102 WeakPolarHBondContact CE-OE1 3.33Å; K100-E102 HydrophobicContact CG-CG 4.01Å; K100-E102 IonicContact NZ-OE1 2.63Å; K100-E102 PolarHBondContact NZ-OE1 2.94Å; E102-L104 PolarHBondContact O-N 3.22Å; E102-L104 VanDerWaalsContact O-N 3.16Å
103	N	95.8	Very high	93.9	Very high	102 Å²	102	64.5 Å²	64.5	55%	0.545	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	58.4	27.3	170.4	-64.3	-57.1	0	0	0	115.1	K75 M76 D77 S146	K75-N103 PolarHBondContact NZ-O 3Å; K75-N103 VanDerWaalsContact NZ-O 3.15Å; M76-N103 PolarHBondContact O-N 2.86Å; D77-N103 PolarHBondContact OD1-N 2.83Å; N103-S146 PolarHBondContact OD1-OG 3.31Å
104	L	95.8	Very high	93.7	Very high	24 Å²	24	69.3 Å²	69.3	13%	0.126	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	141.6	176.2	-59.5	-177.1	0	0	0	110.2	K75 M76 I78 L101 E102 L119 F277	K75-L104 CarbonylContact C-O 3.51Å; K75-L104 VanDerWaalsContact CA-O 3.31Å; K75-L104 WeakPolarHBondContact CA-O 2.91Å; M76-L104 HydrophobicContact CE-CB 4.2Å; M76-L104 HydrophobicContact CG-CB 4.13Å; M76-L104 WeakPolarHBondContact CG-O 3.44Å; M76-L104 PolarHBondContact N-O 2.84Å; M76-L104 PolarHBondContact O-N 3.26Å; I78-L104 HydrophobicContact CD1-CD1 3.66Å; I78-L104 HydrophobicContact CG1-CD1 4.05Å; L101-L104 HydrophobicContact CB-CD1 3.73Å; L101-L104 HydrophobicContact CB-CG 4.25Å; L101-L104 HydrophobicContact CD1-CD1 4.09Å; E102-L104 PolarHBondContact O-N 3.22Å; E102-L104 VanDerWaalsContact O-N 3.16Å; L104-L119 HydrophobicContact CD1-CD1 4.28Å; L104-L119 HydrophobicContact CD2-CD1 3.62Å; L104-F277 HydrophobicContact CD1-CD1 4.04Å; L104-F277 HydrophobicContact CD1-CE1 3.7Å; L104-F277 HydrophobicContact CD1-CZ 4.41Å
105	S	95.9	Very high	93.5	Very high	26 Å²	26	64.1 Å²	64.1	18%	0.182	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	130.7	175	-28.9	0	0	0	0	109.9	K75 G107 D108	K75-S105 PolarHBondContact NZ-OG 3.37Å; S105-G107 PolarHBondContact O-N 3.38Å; S105-D108 VanDerWaalsContact O-CB 3.3Å; S105-D108 WeakPolarHBondContact O-CB 3.49Å; S105-D108 PolarHBondContact O-N 3.49Å; S105-D108 VanDerWaalsContact O-N 3.08Å
106	Y	96.5	Very high	93.4	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.008	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	120.1	174.3	-178.6	-121.5	0	0	0	110.6	N68 F70 G73 M74 M76 M217 V218 Y219 D220 P247	N68-Y106 PolarHBondContact ND2-OH 2.75Å; F70-Y106 HydrophobicContact CB-CD1 3.67Å; F70-Y106 HydrophobicContact CB-CE1 3.9Å; F70-Y106 HydrophobicContact CB-CG 4.1Å; F70-Y106 HydrophobicContact CD1-CG 4.5Å; F70-Y106 WeakPolarHBondContact O-CE1 3.35Å; G73-Y106 PolarHBondContact N-O 3.06Å; M74-Y106 PolarHBondContact O-N 3.47Å; M76-Y106 HydrophobicContact CE-CD2 4.41Å; M76-Y106 HydrophobicContact SD-CD2 4.34Å; Y106-M217 HydrophobicContact CD2-CG 3.97Å; Y106-M217 HydrophobicContact CE2-CE 4.28Å; Y106-M217 HydrophobicContact CE2-CG 3.81Å; Y106-V218 WeakPolarHBondContact CE2-O 3.37Å; Y106-V218 PolarHBondContact OH-O 3.48Å; Y106-Y219 HydrophobicContact CD1-CD2 4.31Å; Y106-Y219 HydrophobicContact CD1-CE2 4.44Å; Y106-Y219 AromaticContact CE1-CD2 3.96Å; Y106-Y219 HydrophobicContact CE1-CD2 3.96Å; Y106-Y219 HydrophobicContact CE1-CE2 4.26Å; Y106-Y219 HydrophobicContact CE2-CD2 4.44Å; Y106-Y219 WeakPolarHBondContact OH-CA 3.48Å; Y106-D220 PolarHBondContact OH-N 2.91Å; Y106-D220 VanDerWaalsContact OH-N 3.08Å; Y106-P247 HydrophobicContact CE2-CB 3.82Å; Y106-P247 HydrophobicContact CE2-CG 4.28Å; Y106-P247 VanDerWaalsContact OH-CB 3.32Å; Y106-P247 WeakPolarHBondContact OH-CB 3.4Å
107	G	92.8	Very high	93.2	Very high	21 Å²	21	60.5 Å²	60.5	22%	0.216	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.6	18.7	-174.1	0	0	0	0	0	114.9	S105 W109	S105-G107 PolarHBondContact O-N 3.38Å; G107-W109 PolarHBondContact O-N 2.82Å
108	D	92.3	Very high	93.1	Very high	53 Å²	53	57.7 Å²	57.7	28%	0.283	32%	0.316	S	S	.	.			trans	-77.2	110.6	172.2	-170.3	-2.3	0	0	0	111.7	S105 N110 A111 P279	S105-D108 VanDerWaalsContact O-CB 3.3Å; S105-D108 WeakPolarHBondContact O-CB 3.49Å; S105-D108 PolarHBondContact O-N 3.49Å; S105-D108 VanDerWaalsContact O-N 3.08Å; D108-N110 PolarHBondContact OD1-N 3.25Å; D108-A111 PolarHBondContact OD1-N 2.77Å; D108-P279 WeakPolarHBondContact O-CG 3.28Å
109	W	94.7	Very high	93	Very high	120 Å²	120	59.5 Å²	59.5	46%	0.455	33%	0.326	S	S	.	.	S	Bend	trans	-91.8	0	178.3	-63.8	92.4	0	0	0	113.8	G107 G117 P279	G107-W109 PolarHBondContact O-N 2.82Å; W109-G117 WeakPolarHBondContact O-CA 3.43Å; W109-P279 HydrophobicContact CD2-CB 4.29Å; W109-P279 HydrophobicContact CD2-CG 3.87Å; W109-P279 HydrophobicContact CE3-CB 4.16Å; W109-P279 HydrophobicContact CE3-CG 3.52Å; W109-P279 HydrophobicContact CG-CG 4.46Å; W109-P279 HydrophobicContact CH2-CB 4.22Å; W109-P279 HydrophobicContact CH2-CG 4.4Å; W109-P279 HydrophobicContact CZ2-CB 4.33Å; W109-P279 HydrophobicContact CZ3-CB 4.12Å; W109-P279 HydrophobicContact CZ3-CG 3.81Å
110	N	93.8	Very high	92.9	Very high	120 Å²	120	64.8 Å²	64.8	64%	0.642	35%	0.348	S	S	*	.	S	Bend	trans	-120.5	23	-178	-52.8	-63.5	0	0	0	111.5	D108 G115	D108-N110 PolarHBondContact OD1-N 3.25Å; N110-G115 WeakPolarHBondContact O-CA 3.28Å
111	A	87.8	Confident	92.9	Very high	16 Å²	16	65 Å²	65	13%	0.132	35%	0.347	C	S	.	.			trans	-61.8	155.3	173.8	0	0	0	0	0	111.7	D108 E116 G117 S118 L119	D108-A111 PolarHBondContact OD1-N 2.77Å; A111-E116 PolarHBondContact O-N 2.83Å; A111-G117 CarbonylContact O-C 3.57Å; A111-G117 VanDerWaalsContact O-CA 3.31Å; A111-G117 WeakPolarHBondContact O-CA 3.36Å; A111-G117 PolarHBondContact O-N 3.36Å; A111-S118 PolarHBondContact O-N 2.96Å; A111-L119 HydrophobicContact CB-CG 4.45Å
112	G	86.9	Confident	92.9	Very high	26 Å²	26	66 Å²	66	27%	0.268	36%	0.357	S	S	.	.	S	Bend	trans	100.6	167	177.8	0	0	0	0	0	114.3	H114 G115 S118	G112-H114 PolarHBondContact O-N 2.65Å; G112-G115 PolarHBondContact O-N 2.65Å; G112-S118 WeakPolarHBondContact CA-O 3.31Å
113	P	86.1	Confident	92.9	Very high	110 Å²	110	64.4 Å²	64.4	71%	0.714	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-28.1	-172.5	-21.9	33.5	0	0	0	113.9
114	H	89.1	Confident	92.9	Very high	168 Å²	168	65.4 Å²	65.4	78%	0.778	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.7	10.8	-175	-56.8	-53.6	0	0	0	113.3	G112 E116	G112-H114 PolarHBondContact O-N 2.65Å; H114-E116 VanDerWaalsContact C-N 3.31Å; H114-E116 PolarHBondContact O-N 2.7Å
115	G	88.3	Confident	92.9	Very high	36 Å²	36	65.3 Å²	65.3	37%	0.371	35%	0.349	S	S	.	.	S	Bend	trans	72.3	22.5	-178.1	0	0	0	0	0	114.4	N110 G112 G117	N110-G115 WeakPolarHBondContact O-CA 3.28Å; G112-G115 PolarHBondContact O-N 2.65Å; G115-G117 PolarHBondContact O-N 3.25Å
116	E	88.7	Confident	92.9	Very high	113 Å²	113	73.6 Å²	73.6	53%	0.528	38%	0.376	S	S	.	.			trans	-73.8	-6	-176.7	63.8	-161	157.9	0	0	114.2	A111 H114 S118	A111-E116 PolarHBondContact O-N 2.83Å; H114-E116 VanDerWaalsContact C-N 3.31Å; H114-E116 PolarHBondContact O-N 2.7Å; E116-S118 VanDerWaalsContact C-N 3.29Å; E116-S118 PolarHBondContact O-N 3.34Å
117	G	91.2	Very high	92.9	Very high	8 Å²	8	73.6 Å²	73.6	8%	0.082	38%	0.376	C	S	.	.	S	Bend	trans	76.9	15.3	-179.4	0	0	0	0	0	113.5	W109 A111 G115 P279	W109-G117 WeakPolarHBondContact O-CA 3.43Å; A111-G117 CarbonylContact O-C 3.57Å; A111-G117 VanDerWaalsContact O-CA 3.31Å; A111-G117 WeakPolarHBondContact O-CA 3.36Å; A111-G117 PolarHBondContact O-N 3.36Å; G115-G117 PolarHBondContact O-N 3.25Å; G117-P279 WeakPolarHBondContact O-CD 3.47Å
118	S	94.2	Very high	93	Very high	28 Å²	28	74 Å²	74	20%	0.196	38%	0.375	C	S	.	.			trans	-145	157.8	179.5	73.5	0	0	0	0	112.4	A111 G112 E116 F277	A111-S118 PolarHBondContact O-N 2.96Å; G112-S118 WeakPolarHBondContact CA-O 3.31Å; E116-S118 VanDerWaalsContact C-N 3.29Å; E116-S118 PolarHBondContact O-N 3.34Å; S118-F277 CarbonylContact C-O 3.53Å; S118-F277 VanDerWaalsContact CA-O 3.28Å; S118-F277 WeakPolarHBondContact CA-O 3.5Å
119	L	95.3	Very high	93.1	Very high	40 Å²	40	74.4 Å²	74.4	21%	0.209	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	119.1	176.9	-67.3	167.7	0	0	0	108.2	L101 L104 A111 T276 F277	L101-L119 HydrophobicContact CD1-CD1 3.99Å; L101-L119 HydrophobicContact CD2-CD1 4.33Å; L104-L119 HydrophobicContact CD1-CD1 4.28Å; L104-L119 HydrophobicContact CD2-CD1 3.62Å; A111-L119 HydrophobicContact CB-CG 4.45Å; L119-T276 CarbonylContact O-C 3.5Å; L119-T276 WeakPolarHBondContact O-CA 3.41Å; L119-F277 HydrophobicContact CB-CB 4.43Å; L119-F277 HydrophobicContact CD1-CD1 4.42Å; L119-F277 PolarHBondContact N-O 3.31Å; L119-F277 PolarHBondContact O-N 3.38Å
120	F	95.3	Very high	93.2	Very high	131 Å²	131	73.1 Å²	73.1	58%	0.575	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.8	133.5	179	178.9	-97.9	0	0	0	110.8	A274	F120-A274 HydrophobicContact CE2-CB 3.77Å; F120-A274 HydrophobicContact CZ-CB 3.84Å
121	Y	96.4	Very high	93.3	Very high	82 Å²	82	67.4 Å²	67.4	32%	0.322	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	133.3	173.8	-176	-102	0	0	0	110.2	F98 L99 K123 A274 V275	F98-Y121 AromaticContact CE1-CD1 3.74Å; F98-Y121 HydrophobicContact CE1-CD1 3.74Å; F98-Y121 HydrophobicContact CE1-CE1 4.11Å; F98-Y121 HydrophobicContact CE2-CE1 4.37Å; F98-Y121 AromaticContact CZ-CD1 3.8Å; F98-Y121 HydrophobicContact CZ-CD1 3.8Å; F98-Y121 AromaticContact CZ-CE1 3.98Å; F98-Y121 HydrophobicContact CZ-CE1 3.98Å; L99-Y121 HydrophobicContact CB-CD1 4.26Å; L99-Y121 HydrophobicContact CB-CE1 4.4Å; L99-Y121 HydrophobicContact CD1-CD1 4.01Å; L99-Y121 HydrophobicContact CD1-CD2 3.88Å; L99-Y121 HydrophobicContact CD1-CE1 4.22Å; L99-Y121 HydrophobicContact CD1-CE2 4.12Å; L99-Y121 HydrophobicContact CD1-CG 3.82Å; L99-Y121 HydrophobicContact CD2-CD1 3.98Å; L99-Y121 HydrophobicContact CD2-CG 3.9Å; L99-Y121 HydrophobicContact CG-CD1 4.31Å; L99-Y121 HydrophobicContact CG-CG 4.39Å; Y121-K123 HydrophobicContact CE1-CB 3.78Å; Y121-K123 HydrophobicContact CE1-CD 4.29Å; Y121-A274 CarbonylContact O-C 3.55Å; Y121-A274 WeakPolarHBondContact O-CA 3.49Å; Y121-V275 PolarHBondContact N-O 3.33Å; Y121-V275 PolarHBondContact O-N 3.4Å
122	S	97.4	Very high	93.6	Very high	49 Å²	49	68.2 Å²	68.2	34%	0.343	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	135.6	178.2	177	0	0	0	0	110.2	L273	S122-L273 WeakPolarHBondContact CA-O 3.48Å
123	K	96.6	Very high	93.9	Very high	77 Å²	77	74 Å²	74	34%	0.335	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	145.2	179.3	-179.9	178	179.6	-176.6	0	110.1	F98 Y121 I125 L273	F98-K123 HydrophobicContact CD2-CD 4.38Å; F98-K123 HydrophobicContact CE2-CB 3.91Å; F98-K123 HydrophobicContact CE2-CD 4.32Å; F98-K123 HydrophobicContact CZ-CB 4.36Å; Y121-K123 HydrophobicContact CE1-CB 3.78Å; Y121-K123 HydrophobicContact CE1-CD 4.29Å; K123-I125 HydrophobicContact CD-CG2 4.48Å; K123-I125 HydrophobicContact CG-CG2 4.37Å; K123-L273 PolarHBondContact N-O 3.19Å; K123-L273 PolarHBondContact O-N 3.16Å
124	E	96.9	Very high	94.1	Very high	124 Å²	124	72 Å²	72	58%	0.579	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	126.9	167.8	-168.7	169.5	167.9	0	0	109.1	T270 L271	E124-T270 HydrophobicContact CG-CG2 4.31Å; E124-T270 WeakPolarHBondContact OE1-CB 3.38Å; E124-T270 WeakPolarHBondContact OE1-CG2 3.4Å; E124-T270 PolarHBondContact OE1-OG1 3.06Å; E124-L271 WeakPolarHBondContact CA-O 3.35Å
125	I	95.7	Very high	94.4	Very high	21 Å²	21	64.8 Å²	64.8	11%	0.108	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	148.6	179.9	65	174.2	0	0	0	109.1	L82 F98 K123 C127 L137 T270 L271	L82-I125 HydrophobicContact CD1-CD1 3.43Å; L82-I125 VanDerWaalsContact CD1-CD1 3.43Å; L82-I125 HydrophobicContact CD1-CG2 4.01Å; F98-I125 HydrophobicContact CD2-CG2 4.23Å; F98-I125 HydrophobicContact CE2-CG2 4.21Å; K123-I125 HydrophobicContact CD-CG2 4.48Å; K123-I125 HydrophobicContact CG-CG2 4.37Å; I125-C127 PolarHBondContact O-N 3.31Å; I125-L137 HydrophobicContact CD1-CD2 3.98Å; I125-T270 CarbonylContact O-C 3.59Å; I125-T270 VanDerWaalsContact O-CA 3.28Å; I125-T270 WeakPolarHBondContact O-CA 3.38Å; I125-L271 HydrophobicContact CD1-CB 4.29Å; I125-L271 HydrophobicContact CG1-CB 3.83Å; I125-L271 WeakPolarHBondContact CG1-O 3.39Å; I125-L271 PolarHBondContact N-O 3.11Å; I125-L271 PolarHBondContact O-N 2.82Å
126	R	95.4	Very high	94.8	Very high	200 Å²	200	64.2 Å²	64.2	76%	0.755	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.9	131.8	170.4	-178.6	178.6	176.5	177.9	0.7	109.3	P128	R126-P128 VanDerWaalsContact O-CD 3.3Å; R126-P128 WeakPolarHBondContact O-CD 3.26Å
127	C	96.1	Very high	95.2	Very high	2 Å²	2	59 Å²	59	1%	0.014	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-69.8	121	172.4	-170.4	0	0	0	0	109.2	I125 Q132 V268 E269 L271	I125-C127 PolarHBondContact O-N 3.31Å; C127-Q132 HydrophobicContact CB-CG 4.4Å; C127-V268 WeakPolarHBondContact CB-O 3.45Å; C127-E269 WeakPolarHBondContact CB-O 3.48Å; C127-E269 PolarHBondContact N-O 3.33Å; C127-L271 HydrophobicContact CB-CD1 4.23Å; C127-L271 HydrophobicContact CB-CG 3.97Å
128	P	95.4	Very high	95.5	Very high	30 Å²	30	59.2 Å²	59.2	20%	0.195	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-64.1	142.6	174.7	-19	31.4	0	0	0	111.1	E84 R126 N130 V131 Q132 L137	E84-P128 HydrophobicContact CG-CB 4.4Å; E84-P128 VanDerWaalsContact OE1-CB 3.22Å; E84-P128 WeakPolarHBondContact OE1-CB 3.4Å; R126-P128 VanDerWaalsContact O-CD 3.3Å; R126-P128 WeakPolarHBondContact O-CD 3.26Å; P128-N130 PolarHBondContact O-N 3.37Å; P128-V131 HydrophobicContact CB-CB 4.41Å; P128-V131 HydrophobicContact CB-CG2 3.92Å; P128-V131 HydrophobicContact CG-CG2 3.91Å; P128-V131 WeakPolarHBondContact O-CB 3.47Å; P128-V131 PolarHBondContact O-N 3.32Å; P128-Q132 PolarHBondContact O-N 3.48Å; P128-L137 HydrophobicContact CG-CD1 4.35Å
129	S	95.1	Very high	95.7	Very high	62 Å²	62	57.9 Å²	57.9	43%	0.434	28%	0.283	S	S	.	.	H	α-helix	trans	-61.8	-29.8	-175.7	-58.6	0	0	0	0	113.5	K133	S129-K133 PolarHBondContact O-N 3.43Å
130	N	95.5	Very high	95.8	Very high	93 Å²	93	56 Å²	56	50%	0.497	27%	0.273	S	S	.	.	H	α-helix	trans	-71	-35.7	174.2	-65.1	-31	0	0	0	111.4	E84 P128 Q132 K133 G135	E84-N130 WeakPolarHBondContact OE2-CB 3.33Å; E84-N130 PolarHBondContact OE2-ND2 2.79Å; P128-N130 PolarHBondContact O-N 3.37Å; N130-Q132 VanDerWaalsContact C-N 3.3Å; N130-Q132 PolarHBondContact O-N 3.02Å; N130-K133 CarbonylContact O-C 3.42Å; N130-K133 WeakPolarHBondContact O-CA 3.22Å; N130-K133 PolarHBondContact O-N 3.44Å; N130-G135 WeakPolarHBondContact O-CA 3.24Å; N130-G135 PolarHBondContact O-N 2.66Å
131	V	95.5	Very high	96	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.7	-35.9	178.1	179.9	0	0	0	0	110.9	E84 P128 K133 N134 L137 N207 I264	E84-V131 HydrophobicContact CG-CG2 4.39Å; P128-V131 HydrophobicContact CB-CB 4.41Å; P128-V131 HydrophobicContact CB-CG2 3.92Å; P128-V131 HydrophobicContact CG-CG2 3.91Å; P128-V131 WeakPolarHBondContact O-CB 3.47Å; P128-V131 PolarHBondContact O-N 3.32Å; V131-K133 PolarHBondContact O-N 3.45Å; V131-N134 PolarHBondContact O-N 2.9Å; V131-L137 HydrophobicContact CG1-CB 4.47Å; V131-L137 HydrophobicContact CG2-CB 3.99Å; V131-N207 PolarHBondContact O-ND2 2.94Å; V131-I264 HydrophobicContact CG1-CD1 3.82Å; V131-I264 HydrophobicContact CG1-CG2 4.42Å
132	Q	94.8	Very high	96.1	Very high	33 Å²	33	46.3 Å²	46.3	15%	0.154	23%	0.232	C	C	.	.	H	α-helix	trans	-59.4	-29.9	169.3	-63.6	176	-17.8	0	0	112.6	C127 P128 N130 N265 V268	C127-Q132 HydrophobicContact CB-CG 4.4Å; P128-Q132 PolarHBondContact O-N 3.48Å; N130-Q132 VanDerWaalsContact C-N 3.3Å; N130-Q132 PolarHBondContact O-N 3.02Å; Q132-N265 WeakPolarHBondContact CG-O 3.16Å; Q132-V268 PolarHBondContact NE2-O 3.49Å
133	K	92.5	Very high	96.1	Very high	146 Å²	146	44 Å²	44	64%	0.635	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.1	43.3	178.6	-61.5	177.3	-177.6	-179.6	0	112	S129 N130 V131 G135	S129-K133 PolarHBondContact O-N 3.43Å; N130-K133 CarbonylContact O-C 3.42Å; N130-K133 WeakPolarHBondContact O-CA 3.22Å; N130-K133 PolarHBondContact O-N 3.44Å; V131-K133 PolarHBondContact O-N 3.45Å; K133-G135 PolarHBondContact O-N 3.3Å
134	N	91	Very high	96.2	Very high	68 Å²	68	40.3 Å²	40.3	36%	0.364	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	21.4	-179.4	-67.5	-33.7	0	0	0	115.5	V131 Y172 I205 N207	V131-N134 PolarHBondContact O-N 2.9Å; N134-Y172 HydrophobicContact CB-CE1 4.39Å; N134-Y172 WeakPolarHBondContact O-CE1 3.44Å; N134-Y172 PolarHBondContact O-OH 2.83Å; N134-I205 PolarHBondContact ND2-O 3.14Å; N134-I205 VanDerWaalsContact ND2-O 3.08Å; N134-N207 WeakPolarHBondContact OD1-CB 3.32Å; N134-N207 PolarHBondContact OD1-N 2.82Å
135	G	94.5	Very high	96.2	Very high	17 Å²	17	38.9 Å²	38.9	18%	0.175	19%	0.192	C	C	.	.			trans	-69.6	162.4	169.6	0	0	0	0	0	112.9	N130 K133 N170 Y172 N207	N130-G135 WeakPolarHBondContact O-CA 3.24Å; N130-G135 PolarHBondContact O-N 2.66Å; K133-G135 PolarHBondContact O-N 3.3Å; G135-N170 PolarHBondContact O-ND2 3.05Å; G135-N170 VanDerWaalsContact O-ND2 3.16Å; G135-Y172 PolarHBondContact O-OH 2.87Å; G135-N207 PolarHBondContact O-ND2 2.94Å
136	S	96.7	Very high	96.4	Very high	24 Å²	24	39.3 Å²	39.3	17%	0.168	20%	0.197	C	C	.	.			trans	-94.5	144.9	176.8	-72.8	0	0	0	0	111	E84 R168 N170 Y172	E84-S136 WeakPolarHBondContact CA-O 3.28Å; S136-R168 WeakPolarHBondContact OG-CD 3.14Å; S136-N170 WeakPolarHBondContact CA-OD1 3.17Å; S136-Y172 PolarHBondContact N-OH 3.21Å; S136-Y172 WeakPolarHBondContact OG-CE2 3.37Å; S136-Y172 PolarHBondContact OG-OH 2.89Å
137	L	97.4	Very high	96.5	Very high	5 Å²	5	32.4 Å²	32.4	3%	0.026	19%	0.188	C	C	.	.			trans	-121.5	125.9	170.1	-173.8	61.9	0	0	0	108.9	L82 I125 P128 V131 L169 N170 W209 L271	L82-L137 HydrophobicContact CB-CD1 4.4Å; I125-L137 HydrophobicContact CD1-CD2 3.98Å; P128-L137 HydrophobicContact CG-CD1 4.35Å; V131-L137 HydrophobicContact CG1-CB 4.47Å; V131-L137 HydrophobicContact CG2-CB 3.99Å; L137-L169 HydrophobicContact CD2-CD1 4.48Å; L137-L169 HydrophobicContact CG-CD1 4.44Å; L137-L169 PolarHBondContact O-N 3.09Å; L137-N170 PolarHBondContact N-OD1 3.2Å; L137-N170 PolarHBondContact O-OD1 2.94Å; L137-W209 HydrophobicContact CD2-CH2 4.2Å; L137-W209 HydrophobicContact CD2-CZ3 3.95Å; L137-L271 HydrophobicContact CD2-CD1 4.13Å
138	F	98.1	Very high	96.5	Very high	11 Å²	11	34.3 Å²	34.3	5%	0.048	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	142.5	-177.6	-59	-88.9	0	0	0	110.8	L82 S83 E84 E86 W166 H167 R168	L82-F138 VanDerWaalsContact CA-O 3.31Å; L82-F138 WeakPolarHBondContact CA-O 3.45Å; S83-F138 PolarHBondContact N-O 2.8Å; S83-F138 WeakPolarHBondContact O-CA 3.28Å; S83-F138 WeakPolarHBondContact O-CB 3.43Å; S83-F138 PolarHBondContact O-N 2.78Å; E84-F138 WeakPolarHBondContact O-CE2 3.33Å; E86-F138 HydrophobicContact CG-CD1 4.25Å; E86-F138 HydrophobicContact CG-CE1 3.63Å; E86-F138 HydrophobicContact CG-CE2 4.12Å; E86-F138 HydrophobicContact CG-CZ 3.56Å; F138-W166 AromaticContact CD1-CE3 3.65Å; F138-W166 HydrophobicContact CD1-CE3 3.65Å; F138-W166 AromaticContact CD1-CZ3 3.88Å; F138-W166 HydrophobicContact CD1-CZ3 3.88Å; F138-W166 AromaticContact CE1-CE3 3.96Å; F138-W166 HydrophobicContact CE1-CE3 3.96Å; F138-W166 AromaticContact CE1-CZ3 3.67Å; F138-W166 HydrophobicContact CE1-CZ3 3.67Å; F138-H167 CarbonylContact C-O 3.17Å; F138-H167 VanDerWaalsContact CA-O 3.29Å; F138-H167 WeakPolarHBondContact CA-O 3.3Å; F138-R168 HydrophobicContact CD1-CB 3.73Å; F138-R168 HydrophobicContact CD1-CG 4.2Å; F138-R168 HydrophobicContact CE1-CB 3.58Å; F138-R168 HydrophobicContact CE1-CG 3.91Å; F138-R168 HydrophobicContact CZ-CB 4.47Å; F138-R168 HydrophobicContact CZ-CG 4.34Å
139	M	98.3	Very high	96.7	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	127.3	162.6	-175.6	175.9	-73.8	0	0	109.1	M80 Y81 L82 V141 W166 H167 L169 I213 V215 F251 L273 V275	M80-M139 HydrophobicContact SD-SD 4.39Å; Y81-M139 CarbonylContact O-C 3.57Å; Y81-M139 WeakPolarHBondContact O-CA 3.28Å; L82-M139 HydrophobicContact CD2-CB 4.13Å; L82-M139 HydrophobicContact CD2-CE 4.15Å; L82-M139 HydrophobicContact CD2-CG 4.34Å; M139-V141 HydrophobicContact CG-CG2 4.11Å; M139-V141 HydrophobicContact SD-CG2 4.2Å; M139-W166 CarbonylContact O-C 3.53Å; M139-W166 WeakPolarHBondContact O-CA 3.34Å; M139-H167 PolarHBondContact N-O 3.18Å; M139-H167 PolarHBondContact O-N 2.95Å; M139-L169 HydrophobicContact CB-CD1 4.09Å; M139-L169 HydrophobicContact CB-CD2 3.89Å; M139-L169 HydrophobicContact CB-CG 4.03Å; M139-L169 HydrophobicContact CE-CD1 4.28Å; M139-L169 HydrophobicContact CE-CD2 4.13Å; M139-I213 HydrophobicContact CE-CG2 3.92Å; M139-I213 HydrophobicContact SD-CG2 4.35Å; M139-V215 HydrophobicContact SD-CG2 4.1Å; M139-F251 HydrophobicContact CB-CE1 4.24Å; M139-F251 HydrophobicContact CG-CE1 4.13Å; M139-F251 HydrophobicContact SD-CE1 4Å; M139-L273 HydrophobicContact CE-CD1 4.45Å; M139-L273 HydrophobicContact CE-CD2 3.71Å; M139-L273 HydrophobicContact CE-CG 4.42Å; M139-V275 HydrophobicContact CE-CG2 3.53Å; M139-V275 HydrophobicContact SD-CG2 4.44Å
140	H	98.4	Very high	96.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	121.7	170.6	-56.3	-88	0	0	0	108.7	M80 Y81 S83 N85 E86 F88 F142 H164 W166	M80-H140 CarbonylContact C-O 3.56Å; M80-H140 VanDerWaalsContact CA-O 3.31Å; M80-H140 WeakPolarHBondContact CA-O 3.37Å; Y81-H140 PolarHBondContact N-O 3.14Å; Y81-H140 PolarHBondContact O-N 3.47Å; S83-H140 PolarHBondContact OG-NE2 3.18Å; N85-H140 PolarHBondContact O-CE1 2.89Å; N85-H140 PolarHBondContact O-NE2 3.36Å; E86-H140 PolarHBondContact O-CE1 3.28Å; E86-H140 VanDerWaalsContact O-CE1 3.26Å; F88-H140 HydrophobicContact CB-CB 4.41Å; F88-H140 AromaticContact CD2-CD2 3.67Å; F88-H140 HydrophobicContact CG-CB 4.43Å; H140-F142 HydrophobicContact CB-CD2 4.46Å; H140-F142 HydrophobicContact CB-CE2 3.83Å; H140-H164 AromaticContact CG-NE2 3.79Å; H140-H164 AromaticContact ND1-CE1 3.8Å; H140-H164 AromaticContact ND1-NE2 3.25Å; H140-H164 PolarHBondContact ND1-NE2 2.61Å; H140-W166 WeakPolarHBondContact ND1-CB 3.34Å
141	V	98.3	Very high	96.8	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	119.9	174.8	179	0	0	0	0	107.7	I78 M80 M139 V143 K165 V215 V249 F251	I78-V141 HydrophobicContact CG2-CG1 3.83Å; M80-V141 HydrophobicContact CE-CG2 4.49Å; M80-V141 HydrophobicContact CG-CG2 4.19Å; M139-V141 HydrophobicContact CG-CG2 4.11Å; M139-V141 HydrophobicContact SD-CG2 4.2Å; V141-V143 HydrophobicContact CG1-CG2 4.3Å; V141-K165 PolarHBondContact N-O 3.41Å; V141-K165 PolarHBondContact O-N 2.96Å; V141-V215 HydrophobicContact CG1-CG1 4.2Å; V141-V215 HydrophobicContact CG2-CG1 4.09Å; V141-V215 HydrophobicContact CG2-CG2 4.18Å; V141-V249 HydrophobicContact CB-CG1 4.27Å; V141-V249 HydrophobicContact CG1-CG1 3.95Å; V141-F251 HydrophobicContact CB-CZ 3.97Å; V141-F251 HydrophobicContact CG2-CE1 3.56Å; V141-F251 HydrophobicContact CG2-CZ 3.45Å; V141-F251 VanDerWaalsContact CG2-CZ 3.45Å
142	F	98.3	Very high	96.9	Very high	10 Å²	10	32.2 Å²	32.2	4%	0.044	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	130.9	169.3	-61.9	-94.2	0	0	0	109.1	I78 H79 Y81 F88 F91 H140 P150 T162 I163 H164	I78-F142 CarbonylContact C-O 3.52Å; I78-F142 VanDerWaalsContact CA-O 3.31Å; I78-F142 WeakPolarHBondContact CA-O 3.18Å; H79-F142 HydrophobicContact CB-CB 4.29Å; H79-F142 PolarHBondContact N-O 3.16Å; H79-F142 PolarHBondContact O-N 3.14Å; Y81-F142 AromaticContact CD2-CD2 3.77Å; Y81-F142 HydrophobicContact CD2-CD2 3.77Å; Y81-F142 AromaticContact CD2-CE2 3.84Å; Y81-F142 HydrophobicContact CD2-CE2 3.84Å; Y81-F142 AromaticContact CE2-CD2 3.98Å; Y81-F142 HydrophobicContact CE2-CD2 3.98Å; Y81-F142 HydrophobicContact CE2-CE2 4.27Å; F88-F142 HydrophobicContact CB-CZ 4.2Å; F88-F142 AromaticContact CD1-CE2 3.67Å; F88-F142 HydrophobicContact CD1-CE2 3.67Å; F88-F142 AromaticContact CD1-CZ 3.69Å; F88-F142 HydrophobicContact CD1-CZ 3.69Å; F88-F142 HydrophobicContact CE1-CE2 4.21Å; F88-F142 HydrophobicContact CG-CE2 4.25Å; F88-F142 HydrophobicContact CG-CZ 4.26Å; F91-F142 HydrophobicContact CE1-CD2 4.37Å; F91-F142 HydrophobicContact CE1-CE1 4.24Å; F91-F142 AromaticContact CE1-CE2 3.93Å; F91-F142 HydrophobicContact CE1-CE2 3.93Å; F91-F142 AromaticContact CE1-CZ 3.86Å; F91-F142 HydrophobicContact CE1-CZ 3.86Å; F91-F142 AromaticContact CZ-CE1 3.93Å; F91-F142 HydrophobicContact CZ-CE1 3.93Å; F91-F142 HydrophobicContact CZ-CE2 4.2Å; F91-F142 AromaticContact CZ-CZ 3.66Å; F91-F142 HydrophobicContact CZ-CZ 3.66Å; H140-F142 HydrophobicContact CB-CD2 4.46Å; H140-F142 HydrophobicContact CB-CE2 3.83Å; F142-P150 HydrophobicContact CB-CB 3.59Å; F142-P150 HydrophobicContact CB-CG 4.39Å; F142-P150 HydrophobicContact CD1-CB 3.84Å; F142-P150 HydrophobicContact CD2-CB 4.38Å; F142-P150 HydrophobicContact CG-CB 3.69Å; F142-T162 HydrophobicContact CD1-CG2 4.11Å; F142-I163 CarbonylContact C-O 3.51Å; F142-I163 WeakPolarHBondContact CA-O 3.49Å; F142-H164 HydrophobicContact CD1-CB 3.81Å; F142-H164 AromaticContact CD1-CD2 3.76Å; F142-H164 AromaticContact CD1-CG 4Å; F142-H164 HydrophobicContact CE1-CB 3.68Å; F142-H164 AromaticContact CE1-CD2 3.29Å; F142-H164 WeakPolarHBondContact CE1-CD2 3.49Å; F142-H164 AromaticContact CE1-CG 3.48Å; F142-H164 VanDerWaalsContact CE1-CG 3.48Å; F142-H164 AromaticContact CE1-NE2 3.91Å; F142-H164 AromaticContact CE2-CD2 3.75Å; F142-H164 AromaticContact CE2-NE2 3.97Å; F142-H164 AromaticContact CZ-CD2 3.28Å; F142-H164 WeakPolarHBondContact CZ-CD2 3.48Å; F142-H164 AromaticContact CZ-CG 3.88Å; F142-H164 AromaticContact CZ-NE2 3.48Å; F142-H164 WeakPolarHBondContact CZ-NE2 3.31Å
143	V	98.2	Very high	97	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.006	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	120.2	170.8	-177	0	0	0	0	107.4	F70 M76 D77 I78 V141 T162 I163 M217 V249	F70-V143 HydrophobicContact CE1-CG1 4.15Å; F70-V143 HydrophobicContact CZ-CG1 4.46Å; M76-V143 HydrophobicContact CB-CG1 4.11Å; M76-V143 HydrophobicContact CG-CG1 4.35Å; M76-V143 HydrophobicContact SD-CG1 3.77Å; D77-V143 WeakPolarHBondContact O-CA 3.37Å; I78-V143 HydrophobicContact CG1-CG2 4.29Å; V141-V143 HydrophobicContact CG1-CG2 4.3Å; V143-T162 CarbonylContact O-C 3.54Å; V143-T162 WeakPolarHBondContact O-CA 3.23Å; V143-I163 HydrophobicContact CB-CB 4.2Å; V143-I163 HydrophobicContact CB-CD1 4.41Å; V143-I163 PolarHBondContact N-O 2.73Å; V143-I163 PolarHBondContact O-N 2.8Å; V143-M217 HydrophobicContact CG2-SD 4.11Å; V143-V249 HydrophobicContact CG2-CG2 3.69Å
144	T	98.2	Very high	97.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	154.6	180	63.5	0	0	0	0	110.2	M76 D77 S146 L148 P150 W161 T162	M76-T144 CarbonylContact C-O 3.47Å; M76-T144 WeakPolarHBondContact CA-O 3.22Å; M76-T144 WeakPolarHBondContact CB-O 3.41Å; D77-T144 PolarHBondContact N-O 3.02Å; D77-T144 PolarHBondContact O-N 3.41Å; T144-S146 PolarHBondContact O-N 2.93Å; T144-L148 WeakPolarHBondContact CB-O 3.29Å; T144-L148 PolarHBondContact OG1-O 3.16Å; T144-P150 HydrophobicContact CG2-CB 3.95Å; T144-W161 CarbonylContact C-O 3.54Å; T144-W161 VanDerWaalsContact CA-O 3.27Å; T144-W161 WeakPolarHBondContact CA-O 3.44Å; T144-T162 HydrophobicContact CG2-CG2 4.12Å
145	K	97.9	Very high	97.5	Very high	94 Å²	94	40.1 Å²	40.1	41%	0.409	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	136.9	158.6	179.3	178.9	-177.8	-175	0	107.8	M74 G147 L148 W161	M74-K145 HydrophobicContact CE-CB 3.66Å; M74-K145 HydrophobicContact CE-CD 3.77Å; M74-K145 HydrophobicContact CE-CG 3.53Å; K145-G147 PolarHBondContact O-N 3.11Å; K145-L148 HydrophobicContact CB-CD1 3.84Å; K145-L148 HydrophobicContact CB-CG 4.24Å; K145-L148 WeakPolarHBondContact O-CB 3.31Å; K145-L148 WeakPolarHBondContact O-CG 3.39Å; K145-L148 PolarHBondContact O-N 3.2Å; K145-W161 HydrophobicContact CB-CB 3.88Å; K145-W161 HydrophobicContact CB-CD2 4.49Å; K145-W161 HydrophobicContact CB-CG 4.22Å; K145-W161 HydrophobicContact CD-CD2 4.46Å; K145-W161 PolarHBondContact N-O 3.17Å
146	S	98	Very high	97.6	Very high	30 Å²	30	42 Å²	42	21%	0.21	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	136.8	-172.3	-171.5	0	0	0	0	112.3	K75 D77 N103 T144 L148	K75-S146 PolarHBondContact O-N 3.27Å; D77-S146 WeakPolarHBondContact OD1-CB 3.22Å; D77-S146 PolarHBondContact OD1-OG 3.45Å; D77-S146 WeakPolarHBondContact OD2-CA 3.41Å; D77-S146 PolarHBondContact OD2-OG 3.32Å; N103-S146 PolarHBondContact OD1-OG 3.31Å; T144-S146 PolarHBondContact O-N 2.93Å; S146-L148 VanDerWaalsContact C-N 3.32Å
147	G	97.5	Very high	97.7	Very high	55 Å²	55	43.7 Å²	43.7	57%	0.567	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	85	-9.3	-175	0	0	0	0	0	115.2	D77 K145	D77-G147 PolarHBondContact OD2-N 3.29Å; K145-G147 PolarHBondContact O-N 3.11Å
148	L	98	Very high	97.7	Very high	41 Å²	41	45.1 Å²	45.1	22%	0.215	25%	0.252	C	S	.	.			trans	-91.7	140.1	176.6	-52.9	-173.5	0	0	0	111.5	T144 K145 S146 T156 W161	T144-L148 WeakPolarHBondContact CB-O 3.29Å; T144-L148 PolarHBondContact OG1-O 3.16Å; K145-L148 HydrophobicContact CB-CD1 3.84Å; K145-L148 HydrophobicContact CB-CG 4.24Å; K145-L148 WeakPolarHBondContact O-CB 3.31Å; K145-L148 WeakPolarHBondContact O-CG 3.39Å; K145-L148 PolarHBondContact O-N 3.2Å; S146-L148 VanDerWaalsContact C-N 3.32Å; L148-T156 WeakPolarHBondContact CD2-O 3.36Å; L148-W161 HydrophobicContact CD1-CB 3.78Å; L148-W161 HydrophobicContact CD1-CG 4.35Å
149	S	97.7	Very high	97.6	Very high	24 Å²	24	52.8 Å²	52.8	17%	0.168	29%	0.286	C	S	.	.			trans	-77.3	141.8	174.9	-175.9	0	0	0	0	112.3	N151 N154 T156 F157	S149-N151 VanDerWaalsContact C-N 3.28Å; S149-N151 PolarHBondContact OG-N 2.75Å; S149-N154 WeakPolarHBondContact CB-OD1 3.39Å; S149-N154 WeakPolarHBondContact OG-CB 3.08Å; S149-T156 VanDerWaalsContact CB-OG1 3.31Å; S149-T156 WeakPolarHBondContact CB-OG1 3.46Å; S149-T156 PolarHBondContact N-OG1 3.17Å; S149-T156 VanDerWaalsContact N-OG1 3.1Å; S149-F157 WeakPolarHBondContact O-CD2 3.42Å
150	P	97.4	Very high	97.5	Very high	3 Å²	3	56.6 Å²	56.6	2%	0.019	30%	0.302	C	S	.	.	S	Bend	trans	-77.5	-13.6	169.9	33.7	-37.4	0	0	0	113	H79 Y81 F91 F142 T144 P152 F157 T162	H79-P150 HydrophobicContact CB-CG 4.07Å; Y81-P150 HydrophobicContact CE2-CG 4.43Å; F91-P150 HydrophobicContact CD1-CG 4.21Å; F91-P150 HydrophobicContact CE1-CB 3.93Å; F91-P150 HydrophobicContact CE1-CG 3.93Å; F91-P150 WeakPolarHBondContact CZ-O 3.25Å; F142-P150 HydrophobicContact CB-CB 3.59Å; F142-P150 HydrophobicContact CB-CG 4.39Å; F142-P150 HydrophobicContact CD1-CB 3.84Å; F142-P150 HydrophobicContact CD2-CB 4.38Å; F142-P150 HydrophobicContact CG-CB 3.69Å; T144-P150 HydrophobicContact CG2-CB 3.95Å; P150-P152 WeakPolarHBondContact O-CD 3.48Å; P150-F157 WeakPolarHBondContact O-CE2 3.34Å; P150-T162 HydrophobicContact CB-CG2 4.45Å
151	N	97.2	Very high	97.4	Very high	37 Å²	37	59.4 Å²	59.4	20%	0.198	31%	0.313	C	S	.	.			trans	-78.7	117	-178	179.3	-1.2	0	0	0	110.9	F91 S149 L153 N154 F157	F91-N151 HydrophobicContact CB-CB 3.84Å; F91-N151 HydrophobicContact CD1-CB 3.85Å; F91-N151 HydrophobicContact CD2-CB 3.85Å; F91-N151 HydrophobicContact CE1-CB 4.39Å; F91-N151 HydrophobicContact CE2-CB 4.39Å; F91-N151 HydrophobicContact CG-CB 3.56Å; S149-N151 VanDerWaalsContact C-N 3.28Å; S149-N151 PolarHBondContact OG-N 2.75Å; N151-L153 PolarHBondContact O-N 3.19Å; N151-L153 WeakPolarHBondContact OD1-CB 3.41Å; N151-L153 PolarHBondContact OD1-N 2.72Å; N151-N154 HydrophobicContact CB-CB 4.24Å; N151-N154 WeakPolarHBondContact O-CB 3.32Å; N151-N154 PolarHBondContact O-N 3.2Å; N151-F157 VanDerWaalsContact O-CB 3.31Å; N151-F157 WeakPolarHBondContact O-CB 3.27Å
152	P	96.7	Very high	97.4	Very high	77 Å²	77	60.3 Å²	60.3	50%	0.5	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-21.1	179.3	-25.5	35.8	0	0	0	115.9	F91 P150 F157	F91-P152 VanDerWaalsContact CE2-CD 3.49Å; P150-P152 WeakPolarHBondContact O-CD 3.48Å; P152-F157 HydrophobicContact CB-CD1 4.31Å; P152-F157 HydrophobicContact CB-CE1 4.1Å; P152-F157 HydrophobicContact CB-CE2 4.38Å; P152-F157 HydrophobicContact CB-CZ 4.15Å; P152-F157 HydrophobicContact CG-CD2 4.5Å; P152-F157 HydrophobicContact CG-CE1 4.44Å; P152-F157 HydrophobicContact CG-CE2 4.02Å; P152-F157 HydrophobicContact CG-CZ 3.99Å
153	L	96	Very high	97.3	Very high	160 Å²	160	60.4 Å²	60.4	84%	0.838	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-8.9	179	-58.1	178.6	0	0	0	113.3	N151	N151-L153 PolarHBondContact O-N 3.19Å; N151-L153 WeakPolarHBondContact OD1-CB 3.41Å; N151-L153 PolarHBondContact OD1-N 2.72Å
154	N	96.7	Very high	97.3	Very high	65 Å²	65	63.6 Å²	63.6	35%	0.348	33%	0.334	S	S	.	.	S	Bend	trans	-85.4	141	178.4	-173.3	-80.7	0	0	0	110.8	S149 N151 T156 F157	S149-N154 WeakPolarHBondContact CB-OD1 3.39Å; S149-N154 WeakPolarHBondContact OG-CB 3.08Å; N151-N154 HydrophobicContact CB-CB 4.24Å; N151-N154 WeakPolarHBondContact O-CB 3.32Å; N151-N154 PolarHBondContact O-N 3.2Å; N154-T156 PolarHBondContact O-N 2.75Å; N154-T156 VanDerWaalsContact O-N 3.16Å; N154-T156 WeakPolarHBondContact OD1-CB 3.35Å; N154-T156 PolarHBondContact OD1-N 2.94Å; N154-T156 PolarHBondContact OD1-OG1 3.44Å; N154-F157 WeakPolarHBondContact O-CB 3.05Å; N154-F157 PolarHBondContact O-N 3.15Å
155	E	97.3	Very high	97.2	Very high	189 Å²	189	66.2 Å²	66.2	88%	0.883	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-29.6	-179	64.5	-174.7	168.8	0	0	114.4	F157	E155-F157 VanDerWaalsContact C-N 3.3Å; E155-F157 PolarHBondContact O-N 3.2Å
156	T	97.3	Very high	97.1	Very high	56 Å²	56	66.7 Å²	66.7	34%	0.344	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-0.8	-179.9	66.9	0	0	0	0	113.3	L148 S149 N154 S158	L148-T156 WeakPolarHBondContact CD2-O 3.36Å; S149-T156 VanDerWaalsContact CB-OG1 3.31Å; S149-T156 WeakPolarHBondContact CB-OG1 3.46Å; S149-T156 PolarHBondContact N-OG1 3.17Å; S149-T156 VanDerWaalsContact N-OG1 3.1Å; N154-T156 PolarHBondContact O-N 2.75Å; N154-T156 VanDerWaalsContact O-N 3.16Å; N154-T156 WeakPolarHBondContact OD1-CB 3.35Å; N154-T156 PolarHBondContact OD1-N 2.94Å; N154-T156 PolarHBondContact OD1-OG1 3.44Å; T156-S158 PolarHBondContact O-N 3.22Å
157	F	97.9	Very high	97.1	Very high	60 Å²	60	67.6 Å²	67.6	26%	0.263	35%	0.345	S	S	.	.			trans	-63.1	137.6	-177.5	175	-103.7	0	0	0	112.2	S149 P150 N151 P152 N154 E155 K159 T162	S149-F157 WeakPolarHBondContact O-CD2 3.42Å; P150-F157 WeakPolarHBondContact O-CE2 3.34Å; N151-F157 VanDerWaalsContact O-CB 3.31Å; N151-F157 WeakPolarHBondContact O-CB 3.27Å; P152-F157 HydrophobicContact CB-CD1 4.31Å; P152-F157 HydrophobicContact CB-CE1 4.1Å; P152-F157 HydrophobicContact CB-CE2 4.38Å; P152-F157 HydrophobicContact CB-CZ 4.15Å; P152-F157 HydrophobicContact CG-CD2 4.5Å; P152-F157 HydrophobicContact CG-CE1 4.44Å; P152-F157 HydrophobicContact CG-CE2 4.02Å; P152-F157 HydrophobicContact CG-CZ 3.99Å; N154-F157 WeakPolarHBondContact O-CB 3.05Å; N154-F157 PolarHBondContact O-N 3.15Å; E155-F157 VanDerWaalsContact C-N 3.3Å; E155-F157 PolarHBondContact O-N 3.2Å; F157-K159 HydrophobicContact CE1-CB 3.91Å; F157-K159 HydrophobicContact CZ-CB 4.07Å; F157-T162 HydrophobicContact CE2-CG2 4.34Å
158	S	97.6	Very high	97.1	Very high	34 Å²	34	70 Å²	70	24%	0.238	34%	0.337	C	S	.	.			trans	-136	107.4	171.2	-171	0	0	0	0	111.5	T156 K160 W161 T162	T156-S158 PolarHBondContact O-N 3.22Å; S158-K160 PolarHBondContact O-N 3.09Å; S158-K160 VanDerWaalsContact O-N 3.12Å; S158-W161 CarbonylContact O-C 3.52Å; S158-W161 PolarHBondContact O-N 2.91Å; S158-T162 WeakPolarHBondContact O-CB 3.25Å; S158-T162 PolarHBondContact O-N 3.28Å; S158-T162 VanDerWaalsContact O-N 3.11Å; S158-T162 PolarHBondContact O-OG1 3.47Å
159	K	96.1	Very high	97	Very high	172 Å²	172	68.6 Å²	68.6	75%	0.748	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-52.9	-36.5	175	-173.5	175.4	-177.9	176.4	0	112.9	F157 W161	F157-K159 HydrophobicContact CE1-CB 3.91Å; F157-K159 HydrophobicContact CZ-CB 4.07Å; K159-W161 VanDerWaalsContact C-N 3.31Å; K159-W161 PolarHBondContact O-N 2.96Å
160	K	96.5	Very high	96.9	Very high	81 Å²	81	67.5 Å²	67.5	35%	0.352	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-64.5	-36.6	178.8	175.2	176.1	176.2	-177.2	0	112.1	S158 Y246	S158-K160 PolarHBondContact O-N 3.09Å; S158-K160 VanDerWaalsContact O-N 3.12Å; K160-Y246 WeakPolarHBondContact O-CE1 3.43Å; K160-Y246 PolarHBondContact O-OH 2.8Å
161	W	96.8	Very high	96.7	Very high	58 Å²	58	70.1 Å²	70.1	22%	0.22	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-106.2	14.7	-172.4	-65.6	115.6	0	0	0	113.3	L69 F70 M74 T144 K145 L148 S158 K159	L69-W161 HydrophobicContact CD1-CH2 4.28Å; L69-W161 HydrophobicContact CD1-CZ3 4.3Å; L69-W161 HydrophobicContact CD2-CE3 4.34Å; L69-W161 HydrophobicContact CD2-CZ3 4.26Å; L69-W161 HydrophobicContact CG-CE3 4.38Å; L69-W161 HydrophobicContact CG-CH2 4.29Å; L69-W161 HydrophobicContact CG-CZ3 3.81Å; F70-W161 HydrophobicContact CE2-CE3 4.28Å; M74-W161 HydrophobicContact CE-CD2 4.38Å; M74-W161 HydrophobicContact CE-CE3 3.56Å; M74-W161 HydrophobicContact CE-CH2 4.24Å; M74-W161 HydrophobicContact CE-CZ3 3.47Å; M74-W161 VanDerWaalsContact CE-CZ3 3.47Å; M74-W161 HydrophobicContact SD-CZ3 3.93Å; T144-W161 CarbonylContact C-O 3.54Å; T144-W161 VanDerWaalsContact CA-O 3.27Å; T144-W161 WeakPolarHBondContact CA-O 3.44Å; K145-W161 HydrophobicContact CB-CB 3.88Å; K145-W161 HydrophobicContact CB-CD2 4.49Å; K145-W161 HydrophobicContact CB-CG 4.22Å; K145-W161 HydrophobicContact CD-CD2 4.46Å; K145-W161 PolarHBondContact N-O 3.17Å; L148-W161 HydrophobicContact CD1-CB 3.78Å; L148-W161 HydrophobicContact CD1-CG 4.35Å; S158-W161 CarbonylContact O-C 3.52Å; S158-W161 PolarHBondContact O-N 2.91Å; K159-W161 VanDerWaalsContact C-N 3.31Å; K159-W161 PolarHBondContact O-N 2.96Å
162	T	97.6	Very high	96.5	Very high	19 Å²	19	71.7 Å²	71.7	12%	0.117	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	119.6	177.8	-61.7	0	0	0	0	109.4	F142 V143 T144 P150 F157 S158	F142-T162 HydrophobicContact CD1-CG2 4.11Å; V143-T162 CarbonylContact O-C 3.54Å; V143-T162 WeakPolarHBondContact O-CA 3.23Å; T144-T162 HydrophobicContact CG2-CG2 4.12Å; P150-T162 HydrophobicContact CB-CG2 4.45Å; F157-T162 HydrophobicContact CE2-CG2 4.34Å; S158-T162 WeakPolarHBondContact O-CB 3.25Å; S158-T162 PolarHBondContact O-N 3.28Å; S158-T162 VanDerWaalsContact O-N 3.11Å; S158-T162 PolarHBondContact O-OG1 3.47Å
163	I	97	Very high	95.9	Very high	13 Å²	13	71.9 Å²	71.9	7%	0.067	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	135.8	168.9	-56.8	168.9	0	0	0	107.1	F70 F142 V143 K165 M217 Y246 P247 V249	F70-I163 HydrophobicContact CE2-CD1 3.98Å; F70-I163 HydrophobicContact CE2-CG1 4.49Å; F70-I163 HydrophobicContact CZ-CD1 4.03Å; F142-I163 CarbonylContact C-O 3.51Å; F142-I163 WeakPolarHBondContact CA-O 3.49Å; V143-I163 HydrophobicContact CB-CB 4.2Å; V143-I163 HydrophobicContact CB-CD1 4.41Å; V143-I163 PolarHBondContact N-O 2.73Å; V143-I163 PolarHBondContact O-N 2.8Å; I163-K165 HydrophobicContact CG2-CG 4.47Å; I163-M217 HydrophobicContact CD1-CE 4.24Å; I163-Y246 HydrophobicContact CD1-CD1 4.03Å; I163-Y246 HydrophobicContact CG1-CD1 3.59Å; I163-Y246 HydrophobicContact CG1-CE1 4.3Å; I163-Y246 HydrophobicContact CG1-CG 4.25Å; I163-P247 HydrophobicContact CD1-CG 3.8Å; I163-V249 HydrophobicContact CG2-CG2 4Å
164	H	97	Very high	95.3	Very high	68 Å²	68	70.8 Å²	70.8	32%	0.315	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	127.4	169.5	176.1	-136.4	0	0	0	109.3	H140 F142	H140-H164 AromaticContact CG-NE2 3.79Å; H140-H164 AromaticContact ND1-CE1 3.8Å; H140-H164 AromaticContact ND1-NE2 3.25Å; H140-H164 PolarHBondContact ND1-NE2 2.61Å; F142-H164 HydrophobicContact CD1-CB 3.81Å; F142-H164 AromaticContact CD1-CD2 3.76Å; F142-H164 AromaticContact CD1-CG 4Å; F142-H164 HydrophobicContact CE1-CB 3.68Å; F142-H164 AromaticContact CE1-CD2 3.29Å; F142-H164 WeakPolarHBondContact CE1-CD2 3.49Å; F142-H164 AromaticContact CE1-CG 3.48Å; F142-H164 VanDerWaalsContact CE1-CG 3.48Å; F142-H164 AromaticContact CE1-NE2 3.91Å; F142-H164 AromaticContact CE2-CD2 3.75Å; F142-H164 AromaticContact CE2-NE2 3.97Å; F142-H164 AromaticContact CZ-CD2 3.28Å; F142-H164 WeakPolarHBondContact CZ-CD2 3.48Å; F142-H164 AromaticContact CZ-CG 3.88Å; F142-H164 AromaticContact CZ-NE2 3.48Å; F142-H164 WeakPolarHBondContact CZ-NE2 3.31Å
165	K	96.8	Very high	94.5	Very high	55 Å²	55	72.7 Å²	72.7	24%	0.239	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	149.3	167.4	-73.4	-66.9	-169.6	168.2	0	109.1	V141 I163 V249 F251	V141-K165 PolarHBondContact N-O 3.41Å; V141-K165 PolarHBondContact O-N 2.96Å; I163-K165 HydrophobicContact CG2-CG 4.47Å; K165-V249 HydrophobicContact CB-CB 4.19Å; K165-V249 HydrophobicContact CB-CG1 4.34Å; K165-V249 HydrophobicContact CG-CB 4Å; K165-F251 HydrophobicContact CB-CE2 3.91Å
166	W	96.9	Very high	93.2	Very high	104 Å²	104	68 Å²	68	39%	0.394	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	157.3	177.8	59.5	-100.1	0	0	0	110.7	E86 F138 M139 H140	E86-W166 HydrophobicContact CB-CD2 4.32Å; E86-W166 HydrophobicContact CB-CH2 4.23Å; E86-W166 HydrophobicContact CB-CZ2 3.94Å; E86-W166 VanDerWaalsContact CD-CZ2 3.49Å; E86-W166 HydrophobicContact CG-CD2 4.45Å; E86-W166 HydrophobicContact CG-CE3 4.23Å; E86-W166 HydrophobicContact CG-CH2 3.64Å; E86-W166 HydrophobicContact CG-CZ2 3.87Å; E86-W166 HydrophobicContact CG-CZ3 3.83Å; E86-W166 VanDerWaalsContact OE1-CH2 3.24Å; E86-W166 WeakPolarHBondContact OE1-CH2 3.15Å; E86-W166 WeakPolarHBondContact OE2-CH2 3.48Å; E86-W166 VanDerWaalsContact OE2-CZ2 3.31Å; E86-W166 WeakPolarHBondContact OE2-CZ2 3.28Å; F138-W166 AromaticContact CD1-CE3 3.65Å; F138-W166 HydrophobicContact CD1-CE3 3.65Å; F138-W166 AromaticContact CD1-CZ3 3.88Å; F138-W166 HydrophobicContact CD1-CZ3 3.88Å; F138-W166 AromaticContact CE1-CE3 3.96Å; F138-W166 HydrophobicContact CE1-CE3 3.96Å; F138-W166 AromaticContact CE1-CZ3 3.67Å; F138-W166 HydrophobicContact CE1-CZ3 3.67Å; M139-W166 CarbonylContact O-C 3.53Å; M139-W166 WeakPolarHBondContact O-CA 3.34Å; H140-W166 WeakPolarHBondContact ND1-CB 3.34Å
167	H	96.5	Very high	91.9	Very high	48 Å²	48	67 Å²	67	22%	0.222	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	136	179.1	-177.8	80.1	0	0	0	110.6	F138 M139 L169 F251	F138-H167 CarbonylContact C-O 3.17Å; F138-H167 VanDerWaalsContact CA-O 3.29Å; F138-H167 WeakPolarHBondContact CA-O 3.3Å; M139-H167 PolarHBondContact N-O 3.18Å; M139-H167 PolarHBondContact O-N 2.95Å; H167-L169 PolarHBondContact O-N 3.35Å; H167-F251 HydrophobicContact CB-CB 3.91Å; H167-F251 HydrophobicContact CB-CD1 3.47Å; H167-F251 VanDerWaalsContact CB-CD1 3.47Å; H167-F251 HydrophobicContact CB-CD2 3.52Å; H167-F251 HydrophobicContact CB-CE1 3.72Å; H167-F251 HydrophobicContact CB-CE2 3.76Å; H167-F251 HydrophobicContact CB-CG 3.35Å; H167-F251 HydrophobicContact CB-CZ 3.84Å; H167-F251 AromaticContact CG-CD1 3.98Å; H167-F251 AromaticContact CG-CG 3.7Å
168	R	97.2	Very high	90.5	Very high	105 Å²	105	71 Å²	71	40%	0.396	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	118.3	173.9	-169.3	177.1	61.2	-154.3	-3.1	109	S136 F138 N170	S136-R168 WeakPolarHBondContact OG-CD 3.14Å; F138-R168 HydrophobicContact CD1-CB 3.73Å; F138-R168 HydrophobicContact CD1-CG 4.2Å; F138-R168 HydrophobicContact CE1-CB 3.58Å; F138-R168 HydrophobicContact CE1-CG 3.91Å; F138-R168 HydrophobicContact CZ-CB 4.47Å; F138-R168 HydrophobicContact CZ-CG 4.34Å; R168-N170 WeakPolarHBondContact CG-O 3.31Å; R168-N170 WeakPolarHBondContact CG-OD1 3.47Å; R168-N170 PolarHBondContact NE-O 3.33Å; R168-N170 VanDerWaalsContact NE-O 3.16Å
169	L	96.8	Very high	88.8	Confident	13 Å²	13	76.3 Å²	76.3	7%	0.068	33%	0.33	C	S	.	.			trans	-75.9	-38	-177	-65.4	176.3	0	0	0	111.9	L82 L137 M139 H167 W209 I213 L273	L82-L169 HydrophobicContact CD2-CD1 3.72Å; L137-L169 HydrophobicContact CD2-CD1 4.48Å; L137-L169 HydrophobicContact CG-CD1 4.44Å; L137-L169 PolarHBondContact O-N 3.09Å; M139-L169 HydrophobicContact CB-CD1 4.09Å; M139-L169 HydrophobicContact CB-CD2 3.89Å; M139-L169 HydrophobicContact CB-CG 4.03Å; M139-L169 HydrophobicContact CE-CD1 4.28Å; M139-L169 HydrophobicContact CE-CD2 4.13Å; H167-L169 PolarHBondContact O-N 3.35Å; L169-W209 HydrophobicContact CB-CE3 4.43Å; L169-W209 HydrophobicContact CB-CH2 4.05Å; L169-W209 HydrophobicContact CB-CZ3 3.54Å; L169-W209 HydrophobicContact CD1-CH2 3.74Å; L169-W209 HydrophobicContact CD1-CZ3 3.99Å; L169-W209 HydrophobicContact CG-CZ3 4.42Å; L169-I213 HydrophobicContact CD2-CB 4.41Å; L169-I213 HydrophobicContact CD2-CG1 4.44Å; L169-I213 HydrophobicContact CD2-CG2 4.12Å; L169-L273 HydrophobicContact CD1-CD1 4.47Å; L169-L273 HydrophobicContact CD1-CD2 4.01Å
170	N	95.1	Very high	87.3	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	32%	0.319	C	S	.	.	S	Bend	trans	-85.4	151.2	179.7	68.5	-60.8	0	0	0	112.1	G135 S136 L137 R168 N207 Y208 I264	G135-N170 PolarHBondContact O-ND2 3.05Å; G135-N170 VanDerWaalsContact O-ND2 3.16Å; S136-N170 WeakPolarHBondContact CA-OD1 3.17Å; L137-N170 PolarHBondContact N-OD1 3.2Å; L137-N170 PolarHBondContact O-OD1 2.94Å; R168-N170 WeakPolarHBondContact CG-O 3.31Å; R168-N170 WeakPolarHBondContact CG-OD1 3.47Å; R168-N170 PolarHBondContact NE-O 3.33Å; R168-N170 VanDerWaalsContact NE-O 3.16Å; N170-N207 VanDerWaalsContact CB-OD1 3.26Å; N170-N207 WeakPolarHBondContact CB-OD1 3.41Å; N170-N207 PolarHBondContact ND2-ND2 2.81Å; N170-N207 PolarHBondContact ND2-OD1 2.78Å; N170-Y208 CarbonylContact C-O 3.51Å; N170-Y208 VanDerWaalsContact CA-O 3.28Å; N170-Y208 WeakPolarHBondContact CA-O 3.4Å; N170-Y208 WeakPolarHBondContact CB-O 3.31Å; N170-I264 HydrophobicContact CB-CD1 4.44Å
171	R	93.9	Very high	85.6	Confident	58 Å²	58	76.7 Å²	76.7	22%	0.219	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	135.1	177.9	-71.6	-170.3	171.7	-127.3	4.6	110.4	Y208 D253 Y261 D299	R171-Y208 PolarHBondContact N-O 2.98Å; R171-Y208 PolarHBondContact O-N 2.93Å; R171-D253 IonicContact CZ-OD2 3.29Å; R171-D253 IonicContact NE-OD2 3.68Å; R171-D253 IonicContact NH2-OD2 2.79Å; R171-D253 PolarHBondContact NH2-OD2 3.06Å; R171-Y261 HydrophobicContact CB-CE1 4.14Å; R171-Y261 HydrophobicContact CG-CE1 3.84Å; R171-Y261 PolarHBondContact NE-OH 2.94Å; R171-D299 IonicContact NH1-OD2 3.11Å
172	Y	92.1	Very high	84.2	Confident	71 Å²	71	77.4 Å²	77.4	28%	0.278	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	133.2	171.3	-63.9	-67.7	0	0	0	109.8	N134 G135 S136 I205 L206 N207	N134-Y172 HydrophobicContact CB-CE1 4.39Å; N134-Y172 WeakPolarHBondContact O-CE1 3.44Å; N134-Y172 PolarHBondContact O-OH 2.83Å; G135-Y172 PolarHBondContact O-OH 2.87Å; S136-Y172 PolarHBondContact N-OH 3.21Å; S136-Y172 WeakPolarHBondContact OG-CE2 3.37Å; S136-Y172 PolarHBondContact OG-OH 2.89Å; Y172-I205 HydrophobicContact CD1-CG2 3.84Å; Y172-I205 HydrophobicContact CG-CG2 4.22Å; Y172-L206 WeakPolarHBondContact CA-O 3.5Å; Y172-N207 HydrophobicContact CE1-CB 4.49Å
173	R	85.5	Confident	83	Confident	81 Å²	81	84.8 Å²	84.8	31%	0.306	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	143.5	174.8	-68.1	-176	157.4	-149.5	-22.1	110.8	I205 L206 Y208 M258	R173-I205 WeakPolarHBondContact O-CA 3.44Å; R173-L206 PolarHBondContact N-O 2.92Å; R173-L206 PolarHBondContact O-N 3.3Å; R173-Y208 HydrophobicContact CB-CD2 3.85Å; R173-Y208 HydrophobicContact CB-CE2 3.71Å; R173-Y208 HydrophobicContact CG-CD2 4.05Å; R173-Y208 HydrophobicContact CG-CE2 4.3Å; R173-M258 PolarHBondContact NH2-SD 2.94Å
174	K	83.7	Confident	81.7	Confident	136 Å²	136	92.1 Å²	92.1	59%	0.591	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	121.7	171.1	-64.3	177.6	170.7	-162.8	0	108
175	R	78	Confident	80.3	Confident	105 Å²	105	93.1 Å²	93.1	40%	0.396	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	116.9	167.3	-171.8	169.6	-180	-153.4	-8.6	107.9	Y177 E194 V204 L206	R175-Y177 HydrophobicContact CG-CE1 4.16Å; R175-E194 IonicContact CZ-OE1 3.65Å; R175-E194 VanDerWaalsContact CZ-OE1 3.29Å; R175-E194 IonicContact NH1-OE1 2.75Å; R175-E194 PolarHBondContact NH1-OE1 2.86Å; R175-E194 VanDerWaalsContact NH1-OE1 3.11Å; R175-E194 IonicContact NH2-OE1 3.91Å; R175-E194 PolarHBondContact NH2-OE1 3.14Å; R175-V204 PolarHBondContact N-O 2.84Å; R175-L206 HydrophobicContact CB-CD1 3.74Å; R175-L206 HydrophobicContact CB-CG 4.28Å; R175-L206 HydrophobicContact CG-CD1 4.28Å
176	V	71.4	Confident	78.6	Confident	92 Å²	92	93 Å²	93	56%	0.558	45%	0.449	S	S	*	.			trans	-92.8	113.9	174.6	-177.8	0	0	0	0	107.6	Q178	V176-Q178 HydrophobicContact CG1-CG 4.33Å; V176-Q178 PolarHBondContact O-N 3.41Å
177	Y	70.1	Confident	77.2	Confident	34 Å²	34	93.5 Å²	93.5	13%	0.133	46%	0.459	C	S	.	.			trans	-78.8	113	173.7	-60.8	-78.3	0	0	0	108.8	R175 E194 L197 V204	R175-Y177 HydrophobicContact CG-CE1 4.16Å; Y177-E194 HydrophobicContact CD1-CB 3.95Å; Y177-E194 HydrophobicContact CD1-CG 3.96Å; Y177-E194 HydrophobicContact CE1-CB 4.04Å; Y177-E194 HydrophobicContact CE1-CG 3.53Å; Y177-L197 HydrophobicContact CD2-CB 3.8Å; Y177-L197 HydrophobicContact CD2-CD1 4.33Å; Y177-L197 HydrophobicContact CE2-CB 4.13Å; Y177-L197 HydrophobicContact CE2-CD1 3.78Å; Y177-L197 HydrophobicContact CG-CB 4.4Å; Y177-V204 HydrophobicContact CE2-CB 4.24Å; Y177-V204 HydrophobicContact CE2-CG2 3.94Å
178	Q	68	Low	75.5	Confident	144 Å²	144	93.7 Å²	93.7	67%	0.673	47%	0.466	S	S	*	.			trans	-98.9	141.1	172.7	-67.4	-173.8	-8.4	0	0	109.5	V176 T180	V176-Q178 HydrophobicContact CG1-CG 4.33Å; V176-Q178 PolarHBondContact O-N 3.41Å; Q178-T180 VanDerWaalsContact C-N 3.29Å; Q178-T180 HydrophobicContact CB-CG2 4.5Å; Q178-T180 PolarHBondContact O-N 2.78Å
179	K	62.6	Low	73.9	Confident	146 Å²	146	98.4 Å²	98.4	64%	0.635	49%	0.492	S	S	*	.			trans	-66	90.6	168.6	-68.8	-175.5	180	-176.3	0	108.6	A198	K179-A198 HydrophobicContact CG-CB 4.34Å
180	T	63.9	Low	72.3	Confident	86 Å²	86	100 Å²	100	53%	0.528	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-91.9	116.1	170.8	49.6	0	0	0	0	108.1	Q178	Q178-T180 VanDerWaalsContact C-N 3.29Å; Q178-T180 HydrophobicContact CB-CG2 4.5Å; Q178-T180 PolarHBondContact O-N 2.78Å
181	K	61.3	Low	71	Confident	174 Å²	174	102.5 Å²	102.5	76%	0.757	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-97.4	127	165.3	-72.5	-170.4	175.3	-171	0	107.1	L183	K181-L183 PolarHBondContact O-N 2.93Å
182	N	66.3	Low	69.9	Low	73 Å²	73	105 Å²	105	39%	0.39	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-63.7	118.1	168.2	-173.7	-31.1	0	0	0	108.1	L184 T185 G186 D187	N182-L184 PolarHBondContact O-N 3.04Å; N182-L184 PolarHBondContact OD1-N 3.16Å; N182-T185 PolarHBondContact ND2-OG1 3.34Å; N182-T185 PolarHBondContact OD1-N 2.85Å; N182-G186 WeakPolarHBondContact O-CA 3.42Å; N182-G186 PolarHBondContact O-N 2.83Å; N182-D187 VanDerWaalsContact CB-O 3.23Å; N182-D187 WeakPolarHBondContact CB-O 3.34Å
183	L	72.9	Confident	68.7	Low	175 Å²	175	108.8 Å²	108.8	92%	0.916	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-22	-177.7	-71.8	165.3	0	0	0	112.9	K181	K181-L183 PolarHBondContact O-N 2.93Å
184	L	69.8	Low	67.9	Low	166 Å²	166	106.7 Å²	106.7	87%	0.869	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-42.6	179.5	-75.2	99.7	0	0	0	112.8	N182	N182-L184 PolarHBondContact O-N 3.04Å; N182-L184 PolarHBondContact OD1-N 3.16Å
185	T	68.1	Low	67.1	Low	89 Å²	89	106 Å²	106	55%	0.546	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-18.6	-173.5	-37	0	0	0	0	112.8	N182 D187	N182-T185 PolarHBondContact ND2-OG1 3.34Å; N182-T185 PolarHBondContact OD1-N 2.85Å; T185-D187 HydrophobicContact CG2-CB 4.32Å; T185-D187 PolarHBondContact O-N 2.78Å
186	G	61.5	Low	66.7	Low	54 Å²	54	105.5 Å²	105.5	56%	0.557	54%	0.544	S	S	*	.			trans	71.3	-20.3	-173.5	0	0	0	0	0	114.4	N182	N182-G186 WeakPolarHBondContact O-CA 3.42Å; N182-G186 PolarHBondContact O-N 2.83Å
187	D	65.5	Low	66.7	Low	114 Å²	114	103 Å²	103	61%	0.61	53%	0.528	S	S	*	.			trans	-81.9	139.1	178.3	-65.5	-32.7	0	0	0	112.1	N182 T185	N182-D187 VanDerWaalsContact CB-O 3.23Å; N182-D187 WeakPolarHBondContact CB-O 3.34Å; T185-D187 HydrophobicContact CG2-CB 4.32Å; T185-D187 PolarHBondContact O-N 2.78Å
188	S	61.2	Low	66.6	Low	52 Å²	52	101.9 Å²	101.9	36%	0.364	53%	0.525	S	S	.	.			trans	-100.1	117.4	168.1	54.8	0	0	0	0	108.5	V190	S188-V190 PolarHBondContact O-N 2.97Å
189	E	63.5	Low	66.6	Low	203 Å²	203	99.9 Å²	99.9	95%	0.949	52%	0.516	S	S	*	.			trans	-69.6	15	171.2	-65.5	-177.9	169.8	0	0	113.1
190	V	63.3	Low	67.1	Low	48 Å²	48	98.3 Å²	98.3	29%	0.291	51%	0.514	S	S	.	.			trans	-85.6	132.9	-176.2	-179.1	0	0	0	0	108.6	S188 E194	S188-V190 PolarHBondContact O-N 2.97Å; V190-E194 HydrophobicContact CG1-CB 3.34Å; V190-E194 HydrophobicContact CG1-CG 4.42Å
191	S	68.1	Low	67.1	Low	52 Å²	52	100.7 Å²	100.7	36%	0.364	52%	0.523	S	S	.	.			trans	-60.8	150.6	177.7	65.4	0	0	0	0	111.5	Q193 E194 R195	S191-Q193 PolarHBondContact O-N 3.21Å; S191-Q193 VanDerWaalsContact O-N 3.14Å; S191-E194 PolarHBondContact N-OE2 2.78Å; S191-E194 PolarHBondContact O-N 3.16Å; S191-E194 WeakPolarHBondContact OG-CB 3.38Å; S191-E194 WeakPolarHBondContact OG-CG 3.22Å; S191-E194 PolarHBondContact OG-N 3.41Å; S191-E194 PolarHBondContact OG-OE2 3.27Å; S191-E194 VanDerWaalsContact OG-OE2 3.11Å; S191-R195 PolarHBondContact O-N 2.86Å
192	E	70.7	Confident	67.5	Low	111 Å²	111	97.2 Å²	97.2	52%	0.519	51%	0.51	S	S	.	.	H	α-helix	trans	-55.3	-35.1	179.1	-178.3	56.3	-151.2	0	0	112	R195 Q196	E192-R195 PolarHBondContact O-N 2.72Å; E192-Q196 WeakPolarHBondContact O-CG 3.33Å; E192-Q196 PolarHBondContact O-N 3.44Å; E192-Q196 PolarHBondContact OE1-NE2 3.34Å
193	Q	68.2	Low	67.7	Low	149 Å²	149	99 Å²	99	70%	0.696	52%	0.516	S	S	*	.	H	α-helix	trans	-64.9	-46.7	175.2	-67.4	179.9	-15.8	0	0	112.6	S191 R195 Q196 L197	S191-Q193 PolarHBondContact O-N 3.21Å; S191-Q193 VanDerWaalsContact O-N 3.14Å; Q193-R195 VanDerWaalsContact C-N 3.26Å; Q193-R195 PolarHBondContact O-N 2.58Å; Q193-Q196 PolarHBondContact O-N 3.27Å; Q193-L197 WeakPolarHBondContact O-CG 3.19Å; Q193-L197 PolarHBondContact O-N 3.26Å
194	E	68.6	Low	68	Low	38 Å²	38	92.8 Å²	92.8	18%	0.178	49%	0.485	C	S	.	.	H	α-helix	trans	-65.3	-32.3	177	-72.6	176.3	136.6	0	0	111.7	R175 Y177 V190 S191 A198	R175-E194 IonicContact CZ-OE1 3.65Å; R175-E194 VanDerWaalsContact CZ-OE1 3.29Å; R175-E194 IonicContact NH1-OE1 2.75Å; R175-E194 PolarHBondContact NH1-OE1 2.86Å; R175-E194 VanDerWaalsContact NH1-OE1 3.11Å; R175-E194 IonicContact NH2-OE1 3.91Å; R175-E194 PolarHBondContact NH2-OE1 3.14Å; Y177-E194 HydrophobicContact CD1-CB 3.95Å; Y177-E194 HydrophobicContact CD1-CG 3.96Å; Y177-E194 HydrophobicContact CE1-CB 4.04Å; Y177-E194 HydrophobicContact CE1-CG 3.53Å; V190-E194 HydrophobicContact CG1-CB 3.34Å; V190-E194 HydrophobicContact CG1-CG 4.42Å; S191-E194 PolarHBondContact N-OE2 2.78Å; S191-E194 PolarHBondContact O-N 3.16Å; S191-E194 WeakPolarHBondContact OG-CB 3.38Å; S191-E194 WeakPolarHBondContact OG-CG 3.22Å; S191-E194 PolarHBondContact OG-N 3.41Å; S191-E194 PolarHBondContact OG-OE2 3.27Å; S191-E194 VanDerWaalsContact OG-OE2 3.11Å; E194-A198 WeakPolarHBondContact O-CB 3.15Å; E194-A198 PolarHBondContact O-N 2.93Å
195	R	65.6	Low	68.6	Low	122 Å²	122	89 Å²	89	46%	0.46	46%	0.464	S	S	.	.	H	α-helix	trans	-67.4	-41.7	174.3	-171.4	180	165.9	-174.1	-3.1	112	S191 E192 Q193 A198 E199	S191-R195 PolarHBondContact O-N 2.86Å; E192-R195 PolarHBondContact O-N 2.72Å; Q193-R195 VanDerWaalsContact C-N 3.26Å; Q193-R195 PolarHBondContact O-N 2.58Å; R195-A198 WeakPolarHBondContact O-CB 3.44Å; R195-A198 PolarHBondContact O-N 3.15Å; R195-E199 IonicContact NE-OE1 3.9Å; R195-E199 WeakPolarHBondContact O-CG 3.43Å; R195-E199 PolarHBondContact O-N 3.18Å
196	Q	71	Confident	69.5	Low	94 Å²	94	86.5 Å²	86.5	44%	0.439	45%	0.448	S	S	.	.	H	α-helix	trans	-65	-42.7	174.4	-71.6	172.3	13.3	0	0	111.8	E192 Q193 A198 E199 L200	E192-Q196 WeakPolarHBondContact O-CG 3.33Å; E192-Q196 PolarHBondContact O-N 3.44Å; E192-Q196 PolarHBondContact OE1-NE2 3.34Å; Q193-Q196 PolarHBondContact O-N 3.27Å; Q196-A198 VanDerWaalsContact C-N 3.31Å; Q196-A198 PolarHBondContact O-N 3.31Å; Q196-E199 WeakPolarHBondContact O-CB 3.38Å; Q196-E199 PolarHBondContact O-N 2.76Å; Q196-E199 VanDerWaalsContact O-N 3.08Å; Q196-L200 WeakPolarHBondContact O-CG 3.28Å; Q196-L200 PolarHBondContact O-N 2.98Å
197	L	70.4	Confident	71.1	Confident	40 Å²	40	83.9 Å²	83.9	21%	0.209	42%	0.421	C	S	.	.	H	α-helix	trans	-61.7	-38.8	174.2	-69.7	169	0	0	0	112	Y177 Q193 E199 L200 N201 E202 V204	Y177-L197 HydrophobicContact CD2-CB 3.8Å; Y177-L197 HydrophobicContact CD2-CD1 4.33Å; Y177-L197 HydrophobicContact CE2-CB 4.13Å; Y177-L197 HydrophobicContact CE2-CD1 3.78Å; Y177-L197 HydrophobicContact CG-CB 4.4Å; Q193-L197 WeakPolarHBondContact O-CG 3.19Å; Q193-L197 PolarHBondContact O-N 3.26Å; L197-E199 VanDerWaalsContact C-N 3.33Å; L197-L200 PolarHBondContact O-N 2.87Å; L197-N201 PolarHBondContact O-N 2.8Å; L197-N201 VanDerWaalsContact O-N 3.13Å; L197-E202 HydrophobicContact CD2-CB 4Å; L197-E202 WeakPolarHBondContact CD2-OE2 3.28Å; L197-E202 PolarHBondContact O-N 3.25Å; L197-V204 HydrophobicContact CD1-CG2 4.16Å; L197-V204 HydrophobicContact CD2-CG2 4.32Å
198	A	67.8	Low	72.4	Confident	10 Å²	10	80.6 Å²	80.6	8%	0.083	40%	0.4	C	S	.	.	H	α-helix	trans	-66	-33.5	172.9	0	0	0	0	0	112.7	K179 E194 R195 Q196 N201	K179-A198 HydrophobicContact CG-CB 4.34Å; E194-A198 WeakPolarHBondContact O-CB 3.15Å; E194-A198 PolarHBondContact O-N 2.93Å; R195-A198 WeakPolarHBondContact O-CB 3.44Å; R195-A198 PolarHBondContact O-N 3.15Å; Q196-A198 VanDerWaalsContact C-N 3.31Å; Q196-A198 PolarHBondContact O-N 3.31Å; A198-N201 PolarHBondContact O-N 3.27Å
199	E	69.2	Low	74.1	Confident	102 Å²	102	78.8 Å²	78.8	48%	0.477	39%	0.386	S	S	.	.	H	α-helix	trans	-70.5	-37.7	175	-78.4	-179.7	-178.5	0	0	112.4	R195 Q196 L197 N201	R195-E199 IonicContact NE-OE1 3.9Å; R195-E199 WeakPolarHBondContact O-CG 3.43Å; R195-E199 PolarHBondContact O-N 3.18Å; Q196-E199 WeakPolarHBondContact O-CB 3.38Å; Q196-E199 PolarHBondContact O-N 2.76Å; Q196-E199 VanDerWaalsContact O-N 3.08Å; L197-E199 VanDerWaalsContact C-N 3.33Å; E199-N201 VanDerWaalsContact C-N 3.25Å; E199-N201 PolarHBondContact O-N 3.11Å
200	L	72	Confident	75.7	Confident	112 Å²	112	69.6 Å²	69.6	59%	0.586	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-5.5	176.6	-63.7	171.8	0	0	0	113.4	Q196 L197 E202	Q196-L200 WeakPolarHBondContact O-CG 3.28Å; Q196-L200 PolarHBondContact O-N 2.98Å; L197-L200 PolarHBondContact O-N 2.87Å; L200-E202 HydrophobicContact CB-CB 4.34Å; L200-E202 HydrophobicContact CB-CG 3.75Å; L200-E202 PolarHBondContact O-N 2.86Å
201	N	64.8	Low	77.3	Confident	137 Å²	137	69 Å²	69	73%	0.733	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	31.8	-168.9	-74	-47.5	0	0	0	112.7	L197 A198 E199 Q203	L197-N201 PolarHBondContact O-N 2.8Å; L197-N201 VanDerWaalsContact O-N 3.13Å; A198-N201 PolarHBondContact O-N 3.27Å; E199-N201 VanDerWaalsContact C-N 3.25Å; E199-N201 PolarHBondContact O-N 3.11Å; N201-Q203 PolarHBondContact O-N 3.45Å
202	E	68.2	Low	78.6	Confident	101 Å²	101	70.2 Å²	70.2	47%	0.472	34%	0.342	S	S	.	.			trans	-78.1	124.1	-177.7	-80.7	-177.7	-172.4	0	0	110.7	L197 L200	L197-E202 HydrophobicContact CD2-CB 4Å; L197-E202 WeakPolarHBondContact CD2-OE2 3.28Å; L197-E202 PolarHBondContact O-N 3.25Å; L200-E202 HydrophobicContact CB-CB 4.34Å; L200-E202 HydrophobicContact CB-CG 3.75Å; L200-E202 PolarHBondContact O-N 2.86Å
203	Q	70.3	Confident	79.9	Confident	110 Å²	110	65.3 Å²	65.3	51%	0.514	32%	0.319	S	S	.	.			trans	-88.5	109.4	175.9	-64.6	-178.8	-7.6	0	0	108.9	N201	N201-Q203 PolarHBondContact O-N 3.45Å
204	V	79.6	Confident	81.3	Confident	44 Å²	44	59.9 Å²	59.9	27%	0.267	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	128.4	173.1	-178.9	0	0	0	0	109.1	R175 Y177 L197 L206	R175-V204 PolarHBondContact N-O 2.84Å; Y177-V204 HydrophobicContact CE2-CB 4.24Å; Y177-V204 HydrophobicContact CE2-CG2 3.94Å; L197-V204 HydrophobicContact CD1-CG2 4.16Å; L197-V204 HydrophobicContact CD2-CG2 4.32Å; V204-L206 HydrophobicContact CG1-CD2 3.87Å; V204-L206 HydrophobicContact CG1-CG 4.33Å
205	I	83.8	Confident	82.6	Confident	86 Å²	86	58.1 Å²	58.1	44%	0.441	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	118.1	169.7	-59.3	174.2	0	0	0	107.5	N134 Y172 R173	N134-I205 PolarHBondContact ND2-O 3.14Å; N134-I205 VanDerWaalsContact ND2-O 3.08Å; Y172-I205 HydrophobicContact CD1-CG2 3.84Å; Y172-I205 HydrophobicContact CG-CG2 4.22Å; R173-I205 WeakPolarHBondContact O-CA 3.44Å
206	L	86.8	Confident	84.2	Confident	37 Å²	37	52.6 Å²	52.6	19%	0.194	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	142.5	175.8	-66.5	-178.1	0	0	0	110.4	Y172 R173 R175 V204 Y208	Y172-L206 WeakPolarHBondContact CA-O 3.5Å; R173-L206 PolarHBondContact N-O 2.92Å; R173-L206 PolarHBondContact O-N 3.3Å; R175-L206 HydrophobicContact CB-CD1 3.74Å; R175-L206 HydrophobicContact CB-CG 4.28Å; R175-L206 HydrophobicContact CG-CD1 4.28Å; V204-L206 HydrophobicContact CG1-CD2 3.87Å; V204-L206 HydrophobicContact CG1-CG 4.33Å; L206-Y208 HydrophobicContact CB-CD2 4.21Å; L206-Y208 HydrophobicContact CB-CE2 3.57Å; L206-Y208 HydrophobicContact CD1-CE2 4.42Å
207	N	93.4	Very high	85.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	130.1	175.5	-163.5	3.8	0	0	0	110.4	V131 N134 G135 N170 Y172 P263 I264	V131-N207 PolarHBondContact O-ND2 2.94Å; N134-N207 WeakPolarHBondContact OD1-CB 3.32Å; N134-N207 PolarHBondContact OD1-N 2.82Å; G135-N207 PolarHBondContact O-ND2 2.94Å; N170-N207 VanDerWaalsContact CB-OD1 3.26Å; N170-N207 WeakPolarHBondContact CB-OD1 3.41Å; N170-N207 PolarHBondContact ND2-ND2 2.81Å; N170-N207 PolarHBondContact ND2-OD1 2.78Å; Y172-N207 HydrophobicContact CE1-CB 4.49Å; N207-P263 CarbonylContact O-C 3.57Å; N207-P263 WeakPolarHBondContact O-CA 3.27Å; N207-I264 HydrophobicContact CB-CB 4.25Å; N207-I264 PolarHBondContact O-N 2.8Å
208	Y	94.8	Very high	86.6	Confident	44 Å²	44	46.5 Å²	46.5	17%	0.173	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	138.2	-178.8	-75.1	-92.9	0	0	0	111.7	N170 R171 R173 L206 Q262 P263	N170-Y208 CarbonylContact C-O 3.51Å; N170-Y208 VanDerWaalsContact CA-O 3.28Å; N170-Y208 WeakPolarHBondContact CA-O 3.4Å; N170-Y208 WeakPolarHBondContact CB-O 3.31Å; R171-Y208 PolarHBondContact N-O 2.98Å; R171-Y208 PolarHBondContact O-N 2.93Å; R173-Y208 HydrophobicContact CB-CD2 3.85Å; R173-Y208 HydrophobicContact CB-CE2 3.71Å; R173-Y208 HydrophobicContact CG-CD2 4.05Å; R173-Y208 HydrophobicContact CG-CE2 4.3Å; L206-Y208 HydrophobicContact CB-CD2 4.21Å; L206-Y208 HydrophobicContact CB-CE2 3.57Å; L206-Y208 HydrophobicContact CD1-CE2 4.42Å; Y208-Q262 CarbonylContact C-O 3.53Å; Y208-Q262 WeakPolarHBondContact CA-O 3.19Å; Y208-P263 HydrophobicContact CD1-CB 4.48Å; Y208-P263 HydrophobicContact CE1-CB 4.19Å
209	W	96.3	Very high	87.9	Confident	14 Å²	14	49.4 Å²	49.4	5%	0.053	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	139.1	178.3	-177.7	-111.9	0	0	0	111.3	L137 L169 Y261 Q262 I264 L271 K272 L273	L137-W209 HydrophobicContact CD2-CH2 4.2Å; L137-W209 HydrophobicContact CD2-CZ3 3.95Å; L169-W209 HydrophobicContact CB-CE3 4.43Å; L169-W209 HydrophobicContact CB-CH2 4.05Å; L169-W209 HydrophobicContact CB-CZ3 3.54Å; L169-W209 HydrophobicContact CD1-CH2 3.74Å; L169-W209 HydrophobicContact CD1-CZ3 3.99Å; L169-W209 HydrophobicContact CG-CZ3 4.42Å; W209-Y261 CarbonylContact O-C 3.58Å; W209-Y261 VanDerWaalsContact O-CA 3.26Å; W209-Y261 WeakPolarHBondContact O-CA 3.31Å; W209-Q262 PolarHBondContact N-O 2.98Å; W209-Q262 PolarHBondContact O-N 2.85Å; W209-I264 HydrophobicContact CB-CD1 3.77Å; W209-I264 HydrophobicContact CB-CG1 3.7Å; W209-I264 HydrophobicContact CE3-CD1 4.42Å; W209-L271 HydrophobicContact CB-CD2 4.28Å; W209-L271 HydrophobicContact CD2-CB 4.37Å; W209-L271 HydrophobicContact CD2-CD1 4.17Å; W209-L271 HydrophobicContact CD2-CD2 4.06Å; W209-L271 HydrophobicContact CD2-CG 4.44Å; W209-L271 HydrophobicContact CE3-CD1 4.06Å; W209-L271 HydrophobicContact CG-CD2 3.86Å; W209-L271 HydrophobicContact CH2-CD1 4.35Å; W209-L271 HydrophobicContact CZ2-CB 3.98Å; W209-L271 HydrophobicContact CZ2-CD1 4.48Å; W209-L271 HydrophobicContact CZ3-CD1 4.15Å; W209-K272 PolarHBondContact NE1-O 3.03Å; W209-L273 HydrophobicContact CH2-CD1 3.99Å; W209-L273 HydrophobicContact CH2-CD2 4.37Å; W209-L273 HydrophobicContact CZ2-CB 3.96Å; W209-L273 HydrophobicContact CZ2-CD1 3.82Å; W209-L273 HydrophobicContact CZ2-CG 4.33Å
210	H	96.6	Very high	89	Confident	10 Å²	10	45 Å²	45	5%	0.046	23%	0.228	C	C	.	.			trans	-117.4	134.1	164.4	-170.8	-91.3	0	0	0	109.2	N212 N256 Y261	H210-N212 PolarHBondContact ND1-N 3.29Å; H210-N212 PolarHBondContact ND1-O 3.25Å; H210-N212 PolarHBondContact O-N 2.81Å; H210-N256 PolarHBondContact CE1-OD1 2.81Å; H210-N256 VanDerWaalsContact CE1-OD1 3.22Å; H210-N256 VanDerWaalsContact ND1-CG 3.29Å; H210-N256 PolarHBondContact ND1-ND2 3.26Å; H210-N256 VanDerWaalsContact ND1-ND2 3.17Å; H210-Y261 HydrophobicContact CB-CD1 3.73Å; H210-Y261 HydrophobicContact CB-CD2 4.19Å; H210-Y261 HydrophobicContact CB-CE1 3.41Å; H210-Y261 VanDerWaalsContact CB-CE1 3.41Å; H210-Y261 HydrophobicContact CB-CE2 3.91Å; H210-Y261 HydrophobicContact CB-CG 4.11Å; H210-Y261 VanDerWaalsContact CB-CZ 3.5Å; H210-Y261 AromaticContact CD2-CD2 3.83Å; H210-Y261 AromaticContact CD2-CE2 3.77Å
211	P	96.3	Very high	90	Very high	35 Å²	35	42.7 Å²	42.7	23%	0.227	21%	0.214	C	C	.	.	S	Bend	trans	-72.6	-16	-173.8	28.9	-35.5	0	0	0	113.6	K272 L273 A274	P211-K272 VanDerWaalsContact CA-O 3.27Å; P211-K272 WeakPolarHBondContact CA-O 3.41Å; P211-L273 CarbonylContact O-C 3.49Å; P211-L273 WeakPolarHBondContact O-CA 3.11Å; P211-A274 PolarHBondContact O-N 2.97Å
212	N	96.3	Very high	91.1	Very high	79 Å²	79	36.6 Å²	36.6	42%	0.422	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	142.3	-173.7	-49.4	-31.7	0	0	0	112.3	H210 N256 A274	H210-N212 PolarHBondContact ND1-N 3.29Å; H210-N212 PolarHBondContact ND1-O 3.25Å; H210-N212 PolarHBondContact O-N 2.81Å; N212-N256 PolarHBondContact O-ND2 2.83Å; N212-A274 WeakPolarHBondContact CA-O 3.4Å; N212-A274 WeakPolarHBondContact OD1-CB 3.44Å
213	I	97	Very high	91.9	Very high	7 Å²	7	33.2 Å²	33.2	4%	0.036	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	141.4	166.8	-173.3	63.8	0	0	0	109.6	M139 L169 F251 D253 L273 A274 V275 T276	M139-I213 HydrophobicContact CE-CG2 3.92Å; M139-I213 HydrophobicContact SD-CG2 4.35Å; L169-I213 HydrophobicContact CD2-CB 4.41Å; L169-I213 HydrophobicContact CD2-CG1 4.44Å; L169-I213 HydrophobicContact CD2-CG2 4.12Å; I213-F251 HydrophobicContact CG1-CD1 4.43Å; I213-D253 HydrophobicContact CD1-CB 3.88Å; I213-L273 HydrophobicContact CG2-CD1 4.07Å; I213-A274 PolarHBondContact N-O 2.99Å; I213-V275 HydrophobicContact CG2-CG2 3.85Å; I213-V275 WeakPolarHBondContact O-CA 3.48Å; I213-T276 PolarHBondContact O-N 2.89Å; I213-T276 VanDerWaalsContact O-N 3.11Å
214	T	97.4	Very high	92.4	Very high	36 Å²	36	28.7 Å²	28.7	22%	0.221	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	130.2	172.2	-61.5	0	0	0	0	109.6	N252 T276	T214-N252 WeakPolarHBondContact CB-O 3.34Å; T214-N252 HydrophobicContact CG2-CB 4.39Å; T214-N252 PolarHBondContact N-O 2.92Å; T214-N252 PolarHBondContact O-N 2.81Å; T214-T276 CarbonylContact C-O 3.6Å; T214-T276 VanDerWaalsContact CA-O 3.31Å; T214-T276 WeakPolarHBondContact CA-O 3.47Å; T214-T276 HydrophobicContact CG2-CG2 4.49Å; T214-T276 WeakPolarHBondContact CG2-O 3.26Å
215	V	97.9	Very high	92.2	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	113.7	172.4	-179.7	0	0	0	0	108	M80 M139 V141 V249 F251 V275 T276 F277 A278	M80-V215 HydrophobicContact CE-CB 4.18Å; M80-V215 HydrophobicContact CE-CG1 4.3Å; M80-V215 HydrophobicContact CE-CG2 4.21Å; M139-V215 HydrophobicContact SD-CG2 4.1Å; V141-V215 HydrophobicContact CG1-CG1 4.2Å; V141-V215 HydrophobicContact CG2-CG1 4.09Å; V141-V215 HydrophobicContact CG2-CG2 4.18Å; V215-V249 HydrophobicContact CG1-CG1 3.96Å; V215-F251 HydrophobicContact CG2-CD1 3.91Å; V215-F251 HydrophobicContact CG2-CE1 3.95Å; V215-V275 HydrophobicContact CG2-CG1 4.02Å; V215-T276 PolarHBondContact N-O 2.79Å; V215-F277 HydrophobicContact CB-CD2 4.24Å; V215-F277 HydrophobicContact CG1-CD2 4.1Å; V215-F277 HydrophobicContact CG1-CE2 4.42Å; V215-F277 WeakPolarHBondContact O-CA 3.3Å; V215-F277 VanDerWaalsContact O-CD2 3.28Å; V215-F277 WeakPolarHBondContact O-CD2 3.3Å; V215-A278 PolarHBondContact O-N 2.94Å
216	N	97.6	Very high	91.4	Very high	7 Å²	7	26.7 Å²	26.7	4%	0.037	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	135.1	-179.8	-71.4	125.4	0	0	0	112.2	Y250 N252 A278 L280	N216-Y250 HydrophobicContact CB-CD1 4.35Å; N216-Y250 PolarHBondContact N-O 3.43Å; N216-Y250 PolarHBondContact O-N 3.22Å; N216-N252 VanDerWaalsContact OD1-CB 3.25Å; N216-N252 WeakPolarHBondContact OD1-CB 3.4Å; N216-N252 PolarHBondContact OD1-ND2 3.44Å; N216-A278 WeakPolarHBondContact CA-O 3.47Å; N216-A278 PolarHBondContact ND2-O 3.42Å; N216-L280 HydrophobicContact CB-CB 3.74Å; N216-L280 HydrophobicContact CB-CD2 3.9Å; N216-L280 HydrophobicContact CB-CG 4.44Å
217	M	96.7	Very high	90.7	Very high	5 Å²	5	28.8 Å²	28.8	3%	0.025	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	112.5	164.5	-163.7	76	-148.1	0	0	109	M76 Y106 V143 I163 Y219 P247 V249 F277 A278 P279 L280	M76-M217 HydrophobicContact CE-CG 4.2Å; Y106-M217 HydrophobicContact CD2-CG 3.97Å; Y106-M217 HydrophobicContact CE2-CE 4.28Å; Y106-M217 HydrophobicContact CE2-CG 3.81Å; V143-M217 HydrophobicContact CG2-SD 4.11Å; I163-M217 HydrophobicContact CD1-CE 4.24Å; M217-Y219 PolarHBondContact O-N 2.79Å; M217-P247 HydrophobicContact CE-CB 3.33Å; M217-P247 HydrophobicContact CE-CG 3.31Å; M217-V249 HydrophobicContact CE-CG2 3.94Å; M217-V249 HydrophobicContact SD-CG2 3.72Å; M217-F277 HydrophobicContact CB-CE2 4.04Å; M217-F277 HydrophobicContact CB-CZ 3.7Å; M217-A278 PolarHBondContact N-O 3.37Å; M217-A278 VanDerWaalsContact N-O 3.08Å; M217-P279 CarbonylContact O-C 3.52Å; M217-P279 VanDerWaalsContact O-CA 3.31Å; M217-P279 WeakPolarHBondContact O-CA 3.31Å; M217-L280 PolarHBondContact O-N 2.88Å
218	V	96.2	Very high	89.8	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	121.1	-179.4	-175.7	0	0	0	0	109.4	Y106 I248 L280 L282 W285	Y106-V218 WeakPolarHBondContact CE2-O 3.37Å; Y106-V218 PolarHBondContact OH-O 3.48Å; V218-I248 HydrophobicContact CB-CB 3.87Å; V218-I248 HydrophobicContact CG2-CB 3.76Å; V218-I248 HydrophobicContact CG2-CG2 4.01Å; V218-I248 PolarHBondContact N-O 2.83Å; V218-L280 CarbonylContact C-O 3.53Å; V218-L280 WeakPolarHBondContact CA-O 3.1Å; V218-L280 HydrophobicContact CG2-CB 4.49Å; V218-L280 HydrophobicContact CG2-CD2 4.46Å; V218-L282 HydrophobicContact CG1-CB 4.3Å; V218-L282 HydrophobicContact CG1-CD1 4.07Å; V218-W285 HydrophobicContact CG1-CB 4.21Å; V218-W285 HydrophobicContact CG1-CG 4.49Å; V218-W285 HydrophobicContact CG2-CB 3.96Å; V218-W285 HydrophobicContact CG2-CG 3.78Å
219	Y	95.3	Very high	89.1	Confident	71 Å²	71	34.2 Å²	34.2	28%	0.278	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	117.8	171.8	-177.2	-103.9	0	0	0	109.8	Y106 M217 Q221 L280 L282	Y106-Y219 HydrophobicContact CD1-CD2 4.31Å; Y106-Y219 HydrophobicContact CD1-CE2 4.44Å; Y106-Y219 AromaticContact CE1-CD2 3.96Å; Y106-Y219 HydrophobicContact CE1-CD2 3.96Å; Y106-Y219 HydrophobicContact CE1-CE2 4.26Å; Y106-Y219 HydrophobicContact CE2-CD2 4.44Å; Y106-Y219 WeakPolarHBondContact OH-CA 3.48Å; M217-Y219 PolarHBondContact O-N 2.79Å; Y219-Q221 HydrophobicContact CE2-CG 4.28Å; Y219-L280 PolarHBondContact N-O 3.17Å; Y219-L282 PolarHBondContact O-N 3.33Å
220	D	92.2	Very high	88.1	Confident	10 Å²	10	35.5 Å²	35.5	5%	0.053	21%	0.208	C	C	.	.			trans	-146.8	138	178.5	-175.7	22.1	0	0	0	110.1	N68 Y106 S222 Y245 L282	N68-D220 PolarHBondContact ND2-O 3.02Å; Y106-D220 PolarHBondContact OH-N 2.91Å; Y106-D220 VanDerWaalsContact OH-N 3.08Å; D220-S222 WeakPolarHBondContact OD1-CB 3.28Å; D220-S222 PolarHBondContact OD1-N 3.19Å; D220-S222 PolarHBondContact OD1-OG 2.9Å; D220-Y245 VanDerWaalsContact CG-OH 3.31Å; D220-Y245 PolarHBondContact OD2-OH 3Å; D220-L282 HydrophobicContact CB-CB 4.42Å; D220-L282 HydrophobicContact CB-CD1 4.5Å
221	Q	91.7	Very high	87.2	Confident	63 Å²	63	40 Å²	40	29%	0.294	24%	0.239	S	C	.	.			trans	-131.3	18.1	172.8	-65.5	-60.8	-31.8	0	0	111.1	F70 P72 Y219	F70-Q221 PolarHBondContact O-NE2 3.08Å; P72-Q221 HydrophobicContact CG-CG 3.92Å; Y219-Q221 HydrophobicContact CE2-CG 4.28Å
222	S	87.9	Confident	86.3	Confident	8 Å²	8	40.8 Å²	40.8	6%	0.056	24%	0.24	C	C	.	.			trans	-63.3	143.8	177.7	-57.1	0	0	0	0	110.4	Q53 D220 Y245	Q53-S222 PolarHBondContact NE2-OG 2.76Å; D220-S222 WeakPolarHBondContact OD1-CB 3.28Å; D220-S222 PolarHBondContact OD1-N 3.19Å; D220-S222 PolarHBondContact OD1-OG 2.9Å; S222-Y245 PolarHBondContact N-OH 2.79Å; S222-Y245 VanDerWaalsContact O-CE1 3.28Å; S222-Y245 WeakPolarHBondContact O-CE1 3.29Å; S222-Y245 PolarHBondContact O-OH 2.75Å
223	V	85.8	Confident	85.6	Confident	31 Å²	31	37 Å²	37	19%	0.188	22%	0.22	C	C	.	.			trans	-101.3	127.5	171	179	0	0	0	0	107.9	M65	M65-V223 HydrophobicContact CB-CG1 3.6Å; M65-V223 HydrophobicContact CE-CG1 4.19Å; M65-V223 HydrophobicContact CG-CG1 3.64Å; M65-V223 HydrophobicContact SD-CG1 3.88Å
224	F	80.7	Confident	84.7	Confident	15 Å²	15	41.2 Å²	41.2	7%	0.066	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-109.7	140.4	178.8	-57.8	-73.2	0	0	0	111.2	W51 Y66 L229 F233 I237 Y245	W51-F224 HydrophobicContact CH2-CE1 4.25Å; W51-F224 HydrophobicContact CZ2-CE1 4.48Å; Y66-F224 WeakPolarHBondContact CB-O 3.47Å; Y66-F224 PolarHBondContact N-O 3.03Å; Y66-F224 PolarHBondContact O-N 3.07Å; F224-L229 HydrophobicContact CB-CD2 3.87Å; F224-L229 HydrophobicContact CD1-CD2 3.7Å; F224-L229 HydrophobicContact CD2-CD2 3.92Å; F224-L229 HydrophobicContact CE1-CD2 4.19Å; F224-L229 HydrophobicContact CE2-CD2 4.39Å; F224-L229 HydrophobicContact CG-CD2 3.54Å; F224-F233 HydrophobicContact CZ-CE1 4.11Å; F224-I237 HydrophobicContact CE2-CD1 4.27Å; F224-Y245 AromaticContact CD2-CD1 3.97Å; F224-Y245 HydrophobicContact CD2-CD1 3.97Å; F224-Y245 AromaticContact CD2-CE1 3.54Å; F224-Y245 HydrophobicContact CD2-CE1 3.54Å; F224-Y245 HydrophobicContact CE2-CD1 4.28Å; F224-Y245 AromaticContact CE2-CE1 3.63Å; F224-Y245 HydrophobicContact CE2-CE1 3.63Å; F224-Y245 AromaticContact CE2-CZ 3.8Å
225	T	76.3	Confident	83.9	Confident	30 Å²	30	44.9 Å²	44.9	18%	0.184	26%	0.261	C	S	.	.			trans	-82.1	138.7	165.6	-44.2	0	0	0	0	108.8	G227 Q228	T225-G227 PolarHBondContact O-N 2.65Å; T225-Q228 PolarHBondContact O-N 3.36Å; T225-Q228 VanDerWaalsContact O-N 3.16Å; T225-Q228 PolarHBondContact OG1-OE1 2.85Å
226	P	66.8	Low	83.3	Confident	58 Å²	58	45.8 Å²	45.8	38%	0.377	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	130	173.7	-19.4	23.6	0	0	0	112.1	K64 Y66	K64-P226 WeakPolarHBondContact O-CD 2.77Å; Y66-P226 HydrophobicContact CD2-CB 4.44Å; Y66-P226 HydrophobicContact CD2-CG 4.14Å; Y66-P226 HydrophobicContact CE1-CG 4.3Å; Y66-P226 HydrophobicContact CE2-CB 3.55Å; Y66-P226 HydrophobicContact CE2-CG 3.45Å; Y66-P226 VanDerWaalsContact CE2-CG 3.45Å
227	G	71.5	Confident	82.8	Confident	81 Å²	81	45.6 Å²	45.6	84%	0.835	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	-6.3	178.5	0	0	0	0	0	116.5	T225	T225-G227 PolarHBondContact O-N 2.65Å
228	Q	75.1	Confident	82.5	Confident	121 Å²	121	51.3 Å²	51.3	57%	0.565	29%	0.289	S	S	*	.			trans	-98.8	13.8	179.2	-64.2	-168	-50.5	0	0	114.2	T225	T225-Q228 PolarHBondContact O-N 3.36Å; T225-Q228 VanDerWaalsContact O-N 3.16Å; T225-Q228 PolarHBondContact OG1-OE1 2.85Å
229	L	79.3	Confident	82.2	Confident	37 Å²	37	55.1 Å²	55.1	19%	0.194	31%	0.305	C	S	.	.			trans	-73.2	131.5	179.3	-67.3	167.9	0	0	0	110.7	F224 F233 F239	F224-L229 HydrophobicContact CB-CD2 3.87Å; F224-L229 HydrophobicContact CD1-CD2 3.7Å; F224-L229 HydrophobicContact CD2-CD2 3.92Å; F224-L229 HydrophobicContact CE1-CD2 4.19Å; F224-L229 HydrophobicContact CE2-CD2 4.39Å; F224-L229 HydrophobicContact CG-CD2 3.54Å; L229-F233 HydrophobicContact CB-CB 4.44Å; L229-F239 HydrophobicContact CD1-CE2 3.5Å; L229-F239 VanDerWaalsContact CD1-CE2 3.5Å; L229-F239 HydrophobicContact CD1-CZ 3.37Å; L229-F239 HydrophobicContact CD2-CZ 4.37Å; L229-F239 HydrophobicContact CG-CZ 4.42Å
230	P	75	Confident	81.9	Confident	40 Å²	40	53.6 Å²	53.6	26%	0.26	30%	0.301	S	S	.	.			trans	-63	149.5	171.5	-18.1	29.2	0	0	0	111.1	W51 L232 F233	W51-P230 HydrophobicContact CE3-CG 4.23Å; W51-P230 HydrophobicContact CZ3-CG 3.94Å; P230-L232 PolarHBondContact O-N 2.84Å; P230-F233 HydrophobicContact CB-CD2 3.74Å; P230-F233 HydrophobicContact CB-CE2 4.01Å; P230-F233 HydrophobicContact CG-CD2 3.75Å; P230-F233 HydrophobicContact CG-CE2 3.69Å; P230-F233 WeakPolarHBondContact O-CB 3.46Å; P230-F233 PolarHBondContact O-N 3.48Å
231	P	78.7	Confident	81.7	Confident	106 Å²	106	58.8 Å²	58.8	69%	0.688	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-53.7	-33.4	-175.7	-28.8	35.1	0	0	0	114.9	F233 N234	P231-F233 PolarHBondContact O-N 3.28Å; P231-F233 VanDerWaalsContact O-N 3.11Å; P231-N234 WeakPolarHBondContact O-CB 3.49Å; P231-N234 PolarHBondContact O-N 2.69Å
232	L	76.7	Confident	81.5	Confident	50 Å²	50	59 Å²	59	26%	0.262	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-58.8	-23.6	178.1	-63.1	-178.8	0	0	0	113.5	P230 V289 Q293	P230-L232 PolarHBondContact O-N 2.84Å; L232-V289 HydrophobicContact CD2-CG1 4.22Å; L232-Q293 VanDerWaalsContact CD2-NE2 3.29Å
233	F	81.1	Confident	81.4	Confident	1 Å²	1	59.1 Å²	59.1	0%	0.004	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-85.2	-19.5	-177.3	-70.6	-102.9	0	0	0	113.3	W51 F224 L229 P230 P231 D235 A236 I237 L282 W285 Q286	W51-F233 HydrophobicContact CH2-CE2 4.36Å; W51-F233 AromaticContact CH2-CZ 3.81Å; W51-F233 HydrophobicContact CH2-CZ 3.81Å; W51-F233 HydrophobicContact CZ3-CE2 4.06Å; W51-F233 AromaticContact CZ3-CZ 3.99Å; W51-F233 HydrophobicContact CZ3-CZ 3.99Å; F224-F233 HydrophobicContact CZ-CE1 4.11Å; L229-F233 HydrophobicContact CB-CB 4.44Å; P230-F233 HydrophobicContact CB-CD2 3.74Å; P230-F233 HydrophobicContact CB-CE2 4.01Å; P230-F233 HydrophobicContact CG-CD2 3.75Å; P230-F233 HydrophobicContact CG-CE2 3.69Å; P230-F233 WeakPolarHBondContact O-CB 3.46Å; P230-F233 PolarHBondContact O-N 3.48Å; P231-F233 PolarHBondContact O-N 3.28Å; P231-F233 VanDerWaalsContact O-N 3.11Å; F233-D235 VanDerWaalsContact C-N 3.3Å; F233-D235 PolarHBondContact O-N 3.02Å; F233-A236 PolarHBondContact O-N 2.81Å; F233-A236 VanDerWaalsContact O-N 3.16Å; F233-I237 HydrophobicContact CB-CG1 4.44Å; F233-I237 HydrophobicContact CD1-CD1 3.44Å; F233-I237 VanDerWaalsContact CD1-CD1 3.44Å; F233-I237 HydrophobicContact CD1-CG1 3.89Å; F233-I237 HydrophobicContact CE1-CD1 4.07Å; F233-I237 HydrophobicContact CG-CD1 4.47Å; F233-I237 PolarHBondContact O-N 2.75Å; F233-L282 HydrophobicContact CE1-CD1 3.66Å; F233-L282 HydrophobicContact CE1-CD2 4.15Å; F233-L282 HydrophobicContact CE1-CG 4.38Å; F233-L282 HydrophobicContact CZ-CD1 3.95Å; F233-L282 HydrophobicContact CZ-CD2 4.06Å; F233-L282 HydrophobicContact CZ-CG 4.27Å; F233-W285 HydrophobicContact CD1-CH2 4.49Å; F233-W285 HydrophobicContact CD1-CZ3 4.19Å; F233-W285 AromaticContact CE1-CZ3 3.99Å; F233-W285 HydrophobicContact CE1-CZ3 3.99Å; F233-W285 HydrophobicContact CE2-CZ3 4.28Å; F233-W285 HydrophobicContact CG-CZ3 4.49Å; F233-W285 HydrophobicContact CZ-CZ3 4.03Å; F233-Q286 HydrophobicContact CZ-CG 4.48Å
234	N	78.5	Confident	81.6	Confident	94 Å²	94	60.9 Å²	60.9	50%	0.503	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-39.2	-171.4	-70.9	-12.5	0	0	0	112.8	P231 R238	P231-N234 WeakPolarHBondContact O-CB 3.49Å; P231-N234 PolarHBondContact O-N 2.69Å; N234-R238 PolarHBondContact O-NH1 2.99Å
235	D	80.6	Confident	82.2	Confident	114 Å²	114	60.2 Å²	60.2	61%	0.61	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-26.8	179	-65.1	-25.6	0	0	0	112.8	F233 R238	F233-D235 VanDerWaalsContact C-N 3.3Å; F233-D235 PolarHBondContact O-N 3.02Å; D235-R238 PolarHBondContact O-NH1 2.88Å
236	A	86.5	Confident	83	Confident	18 Å²	18	60.4 Å²	60.4	15%	0.149	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-43.6	-172.7	0	0	0	0	0	112.6	F233 I248 W285	F233-A236 PolarHBondContact O-N 2.81Å; F233-A236 VanDerWaalsContact O-N 3.16Å; A236-I248 HydrophobicContact CB-CD1 4.01Å; A236-I248 HydrophobicContact CB-CG1 4.3Å; A236-I248 HydrophobicContact CB-CG2 4.31Å; A236-W285 HydrophobicContact CB-CH2 3.6Å; A236-W285 HydrophobicContact CB-CZ2 3.31Å
237	I	87.2	Confident	84.4	Confident	4 Å²	4	57.8 Å²	57.8	2%	0.021	33%	0.332	C	S	.	.			trans	-90.6	140.7	-178	-67.2	-160.7	0	0	0	110.8	F224 F233 F239 Y245 I248	F224-I237 HydrophobicContact CE2-CD1 4.27Å; F233-I237 HydrophobicContact CB-CG1 4.44Å; F233-I237 HydrophobicContact CD1-CD1 3.44Å; F233-I237 VanDerWaalsContact CD1-CD1 3.44Å; F233-I237 HydrophobicContact CD1-CG1 3.89Å; F233-I237 HydrophobicContact CE1-CD1 4.07Å; F233-I237 HydrophobicContact CG-CD1 4.47Å; F233-I237 PolarHBondContact O-N 2.75Å; I237-F239 HydrophobicContact CG2-CD2 4.25Å; I237-F239 HydrophobicContact CG2-CE1 4.33Å; I237-F239 HydrophobicContact CG2-CE2 3.67Å; I237-F239 HydrophobicContact CG2-CZ 3.69Å; I237-Y245 HydrophobicContact CD1-CD2 4.12Å; I237-Y245 HydrophobicContact CD1-CE2 4.43Å; I237-Y245 HydrophobicContact CD1-CG 4.47Å; I237-Y245 HydrophobicContact CG2-CD2 4.36Å; I237-Y245 HydrophobicContact CG2-CG 4.13Å; I237-I248 HydrophobicContact CD1-CD1 4.44Å; I237-I248 HydrophobicContact CG1-CD1 3.89Å; I237-I248 HydrophobicContact CG1-CG1 3.94Å
238	R	89.2	Confident	85.5	Confident	125 Å²	125	54.4 Å²	54.4	47%	0.472	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	139.1	170.4	-65.4	-68.6	176.5	-107.6	8.9	108.9	N234 D235 Y245 Y246	N234-R238 PolarHBondContact O-NH1 2.99Å; D235-R238 PolarHBondContact O-NH1 2.88Å; R238-Y245 CarbonylContact O-C 3.53Å; R238-Y245 WeakPolarHBondContact O-CA 3.28Å; R238-Y246 HydrophobicContact CB-CD2 4.16Å; R238-Y246 WeakPolarHBondContact O-CD2 3.32Å; R238-Y246 PolarHBondContact O-N 3.49Å
239	F	89.5	Confident	86.5	Confident	81 Å²	81	49 Å²	49	36%	0.355	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	136.3	179.5	-67.5	-86.6	0	0	0	110.4	Y66 L229 I237 G243 Y245	Y66-F239 HydrophobicContact CD2-CD1 4.22Å; Y66-F239 AromaticContact CD2-CE1 3.73Å; Y66-F239 HydrophobicContact CD2-CE1 3.73Å; Y66-F239 HydrophobicContact CD2-CZ 4.41Å; Y66-F239 HydrophobicContact CE2-CE1 4.43Å; Y66-F239 HydrophobicContact CG-CD1 4.19Å; Y66-F239 AromaticContact CG-CE1 3.89Å; Y66-F239 HydrophobicContact CG-CE1 3.89Å; L229-F239 HydrophobicContact CD1-CE2 3.5Å; L229-F239 VanDerWaalsContact CD1-CE2 3.5Å; L229-F239 HydrophobicContact CD1-CZ 3.37Å; L229-F239 HydrophobicContact CD2-CZ 4.37Å; L229-F239 HydrophobicContact CG-CZ 4.42Å; I237-F239 HydrophobicContact CG2-CD2 4.25Å; I237-F239 HydrophobicContact CG2-CE1 4.33Å; I237-F239 HydrophobicContact CG2-CE2 3.67Å; I237-F239 HydrophobicContact CG2-CZ 3.69Å; F239-G243 WeakPolarHBondContact CD1-O 3.06Å; F239-Y245 HydrophobicContact CE1-CD1 4.36Å; F239-Y245 HydrophobicContact CE1-CG 4.47Å
240	H	90.4	Very high	87.3	Confident	38 Å²	38	48.6 Å²	48.6	18%	0.176	27%	0.266	C	S	.	.			trans	-78.1	159	166.3	-179.7	-105.7	0	0	0	109.7	S242 G243 K244 Y246	H240-S242 WeakPolarHBondContact ND1-CB 3.39Å; H240-S242 PolarHBondContact ND1-N 2.95Å; H240-S242 VanDerWaalsContact ND1-N 3.17Å; H240-S242 PolarHBondContact ND1-OG 2.93Å; H240-S242 PolarHBondContact O-N 2.79Å; H240-G243 PolarHBondContact O-N 3.39Å; H240-K244 WeakPolarHBondContact CB-O 3.39Å; H240-K244 PolarHBondContact N-O 3.24Å; H240-Y246 HydrophobicContact CB-CE2 3.81Å; H240-Y246 PolarHBondContact CD2-OH 3.17Å
241	S	87.7	Confident	88.3	Confident	119 Å²	119	47.5 Å²	47.5	83%	0.832	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-21.4	178.9	57.5	0	0	0	0	114	G243	S241-G243 PolarHBondContact O-N 2.94Å
242	S	87.1	Confident	89.1	Confident	68 Å²	68	42.8 Å²	42.8	48%	0.476	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-3.8	173.7	68	0	0	0	0	114.3	H240 K244	H240-S242 WeakPolarHBondContact ND1-CB 3.39Å; H240-S242 PolarHBondContact ND1-N 2.95Å; H240-S242 VanDerWaalsContact ND1-N 3.17Å; H240-S242 PolarHBondContact ND1-OG 2.93Å; H240-S242 PolarHBondContact O-N 2.79Å; S242-K244 VanDerWaalsContact C-N 3.28Å; S242-K244 PolarHBondContact O-N 2.86Å
243	G	85.8	Confident	89.9	Confident	10 Å²	10	41.4 Å²	41.4	10%	0.103	22%	0.219	C	C	.	.	S	Bend	trans	85.5	-16.7	-173.8	0	0	0	0	0	114.5	Y66 F239 H240 S241	Y66-G243 VanDerWaalsContact CB-O 3.26Å; Y66-G243 WeakPolarHBondContact CB-O 3.44Å; Y66-G243 VanDerWaalsContact CD1-C 3.43Å; Y66-G243 WeakPolarHBondContact CD1-O 3.42Å; F239-G243 WeakPolarHBondContact CD1-O 3.06Å; H240-G243 PolarHBondContact O-N 3.39Å; S241-G243 PolarHBondContact O-N 2.94Å
244	K	90.7	Very high	90.3	Very high	68 Å²	68	44.9 Å²	44.9	30%	0.296	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-67.9	151.1	172.6	-70.1	-165.6	168.6	-156.1	0	111	G67 N68 L69 E71 H240 S242	G67-K244 CarbonylContact O-C 3.51Å; G67-K244 WeakPolarHBondContact O-CA 3.07Å; G67-K244 VanDerWaalsContact O-CB 3.31Å; G67-K244 WeakPolarHBondContact O-CB 3.31Å; N68-K244 PolarHBondContact O-NZ 2.99Å; L69-K244 HydrophobicContact CB-CB 4.18Å; L69-K244 HydrophobicContact CD1-CB 4.04Å; L69-K244 HydrophobicContact CD1-CD 4Å; E71-K244 IonicContact OE1-NZ 2.66Å; E71-K244 PolarHBondContact OE1-NZ 2.82Å; H240-K244 WeakPolarHBondContact CB-O 3.39Å; H240-K244 PolarHBondContact N-O 3.24Å; S242-K244 VanDerWaalsContact C-N 3.28Å; S242-K244 PolarHBondContact O-N 2.86Å
245	Y	91.7	Very high	90.8	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.008	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	151.9	178.3	65.1	-95.8	0	0	0	113.4	Y66 G67 N68 L69 D220 S222 F224 I237 R238 F239	Y66-Y245 WeakPolarHBondContact O-CE1 3.39Å; G67-Y245 VanDerWaalsContact C-CD1 3.46Å; G67-Y245 VanDerWaalsContact O-CD1 3.3Å; G67-Y245 WeakPolarHBondContact O-CD1 3.31Å; G67-Y245 PolarHBondContact O-N 2.87Å; N68-Y245 HydrophobicContact CB-CD2 4.43Å; N68-Y245 HydrophobicContact CB-CE1 4.37Å; N68-Y245 HydrophobicContact CB-CE2 3.71Å; N68-Y245 VanDerWaalsContact N-CE1 3.3Å; N68-Y245 PolarHBondContact OD1-O 2.81Å; L69-Y245 VanDerWaalsContact CB-O 3.27Å; L69-Y245 WeakPolarHBondContact CB-O 3.39Å; L69-Y245 PolarHBondContact N-O 3.03Å; D220-Y245 VanDerWaalsContact CG-OH 3.31Å; D220-Y245 PolarHBondContact OD2-OH 3Å; S222-Y245 PolarHBondContact N-OH 2.79Å; S222-Y245 VanDerWaalsContact O-CE1 3.28Å; S222-Y245 WeakPolarHBondContact O-CE1 3.29Å; S222-Y245 PolarHBondContact O-OH 2.75Å; F224-Y245 AromaticContact CD2-CD1 3.97Å; F224-Y245 HydrophobicContact CD2-CD1 3.97Å; F224-Y245 AromaticContact CD2-CE1 3.54Å; F224-Y245 HydrophobicContact CD2-CE1 3.54Å; F224-Y245 HydrophobicContact CE2-CD1 4.28Å; F224-Y245 AromaticContact CE2-CE1 3.63Å; F224-Y245 HydrophobicContact CE2-CE1 3.63Å; F224-Y245 AromaticContact CE2-CZ 3.8Å; I237-Y245 HydrophobicContact CD1-CD2 4.12Å; I237-Y245 HydrophobicContact CD1-CE2 4.43Å; I237-Y245 HydrophobicContact CD1-CG 4.47Å; I237-Y245 HydrophobicContact CG2-CD2 4.36Å; I237-Y245 HydrophobicContact CG2-CG 4.13Å; R238-Y245 CarbonylContact O-C 3.53Å; R238-Y245 WeakPolarHBondContact O-CA 3.28Å; F239-Y245 HydrophobicContact CE1-CD1 4.36Å; F239-Y245 HydrophobicContact CE1-CG 4.47Å
246	Y	94.6	Very high	91.3	Very high	33 Å²	33	44.5 Å²	44.5	13%	0.129	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	139.3	172.5	-69	-81.1	0	0	0	110.8	L69 K160 I163 R238 H240	L69-Y246 HydrophobicContact CD2-CD1 3.76Å; L69-Y246 HydrophobicContact CD2-CE1 3.29Å; K160-Y246 WeakPolarHBondContact O-CE1 3.43Å; K160-Y246 PolarHBondContact O-OH 2.8Å; I163-Y246 HydrophobicContact CD1-CD1 4.03Å; I163-Y246 HydrophobicContact CG1-CD1 3.59Å; I163-Y246 HydrophobicContact CG1-CE1 4.3Å; I163-Y246 HydrophobicContact CG1-CG 4.25Å; R238-Y246 HydrophobicContact CB-CD2 4.16Å; R238-Y246 WeakPolarHBondContact O-CD2 3.32Å; R238-Y246 PolarHBondContact O-N 3.49Å; H240-Y246 HydrophobicContact CB-CE2 3.81Å; H240-Y246 PolarHBondContact CD2-OH 3.17Å
247	P	95	Very high	91.3	Very high	4 Å²	4	48.8 Å²	48.8	3%	0.026	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-63.6	151.8	172.3	27.4	-33.7	0	0	0	111.4	N68 F70 Y106 I163 M217	N68-P247 WeakPolarHBondContact OD1-CD 3.29Å; F70-P247 HydrophobicContact CB-CG 3.91Å; F70-P247 HydrophobicContact CD1-CG 4.21Å; F70-P247 HydrophobicContact CD2-CG 3.72Å; F70-P247 HydrophobicContact CE2-CG 4.3Å; F70-P247 HydrophobicContact CG-CG 3.69Å; Y106-P247 HydrophobicContact CE2-CB 3.82Å; Y106-P247 HydrophobicContact CE2-CG 4.28Å; Y106-P247 VanDerWaalsContact OH-CB 3.32Å; Y106-P247 WeakPolarHBondContact OH-CB 3.4Å; I163-P247 HydrophobicContact CD1-CG 3.8Å; M217-P247 HydrophobicContact CE-CB 3.33Å; M217-P247 HydrophobicContact CE-CG 3.31Å
248	I	95.1	Very high	91.2	Very high	10 Å²	10	52.5 Å²	52.5	5%	0.051	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-83.4	126.2	-172.5	-55.7	163.3	0	0	0	109.3	V218 A236 I237 L282 W285	V218-I248 HydrophobicContact CB-CB 3.87Å; V218-I248 HydrophobicContact CG2-CB 3.76Å; V218-I248 HydrophobicContact CG2-CG2 4.01Å; V218-I248 PolarHBondContact N-O 2.83Å; A236-I248 HydrophobicContact CB-CD1 4.01Å; A236-I248 HydrophobicContact CB-CG1 4.3Å; A236-I248 HydrophobicContact CB-CG2 4.31Å; I237-I248 HydrophobicContact CD1-CD1 4.44Å; I237-I248 HydrophobicContact CG1-CD1 3.89Å; I237-I248 HydrophobicContact CG1-CG1 3.94Å; I248-L282 HydrophobicContact CD1-CD1 4.44Å; I248-W285 HydrophobicContact CD1-CD2 4.14Å; I248-W285 HydrophobicContact CD1-CE3 4.11Å; I248-W285 HydrophobicContact CD1-CH2 3.93Å; I248-W285 HydrophobicContact CD1-CZ2 3.96Å; I248-W285 HydrophobicContact CD1-CZ3 3.99Å
249	V	96.7	Very high	91.1	Very high	8 Å²	8	50.6 Å²	50.6	5%	0.048	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	115.1	164.1	-178.2	0	0	0	0	107.3	V141 V143 I163 K165 V215 M217	V141-V249 HydrophobicContact CB-CG1 4.27Å; V141-V249 HydrophobicContact CG1-CG1 3.95Å; V143-V249 HydrophobicContact CG2-CG2 3.69Å; I163-V249 HydrophobicContact CG2-CG2 4Å; K165-V249 HydrophobicContact CB-CB 4.19Å; K165-V249 HydrophobicContact CB-CG1 4.34Å; K165-V249 HydrophobicContact CG-CB 4Å; V215-V249 HydrophobicContact CG1-CG1 3.96Å; M217-V249 HydrophobicContact CE-CG2 3.94Å; M217-V249 HydrophobicContact SD-CG2 3.72Å
250	Y	96	Very high	91.1	Very high	28 Å²	28	50.4 Å²	50.4	11%	0.11	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.3	-173.4	177.4	-122.2	0	0	0	110.8	N216 N252 L280 W285 Y288 V289	N216-Y250 HydrophobicContact CB-CD1 4.35Å; N216-Y250 PolarHBondContact N-O 3.43Å; N216-Y250 PolarHBondContact O-N 3.22Å; Y250-N252 HydrophobicContact CD1-CB 3.84Å; Y250-N252 HydrophobicContact CE1-CB 3.55Å; Y250-L280 HydrophobicContact CD1-CD2 3.82Å; Y250-L280 HydrophobicContact CE1-CD2 4.39Å; Y250-W285 AromaticContact CD1-CD1 3.78Å; Y250-W285 AromaticContact CD2-CD1 3.92Å; Y250-W285 AromaticContact CD2-NE1 3.7Å; Y250-W285 AromaticContact CG-CD1 3.58Å; Y250-W285 AromaticContact CG-NE1 3.8Å; Y250-Y288 HydrophobicContact CE1-CD2 4.29Å; Y250-Y288 HydrophobicContact CE1-CG 4.48Å; Y250-V289 HydrophobicContact CE2-CG2 4.19Å
251	F	96.5	Very high	91.3	Very high	17 Å²	17	49.2 Å²	49.2	8%	0.075	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	112.3	170.7	-64.5	-95	0	0	0	108.2	M139 V141 K165 H167 I213 V215	M139-F251 HydrophobicContact CB-CE1 4.24Å; M139-F251 HydrophobicContact CG-CE1 4.13Å; M139-F251 HydrophobicContact SD-CE1 4Å; V141-F251 HydrophobicContact CB-CZ 3.97Å; V141-F251 HydrophobicContact CG2-CE1 3.56Å; V141-F251 HydrophobicContact CG2-CZ 3.45Å; V141-F251 VanDerWaalsContact CG2-CZ 3.45Å; K165-F251 HydrophobicContact CB-CE2 3.91Å; H167-F251 HydrophobicContact CB-CB 3.91Å; H167-F251 HydrophobicContact CB-CD1 3.47Å; H167-F251 VanDerWaalsContact CB-CD1 3.47Å; H167-F251 HydrophobicContact CB-CD2 3.52Å; H167-F251 HydrophobicContact CB-CE1 3.72Å; H167-F251 HydrophobicContact CB-CE2 3.76Å; H167-F251 HydrophobicContact CB-CG 3.35Å; H167-F251 HydrophobicContact CB-CZ 3.84Å; H167-F251 AromaticContact CG-CD1 3.98Å; H167-F251 AromaticContact CG-CG 3.7Å; I213-F251 HydrophobicContact CG1-CD1 4.43Å; V215-F251 HydrophobicContact CG2-CD1 3.91Å; V215-F251 HydrophobicContact CG2-CE1 3.95Å
252	N	95	Very high	91.5	Very high	7 Å²	7	49 Å²	49	4%	0.037	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	106.2	-175.6	-173.2	-0.1	0	0	0	110	T214 N216 Y250 Y254 Y288	T214-N252 WeakPolarHBondContact CB-O 3.34Å; T214-N252 HydrophobicContact CG2-CB 4.39Å; T214-N252 PolarHBondContact N-O 2.92Å; T214-N252 PolarHBondContact O-N 2.81Å; N216-N252 VanDerWaalsContact OD1-CB 3.25Å; N216-N252 WeakPolarHBondContact OD1-CB 3.4Å; N216-N252 PolarHBondContact OD1-ND2 3.44Å; Y250-N252 HydrophobicContact CD1-CB 3.84Å; Y250-N252 HydrophobicContact CE1-CB 3.55Å; N252-Y254 WeakPolarHBondContact OD1-CB 3.42Å; N252-Y254 PolarHBondContact OD1-N 3Å; N252-Y288 WeakPolarHBondContact ND2-CE2 3.38Å
253	D	92.8	Very high	91.8	Very high	21 Å²	21	48.6 Å²	48.6	11%	0.112	24%	0.244	C	C	.	.			trans	-111.9	13.7	173.2	62.8	-8.5	0	0	0	111.7	R171 I213 W255 N256	R171-D253 IonicContact CZ-OD2 3.29Å; R171-D253 IonicContact NE-OD2 3.68Å; R171-D253 IonicContact NH2-OD2 2.79Å; R171-D253 PolarHBondContact NH2-OD2 3.06Å; I213-D253 HydrophobicContact CD1-CB 3.88Å; D253-W255 PolarHBondContact O-N 2.74Å; D253-N256 HydrophobicContact CB-CB 4.37Å; D253-N256 VanDerWaalsContact O-CB 3.28Å; D253-N256 WeakPolarHBondContact O-CB 3.31Å; D253-N256 PolarHBondContact O-N 2.98Å
254	Y	90.4	Very high	92.2	Very high	74 Å²	74	48.4 Å²	48.4	29%	0.29	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-36	-176.5	176.7	-92.7	0	0	0	112.8	N252 N256 Y288 Q291 T292	N252-Y254 WeakPolarHBondContact OD1-CB 3.42Å; N252-Y254 PolarHBondContact OD1-N 3Å; Y254-N256 VanDerWaalsContact C-N 3.33Å; Y254-Y288 AromaticContact CD1-CD1 3.86Å; Y254-Y288 HydrophobicContact CD1-CD1 3.86Å; Y254-Y288 AromaticContact CD1-CE1 3.56Å; Y254-Y288 HydrophobicContact CD1-CE1 3.56Å; Y254-Y288 AromaticContact CD2-CD1 3.95Å; Y254-Y288 HydrophobicContact CD2-CD1 3.95Å; Y254-Y288 HydrophobicContact CD2-CE1 4.49Å; Y254-Y288 HydrophobicContact CE1-CD1 4.41Å; Y254-Y288 HydrophobicContact CE1-CE1 4.11Å; Y254-Y288 HydrophobicContact CE2-CD1 4.49Å; Y254-Y288 AromaticContact CG-CD1 3.6Å; Y254-Y288 HydrophobicContact CG-CD1 3.6Å; Y254-Y288 AromaticContact CG-CE1 3.78Å; Y254-Y288 HydrophobicContact CG-CE1 3.78Å; Y254-Q291 HydrophobicContact CE2-CB 4.02Å; Y254-Q291 PolarHBondContact OH-OE1 3.07Å; Y254-T292 HydrophobicContact CD2-CG2 4.31Å
255	W	88.5	Confident	92.1	Very high	176 Å²	176	48.5 Å²	48.5	67%	0.667	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-1.2	179.4	-63.8	104.8	0	0	0	113.6	D253 L257 Y288	D253-W255 PolarHBondContact O-N 2.74Å; W255-L257 PolarHBondContact O-N 3.27Å; W255-Y288 AromaticContact NE1-CE1 3.94Å; W255-Y288 AromaticContact NE1-CZ 3.94Å; W255-Y288 PolarHBondContact NE1-OH 3.08Å; W255-Y288 VanDerWaalsContact NE1-OH 3.15Å
256	N	90.1	Very high	92	Very high	23 Å²	23	55.3 Å²	55.3	12%	0.123	28%	0.277	C	S	.	.			trans	-78.9	108.4	177.6	-65.6	0.4	0	0	0	108.7	H210 N212 D253 Y254 Y261	H210-N256 PolarHBondContact CE1-OD1 2.81Å; H210-N256 VanDerWaalsContact CE1-OD1 3.22Å; H210-N256 VanDerWaalsContact ND1-CG 3.29Å; H210-N256 PolarHBondContact ND1-ND2 3.26Å; H210-N256 VanDerWaalsContact ND1-ND2 3.17Å; N212-N256 PolarHBondContact O-ND2 2.83Å; D253-N256 HydrophobicContact CB-CB 4.37Å; D253-N256 VanDerWaalsContact O-CB 3.28Å; D253-N256 WeakPolarHBondContact O-CB 3.31Å; D253-N256 PolarHBondContact O-N 2.98Å; Y254-N256 VanDerWaalsContact C-N 3.33Å; N256-Y261 HydrophobicContact CB-CE2 4.1Å
257	L	87.9	Confident	91.9	Very high	109 Å²	109	59.2 Å²	59.2	57%	0.571	30%	0.304	S	S	*	.			trans	-77.8	145	-178.9	-58.2	178.6	0	0	0	110.4	W255 A259 D260 Y261	W255-L257 PolarHBondContact O-N 3.27Å; L257-A259 PolarHBondContact O-N 2.92Å; L257-D260 PolarHBondContact O-N 2.87Å; L257-Y261 WeakPolarHBondContact O-CD2 3.21Å
258	M	84.1	Confident	91.9	Very high	81 Å²	81	60.7 Å²	60.7	40%	0.399	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-63.7	-26.4	-178.9	-62.5	-52.3	-174.9	0	0	113.5	R173 D260 Y261	R173-M258 PolarHBondContact NH2-SD 2.94Å; M258-D260 VanDerWaalsContact C-N 3.26Å; M258-D260 PolarHBondContact O-N 3.43Å; M258-Y261 HydrophobicContact SD-CD2 4.3Å; M258-Y261 HydrophobicContact SD-CE2 4.17Å
259	A	87.6	Confident	92	Very high	86 Å²	86	67.2 Å²	67.2	71%	0.711	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-70.5	-22.4	176.9	0	0	0	0	0	113.1	L257 Y261	L257-A259 PolarHBondContact O-N 2.92Å; A259-Y261 VanDerWaalsContact C-N 3.33Å
260	D	90.7	Very high	92	Very high	76 Å²	76	69.9 Å²	69.9	41%	0.406	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-86.9	-8.8	-176.9	-61.4	-30.2	0	0	0	112.4	L257 M258	L257-D260 PolarHBondContact O-N 2.87Å; M258-D260 VanDerWaalsContact C-N 3.26Å; M258-D260 PolarHBondContact O-N 3.43Å
261	Y	93.5	Very high	92	Very high	14 Å²	14	68.9 Å²	68.9	6%	0.055	36%	0.356	C	S	.	.			trans	-74.2	125.9	176.1	-82.4	-96.7	0	0	0	111.1	R171 W209 H210 N256 L257 M258 A259	R171-Y261 HydrophobicContact CB-CE1 4.14Å; R171-Y261 HydrophobicContact CG-CE1 3.84Å; R171-Y261 PolarHBondContact NE-OH 2.94Å; W209-Y261 CarbonylContact O-C 3.58Å; W209-Y261 VanDerWaalsContact O-CA 3.26Å; W209-Y261 WeakPolarHBondContact O-CA 3.31Å; H210-Y261 HydrophobicContact CB-CD1 3.73Å; H210-Y261 HydrophobicContact CB-CD2 4.19Å; H210-Y261 HydrophobicContact CB-CE1 3.41Å; H210-Y261 VanDerWaalsContact CB-CE1 3.41Å; H210-Y261 HydrophobicContact CB-CE2 3.91Å; H210-Y261 HydrophobicContact CB-CG 4.11Å; H210-Y261 VanDerWaalsContact CB-CZ 3.5Å; H210-Y261 AromaticContact CD2-CD2 3.83Å; H210-Y261 AromaticContact CD2-CE2 3.77Å; N256-Y261 HydrophobicContact CB-CE2 4.1Å; L257-Y261 WeakPolarHBondContact O-CD2 3.21Å; M258-Y261 HydrophobicContact SD-CD2 4.3Å; M258-Y261 HydrophobicContact SD-CE2 4.17Å; A259-Y261 VanDerWaalsContact C-N 3.33Å
262	Q	92.6	Very high	92.1	Very high	114 Å²	114	74 Å²	74	53%	0.533	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	139.7	179.3	-59.8	-56.2	-36.6	0	0	111.2	Y208 W209	Y208-Q262 CarbonylContact C-O 3.53Å; Y208-Q262 WeakPolarHBondContact CA-O 3.19Å; W209-Q262 PolarHBondContact N-O 2.98Å; W209-Q262 PolarHBondContact O-N 2.85Å
263	P	92.8	Very high	92.2	Very high	59 Å²	59	73.7 Å²	73.7	38%	0.383	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	138	177.4	28.7	-33.9	0	0	0	111	N207 Y208	N207-P263 CarbonylContact O-C 3.57Å; N207-P263 WeakPolarHBondContact O-CA 3.27Å; Y208-P263 HydrophobicContact CD1-CB 4.48Å; Y208-P263 HydrophobicContact CE1-CB 4.19Å
264	I	93.5	Very high	92.4	Very high	7 Å²	7	72.9 Å²	72.9	4%	0.036	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	129.1	170.1	-47.2	179.3	0	0	0	108.1	V131 N170 N207 W209 V268 L271	V131-I264 HydrophobicContact CG1-CD1 3.82Å; V131-I264 HydrophobicContact CG1-CG2 4.42Å; N170-I264 HydrophobicContact CB-CD1 4.44Å; N207-I264 HydrophobicContact CB-CB 4.25Å; N207-I264 PolarHBondContact O-N 2.8Å; W209-I264 HydrophobicContact CB-CD1 3.77Å; W209-I264 HydrophobicContact CB-CG1 3.7Å; W209-I264 HydrophobicContact CE3-CD1 4.42Å; I264-V268 HydrophobicContact CG2-CB 4.24Å; I264-V268 HydrophobicContact CG2-CG1 4.38Å; I264-L271 HydrophobicContact CD1-CD2 4.33Å; I264-L271 HydrophobicContact CG1-CD2 4.46Å
265	N	89.9	Confident	92.8	Very high	70 Å²	70	69.4 Å²	69.4	37%	0.374	36%	0.359	S	S	.	.			trans	-143.1	-172.7	175.2	65.2	28.3	0	0	0	110	Q132 T267 V268	Q132-N265 WeakPolarHBondContact CG-O 3.16Å; N265-T267 PolarHBondContact O-N 3.27Å; N265-T267 WeakPolarHBondContact OD1-CA 3.45Å; N265-T267 WeakPolarHBondContact OD1-CB 3.37Å; N265-T267 PolarHBondContact OD1-N 3.48Å; N265-T267 PolarHBondContact OD1-OG1 2.9Å; N265-V268 PolarHBondContact O-N 3.31Å; N265-V268 VanDerWaalsContact O-N 3.14Å; N265-V268 PolarHBondContact OD1-N 3.41Å
266	E	89.9	Confident	93.2	Very high	145 Å²	145	62.8 Å²	62.8	68%	0.678	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-21.4	-178.4	-58.3	-177.5	161.6	0	0	114.4
267	T	92	Very high	93.5	Very high	114 Å²	114	62.4 Å²	62.4	70%	0.699	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-11.6	178.9	67.5	0	0	0	0	113.6	N265 E269	N265-T267 PolarHBondContact O-N 3.27Å; N265-T267 WeakPolarHBondContact OD1-CA 3.45Å; N265-T267 WeakPolarHBondContact OD1-CB 3.37Å; N265-T267 PolarHBondContact OD1-N 3.48Å; N265-T267 PolarHBondContact OD1-OG1 2.9Å; T267-E269 PolarHBondContact O-N 2.78Å
268	V	95	Very high	93.9	Very high	35 Å²	35	58 Å²	58	21%	0.212	32%	0.315	C	S	.	.			trans	-84	96.4	-179.5	179.5	0	0	0	0	109.5	C127 Q132 I264 N265 T270 L271	C127-V268 WeakPolarHBondContact CB-O 3.45Å; Q132-V268 PolarHBondContact NE2-O 3.49Å; I264-V268 HydrophobicContact CG2-CB 4.24Å; I264-V268 HydrophobicContact CG2-CG1 4.38Å; N265-V268 PolarHBondContact O-N 3.31Å; N265-V268 VanDerWaalsContact O-N 3.14Å; N265-V268 PolarHBondContact OD1-N 3.41Å; V268-T270 WeakPolarHBondContact CG1-O 3.42Å; V268-L271 HydrophobicContact CG1-CD2 3.68Å
269	E	96.2	Very high	94.5	Very high	148 Å²	148	55 Å²	55	69%	0.692	30%	0.302	S	S	*	.			trans	-81.6	-27.9	-179.7	-63.5	-174.1	174.7	0	0	113.4	C127 T267	C127-E269 WeakPolarHBondContact CB-O 3.48Å; C127-E269 PolarHBondContact N-O 3.33Å; T267-E269 PolarHBondContact O-N 2.78Å
270	T	96.9	Very high	94.9	Very high	64 Å²	64	51.3 Å²	51.3	39%	0.393	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	152.5	-175.7	62.4	0	0	0	0	111.9	E124 I125 V268	E124-T270 HydrophobicContact CG-CG2 4.31Å; E124-T270 WeakPolarHBondContact OE1-CB 3.38Å; E124-T270 WeakPolarHBondContact OE1-CG2 3.4Å; E124-T270 PolarHBondContact OE1-OG1 3.06Å; I125-T270 CarbonylContact O-C 3.59Å; I125-T270 VanDerWaalsContact O-CA 3.28Å; I125-T270 WeakPolarHBondContact O-CA 3.38Å; V268-T270 WeakPolarHBondContact CG1-O 3.42Å
271	L	96.7	Very high	95.1	Very high	6 Å²	6	49.8 Å²	49.8	3%	0.031	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	125.6	177.2	-59.4	172.6	0	0	0	108.3	E124 I125 C127 L137 W209 I264 V268	E124-L271 WeakPolarHBondContact CA-O 3.35Å; I125-L271 HydrophobicContact CD1-CB 4.29Å; I125-L271 HydrophobicContact CG1-CB 3.83Å; I125-L271 WeakPolarHBondContact CG1-O 3.39Å; I125-L271 PolarHBondContact N-O 3.11Å; I125-L271 PolarHBondContact O-N 2.82Å; C127-L271 HydrophobicContact CB-CD1 4.23Å; C127-L271 HydrophobicContact CB-CG 3.97Å; L137-L271 HydrophobicContact CD2-CD1 4.13Å; W209-L271 HydrophobicContact CB-CD2 4.28Å; W209-L271 HydrophobicContact CD2-CB 4.37Å; W209-L271 HydrophobicContact CD2-CD1 4.17Å; W209-L271 HydrophobicContact CD2-CD2 4.06Å; W209-L271 HydrophobicContact CD2-CG 4.44Å; W209-L271 HydrophobicContact CE3-CD1 4.06Å; W209-L271 HydrophobicContact CG-CD2 3.86Å; W209-L271 HydrophobicContact CH2-CD1 4.35Å; W209-L271 HydrophobicContact CZ2-CB 3.98Å; W209-L271 HydrophobicContact CZ2-CD1 4.48Å; W209-L271 HydrophobicContact CZ3-CD1 4.15Å; I264-L271 HydrophobicContact CD1-CD2 4.33Å; I264-L271 HydrophobicContact CG1-CD2 4.46Å; V268-L271 HydrophobicContact CG1-CD2 3.68Å
272	K	97.2	Very high	95	Very high	125 Å²	125	49.8 Å²	49.8	54%	0.543	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	128.5	168.3	-174.8	176.7	-179.9	179.4	0	108.9	W209 P211	W209-K272 PolarHBondContact NE1-O 3.03Å; P211-K272 VanDerWaalsContact CA-O 3.27Å; P211-K272 WeakPolarHBondContact CA-O 3.41Å
273	L	97.9	Very high	94.9	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	116.7	175.5	-176	56.3	0	0	0	110.4	L82 F98 S122 K123 M139 L169 W209 P211 I213 V275	L82-L273 HydrophobicContact CD1-CD2 4.05Å; L82-L273 HydrophobicContact CD2-CD2 3.98Å; F98-L273 HydrophobicContact CD2-CD2 4.24Å; F98-L273 HydrophobicContact CE1-CD2 4.47Å; F98-L273 HydrophobicContact CE2-CB 4.13Å; F98-L273 HydrophobicContact CE2-CD2 3.72Å; F98-L273 HydrophobicContact CE2-CG 4.07Å; F98-L273 HydrophobicContact CZ-CB 4.26Å; F98-L273 HydrophobicContact CZ-CD2 3.85Å; F98-L273 HydrophobicContact CZ-CG 3.89Å; S122-L273 WeakPolarHBondContact CA-O 3.48Å; K123-L273 PolarHBondContact N-O 3.19Å; K123-L273 PolarHBondContact O-N 3.16Å; M139-L273 HydrophobicContact CE-CD1 4.45Å; M139-L273 HydrophobicContact CE-CD2 3.71Å; M139-L273 HydrophobicContact CE-CG 4.42Å; L169-L273 HydrophobicContact CD1-CD1 4.47Å; L169-L273 HydrophobicContact CD1-CD2 4.01Å; W209-L273 HydrophobicContact CH2-CD1 3.99Å; W209-L273 HydrophobicContact CH2-CD2 4.37Å; W209-L273 HydrophobicContact CZ2-CB 3.96Å; W209-L273 HydrophobicContact CZ2-CD1 3.82Å; W209-L273 HydrophobicContact CZ2-CG 4.33Å; P211-L273 CarbonylContact O-C 3.49Å; P211-L273 WeakPolarHBondContact O-CA 3.11Å; I213-L273 HydrophobicContact CG2-CD1 4.07Å; L273-V275 HydrophobicContact CD1-CG2 4.39Å; L273-V275 HydrophobicContact CG-CG2 4.12Å
274	A	97.7	Very high	94.9	Very high	3 Å²	3	51.9 Å²	51.9	3%	0.025	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.9	171.4	0	0	0	0	0	109.9	F120 Y121 P211 N212 I213	F120-A274 HydrophobicContact CE2-CB 3.77Å; F120-A274 HydrophobicContact CZ-CB 3.84Å; Y121-A274 CarbonylContact O-C 3.55Å; Y121-A274 WeakPolarHBondContact O-CA 3.49Å; P211-A274 PolarHBondContact O-N 2.97Å; N212-A274 WeakPolarHBondContact CA-O 3.4Å; N212-A274 WeakPolarHBondContact OD1-CB 3.44Å; I213-A274 PolarHBondContact N-O 2.99Å
275	V	97.8	Very high	94.9	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.2	179.5	-176.6	0	0	0	0	109.3	M80 F98 Y121 M139 I213 V215 L273	M80-V275 HydrophobicContact CE-CG1 4.11Å; M80-V275 HydrophobicContact SD-CG1 3.86Å; F98-V275 HydrophobicContact CD1-CG2 4.4Å; F98-V275 HydrophobicContact CE1-CB 4.14Å; F98-V275 HydrophobicContact CE1-CG2 3.43Å; F98-V275 VanDerWaalsContact CE1-CG2 3.43Å; F98-V275 HydrophobicContact CZ-CG2 3.85Å; Y121-V275 PolarHBondContact N-O 3.33Å; Y121-V275 PolarHBondContact O-N 3.4Å; M139-V275 HydrophobicContact CE-CG2 3.53Å; M139-V275 HydrophobicContact SD-CG2 4.44Å; I213-V275 HydrophobicContact CG2-CG2 3.85Å; I213-V275 WeakPolarHBondContact O-CA 3.48Å; V215-V275 HydrophobicContact CG2-CG1 4.02Å; L273-V275 HydrophobicContact CD1-CG2 4.39Å; L273-V275 HydrophobicContact CG-CG2 4.12Å
276	T	96.7	Very high	94.9	Very high	37 Å²	37	50 Å²	50	23%	0.227	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	122.4	168.3	-58.3	0	0	0	0	108.7	L119 I213 T214 V215	L119-T276 CarbonylContact O-C 3.5Å; L119-T276 WeakPolarHBondContact O-CA 3.41Å; I213-T276 PolarHBondContact O-N 2.89Å; I213-T276 VanDerWaalsContact O-N 3.11Å; T214-T276 CarbonylContact C-O 3.6Å; T214-T276 VanDerWaalsContact CA-O 3.31Å; T214-T276 WeakPolarHBondContact CA-O 3.47Å; T214-T276 HydrophobicContact CG2-CG2 4.49Å; T214-T276 WeakPolarHBondContact CG2-O 3.26Å; V215-T276 PolarHBondContact N-O 2.79Å
277	F	96.7	Very high	94.9	Very high	15 Å²	15	46.7 Å²	46.7	7%	0.066	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	128.6	170.3	-179.8	-94.8	0	0	0	110.4	M76 I78 M80 L101 L104 S118 L119 V215 M217	M76-F277 HydrophobicContact CE-CZ 4.3Å; I78-F277 HydrophobicContact CD1-CD1 4.16Å; I78-F277 HydrophobicContact CD1-CD2 3.71Å; I78-F277 HydrophobicContact CD1-CE1 3.61Å; I78-F277 HydrophobicContact CD1-CE2 3.1Å; I78-F277 HydrophobicContact CD1-CG 4.21Å; I78-F277 HydrophobicContact CD1-CZ 3.02Å; M80-F277 HydrophobicContact CE-CD2 4.3Å; L101-F277 HydrophobicContact CD1-CB 3.89Å; L101-F277 HydrophobicContact CD1-CD1 4.13Å; L101-F277 HydrophobicContact CD1-CG 3.99Å; L104-F277 HydrophobicContact CD1-CD1 4.04Å; L104-F277 HydrophobicContact CD1-CE1 3.7Å; L104-F277 HydrophobicContact CD1-CZ 4.41Å; S118-F277 CarbonylContact C-O 3.53Å; S118-F277 VanDerWaalsContact CA-O 3.28Å; S118-F277 WeakPolarHBondContact CA-O 3.5Å; L119-F277 HydrophobicContact CB-CB 4.43Å; L119-F277 HydrophobicContact CD1-CD1 4.42Å; L119-F277 PolarHBondContact N-O 3.31Å; L119-F277 PolarHBondContact O-N 3.38Å; V215-F277 HydrophobicContact CB-CD2 4.24Å; V215-F277 HydrophobicContact CG1-CD2 4.1Å; V215-F277 HydrophobicContact CG1-CE2 4.42Å; V215-F277 WeakPolarHBondContact O-CA 3.3Å; V215-F277 VanDerWaalsContact O-CD2 3.28Å; V215-F277 WeakPolarHBondContact O-CD2 3.3Å; M217-F277 HydrophobicContact CB-CE2 4.04Å; M217-F277 HydrophobicContact CB-CZ 3.7Å
278	A	96	Very high	94.9	Very high	16 Å²	16	42.1 Å²	42.1	13%	0.132	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	150.8	-179.1	0	0	0	0	0	112.4	V215 N216 M217	V215-A278 PolarHBondContact O-N 2.94Å; N216-A278 WeakPolarHBondContact CA-O 3.47Å; N216-A278 PolarHBondContact ND2-O 3.42Å; M217-A278 PolarHBondContact N-O 3.37Å; M217-A278 VanDerWaalsContact N-O 3.08Å
279	P	96.7	Very high	94.5	Very high	20 Å²	20	41.2 Å²	41.2	13%	0.13	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	155	168.5	34.2	-36.9	0	0	0	110.9	D108 W109 G117 M217	D108-P279 WeakPolarHBondContact O-CG 3.28Å; W109-P279 HydrophobicContact CD2-CB 4.29Å; W109-P279 HydrophobicContact CD2-CG 3.87Å; W109-P279 HydrophobicContact CE3-CB 4.16Å; W109-P279 HydrophobicContact CE3-CG 3.52Å; W109-P279 HydrophobicContact CG-CG 4.46Å; W109-P279 HydrophobicContact CH2-CB 4.22Å; W109-P279 HydrophobicContact CH2-CG 4.4Å; W109-P279 HydrophobicContact CZ2-CB 4.33Å; W109-P279 HydrophobicContact CZ3-CB 4.12Å; W109-P279 HydrophobicContact CZ3-CG 3.81Å; G117-P279 WeakPolarHBondContact O-CD 3.47Å; M217-P279 CarbonylContact O-C 3.52Å; M217-P279 VanDerWaalsContact O-CA 3.31Å; M217-P279 WeakPolarHBondContact O-CA 3.31Å
280	L	96.2	Very high	94	Very high	7 Å²	7	37.1 Å²	37.1	4%	0.037	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	135.4	176.3	-175	65.3	0	0	0	109.9	N216 M217 V218 Y219 Y250 K284 W285 Y288	N216-L280 HydrophobicContact CB-CB 3.74Å; N216-L280 HydrophobicContact CB-CD2 3.9Å; N216-L280 HydrophobicContact CB-CG 4.44Å; M217-L280 PolarHBondContact O-N 2.88Å; V218-L280 CarbonylContact C-O 3.53Å; V218-L280 WeakPolarHBondContact CA-O 3.1Å; V218-L280 HydrophobicContact CG2-CB 4.49Å; V218-L280 HydrophobicContact CG2-CD2 4.46Å; Y219-L280 PolarHBondContact N-O 3.17Å; Y250-L280 HydrophobicContact CD1-CD2 3.82Å; Y250-L280 HydrophobicContact CE1-CD2 4.39Å; L280-K284 HydrophobicContact CD1-CB 3.79Å; L280-K284 HydrophobicContact CD1-CD 3.6Å; L280-K284 HydrophobicContact CD1-CG 3.68Å; L280-K284 HydrophobicContact CG-CB 4.43Å; L280-W285 HydrophobicContact CD2-CB 3.74Å; L280-W285 HydrophobicContact CD2-CG 4.46Å; L280-W285 HydrophobicContact CG-CB 4.18Å; L280-Y288 HydrophobicContact CD1-CD2 4.37Å; L280-Y288 HydrophobicContact CD1-CE2 3.91Å; L280-Y288 HydrophobicContact CD2-CD2 4.08Å; L280-Y288 HydrophobicContact CD2-CE2 4.32Å
281	S	94.9	Very high	93.2	Very high	44 Å²	44	38.1 Å²	38.1	31%	0.308	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	149.5	177.1	66.8	0	0	0	0	110.1	F283 K284 W285	S281-F283 PolarHBondContact O-N 3.12Å; S281-K284 PolarHBondContact O-N 3Å; S281-K284 VanDerWaalsContact O-N 3.15Å; S281-K284 VanDerWaalsContact OG-CB 3.32Å; S281-K284 WeakPolarHBondContact OG-CB 3.5Å; S281-K284 PolarHBondContact OG-N 3.21Å; S281-W285 PolarHBondContact O-N 3Å
282	L	91.8	Very high	92.1	Very high	15 Å²	15	39.2 Å²	39.2	8%	0.079	20%	0.202	C	C	.	.	H	α-helix	trans	-54.4	-42.6	177.8	-175.8	68	0	0	0	112.4	W51 V218 Y219 D220 F233 I248 W285 Q286	W51-L282 HydrophobicContact CH2-CD2 3.87Å; W51-L282 HydrophobicContact CZ2-CD2 4.16Å; V218-L282 HydrophobicContact CG1-CB 4.3Å; V218-L282 HydrophobicContact CG1-CD1 4.07Å; Y219-L282 PolarHBondContact O-N 3.33Å; D220-L282 HydrophobicContact CB-CB 4.42Å; D220-L282 HydrophobicContact CB-CD1 4.5Å; F233-L282 HydrophobicContact CE1-CD1 3.66Å; F233-L282 HydrophobicContact CE1-CD2 4.15Å; F233-L282 HydrophobicContact CE1-CG 4.38Å; F233-L282 HydrophobicContact CZ-CD1 3.95Å; F233-L282 HydrophobicContact CZ-CD2 4.06Å; F233-L282 HydrophobicContact CZ-CG 4.27Å; I248-L282 HydrophobicContact CD1-CD1 4.44Å; L282-W285 HydrophobicContact CD1-CE3 3.67Å; L282-W285 HydrophobicContact CD1-CZ3 4.05Å; L282-W285 WeakPolarHBondContact O-CB 3.18Å; L282-W285 PolarHBondContact O-N 2.84Å; L282-Q286 WeakPolarHBondContact O-CG 3.1Å; L282-Q286 PolarHBondContact O-N 3.26Å
283	F	90.5	Very high	90.6	Very high	115 Å²	115	36.2 Å²	36.2	50%	0.504	19%	0.19	S	C	.	.	H	α-helix	trans	-62.1	-45.6	177.9	178.8	-108.2	0	0	0	112.5	S281 W285 Q286 L287	S281-F283 PolarHBondContact O-N 3.12Å; F283-W285 VanDerWaalsContact C-N 3.31Å; F283-W285 PolarHBondContact O-N 3.46Å; F283-Q286 WeakPolarHBondContact O-CB 3.32Å; F283-Q286 PolarHBondContact O-N 3.48Å; F283-L287 HydrophobicContact CD1-CD1 4.13Å; F283-L287 HydrophobicContact CE1-CD1 3.6Å; F283-L287 HydrophobicContact CE1-CG 4.21Å; F283-L287 HydrophobicContact CZ-CD1 3.97Å; F283-L287 HydrophobicContact CZ-CD2 4.24Å; F283-L287 HydrophobicContact CZ-CG 4.2Å; F283-L287 PolarHBondContact O-N 3.44Å
284	K	92.4	Very high	88.6	Confident	101 Å²	101	37.6 Å²	37.6	44%	0.439	21%	0.205	S	C	.	.	H	α-helix	trans	-67.1	-36.2	179	-167.9	173.1	173.9	179.8	0	111.3	L280 S281 L287 Y288	L280-K284 HydrophobicContact CD1-CB 3.79Å; L280-K284 HydrophobicContact CD1-CD 3.6Å; L280-K284 HydrophobicContact CD1-CG 3.68Å; L280-K284 HydrophobicContact CG-CB 4.43Å; S281-K284 PolarHBondContact O-N 3Å; S281-K284 VanDerWaalsContact O-N 3.15Å; S281-K284 VanDerWaalsContact OG-CB 3.32Å; S281-K284 WeakPolarHBondContact OG-CB 3.5Å; S281-K284 PolarHBondContact OG-N 3.21Å; K284-L287 PolarHBondContact O-N 3.36Å; K284-Y288 HydrophobicContact CD-CE2 4.23Å; K284-Y288 VanDerWaalsContact CE-OH 3.25Å; K284-Y288 WeakPolarHBondContact CE-OH 3.21Å; K284-Y288 HydrophobicContact CG-CD2 4.22Å; K284-Y288 HydrophobicContact CG-CE2 3.77Å; K284-Y288 VanDerWaalsContact O-CD2 3.23Å; K284-Y288 WeakPolarHBondContact O-CD2 3.29Å; K284-Y288 PolarHBondContact O-N 3.5Å; K284-Y288 VanDerWaalsContact O-N 3.09Å
285	W	93.8	Very high	86.5	Confident	4 Å²	4	41.7 Å²	41.7	2%	0.015	23%	0.226	C	C	.	.	H	α-helix	trans	-59.2	-46.9	170.7	171.9	74.7	0	0	0	112.1	V218 F233 A236 I248 Y250 L280 S281 L282 F283 L287 Y288 V289	V218-W285 HydrophobicContact CG1-CB 4.21Å; V218-W285 HydrophobicContact CG1-CG 4.49Å; V218-W285 HydrophobicContact CG2-CB 3.96Å; V218-W285 HydrophobicContact CG2-CG 3.78Å; F233-W285 HydrophobicContact CD1-CH2 4.49Å; F233-W285 HydrophobicContact CD1-CZ3 4.19Å; F233-W285 AromaticContact CE1-CZ3 3.99Å; F233-W285 HydrophobicContact CE1-CZ3 3.99Å; F233-W285 HydrophobicContact CE2-CZ3 4.28Å; F233-W285 HydrophobicContact CG-CZ3 4.49Å; F233-W285 HydrophobicContact CZ-CZ3 4.03Å; A236-W285 HydrophobicContact CB-CH2 3.6Å; A236-W285 HydrophobicContact CB-CZ2 3.31Å; I248-W285 HydrophobicContact CD1-CD2 4.14Å; I248-W285 HydrophobicContact CD1-CE3 4.11Å; I248-W285 HydrophobicContact CD1-CH2 3.93Å; I248-W285 HydrophobicContact CD1-CZ2 3.96Å; I248-W285 HydrophobicContact CD1-CZ3 3.99Å; Y250-W285 AromaticContact CD1-CD1 3.78Å; Y250-W285 AromaticContact CD2-CD1 3.92Å; Y250-W285 AromaticContact CD2-NE1 3.7Å; Y250-W285 AromaticContact CG-CD1 3.58Å; Y250-W285 AromaticContact CG-NE1 3.8Å; L280-W285 HydrophobicContact CD2-CB 3.74Å; L280-W285 HydrophobicContact CD2-CG 4.46Å; L280-W285 HydrophobicContact CG-CB 4.18Å; S281-W285 PolarHBondContact O-N 3Å; L282-W285 HydrophobicContact CD1-CE3 3.67Å; L282-W285 HydrophobicContact CD1-CZ3 4.05Å; L282-W285 WeakPolarHBondContact O-CB 3.18Å; L282-W285 PolarHBondContact O-N 2.84Å; F283-W285 VanDerWaalsContact C-N 3.31Å; F283-W285 PolarHBondContact O-N 3.46Å; W285-L287 VanDerWaalsContact C-N 3.3Å; W285-L287 PolarHBondContact O-N 3.21Å; W285-Y288 PolarHBondContact O-N 2.92Å; W285-V289 HydrophobicContact CD2-CG2 4.23Å; W285-V289 HydrophobicContact CG-CG2 4.47Å; W285-V289 HydrophobicContact CZ2-CG2 3.77Å; W285-V289 WeakPolarHBondContact O-CG2 3.27Å; W285-V289 PolarHBondContact O-N 3.08Å
286	Q	90.9	Very high	84.2	Confident	35 Å²	35	48 Å²	48	16%	0.164	25%	0.25	C	S	.	.	H	α-helix	trans	-57.9	-42.2	176.1	-71.3	169.5	-25.3	0	0	112	F233 L282 F283 V289 S290	F233-Q286 HydrophobicContact CZ-CG 4.48Å; L282-Q286 WeakPolarHBondContact O-CG 3.1Å; L282-Q286 PolarHBondContact O-N 3.26Å; F283-Q286 WeakPolarHBondContact O-CB 3.32Å; F283-Q286 PolarHBondContact O-N 3.48Å; Q286-V289 PolarHBondContact O-N 3.21Å; Q286-S290 WeakPolarHBondContact O-CB 3.37Å; Q286-S290 PolarHBondContact O-N 2.87Å; Q286-S290 PolarHBondContact O-OG 3.48Å
287	L	90.1	Very high	81.6	Confident	74 Å²	74	54.3 Å²	54.3	39%	0.387	27%	0.27	S	S	.	.	H	α-helix	trans	-59.9	-47	176.1	-68.9	177.5	0	0	0	111.8	F283 K284 W285 S290 Q291	F283-L287 HydrophobicContact CD1-CD1 4.13Å; F283-L287 HydrophobicContact CE1-CD1 3.6Å; F283-L287 HydrophobicContact CE1-CG 4.21Å; F283-L287 HydrophobicContact CZ-CD1 3.97Å; F283-L287 HydrophobicContact CZ-CD2 4.24Å; F283-L287 HydrophobicContact CZ-CG 4.2Å; F283-L287 PolarHBondContact O-N 3.44Å; K284-L287 PolarHBondContact O-N 3.36Å; W285-L287 VanDerWaalsContact C-N 3.3Å; W285-L287 PolarHBondContact O-N 3.21Å; L287-S290 PolarHBondContact O-N 2.81Å; L287-S290 PolarHBondContact O-OG 2.8Å; L287-Q291 WeakPolarHBondContact O-CG 3.37Å; L287-Q291 PolarHBondContact O-N 2.93Å
288	Y	91.2	Very high	79.3	Confident	18 Å²	18	59.1 Å²	59.1	7%	0.071	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-44.5	177.9	-72	-52.8	0	0	0	112.6	Y250 N252 Y254 W255 L280 K284 W285 S290 Q291 T292	Y250-Y288 HydrophobicContact CE1-CD2 4.29Å; Y250-Y288 HydrophobicContact CE1-CG 4.48Å; N252-Y288 WeakPolarHBondContact ND2-CE2 3.38Å; Y254-Y288 AromaticContact CD1-CD1 3.86Å; Y254-Y288 HydrophobicContact CD1-CD1 3.86Å; Y254-Y288 AromaticContact CD1-CE1 3.56Å; Y254-Y288 HydrophobicContact CD1-CE1 3.56Å; Y254-Y288 AromaticContact CD2-CD1 3.95Å; Y254-Y288 HydrophobicContact CD2-CD1 3.95Å; Y254-Y288 HydrophobicContact CD2-CE1 4.49Å; Y254-Y288 HydrophobicContact CE1-CD1 4.41Å; Y254-Y288 HydrophobicContact CE1-CE1 4.11Å; Y254-Y288 HydrophobicContact CE2-CD1 4.49Å; Y254-Y288 AromaticContact CG-CD1 3.6Å; Y254-Y288 HydrophobicContact CG-CD1 3.6Å; Y254-Y288 AromaticContact CG-CE1 3.78Å; Y254-Y288 HydrophobicContact CG-CE1 3.78Å; W255-Y288 AromaticContact NE1-CE1 3.94Å; W255-Y288 AromaticContact NE1-CZ 3.94Å; W255-Y288 PolarHBondContact NE1-OH 3.08Å; W255-Y288 VanDerWaalsContact NE1-OH 3.15Å; L280-Y288 HydrophobicContact CD1-CD2 4.37Å; L280-Y288 HydrophobicContact CD1-CE2 3.91Å; L280-Y288 HydrophobicContact CD2-CD2 4.08Å; L280-Y288 HydrophobicContact CD2-CE2 4.32Å; K284-Y288 HydrophobicContact CD-CE2 4.23Å; K284-Y288 VanDerWaalsContact CE-OH 3.25Å; K284-Y288 WeakPolarHBondContact CE-OH 3.21Å; K284-Y288 HydrophobicContact CG-CD2 4.22Å; K284-Y288 HydrophobicContact CG-CE2 3.77Å; K284-Y288 VanDerWaalsContact O-CD2 3.23Å; K284-Y288 WeakPolarHBondContact O-CD2 3.29Å; K284-Y288 PolarHBondContact O-N 3.5Å; K284-Y288 VanDerWaalsContact O-N 3.09Å; W285-Y288 PolarHBondContact O-N 2.92Å; Y288-S290 PolarHBondContact O-N 2.94Å; Y288-Q291 PolarHBondContact O-N 3.43Å; Y288-T292 WeakPolarHBondContact O-CG2 3.31Å; Y288-T292 PolarHBondContact O-N 3.03Å; Y288-T292 PolarHBondContact O-OG1 3.39Å
289	V	87.4	Confident	77.2	Confident	16 Å²	16	62.7 Å²	62.7	10%	0.097	31%	0.308	C	S	.	.	H	α-helix	trans	-65.8	-39.9	179.9	177.3	0	0	0	0	111.2	L232 Y250 W285 Q286 Q291 T292 Q293	L232-V289 HydrophobicContact CD2-CG1 4.22Å; Y250-V289 HydrophobicContact CE2-CG2 4.19Å; W285-V289 HydrophobicContact CD2-CG2 4.23Å; W285-V289 HydrophobicContact CG-CG2 4.47Å; W285-V289 HydrophobicContact CZ2-CG2 3.77Å; W285-V289 WeakPolarHBondContact O-CG2 3.27Å; W285-V289 PolarHBondContact O-N 3.08Å; Q286-V289 PolarHBondContact O-N 3.21Å; V289-Q291 VanDerWaalsContact C-N 3.29Å; V289-Q291 PolarHBondContact O-N 2.88Å; V289-T292 WeakPolarHBondContact CA-OG1 3.18Å; V289-T292 PolarHBondContact O-N 2.95Å; V289-T292 PolarHBondContact O-OG1 2.91Å; V289-T292 VanDerWaalsContact O-OG1 3.14Å; V289-Q293 HydrophobicContact CG1-CG 4.2Å; V289-Q293 WeakPolarHBondContact O-CB 3.42Å; V289-Q293 VanDerWaalsContact O-CG 3.31Å; V289-Q293 WeakPolarHBondContact O-CG 3.49Å; V289-Q293 PolarHBondContact O-N 3.4Å
290	S	84.3	Confident	75	Confident	63 Å²	63	68 Å²	68	44%	0.441	33%	0.333	S	S	.	.	H	α-helix	trans	-61.2	-36.1	178.8	70.4	0	0	0	0	113.1	Q286 L287 Y288	Q286-S290 WeakPolarHBondContact O-CB 3.37Å; Q286-S290 PolarHBondContact O-N 2.87Å; Q286-S290 PolarHBondContact O-OG 3.48Å; L287-S290 PolarHBondContact O-N 2.81Å; L287-S290 PolarHBondContact O-OG 2.8Å; Y288-S290 PolarHBondContact O-N 2.94Å
291	Q	79.8	Confident	72.7	Confident	84 Å²	84	73.7 Å²	73.7	39%	0.393	36%	0.358	S	S	.	.	H	α-helix	trans	-78.9	-42.4	179	-68	-179.2	61.8	0	0	112.3	Y254 L287 Y288 V289 Q293 G294 N295	Y254-Q291 HydrophobicContact CE2-CB 4.02Å; Y254-Q291 PolarHBondContact OH-OE1 3.07Å; L287-Q291 WeakPolarHBondContact O-CG 3.37Å; L287-Q291 PolarHBondContact O-N 2.93Å; Y288-Q291 PolarHBondContact O-N 3.43Å; V289-Q291 VanDerWaalsContact C-N 3.29Å; V289-Q291 PolarHBondContact O-N 2.88Å; Q291-Q293 VanDerWaalsContact C-N 3.32Å; Q291-Q293 PolarHBondContact O-N 2.75Å; Q291-G294 PolarHBondContact O-N 3.1Å; Q291-N295 PolarHBondContact O-N 2.98Å
292	T	75.1	Confident	70.1	Confident	30 Å²	30	74.9 Å²	74.9	18%	0.184	38%	0.378	C	S	.	.	H	α-helix	trans	-67.9	-31	178.7	51.6	0	0	0	0	112.4	Y254 Y288 V289 G294 N295 R296	Y254-T292 HydrophobicContact CD2-CG2 4.31Å; Y288-T292 WeakPolarHBondContact O-CG2 3.31Å; Y288-T292 PolarHBondContact O-N 3.03Å; Y288-T292 PolarHBondContact O-OG1 3.39Å; V289-T292 WeakPolarHBondContact CA-OG1 3.18Å; V289-T292 PolarHBondContact O-N 2.95Å; V289-T292 PolarHBondContact O-OG1 2.91Å; V289-T292 VanDerWaalsContact O-OG1 3.14Å; T292-G294 VanDerWaalsContact C-N 3.3Å; T292-G294 PolarHBondContact O-N 2.97Å; T292-N295 PolarHBondContact O-N 3.04Å; T292-N295 VanDerWaalsContact O-N 3.13Å; T292-R296 WeakPolarHBondContact O-CG 3.45Å; T292-R296 PolarHBondContact O-N 3.15Å
293	Q	64.8	Low	67.4	Low	62 Å²	62	83 Å²	83	29%	0.29	42%	0.42	S	S	.	.	H	α-helix	trans	-61	-39.7	171.8	-76.2	-164.3	6.6	0	0	112.1	L232 V289 Q291 N295 R296 W297	L232-Q293 VanDerWaalsContact CD2-NE2 3.29Å; V289-Q293 HydrophobicContact CG1-CG 4.2Å; V289-Q293 WeakPolarHBondContact O-CB 3.42Å; V289-Q293 VanDerWaalsContact O-CG 3.31Å; V289-Q293 WeakPolarHBondContact O-CG 3.49Å; V289-Q293 PolarHBondContact O-N 3.4Å; Q291-Q293 VanDerWaalsContact C-N 3.32Å; Q291-Q293 PolarHBondContact O-N 2.75Å; Q293-N295 VanDerWaalsContact C-N 3.32Å; Q293-N295 PolarHBondContact O-N 2.82Å; Q293-R296 PolarHBondContact O-N 3.16Å; Q293-W297 PolarHBondContact O-N 3.03Å
294	G	55.2	Low	66.3	Low	30 Å²	30	81.4 Å²	81.4	31%	0.309	42%	0.416	S	S	.	.	H	α-helix	trans	-56.1	-46.8	170.7	0	0	0	0	0	111.7	Q291 T292 R296 W297 F298	Q291-G294 PolarHBondContact O-N 3.1Å; T292-G294 VanDerWaalsContact C-N 3.3Å; T292-G294 PolarHBondContact O-N 2.97Å; G294-R296 PolarHBondContact O-N 3.49Å; G294-W297 WeakPolarHBondContact O-CB 3.31Å; G294-W297 PolarHBondContact O-N 3.49Å; G294-F298 WeakPolarHBondContact O-CD2 3.37Å; G294-F298 PolarHBondContact O-N 3.01Å
295	N	53.4	Low	64.9	Low	88 Å²	88	80.4 Å²	80.4	47%	0.471	41%	0.414	S	S	.	.	H	α-helix	trans	-65.6	-33.3	178.4	-66.5	-0	0	0	0	113.7	Q291 T292 Q293 W297 F298 D299	Q291-N295 PolarHBondContact O-N 2.98Å; T292-N295 PolarHBondContact O-N 3.04Å; T292-N295 VanDerWaalsContact O-N 3.13Å; Q293-N295 VanDerWaalsContact C-N 3.32Å; Q293-N295 PolarHBondContact O-N 2.82Å; N295-W297 VanDerWaalsContact C-N 3.25Å; N295-W297 PolarHBondContact O-N 3.25Å; N295-F298 PolarHBondContact O-N 3.08Å; N295-F298 VanDerWaalsContact O-N 3.11Å; N295-D299 PolarHBondContact O-N 3.28Å
296	R	50	Low	63.3	Low	135 Å²	135	84.6 Å²	84.6	51%	0.509	44%	0.437	S	S	.	.	H	α-helix	trans	-63.1	-32.4	174.5	-68.5	-163.1	-61.6	-175.3	2.9	112.3	T292 Q293 G294 I300	T292-R296 WeakPolarHBondContact O-CG 3.45Å; T292-R296 PolarHBondContact O-N 3.15Å; Q293-R296 PolarHBondContact O-N 3.16Å; G294-R296 PolarHBondContact O-N 3.49Å; R296-I300 WeakPolarHBondContact O-CB 3.49Å; R296-I300 WeakPolarHBondContact O-CD1 3.36Å; R296-I300 WeakPolarHBondContact O-CG1 3.41Å; R296-I300 PolarHBondContact O-N 2.83Å
297	W	43.4	Very low	61.7	Low	168 Å²	168	87.5 Å²	87.5	64%	0.636	45%	0.453	S	S	*	.	H	α-helix	trans	-64	-47	171.2	-74.5	94.4	0	0	0	110.3	Q293 G294 N295 D299 I300 F301	Q293-W297 PolarHBondContact O-N 3.03Å; G294-W297 WeakPolarHBondContact O-CB 3.31Å; G294-W297 PolarHBondContact O-N 3.49Å; N295-W297 VanDerWaalsContact C-N 3.25Å; N295-W297 PolarHBondContact O-N 3.25Å; W297-D299 PolarHBondContact O-N 2.83Å; W297-I300 PolarHBondContact O-N 2.97Å; W297-F301 HydrophobicContact CE3-CD2 4.01Å; W297-F301 AromaticContact CE3-CE2 3.38Å; W297-F301 HydrophobicContact CE3-CE2 3.38Å; W297-F301 HydrophobicContact CE3-CZ 4.37Å; W297-F301 AromaticContact CZ3-CE2 3.62Å; W297-F301 HydrophobicContact CZ3-CE2 3.62Å; W297-F301 HydrophobicContact CZ3-CZ 4.2Å; W297-F301 WeakPolarHBondContact O-CD2 3.48Å; W297-F301 PolarHBondContact O-N 3.42Å
298	F	46.7	Very low	59.9	Low	116 Å²	116	88.4 Å²	88.4	51%	0.509	46%	0.457	S	S	.	.	H	α-helix	trans	-60.4	-45.5	176.3	-66.2	-71.6	0	0	0	112.8	G294 N295 I300 F301 G302 L303	G294-F298 WeakPolarHBondContact O-CD2 3.37Å; G294-F298 PolarHBondContact O-N 3.01Å; N295-F298 PolarHBondContact O-N 3.08Å; N295-F298 VanDerWaalsContact O-N 3.11Å; F298-I300 PolarHBondContact O-N 2.74Å; F298-F301 CarbonylContact O-C 3.53Å; F298-F301 PolarHBondContact O-N 3.49Å; F298-G302 PolarHBondContact O-N 2.63Å; F298-L303 HydrophobicContact CD1-CB 4.37Å; F298-L303 PolarHBondContact O-N 2.95Å; F298-L303 VanDerWaalsContact O-N 3.15Å
299	D	52.6	Low	57.8	Low	91 Å²	91	93.1 Å²	93.1	49%	0.487	48%	0.483	S	S	.	.	H	α-helix	trans	-64	-39.3	178	-78.8	-22.1	0	0	0	113	R171 N295 W297 G302	R171-D299 IonicContact NH1-OD2 3.11Å; N295-D299 PolarHBondContact O-N 3.28Å; W297-D299 PolarHBondContact O-N 2.83Å; D299-G302 PolarHBondContact O-N 2.67Å
300	I	50.7	Low	55.7	Low	131 Å²	131	98.6 Å²	98.6	67%	0.672	51%	0.51	S	S	*	.	H	α-helix	trans	-68.1	-39.3	177.4	-72.3	167.3	0	0	0	111.1	R296 W297 F298 G302	R296-I300 WeakPolarHBondContact O-CB 3.49Å; R296-I300 WeakPolarHBondContact O-CD1 3.36Å; R296-I300 WeakPolarHBondContact O-CG1 3.41Å; R296-I300 PolarHBondContact O-N 2.83Å; W297-I300 PolarHBondContact O-N 2.97Å; F298-I300 PolarHBondContact O-N 2.74Å; I300-G302 VanDerWaalsContact C-N 3.32Å
301	F	46.7	Very low	53.5	Low	128 Å²	128	101.3 Å²	101.3	56%	0.561	52%	0.515	S	S	*	.	H	α-helix	trans	-87.5	-0.8	-179	-72.6	-75.6	0	0	0	113.6	W297 F298 L303	W297-F301 HydrophobicContact CE3-CD2 4.01Å; W297-F301 AromaticContact CE3-CE2 3.38Å; W297-F301 HydrophobicContact CE3-CE2 3.38Å; W297-F301 HydrophobicContact CE3-CZ 4.37Å; W297-F301 AromaticContact CZ3-CE2 3.62Å; W297-F301 HydrophobicContact CZ3-CE2 3.62Å; W297-F301 HydrophobicContact CZ3-CZ 4.2Å; W297-F301 WeakPolarHBondContact O-CD2 3.48Å; W297-F301 PolarHBondContact O-N 3.42Å; F298-F301 CarbonylContact O-C 3.53Å; F298-F301 PolarHBondContact O-N 3.49Å; F301-L303 HydrophobicContact CB-CD1 4.35Å; F301-L303 HydrophobicContact CB-CG 4.42Å; F301-L303 PolarHBondContact O-N 3.16Å
302	G	42.2	Very low	51.3	Low	69 Å²	69	102.8 Å²	102.8	71%	0.711	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	29	178.2	0	0	0	0	0	113.4	F298 D299 I300	F298-G302 PolarHBondContact O-N 2.63Å; D299-G302 PolarHBondContact O-N 2.67Å; I300-G302 VanDerWaalsContact C-N 3.32Å
303	L	34.6	Very low	49.1	Very low	185 Å²	185	109.4 Å²	109.4	97%	0.969	56%	0.557	S	S	*	*			trans	-101.7	0	177.3	-68.9	174.2	0	0	0	110.6	F298 F301	F298-L303 HydrophobicContact CD1-CB 4.37Å; F298-L303 PolarHBondContact O-N 2.95Å; F298-L303 VanDerWaalsContact O-N 3.15Å; F301-L303 HydrophobicContact CB-CD1 4.35Å; F301-L303 HydrophobicContact CB-CG 4.42Å; F301-L303 PolarHBondContact O-N 3.16Å

Retrieved 303 of 303 residues in 510.7 ms (Link to these results)

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