A0AA82N8K5_SCHMA Loading...

Egg protein CP391S-like protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N8K5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 266 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.2	Very low	36.4	Very low	224 Å²	224	160.5 Å²	160.5	100%	1.103	83%	0.829	S	S	*	*				0	115.6	0	-113.8	169.9	-168.4	0	0	107.7
2	R	24.9	Very low	36.8	Very low	250 Å²	250	159.7 Å²	159.7	94%	0.943	83%	0.825	S	S	*	*			trans	-83.2	122.2	171.8	-75.3	-179.2	173.7	178.8	-2.2	107.3	M4	R2-M4 PolarHBondContact O-N 3.49Å
3	Y	32.4	Very low	37.2	Very low	199 Å²	199	159.3 Å²	159.3	78%	0.78	81%	0.814	S	S	*	*			trans	-84.5	110.5	168.7	-86.8	-85.8	0	0	0	108.7	T5	Y3-T5 HydrophobicContact CD1-CG2 4.39Å
4	M	25.5	Very low	37.6	Very low	184 Å²	184	156.4 Å²	156.4	91%	0.906	80%	0.802	S	S	*	*			trans	-97.2	102.1	156.4	-76.6	-172.5	75.9	0	0	106.4	R2	R2-M4 PolarHBondContact O-N 3.49Å
5	T	38.1	Very low	37.8	Very low	123 Å²	123	155.1 Å²	155.1	76%	0.755	80%	0.796	S	S	*	*			trans	-95.4	109.9	167.3	50.7	0	0	0	0	108.1	Y3	Y3-T5 HydrophobicContact CD1-CG2 4.39Å
6	S	36	Very low	38.2	Very low	104 Å²	104	151.4 Å²	151.4	73%	0.727	78%	0.783	S	S	*	*			trans	-50.9	132.1	175.5	173	0	0	0	0	111.8	A8	S6-A8 PolarHBondContact O-N 2.89Å
7	S	44.2	Very low	38.2	Very low	126 Å²	126	146.6 Å²	146.6	88%	0.881	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	32	-174.6	45.1	0	0	0	0	115.1
8	A	42.6	Very low	38.3	Very low	77 Å²	77	142.7 Å²	142.7	64%	0.636	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	5.3	-172.3	0	0	0	0	0	115.9	S6	S6-A8 PolarHBondContact O-N 2.89Å
9	Q	39.2	Very low	38.4	Very low	184 Å²	184	142.5 Å²	142.5	86%	0.86	75%	0.748	S	S	*	*	S	Bend	trans	-131	12.8	-178.4	-71	-172	-20.3	0	0	116.6	I11	Q9-I11 VanDerWaalsContact C-N 3.35Å; Q9-I11 PolarHBondContact O-N 3.43Å
10	L	39.2	Very low	38.5	Very low	139 Å²	139	139.8 Å²	139.8	73%	0.728	74%	0.737	S	S	*	*	G	3₁₀ helix	trans	-88.5	15.9	177.2	-85.7	166.8	0	0	0	115.3
11	I	45.3	Very low	38.4	Very low	156 Å²	156	137.9 Å²	137.9	80%	0.8	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-87.2	-5.6	-176.9	-63	-179.9	0	0	0	113.8	Q9	Q9-I11 VanDerWaalsContact C-N 3.35Å; Q9-I11 PolarHBondContact O-N 3.43Å
12	L	40.8	Very low	38.7	Very low	150 Å²	150	134 Å²	134	79%	0.785	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-112	25.1	179.4	-140.4	85.9	0	0	0	116.5
13	F	42.6	Very low	39.6	Very low	155 Å²	155	127.9 Å²	127.9	68%	0.68	70%	0.696	S	S	*	*	S	Bend	trans	-113.8	-7.5	170.4	-93.2	-79.8	0	0	0	115.2
14	N	41.7	Very low	40	Very low	119 Å²	119	126.4 Å²	126.4	64%	0.636	69%	0.694	S	S	*	*	H	α-helix	trans	-84.5	-14.1	-177.9	-74.1	-45.8	0	0	0	115.1	S18	N14-S18 PolarHBondContact O-OG 3.49Å
15	L	41.1	Very low	41.2	Very low	137 Å²	137	120.3 Å²	120.3	72%	0.717	67%	0.665	S	S	*	*	H	α-helix	trans	-82	-28.9	178	-93.3	155.1	0	0	0	113.5
16	V	43.8	Very low	42.2	Very low	96 Å²	96	117.1 Å²	117.1	58%	0.582	65%	0.647	S	S	*	*	H	α-helix	trans	-76.2	-31.5	178.2	-176	0	0	0	0	111.1	S18 L19 T20	V16-S18 VanDerWaalsContact C-N 3.32Å; V16-S18 PolarHBondContact O-N 3.44Å; V16-L19 PolarHBondContact O-N 3.38Å; V16-T20 PolarHBondContact O-OG1 3.43Å
17	V	38.4	Very low	43.2	Very low	70 Å²	70	117.2 Å²	117.2	42%	0.424	64%	0.635	S	S	.	*	H	α-helix	trans	-67.9	-32	179.8	175.7	0	0	0	0	111.8	T20 L21	V17-T20 PolarHBondContact O-OG1 3.24Å; V17-L21 HydrophobicContact CG1-CD1 3.52Å; V17-L21 HydrophobicContact CG1-CG 4.28Å; V17-L21 WeakPolarHBondContact O-CB 3.31Å; V17-L21 VanDerWaalsContact O-CD1 3.31Å; V17-L21 WeakPolarHBondContact O-CD1 3.32Å; V17-L21 WeakPolarHBondContact O-CG 3.4Å; V17-L21 PolarHBondContact O-N 3.25Å
18	S	41.2	Very low	44	Very low	75 Å²	75	117.1 Å²	117.1	52%	0.524	62%	0.621	S	S	.	*	H	α-helix	trans	-69.1	-34.5	179.4	-62.6	0	0	0	0	114	N14 V16	N14-S18 PolarHBondContact O-OG 3.49Å; V16-S18 VanDerWaalsContact C-N 3.32Å; V16-S18 PolarHBondContact O-N 3.44Å
19	L	39	Very low	45.4	Very low	140 Å²	140	114.7 Å²	114.7	73%	0.733	60%	0.601	S	S	*	*	H	α-helix	trans	-76.9	-30	179.5	-86	146.5	0	0	0	112.7	V16	V16-L19 PolarHBondContact O-N 3.38Å
20	T	40.4	Very low	47.6	Very low	87 Å²	87	106.2 Å²	106.2	53%	0.534	56%	0.562	S	S	.	*	H	α-helix	trans	-83	-15.6	176.4	52.9	0	0	0	0	113.9	V16 V17	V16-T20 PolarHBondContact O-OG1 3.43Å; V17-T20 PolarHBondContact O-OG1 3.24Å
21	L	36.9	Very low	49.8	Very low	101 Å²	101	103.8 Å²	103.8	53%	0.529	55%	0.549	S	S	.	.	H	α-helix	trans	-78.9	-22.4	-176.5	-93.4	162.6	0	0	0	114.1	V17 V23 F24	V17-L21 HydrophobicContact CG1-CD1 3.52Å; V17-L21 HydrophobicContact CG1-CG 4.28Å; V17-L21 WeakPolarHBondContact O-CB 3.31Å; V17-L21 VanDerWaalsContact O-CD1 3.31Å; V17-L21 WeakPolarHBondContact O-CD1 3.32Å; V17-L21 WeakPolarHBondContact O-CG 3.4Å; V17-L21 PolarHBondContact O-N 3.25Å; L21-V23 PolarHBondContact O-N 3.09Å; L21-F24 PolarHBondContact O-N 3.36Å; L21-F24 VanDerWaalsContact O-N 3.09Å
22	E	38.4	Very low	51.6	Low	142 Å²	142	99.7 Å²	99.7	66%	0.664	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-64.5	-26.1	176.9	-76.5	-170.3	165.9	0	0	112.7	F24	E22-F24 PolarHBondContact O-N 3.28Å
23	V	44.1	Very low	53.7	Low	121 Å²	121	92.5 Å²	92.5	73%	0.733	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-70.8	-20.2	176.2	-176.5	0	0	0	0	112.1	L21	L21-V23 PolarHBondContact O-N 3.09Å
24	F	42	Very low	55.8	Low	169 Å²	169	88 Å²	88	74%	0.741	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-104.9	2.6	-172.5	-91.4	-77.6	0	0	0	115.6	L21 E22 P26	L21-F24 PolarHBondContact O-N 3.36Å; L21-F24 VanDerWaalsContact O-N 3.09Å; E22-F24 PolarHBondContact O-N 3.28Å; F24-P26 WeakPolarHBondContact O-CD 3.35Å
25	N	50.2	Low	57.8	Low	55 Å²	55	85.4 Å²	85.4	29%	0.294	46%	0.463	S	S	.	.			trans	-92.9	103.6	171.5	-170.4	-12.6	0	0	0	110.1	E27 H28 A29	N25-E27 PolarHBondContact O-N 3.32Å; N25-E27 WeakPolarHBondContact OD1-CB 3.22Å; N25-E27 PolarHBondContact OD1-N 3.23Å; N25-E27 VanDerWaalsContact OD1-N 3.13Å; N25-H28 HydrophobicContact CB-CB 4.24Å; N25-H28 PolarHBondContact O-N 2.67Å; N25-A29 PolarHBondContact O-N 3.43Å; N25-A29 VanDerWaalsContact O-N 3.14Å
26	P	58.6	Low	59.8	Low	57 Å²	57	81 Å²	81	37%	0.37	44%	0.438	S	S	.	.	H	α-helix	trans	-61.1	-28.2	-177.4	-19.7	34.3	0	0	0	112.7	F24 C30	F24-P26 WeakPolarHBondContact O-CD 3.35Å; P26-C30 WeakPolarHBondContact O-CB 3.27Å; P26-C30 PolarHBondContact O-N 3.44Å; P26-C30 PolarHBondContact O-SG 3.05Å
27	E	57.3	Low	61.7	Low	105 Å²	105	81.1 Å²	81.1	49%	0.491	43%	0.428	S	S	.	.	H	α-helix	trans	-68.9	-45.8	177.9	-167.3	-171.9	-177.6	0	0	111.5	N25 A29 C30 N31	N25-E27 PolarHBondContact O-N 3.32Å; N25-E27 WeakPolarHBondContact OD1-CB 3.22Å; N25-E27 PolarHBondContact OD1-N 3.23Å; N25-E27 VanDerWaalsContact OD1-N 3.13Å; E27-A29 VanDerWaalsContact C-N 3.3Å; E27-A29 PolarHBondContact O-N 2.89Å; E27-C30 PolarHBondContact O-N 3.44Å; E27-N31 WeakPolarHBondContact O-CB 3.24Å; E27-N31 PolarHBondContact O-N 3.42Å; E27-N31 PolarHBondContact O-ND2 3.2Å
28	H	60.4	Low	64.1	Low	124 Å²	124	84 Å²	84	57%	0.574	44%	0.442	S	S	*	.	H	α-helix	trans	-62.5	-39.7	175.4	-90.2	-51	0	0	0	111.7	N25 K32	N25-H28 HydrophobicContact CB-CB 4.24Å; N25-H28 PolarHBondContact O-N 2.67Å; H28-K32 VanDerWaalsContact O-CB 3.3Å; H28-K32 WeakPolarHBondContact O-CB 3.35Å; H28-K32 PolarHBondContact O-N 3.13Å
29	A	73.7	Confident	66.5	Low	26 Å²	26	81.4 Å²	81.4	22%	0.215	43%	0.427	C	S	.	.	H	α-helix	trans	-61.6	-47.5	174.4	0	0	0	0	0	111.5	N25 E27 K32 I33	N25-A29 PolarHBondContact O-N 3.43Å; N25-A29 VanDerWaalsContact O-N 3.14Å; E27-A29 VanDerWaalsContact C-N 3.3Å; E27-A29 PolarHBondContact O-N 2.89Å; A29-K32 PolarHBondContact O-N 3.32Å; A29-I33 WeakPolarHBondContact O-CD1 3.29Å; A29-I33 VanDerWaalsContact O-CG1 3.25Å; A29-I33 WeakPolarHBondContact O-CG1 3.5Å; A29-I33 PolarHBondContact O-N 3.45Å
30	C	84.8	Confident	69.1	Low	6 Å²	6	79.6 Å²	79.6	4%	0.041	41%	0.41	C	S	.	.	H	α-helix	trans	-69.3	-38.8	-178.7	-69.1	0	0	0	0	113.7	P26 E27 K32 I33 D34 C174 R180	P26-C30 WeakPolarHBondContact O-CB 3.27Å; P26-C30 PolarHBondContact O-N 3.44Å; P26-C30 PolarHBondContact O-SG 3.05Å; E27-C30 PolarHBondContact O-N 3.44Å; C30-K32 VanDerWaalsContact C-N 3.3Å; C30-K32 PolarHBondContact O-N 3.18Å; C30-I33 WeakPolarHBondContact O-CB 3.27Å; C30-I33 PolarHBondContact O-N 3.38Å; C30-D34 PolarHBondContact O-N 3.37Å; C30-C174 HydrophobicContact CB-CB 3.98Å; C30-C174 WeakPolarHBondContact CB-SG 3.5Å; C30-C174 VanDerWaalsContact SG-CA 3.51Å; C30-C174 WeakPolarHBondContact SG-CB 3.4Å; C30-C174 CovalentContact SG-SG 2.03Å; C30-C174 PolarHBondContact SG-SG 3.14Å; C30-R180 HydrophobicContact CB-CG 4.31Å
31	N	84.7	Confident	71.7	Confident	88 Å²	88	79.8 Å²	79.8	47%	0.471	41%	0.407	S	S	.	.	H	α-helix	trans	-62.6	-39.5	173.1	-74.3	-28.1	0	0	0	111.6	E27 D34 S35	E27-N31 WeakPolarHBondContact O-CB 3.24Å; E27-N31 PolarHBondContact O-N 3.42Å; E27-N31 PolarHBondContact O-ND2 3.2Å; N31-D34 PolarHBondContact O-N 3.06Å; N31-S35 PolarHBondContact O-N 3.14Å
32	K	82.7	Confident	74.5	Confident	70 Å²	70	75.3 Å²	75.3	30%	0.304	38%	0.384	S	S	.	.	H	α-helix	trans	-65.5	-45.8	175.5	-171.7	173.1	177.1	179.5	0	111.2	H28 A29 C30 D34 S35 E36 Y54	H28-K32 VanDerWaalsContact O-CB 3.3Å; H28-K32 WeakPolarHBondContact O-CB 3.35Å; H28-K32 PolarHBondContact O-N 3.13Å; A29-K32 PolarHBondContact O-N 3.32Å; C30-K32 VanDerWaalsContact C-N 3.3Å; C30-K32 PolarHBondContact O-N 3.18Å; K32-D34 VanDerWaalsContact C-N 3.35Å; K32-D34 PolarHBondContact O-N 3.03Å; K32-S35 PolarHBondContact O-N 2.84Å; K32-S35 PolarHBondContact O-OG 2.88Å; K32-E36 WeakPolarHBondContact CE-OE1 3.29Å; K32-E36 WeakPolarHBondContact CE-OE2 3.34Å; K32-E36 HydrophobicContact CG-CG 4.48Å; K32-E36 WeakPolarHBondContact O-CB 3.44Å; K32-E36 PolarHBondContact O-N 2.87Å; K32-Y54 HydrophobicContact CB-CE2 4.19Å; K32-Y54 HydrophobicContact CD-CD2 4.31Å; K32-Y54 HydrophobicContact CD-CE2 3.98Å; K32-Y54 HydrophobicContact CG-CD2 4Å; K32-Y54 HydrophobicContact CG-CE2 3.95Å
33	I	86.8	Confident	77.2	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-53.4	-51.2	173.7	-73.1	160.7	0	0	0	110.5	A29 C30 S35 E36 R37 Y54 F172 R180 V182	A29-I33 WeakPolarHBondContact O-CD1 3.29Å; A29-I33 VanDerWaalsContact O-CG1 3.25Å; A29-I33 WeakPolarHBondContact O-CG1 3.5Å; A29-I33 PolarHBondContact O-N 3.45Å; C30-I33 WeakPolarHBondContact O-CB 3.27Å; C30-I33 PolarHBondContact O-N 3.38Å; I33-S35 PolarHBondContact O-N 2.78Å; I33-S35 VanDerWaalsContact O-N 3.09Å; I33-E36 PolarHBondContact O-N 2.86Å; I33-E36 VanDerWaalsContact O-N 3.1Å; I33-R37 HydrophobicContact CG2-CB 4.3Å; I33-R37 WeakPolarHBondContact O-CB 3.4Å; I33-R37 WeakPolarHBondContact O-CG 3.47Å; I33-R37 PolarHBondContact O-N 2.83Å; I33-Y54 HydrophobicContact CD1-CD1 4.43Å; I33-Y54 HydrophobicContact CD1-CE1 3.94Å; I33-Y54 HydrophobicContact CG1-CD1 3.69Å; I33-Y54 HydrophobicContact CG1-CD2 3.83Å; I33-Y54 HydrophobicContact CG1-CE1 3.58Å; I33-Y54 HydrophobicContact CG1-CE2 3.71Å; I33-Y54 HydrophobicContact CG1-CG 3.81Å; I33-F172 HydrophobicContact CD1-CB 3.87Å; I33-F172 HydrophobicContact CD1-CD1 3.76Å; I33-F172 HydrophobicContact CD1-CD2 3.49Å; I33-F172 VanDerWaalsContact CD1-CD2 3.49Å; I33-F172 HydrophobicContact CD1-CE1 4.13Å; I33-F172 HydrophobicContact CD1-CE2 3.9Å; I33-F172 HydrophobicContact CD1-CG 3.41Å; I33-F172 VanDerWaalsContact CD1-CG 3.41Å; I33-F172 HydrophobicContact CD1-CZ 4.18Å; I33-F172 HydrophobicContact CG1-CD2 4.47Å; I33-R180 HydrophobicContact CG2-CB 4.09Å; I33-V182 HydrophobicContact CB-CG2 4.46Å; I33-V182 HydrophobicContact CG1-CG2 4.23Å; I33-V182 HydrophobicContact CG2-CG2 3.62Å
34	D	85.5	Confident	79.6	Confident	59 Å²	59	67 Å²	67	32%	0.316	34%	0.337	S	S	.	.	H	α-helix	trans	-58.9	-27.8	-179.2	-75.5	-23.7	0	0	0	112.4	C30 N31 K32 R37 R180	C30-D34 PolarHBondContact O-N 3.37Å; N31-D34 PolarHBondContact O-N 3.06Å; K32-D34 VanDerWaalsContact C-N 3.35Å; K32-D34 PolarHBondContact O-N 3.03Å; D34-R37 IonicContact OD1-NH1 3.35Å; D34-R180 VanDerWaalsContact OD1-CD 3.24Å; D34-R180 WeakPolarHBondContact OD1-CD 3.09Å; D34-R180 IonicContact OD1-NE 3.91Å; D34-R180 PolarHBondContact OD1-NE 3.1Å; D34-R180 IonicContact OD2-CZ 2.7Å; D34-R180 IonicContact OD2-NE 3.77Å; D34-R180 PolarHBondContact OD2-NE 3.13Å; D34-R180 VanDerWaalsContact OD2-NE 3.09Å; D34-R180 IonicContact OD2-NH2 3.58Å; D34-R180 PolarHBondContact OD2-NH2 3.38Å
35	S	83.5	Confident	82	Confident	66 Å²	66	60.1 Å²	60.1	46%	0.462	31%	0.314	S	S	.	.	H	α-helix	trans	-90.9	-16.1	179	75.2	0	0	0	0	116	N31 K32 I33 R40	N31-S35 PolarHBondContact O-N 3.14Å; K32-S35 PolarHBondContact O-N 2.84Å; K32-S35 PolarHBondContact O-OG 2.88Å; I33-S35 PolarHBondContact O-N 2.78Å; I33-S35 VanDerWaalsContact O-N 3.09Å; S35-R40 PolarHBondContact O-NH2 3.38Å
36	E	84	Confident	84	Confident	44 Å²	44	66.7 Å²	66.7	21%	0.206	34%	0.343	C	S	.	.	H	α-helix	trans	-127.7	-8	-169.9	-69.6	178.8	-171.1	0	0	114.3	K32 I33 D38 G39 Y54	K32-E36 WeakPolarHBondContact CE-OE1 3.29Å; K32-E36 WeakPolarHBondContact CE-OE2 3.34Å; K32-E36 HydrophobicContact CG-CG 4.48Å; K32-E36 WeakPolarHBondContact O-CB 3.44Å; K32-E36 PolarHBondContact O-N 2.87Å; I33-E36 PolarHBondContact O-N 2.86Å; I33-E36 VanDerWaalsContact O-N 3.1Å; E36-D38 VanDerWaalsContact C-N 3.34Å; E36-D38 PolarHBondContact O-N 3.22Å; E36-G39 PolarHBondContact O-N 2.82Å; E36-G39 VanDerWaalsContact O-N 3.15Å; E36-Y54 PolarHBondContact O-N 3.22Å
37	R	83.5	Confident	85.7	Confident	98 Å²	98	66.2 Å²	66.2	37%	0.37	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-35.7	-174.9	66.5	179.9	-164.6	-163.4	2.3	114.4	I33 D34 G39 V182	I33-R37 HydrophobicContact CG2-CB 4.3Å; I33-R37 WeakPolarHBondContact O-CB 3.4Å; I33-R37 WeakPolarHBondContact O-CG 3.47Å; I33-R37 PolarHBondContact O-N 2.83Å; D34-R37 IonicContact OD1-NH1 3.35Å; R37-G39 PolarHBondContact O-N 3.22Å; R37-V182 HydrophobicContact CB-CG1 4.39Å; R37-V182 HydrophobicContact CB-CG2 3.99Å
38	D	88.2	Confident	87.5	Confident	132 Å²	132	62.9 Å²	62.9	71%	0.706	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-7.8	-177.5	-62	-22.7	0	0	0	112.3	E36	E36-D38 VanDerWaalsContact C-N 3.34Å; E36-D38 PolarHBondContact O-N 3.22Å
39	G	92	Very high	89.2	Confident	20 Å²	20	57.4 Å²	57.4	21%	0.206	30%	0.3	C	S	.	.			trans	74	161.8	-175.6	0	0	0	0	0	113.3	E36 R37 Q52	E36-G39 PolarHBondContact O-N 2.82Å; E36-G39 VanDerWaalsContact O-N 3.15Å; R37-G39 PolarHBondContact O-N 3.22Å; G39-Q52 CarbonylContact C-O 3.51Å; G39-Q52 VanDerWaalsContact CA-O 3.29Å; G39-Q52 WeakPolarHBondContact CA-O 3.35Å
40	R	93.5	Very high	90.3	Very high	102 Å²	102	56.2 Å²	56.2	39%	0.385	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	113.7	177.8	-61.8	-173.8	178.4	-162.2	-6.2	108.6	S35 V42 Q52 R232	S35-R40 PolarHBondContact O-NH2 3.38Å; R40-V42 PolarHBondContact O-N 2.73Å; R40-Q52 PolarHBondContact N-O 2.95Å; R40-Q52 PolarHBondContact O-N 3.45Å; R40-R232 VanDerWaalsContact CD-CZ 3.45Å; R40-R232 VanDerWaalsContact CD-NH1 3.26Å
41	L	95.1	Very high	90.8	Very high	90 Å²	90	56.8 Å²	56.8	47%	0.471	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	125.1	175	-178.3	64.3	0	0	0	109.3	F43 E44 E49 I51	L41-F43 WeakPolarHBondContact CD1-O 2.98Å; L41-E44 HydrophobicContact CD1-CB 4.2Å; L41-E44 HydrophobicContact CD2-CB 4.33Å; L41-E49 HydrophobicContact CD1-CG 3.84Å; L41-I51 HydrophobicContact CD1-CD1 4.22Å; L41-I51 HydrophobicContact CD1-CG1 3.79Å
42	V	95.3	Very high	91.2	Very high	7 Å²	7	53.1 Å²	53.1	4%	0.042	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-49.6	177.1	-177.3	0	0	0	0	109.2	R40 Y50 Q52 C227 A230 I234	R40-V42 PolarHBondContact O-N 2.73Å; V42-Y50 HydrophobicContact CB-CD1 3.66Å; V42-Y50 HydrophobicContact CB-CE1 4.33Å; V42-Y50 HydrophobicContact CG1-CD1 4.22Å; V42-Y50 HydrophobicContact CG2-CD1 3.54Å; V42-Y50 HydrophobicContact CG2-CE1 3.82Å; V42-Y50 PolarHBondContact N-O 2.78Å; V42-Q52 HydrophobicContact CG2-CB 4.17Å; V42-C227 HydrophobicContact CG1-CB 4.14Å; V42-C227 WeakPolarHBondContact CG1-SG 3.44Å; V42-A230 HydrophobicContact CB-CB 4.25Å; V42-A230 HydrophobicContact CG1-CB 3.51Å; V42-I234 HydrophobicContact CG1-CG2 4.1Å; V42-I234 HydrophobicContact CG2-CG2 4.21Å
43	F	95.2	Very high	91.7	Very high	4 Å²	4	50.7 Å²	50.7	2%	0.018	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	155	172.3	58.8	-101.3	0	0	0	111.2	L41 Y50 M59 K245 G248	L41-F43 WeakPolarHBondContact CD1-O 2.98Å; F43-Y50 HydrophobicContact CE1-CD1 4.41Å; F43-Y50 AromaticContact CE1-CG 3.98Å; F43-Y50 HydrophobicContact CE1-CG 3.98Å; F43-Y50 HydrophobicContact CZ-CD2 4.37Å; F43-Y50 AromaticContact CZ-CG 3.95Å; F43-Y50 HydrophobicContact CZ-CG 3.95Å; F43-Y50 PolarHBondContact N-O 3.13Å; F43-Y50 PolarHBondContact O-N 2.89Å; F43-M59 HydrophobicContact CE2-CE 4.25Å; F43-M59 HydrophobicContact CE2-SD 4.27Å; F43-M59 HydrophobicContact CZ-CE 4.5Å; F43-M59 HydrophobicContact CZ-SD 4.18Å; F43-K245 HydrophobicContact CE1-CG 4.48Å; F43-K245 HydrophobicContact CZ-CG 4.28Å; F43-G248 WeakPolarHBondContact CB-O 3.23Å
44	E	94.8	Very high	91.8	Very high	85 Å²	85	52.1 Å²	52.1	40%	0.397	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	136.8	174.1	-173.3	179.3	177.7	0	0	108.1	L41 E49 K189 W190	L41-E44 HydrophobicContact CD1-CB 4.2Å; L41-E44 HydrophobicContact CD2-CB 4.33Å; E44-E49 HydrophobicContact CB-CG 4.47Å; E44-E49 HydrophobicContact CG-CB 4.49Å; E44-E49 HydrophobicContact CG-CG 4.33Å; E44-K189 IonicContact OE1-NZ 2.6Å; E44-K189 PolarHBondContact OE1-NZ 3.31Å; E44-K189 IonicContact OE2-NZ 3.79Å; E44-W190 HydrophobicContact CG-CZ2 4.26Å
45	G	92	Very high	92.1	Very high	25 Å²	25	51.6 Å²	51.6	26%	0.258	26%	0.261	S	S	.	.			trans	-131	-176.9	168.6	0	0	0	0	0	109.9	S47 H48	G45-S47 VanDerWaalsContact C-N 3.27Å; G45-S47 PolarHBondContact O-N 2.99Å; G45-H48 PolarHBondContact N-O 2.96Å
46	E	92.2	Very high	92.5	Very high	193 Å²	193	48.4 Å²	48.4	90%	0.902	24%	0.239	S	C	*	.	S	Bend	trans	-65	-30.3	-175.8	-62.1	-171.7	162	0	0	113.7
47	S	94.1	Very high	93	Very high	47 Å²	47	46.4 Å²	46.4	33%	0.329	23%	0.229	S	C	.	.	S	Bend	trans	-119.5	4.8	-174.5	67	0	0	0	0	114.2	G45 R61 L62	G45-S47 VanDerWaalsContact C-N 3.27Å; G45-S47 PolarHBondContact O-N 2.99Å; S47-R61 WeakPolarHBondContact O-CA 3.42Å; S47-L62 PolarHBondContact O-N 2.95Å
48	H	95.1	Very high	93.6	Very high	35 Å²	35	42 Å²	42	16%	0.162	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	153.1	-178.3	56.3	56.4	0	0	0	113.5	G45 M59 I60 R61 F244	G45-H48 PolarHBondContact N-O 2.96Å; H48-M59 HydrophobicContact CB-CE 3.73Å; H48-I60 CarbonylContact C-O 3.53Å; H48-I60 WeakPolarHBondContact CA-O 3.06Å; H48-I60 VanDerWaalsContact CB-O 3.24Å; H48-I60 WeakPolarHBondContact CB-O 3.43Å; H48-R61 HydrophobicContact CB-CG 4.32Å; H48-F244 AromaticContact CD2-CD1 3.7Å
49	E	96.2	Very high	93.9	Very high	8 Å²	8	35.8 Å²	35.8	4%	0.037	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	140.6	178.8	-173.8	-170.1	80	0	0	109.5	L41 E44 I51 R58 M59 I60 K189 W190	L41-E49 HydrophobicContact CD1-CG 3.84Å; E44-E49 HydrophobicContact CB-CG 4.47Å; E44-E49 HydrophobicContact CG-CB 4.49Å; E44-E49 HydrophobicContact CG-CG 4.33Å; E49-I51 HydrophobicContact CG-CD1 4.32Å; E49-I51 HydrophobicContact CG-CG1 4.03Å; E49-I51 WeakPolarHBondContact OE1-CD1 3.05Å; E49-R58 IonicContact OE1-CZ 3.09Å; E49-R58 IonicContact OE1-NE 3.47Å; E49-R58 IonicContact OE1-NH2 3.2Å; E49-R58 PolarHBondContact OE1-NH2 3.11Å; E49-M59 CarbonylContact O-C 3.57Å; E49-M59 WeakPolarHBondContact O-CA 3.46Å; E49-I60 HydrophobicContact CB-CB 4.35Å; E49-I60 PolarHBondContact N-O 3.34Å; E49-I60 PolarHBondContact O-N 3.18Å; E49-K189 IonicContact OE2-NZ 3.39Å; E49-K189 PolarHBondContact OE2-NZ 3.03Å; E49-W190 HydrophobicContact CB-CH2 4.27Å; E49-W190 HydrophobicContact CB-CZ2 3.57Å; E49-W190 VanDerWaalsContact CD-NE1 3.32Å; E49-W190 HydrophobicContact CG-CZ2 4.31Å; E49-W190 PolarHBondContact OE1-NE1 3.44Å; E49-W190 PolarHBondContact OE2-NE1 3.2Å
50	Y	96.7	Very high	94.1	Very high	1 Å²	1	34.9 Å²	34.9	0%	0.004	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	122.8	172.3	-171.9	-81.7	0	0	0	111.2	V42 F43 S57 R58 M59 I234 V235 K245	V42-Y50 HydrophobicContact CB-CD1 3.66Å; V42-Y50 HydrophobicContact CB-CE1 4.33Å; V42-Y50 HydrophobicContact CG1-CD1 4.22Å; V42-Y50 HydrophobicContact CG2-CD1 3.54Å; V42-Y50 HydrophobicContact CG2-CE1 3.82Å; V42-Y50 PolarHBondContact N-O 2.78Å; F43-Y50 HydrophobicContact CE1-CD1 4.41Å; F43-Y50 AromaticContact CE1-CG 3.98Å; F43-Y50 HydrophobicContact CE1-CG 3.98Å; F43-Y50 HydrophobicContact CZ-CD2 4.37Å; F43-Y50 AromaticContact CZ-CG 3.95Å; F43-Y50 HydrophobicContact CZ-CG 3.95Å; F43-Y50 PolarHBondContact N-O 3.13Å; F43-Y50 PolarHBondContact O-N 2.89Å; Y50-S57 WeakPolarHBondContact OH-CB 3.46Å; Y50-S57 PolarHBondContact OH-OG 3.18Å; Y50-S57 VanDerWaalsContact OH-OG 3.09Å; Y50-R58 VanDerWaalsContact CA-O 3.28Å; Y50-R58 WeakPolarHBondContact CA-O 3.37Å; Y50-M59 HydrophobicContact CD2-CB 4.08Å; Y50-M59 HydrophobicContact CD2-CG 4.5Å; Y50-M59 HydrophobicContact CD2-SD 3.72Å; Y50-M59 HydrophobicContact CG-SD 4.31Å; Y50-I234 HydrophobicContact CE1-CB 4.09Å; Y50-I234 HydrophobicContact CE1-CD1 4.25Å; Y50-I234 HydrophobicContact CE1-CG2 3.9Å; Y50-V235 WeakPolarHBondContact OH-CG1 3.12Å; Y50-K245 HydrophobicContact CE2-CD 4.41Å; Y50-K245 VanDerWaalsContact CE2-CE 3.48Å
51	I	95.4	Very high	94.2	Very high	18 Å²	18	30.6 Å²	30.6	9%	0.092	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	134.9	178.4	-54.5	-167.6	0	0	0	109.3	L41 E49 Y53 S57 R58	L41-I51 HydrophobicContact CD1-CD1 4.22Å; L41-I51 HydrophobicContact CD1-CG1 3.79Å; E49-I51 HydrophobicContact CG-CD1 4.32Å; E49-I51 HydrophobicContact CG-CG1 4.03Å; E49-I51 WeakPolarHBondContact OE1-CD1 3.05Å; I51-Y53 HydrophobicContact CB-CD2 4.32Å; I51-Y53 HydrophobicContact CB-CE2 3.63Å; I51-Y53 HydrophobicContact CG2-CD1 4.5Å; I51-Y53 HydrophobicContact CG2-CD2 3.91Å; I51-Y53 HydrophobicContact CG2-CE1 4.03Å; I51-Y53 HydrophobicContact CG2-CE2 3.38Å; I51-Y53 HydrophobicContact CG2-CG 4.44Å; I51-Y53 VanDerWaalsContact CG2-CZ 3.44Å; I51-S57 CarbonylContact O-C 3.58Å; I51-S57 WeakPolarHBondContact O-CA 3.1Å; I51-R58 PolarHBondContact N-O 2.04Å; I51-R58 PolarHBondContact O-N 3.26Å
52	Q	93.8	Very high	94.2	Very high	11 Å²	11	27.4 Å²	27.4	5%	0.051	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	120.6	173	-176.4	174	57.1	0	0	109.5	G39 R40 V42 C233	G39-Q52 CarbonylContact C-O 3.51Å; G39-Q52 VanDerWaalsContact CA-O 3.29Å; G39-Q52 WeakPolarHBondContact CA-O 3.35Å; R40-Q52 PolarHBondContact N-O 2.95Å; R40-Q52 PolarHBondContact O-N 3.45Å; V42-Q52 HydrophobicContact CG2-CB 4.17Å; Q52-C233 PolarHBondContact NE2-O 2.72Å
53	Y	92.1	Very high	94.1	Very high	19 Å²	19	33.7 Å²	33.7	8%	0.075	17%	0.171	C	C	.	.			trans	-108.1	176.3	175	-63.9	-87.9	0	0	0	110.5	I51 Y55 Y56 R58 I184	I51-Y53 HydrophobicContact CB-CD2 4.32Å; I51-Y53 HydrophobicContact CB-CE2 3.63Å; I51-Y53 HydrophobicContact CG2-CD1 4.5Å; I51-Y53 HydrophobicContact CG2-CD2 3.91Å; I51-Y53 HydrophobicContact CG2-CE1 4.03Å; I51-Y53 HydrophobicContact CG2-CE2 3.38Å; I51-Y53 HydrophobicContact CG2-CG 4.44Å; I51-Y53 VanDerWaalsContact CG2-CZ 3.44Å; Y53-Y55 PolarHBondContact O-N 3.43Å; Y53-Y56 CarbonylContact C-O 3.51Å; Y53-Y56 VanDerWaalsContact CA-O 3.31Å; Y53-Y56 WeakPolarHBondContact CA-O 3.46Å; Y53-Y56 WeakPolarHBondContact CB-O 3.29Å; Y53-Y56 PolarHBondContact N-O 3.29Å; Y53-R58 HydrophobicContact CD2-CB 4.38Å; Y53-R58 HydrophobicContact CE2-CB 4.02Å; Y53-R58 PolarHBondContact OH-NH1 2.83Å; Y53-I184 HydrophobicContact CD1-CD1 4.1Å; Y53-I184 HydrophobicContact CD1-CG1 3.77Å; Y53-I184 HydrophobicContact CD1-CG2 4.46Å; Y53-I184 HydrophobicContact CD2-CD1 3.75Å; Y53-I184 HydrophobicContact CD2-CG1 4.18Å; Y53-I184 HydrophobicContact CD2-CG2 4.16Å; Y53-I184 HydrophobicContact CE1-CB 4.44Å; Y53-I184 HydrophobicContact CE1-CG1 4.02Å; Y53-I184 HydrophobicContact CE1-CG2 3.93Å; Y53-I184 HydrophobicContact CE2-CD1 4.29Å; Y53-I184 HydrophobicContact CE2-CG1 4.38Å; Y53-I184 HydrophobicContact CE2-CG2 3.57Å; Y53-I184 HydrophobicContact CG-CD1 3.64Å; Y53-I184 HydrophobicContact CG-CG1 3.87Å; Y53-I184 VanDerWaalsContact CZ-CG2 3.44Å
54	Y	89.8	Confident	94.1	Very high	30 Å²	30	35.8 Å²	35.8	12%	0.118	18%	0.181	C	C	.	.	S	Bend	trans	-57.4	128	163.3	-179.8	-98.7	0	0	0	110.2	K32 I33 E36 Y56 Y91 F172 V182	K32-Y54 HydrophobicContact CB-CE2 4.19Å; K32-Y54 HydrophobicContact CD-CD2 4.31Å; K32-Y54 HydrophobicContact CD-CE2 3.98Å; K32-Y54 HydrophobicContact CG-CD2 4Å; K32-Y54 HydrophobicContact CG-CE2 3.95Å; I33-Y54 HydrophobicContact CD1-CD1 4.43Å; I33-Y54 HydrophobicContact CD1-CE1 3.94Å; I33-Y54 HydrophobicContact CG1-CD1 3.69Å; I33-Y54 HydrophobicContact CG1-CD2 3.83Å; I33-Y54 HydrophobicContact CG1-CE1 3.58Å; I33-Y54 HydrophobicContact CG1-CE2 3.71Å; I33-Y54 HydrophobicContact CG1-CG 3.81Å; E36-Y54 PolarHBondContact O-N 3.22Å; Y54-Y56 PolarHBondContact O-N 3.12Å; Y54-Y91 HydrophobicContact CD1-CD1 4.19Å; Y54-Y91 HydrophobicContact CD1-CE1 4.47Å; Y54-F172 AromaticContact CD1-CZ 4Å; Y54-F172 HydrophobicContact CD1-CZ 4Å; Y54-F172 AromaticContact CE1-CE1 3.75Å; Y54-F172 HydrophobicContact CE1-CE1 3.75Å; Y54-F172 HydrophobicContact CE1-CE2 4.44Å; Y54-F172 AromaticContact CE1-CZ 3.63Å; Y54-F172 HydrophobicContact CE1-CZ 3.63Å; Y54-V182 HydrophobicContact CD1-CG2 4.1Å; Y54-V182 HydrophobicContact CG-CG2 4.44Å
55	Y	90.8	Very high	93.9	Very high	48 Å²	48	37.6 Å²	37.6	19%	0.188	20%	0.197	C	C	.	.	S	Bend	trans	65.2	-38.3	-179.9	-163.4	-89.5	0	0	0	116.9	Y53 Q89 Y91 G92 V201 S202	Y53-Y55 PolarHBondContact O-N 3.43Å; Y55-Q89 PolarHBondContact OH-OE1 2.86Å; Y55-Y91 HydrophobicContact CD1-CD1 4.33Å; Y55-Y91 HydrophobicContact CG-CD1 4.21Å; Y55-G92 VanDerWaalsContact CZ-CA 3.4Å; Y55-G92 VanDerWaalsContact OH-CA 3.25Å; Y55-G92 WeakPolarHBondContact OH-CA 3.09Å; Y55-G92 PolarHBondContact OH-N 3.5Å; Y55-G92 VanDerWaalsContact OH-N 3.16Å; Y55-V201 HydrophobicContact CE1-CG1 3.92Å; Y55-V201 HydrophobicContact CE1-CG2 4.02Å; Y55-S202 WeakPolarHBondContact O-CB 3.1Å; Y55-S202 PolarHBondContact O-N 3.26Å; Y55-S202 PolarHBondContact O-OG 3.19Å
56	Y	93.4	Very high	93.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	152.2	179.9	-69.3	-75.8	0	0	0	112.6	Y53 Y54 Y91 F168 E200 V201 S202	Y53-Y56 CarbonylContact C-O 3.51Å; Y53-Y56 VanDerWaalsContact CA-O 3.31Å; Y53-Y56 WeakPolarHBondContact CA-O 3.46Å; Y53-Y56 WeakPolarHBondContact CB-O 3.29Å; Y53-Y56 PolarHBondContact N-O 3.29Å; Y54-Y56 PolarHBondContact O-N 3.12Å; Y56-Y91 AromaticContact CD2-CD1 3.93Å; Y56-Y91 HydrophobicContact CD2-CD1 3.93Å; Y56-Y91 AromaticContact CD2-CE1 3.67Å; Y56-Y91 HydrophobicContact CD2-CE1 3.67Å; Y56-Y91 HydrophobicContact CD2-CE2 4.32Å; Y56-Y91 HydrophobicContact CD2-CG 4.37Å; Y56-Y91 AromaticContact CD2-CZ 3.91Å; Y56-Y91 AromaticContact CE2-CD1 3.88Å; Y56-Y91 HydrophobicContact CE2-CD1 3.88Å; Y56-Y91 AromaticContact CE2-CD2 3.9Å; Y56-Y91 HydrophobicContact CE2-CD2 3.9Å; Y56-Y91 AromaticContact CE2-CE1 3.98Å; Y56-Y91 HydrophobicContact CE2-CE1 3.98Å; Y56-Y91 HydrophobicContact CE2-CE2 4Å; Y56-Y91 AromaticContact CE2-CG 3.86Å; Y56-Y91 HydrophobicContact CE2-CG 3.86Å; Y56-Y91 PolarHBondContact OH-N 2.97Å; Y56-F168 AromaticContact CD2-CE1 3.58Å; Y56-F168 HydrophobicContact CD2-CE1 3.58Å; Y56-F168 HydrophobicContact CD2-CZ 4.01Å; Y56-F168 HydrophobicContact CE1-CZ 4.49Å; Y56-F168 AromaticContact CE2-CE1 3.44Å; Y56-F168 HydrophobicContact CE2-CE1 3.44Å; Y56-F168 VanDerWaalsContact CE2-CE1 3.44Å; Y56-F168 AromaticContact CE2-CZ 3.54Å; Y56-F168 HydrophobicContact CE2-CZ 3.54Å; Y56-F168 HydrophobicContact CG-CE1 4.4Å; Y56-F168 AromaticContact CZ-CZ 3.81Å; Y56-E200 CarbonylContact C-O 3.49Å; Y56-E200 VanDerWaalsContact CA-O 3.31Å; Y56-E200 WeakPolarHBondContact CA-O 3.48Å; Y56-V201 HydrophobicContact CD1-CG2 4.39Å; Y56-V201 HydrophobicContact CE1-CG2 3.92Å; Y56-S202 PolarHBondContact O-OG 3.16Å
57	S	94.4	Very high	93	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.007	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	139.5	160.6	59.8	0	0	0	0	109.3	Y50 I51 Y199 E200 S202 V235	Y50-S57 WeakPolarHBondContact OH-CB 3.46Å; Y50-S57 PolarHBondContact OH-OG 3.18Å; Y50-S57 VanDerWaalsContact OH-OG 3.09Å; I51-S57 CarbonylContact O-C 3.58Å; I51-S57 WeakPolarHBondContact O-CA 3.1Å; S57-Y199 CarbonylContact O-C 3.59Å; S57-Y199 WeakPolarHBondContact O-CA 3.3Å; S57-E200 PolarHBondContact N-O 3.24Å; S57-E200 PolarHBondContact O-N 2.74Å; S57-E200 PolarHBondContact OG-O 3.27Å; S57-S202 PolarHBondContact N-OG 3.36Å; S57-S202 VanDerWaalsContact N-OG 3.16Å; S57-V235 WeakPolarHBondContact OG-CG1 3.47Å
58	R	95.1	Very high	92	Very high	5 Å²	5	31.1 Å²	31.1	2%	0.019	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	130.5	179.8	-174	-177.6	70.7	-162.3	6.3	110.4	E49 Y50 I51 Y53 I60 V185 V197 E198 Y199	E49-R58 IonicContact OE1-CZ 3.09Å; E49-R58 IonicContact OE1-NE 3.47Å; E49-R58 IonicContact OE1-NH2 3.2Å; E49-R58 PolarHBondContact OE1-NH2 3.11Å; Y50-R58 VanDerWaalsContact CA-O 3.28Å; Y50-R58 WeakPolarHBondContact CA-O 3.37Å; I51-R58 PolarHBondContact N-O 2.04Å; I51-R58 PolarHBondContact O-N 3.26Å; Y53-R58 HydrophobicContact CD2-CB 4.38Å; Y53-R58 HydrophobicContact CE2-CB 4.02Å; Y53-R58 PolarHBondContact OH-NH1 2.83Å; R58-I60 HydrophobicContact CG-CG1 4.15Å; R58-V185 PolarHBondContact NH1-O 3.5Å; R58-V197 HydrophobicContact CG-CG1 3.74Å; R58-E198 CarbonylContact C-O 3.6Å; R58-E198 VanDerWaalsContact CA-O 3.27Å; R58-E198 WeakPolarHBondContact CA-O 3.14Å; R58-Y199 HydrophobicContact CB-CD1 4.06Å; R58-Y199 HydrophobicContact CB-CE1 3.93Å; R58-Y199 WeakPolarHBondContact CD-OH 3.25Å; R58-Y199 HydrophobicContact CG-CD1 4.21Å; R58-Y199 HydrophobicContact CG-CE1 3.84Å; R58-Y199 HydrophobicContact CG-CE2 4.39Å
59	M	95.9	Very high	90.5	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.015	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	126.4	165.5	-173.8	67.1	-169.1	0	0	109.2	F43 H48 E49 Y50 R61 V197 E198 F244	F43-M59 HydrophobicContact CE2-CE 4.25Å; F43-M59 HydrophobicContact CE2-SD 4.27Å; F43-M59 HydrophobicContact CZ-CE 4.5Å; F43-M59 HydrophobicContact CZ-SD 4.18Å; H48-M59 HydrophobicContact CB-CE 3.73Å; E49-M59 CarbonylContact O-C 3.57Å; E49-M59 WeakPolarHBondContact O-CA 3.46Å; Y50-M59 HydrophobicContact CD2-CB 4.08Å; Y50-M59 HydrophobicContact CD2-CG 4.5Å; Y50-M59 HydrophobicContact CD2-SD 3.72Å; Y50-M59 HydrophobicContact CG-SD 4.31Å; M59-R61 HydrophobicContact CE-CG 3.63Å; M59-R61 HydrophobicContact CG-CG 4.13Å; M59-V197 CarbonylContact O-C 3.6Å; M59-V197 WeakPolarHBondContact O-CA 3.25Å; M59-E198 PolarHBondContact N-O 2.94Å; M59-E198 PolarHBondContact O-N 3.1Å; M59-F244 HydrophobicContact CE-CB 3.59Å; M59-F244 HydrophobicContact CE-CD1 4.35Å; M59-F244 HydrophobicContact CE-CG 4.04Å
60	I	96	Very high	88.9	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	136.5	170.4	-60.2	-175.4	0	0	0	108.4	H48 E49 R58 V186 W190 T195 L196 V197	H48-I60 CarbonylContact C-O 3.53Å; H48-I60 WeakPolarHBondContact CA-O 3.06Å; H48-I60 VanDerWaalsContact CB-O 3.24Å; H48-I60 WeakPolarHBondContact CB-O 3.43Å; E49-I60 HydrophobicContact CB-CB 4.35Å; E49-I60 PolarHBondContact N-O 3.34Å; E49-I60 PolarHBondContact O-N 3.18Å; R58-I60 HydrophobicContact CG-CG1 4.15Å; I60-V186 HydrophobicContact CD1-CG1 4.07Å; I60-W190 HydrophobicContact CB-CD2 4.49Å; I60-W190 HydrophobicContact CD1-CB 4.1Å; I60-W190 HydrophobicContact CD1-CD2 4.37Å; I60-W190 HydrophobicContact CD1-CG 3.75Å; I60-W190 HydrophobicContact CG2-CB 4Å; I60-W190 HydrophobicContact CG2-CD2 3.74Å; I60-W190 HydrophobicContact CG2-CE3 3.73Å; I60-W190 HydrophobicContact CG2-CG 3.86Å; I60-T195 HydrophobicContact CG2-CG2 3.78Å; I60-L196 CarbonylContact C-O 3.58Å; I60-L196 WeakPolarHBondContact CA-O 3.3Å; I60-V197 HydrophobicContact CD1-CG1 4.48Å; I60-V197 HydrophobicContact CD1-CG2 4.3Å; I60-V197 HydrophobicContact CG1-CB 4.38Å; I60-V197 HydrophobicContact CG1-CG1 3.98Å; I60-V197 HydrophobicContact CG1-CG2 4.01Å; I60-V197 HydrophobicContact CG2-CG2 4.38Å
61	R	95.7	Very high	87.2	Confident	13 Å²	13	45.2 Å²	45.2	5%	0.049	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	130.9	175	-64.5	178.9	-68.9	163.9	-1.3	110.8	S47 H48 M59 Q64 T195 L196 E198 D240 N241	S47-R61 WeakPolarHBondContact O-CA 3.42Å; H48-R61 HydrophobicContact CB-CG 4.32Å; M59-R61 HydrophobicContact CE-CG 3.63Å; M59-R61 HydrophobicContact CG-CG 4.13Å; R61-Q64 HydrophobicContact CB-CG 3.66Å; R61-T195 WeakPolarHBondContact O-CA 3.07Å; R61-L196 PolarHBondContact N-O 3.24Å; R61-L196 PolarHBondContact O-N 2.99Å; R61-E198 IonicContact CZ-OE2 3.79Å; R61-E198 IonicContact NE-OE2 3.7Å; R61-E198 IonicContact NH2-OE1 2.71Å; R61-E198 IonicContact NH2-OE2 2.96Å; R61-E198 PolarHBondContact NH2-OE2 2.84Å; R61-D240 PolarHBondContact NH1-O 3.46Å; R61-N241 PolarHBondContact NE-OD1 3.13Å; R61-N241 VanDerWaalsContact NE-OD1 3.17Å; R61-N241 PolarHBondContact NH1-OD1 2.8Å; R61-N241 VanDerWaalsContact NH1-OD1 3.11Å; R61-N241 PolarHBondContact NH2-OD1 2.91Å
62	L	94.9	Very high	85.5	Confident	22 Å²	22	51.1 Å²	51.1	12%	0.115	30%	0.296	C	S	.	.	S	Bend	trans	-84.7	164	172.6	-59.2	-173.7	0	0	0	111.5	S47 Q64 W190 G194 T195	S47-L62 PolarHBondContact O-N 2.95Å; L62-Q64 PolarHBondContact O-N 2.89Å; L62-Q64 PolarHBondContact O-NE2 3.43Å; L62-W190 HydrophobicContact CD1-CE3 4.29Å; L62-W190 HydrophobicContact CD1-CZ3 4Å; L62-W190 HydrophobicContact CD2-CE3 3.81Å; L62-W190 HydrophobicContact CD2-CZ3 4.24Å; L62-W190 HydrophobicContact CG-CE3 4Å; L62-W190 HydrophobicContact CG-CZ3 3.91Å; L62-G194 CarbonylContact C-O 3.59Å; L62-T195 HydrophobicContact CD2-CG2 3.85Å; L62-T195 WeakPolarHBondContact CD2-OG1 3.4Å
63	N	93.6	Very high	84.2	Confident	140 Å²	140	57 Å²	57	75%	0.749	32%	0.322	S	S	*	.	S	Bend	trans	56.5	34.1	173.6	-52.9	-40.3	0	0	0	114	G194	N63-G194 PolarHBondContact N-O 3.16Å
64	Q	93.6	Very high	82.9	Confident	48 Å²	48	63.9 Å²	63.9	22%	0.224	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-87.3	149.3	176	-58	-54.2	-66.8	0	0	110.4	R61 L62 Y153 G194 L196	R61-Q64 HydrophobicContact CB-CG 3.66Å; L62-Q64 PolarHBondContact O-N 2.89Å; L62-Q64 PolarHBondContact O-NE2 3.43Å; Q64-Y153 PolarHBondContact O-OH 2.79Å; Q64-G194 PolarHBondContact N-O 3.31Å; Q64-L196 HydrophobicContact CB-CB 3.91Å; Q64-L196 HydrophobicContact CB-CD2 4.47Å; Q64-L196 HydrophobicContact CG-CB 3.81Å; Q64-L196 HydrophobicContact CG-CD2 4.41Å
65	T	91	Very high	81.8	Confident	122 Å²	122	67.1 Å²	67.1	75%	0.748	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-73.2	152.5	167.8	51.1	0	0	0	0	110.2
66	S	84.5	Confident	80.6	Confident	39 Å²	39	66.4 Å²	66.4	27%	0.273	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-54.8	129.5	174.1	-180	0	0	0	0	110.9	I68 Y153	S66-I68 PolarHBondContact O-N 3.05Å; S66-I68 PolarHBondContact OG-N 3.38Å; S66-Y153 VanDerWaalsContact CA-CZ 3.49Å; S66-Y153 PolarHBondContact N-OH 2.9Å
67	P	81.1	Confident	79.4	Confident	50 Å²	50	73.2 Å²	73.2	33%	0.325	40%	0.4	S	S	.	.	S	Bend	trans	-71.7	-13.2	175.8	28.9	-34.8	0	0	0	112.7	V69 L143 Y153 L196	P67-V69 PolarHBondContact O-N 3.43Å; P67-L143 HydrophobicContact CB-CD1 3.78Å; P67-L143 HydrophobicContact CG-CD1 3.49Å; P67-L143 VanDerWaalsContact CG-CD1 3.49Å; P67-Y153 HydrophobicContact CG-CG 4.31Å; P67-L196 HydrophobicContact CG-CD1 4.21Å
68	I	72.9	Confident	78.4	Confident	40 Å²	40	74.4 Å²	74.4	21%	0.205	41%	0.412	C	S	.	.			trans	-79.8	109.2	177.5	-56.7	152.4	0	0	0	108.6	S66 F73 T141	S66-I68 PolarHBondContact O-N 3.05Å; S66-I68 PolarHBondContact OG-N 3.38Å; I68-F73 HydrophobicContact CD1-CE1 4.45Å; I68-F73 HydrophobicContact CD1-CE2 4.29Å; I68-F73 HydrophobicContact CD1-CZ 3.55Å; I68-F73 HydrophobicContact CG1-CZ 4.2Å; I68-F73 HydrophobicContact CG2-CE2 4.48Å; I68-F73 HydrophobicContact CG2-CZ 4.19Å; I68-T141 HydrophobicContact CD1-CG2 3.43Å; I68-T141 VanDerWaalsContact CD1-CG2 3.43Å; I68-T141 WeakPolarHBondContact CD1-OG1 3.21Å; I68-T141 HydrophobicContact CG1-CG2 3.89Å
69	V	63	Low	77.7	Confident	125 Å²	125	78.9 Å²	78.9	76%	0.758	44%	0.437	S	S	*	.	S	Bend	trans	-90.3	-36.1	177.5	-174.7	0	0	0	0	111.6	P67	P67-V69 PolarHBondContact O-N 3.43Å
70	N	63.8	Low	77.2	Confident	159 Å²	159	82.3 Å²	82.3	85%	0.85	45%	0.453	S	S	*	.	S	Bend	trans	-159.4	127.4	177.5	-78	-46.9	0	0	0	109.8
71	G	59.7	Low	76.8	Confident	56 Å²	56	84.9 Å²	84.9	58%	0.577	48%	0.479	S	S	*	.			trans	-173.7	148.6	175.1	0	0	0	0	0	112.5
72	T	61.4	Low	76.5	Confident	142 Å²	142	89.4 Å²	89.4	87%	0.871	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-99.9	125.1	167.4	45.3	0	0	0	0	108.4
73	F	66	Low	76.3	Confident	134 Å²	134	94.4 Å²	94.4	59%	0.588	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-90.6	130.1	172	-61.1	-82.9	0	0	0	108.6	I68	I68-F73 HydrophobicContact CD1-CE1 4.45Å; I68-F73 HydrophobicContact CD1-CE2 4.29Å; I68-F73 HydrophobicContact CD1-CZ 3.55Å; I68-F73 HydrophobicContact CG1-CZ 4.2Å; I68-F73 HydrophobicContact CG2-CE2 4.48Å; I68-F73 HydrophobicContact CG2-CZ 4.19Å
74	E	64.9	Low	76	Confident	165 Å²	165	88.7 Å²	88.7	77%	0.771	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-87	137.3	167.6	-65.9	-172.5	176.7	0	0	109
75	Q	66.9	Low	75.7	Confident	98 Å²	98	95.8 Å²	95.8	46%	0.458	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-76.6	125.1	172.4	-173.6	174.4	7.8	0	0	108.4	F77 H130	Q75-F77 HydrophobicContact CB-CE2 4.38Å; Q75-F77 HydrophobicContact CG-CE2 4.22Å; Q75-F77 HydrophobicContact CG-CZ 4.09Å; Q75-H130 WeakPolarHBondContact CG-NE2 3.42Å; Q75-H130 PolarHBondContact NE2-CD2 2.94Å; Q75-H130 PolarHBondContact NE2-NE2 3.17Å
76	L	63.9	Low	75.6	Confident	32 Å²	32	93.7 Å²	93.7	17%	0.168	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-83.6	133	175.9	-58.9	178.3	0	0	0	109.6	Q80 M100	L76-Q80 HydrophobicContact CD2-CB 4.08Å; L76-Q80 VanDerWaalsContact CD2-CD 3.4Å; L76-Q80 HydrophobicContact CD2-CG 3.98Å; L76-M100 HydrophobicContact CD1-CB 3.9Å; L76-M100 HydrophobicContact CD1-CE 3.84Å; L76-M100 HydrophobicContact CD1-CG 3.46Å; L76-M100 VanDerWaalsContact CD1-CG 3.46Å; L76-M100 HydrophobicContact CD1-SD 3.44Å; L76-M100 WeakPolarHBondContact CD1-SD 3.38Å
77	F	68.5	Low	75.8	Confident	143 Å²	143	97.7 Å²	97.7	63%	0.627	53%	0.531	S	S	*	.			trans	-113.5	110.7	168.1	-64.3	-81.4	0	0	0	107.8	Q75	Q75-F77 HydrophobicContact CB-CE2 4.38Å; Q75-F77 HydrophobicContact CG-CE2 4.22Å; Q75-F77 HydrophobicContact CG-CZ 4.09Å
78	G	74.4	Confident	76.2	Confident	26 Å²	26	95.7 Å²	95.7	27%	0.268	52%	0.517	S	S	.	.	S	Bend	trans	66.1	-165.1	-173.3	0	0	0	0	0	114.2	Q80 D102	G78-Q80 PolarHBondContact O-N 2.03Å; G78-D102 PolarHBondContact N-OD2 3.28Å
79	D	80.9	Confident	77.1	Confident	99 Å²	99	97.9 Å²	97.9	53%	0.529	53%	0.527	S	S	.	.			trans	-72.6	123.8	-179	-71.8	17.1	0	0	0	111.1	M100 T101 R107	D79-M100 WeakPolarHBondContact CA-O 3.25Å; D79-T101 WeakPolarHBondContact OD1-CB 3.4Å; D79-T101 VanDerWaalsContact OD1-CG2 3.32Å; D79-T101 WeakPolarHBondContact OD1-CG2 2.98Å; D79-R107 IonicContact OD2-NH1 3.69Å; D79-R107 PolarHBondContact OD2-NH1 2.86Å
80	Q	84.6	Confident	78.4	Confident	76 Å²	76	92 Å²	92	36%	0.355	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	136.5	174.2	-64.5	-162.2	-3.8	0	0	111.2	L76 G78 E99 M100	L76-Q80 HydrophobicContact CD2-CB 4.08Å; L76-Q80 VanDerWaalsContact CD2-CD 3.4Å; L76-Q80 HydrophobicContact CD2-CG 3.98Å; G78-Q80 PolarHBondContact O-N 2.03Å; Q80-E99 CarbonylContact O-C 3.6Å; Q80-E99 VanDerWaalsContact O-CA 3.31Å; Q80-E99 WeakPolarHBondContact O-CA 3.39Å; Q80-M100 PolarHBondContact N-O 2.94Å; Q80-M100 PolarHBondContact O-N 3.27Å
81	G	88.5	Confident	79.7	Confident	53 Å²	53	85 Å²	85	55%	0.546	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	141.4	178.4	0	0	0	0	0	112.5	V98	G81-V98 CarbonylContact C-O 3.6Å; G81-V98 WeakPolarHBondContact CA-O 3.29Å
82	W	88.4	Confident	81.1	Confident	108 Å²	108	84.2 Å²	84.2	41%	0.409	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	162.2	174.4	67.8	97.2	0	0	0	111.9	V98 M100	W82-V98 HydrophobicContact CD2-CB 4.09Å; W82-V98 HydrophobicContact CD2-CG1 4.43Å; W82-V98 HydrophobicContact CH2-CB 4.32Å; W82-V98 HydrophobicContact CH2-CG1 3.62Å; W82-V98 HydrophobicContact CZ2-CB 3.8Å; W82-V98 HydrophobicContact CZ2-CG1 3.36Å; W82-V98 HydrophobicContact CZ3-CG1 4.25Å; W82-V98 PolarHBondContact N-O 3.38Å; W82-V98 PolarHBondContact O-N 2.87Å; W82-M100 HydrophobicContact CH2-CB 3.77Å; W82-M100 HydrophobicContact CH2-SD 4.07Å; W82-M100 HydrophobicContact CZ3-CB 3.55Å; W82-M100 HydrophobicContact CZ3-SD 4.47Å
83	I	91.1	Very high	82.5	Confident	128 Å²	128	79 Å²	79	66%	0.656	42%	0.416	S	S	*	.			trans	-100	128.2	173	-61.5	174.1	0	0	0	106.9	E85	I83-E85 PolarHBondContact O-N 2.8Å
84	P	87.6	Confident	83.8	Confident	19 Å²	19	77.6 Å²	77.6	12%	0.123	42%	0.415	C	S	.	.			trans	-56.5	132.2	174.7	-25	34.4	0	0	0	111.9	F86 L88 V95 V98	P84-F86 PolarHBondContact O-N 2.79Å; P84-L88 HydrophobicContact CB-CB 4.12Å; P84-L88 HydrophobicContact CB-CD2 4.38Å; P84-L88 HydrophobicContact CG-CB 4.28Å; P84-L88 HydrophobicContact CG-CD2 3.98Å; P84-V95 HydrophobicContact CG-CB 4.42Å; P84-V95 HydrophobicContact CG-CG1 3.95Å; P84-V98 HydrophobicContact CG-CG2 3.96Å
85	E	87.3	Confident	85.2	Confident	198 Å²	198	70.4 Å²	70.4	93%	0.925	38%	0.382	S	S	*	.	S	Bend	trans	-78.4	-2.2	178.5	-61.3	-173.1	162.6	0	0	113.3	I83	I83-E85 PolarHBondContact O-N 2.8Å
86	F	87.5	Confident	86.5	Confident	77 Å²	77	69.2 Å²	69.2	34%	0.338	38%	0.381	S	S	.	.	S	Bend	trans	-135.1	157.5	178.2	51.8	-96.4	0	0	0	110.1	P84 L88 I144	P84-F86 PolarHBondContact O-N 2.79Å; F86-L88 HydrophobicContact CD2-CB 4.23Å; F86-L88 HydrophobicContact CE2-CB 4.04Å; F86-L88 HydrophobicContact CE2-CD1 4.25Å; F86-L88 PolarHBondContact O-N 2.91Å; F86-I144 HydrophobicContact CZ-CG2 4.42Å
87	P	89.2	Confident	88	Confident	123 Å²	123	72.7 Å²	72.7	80%	0.799	39%	0.392	S	S	*	.			trans	-58.4	113.3	172.6	-21.8	33.4	0	0	0	110.4
88	L	89.7	Confident	89.1	Confident	8 Å²	8	65.9 Å²	65.9	4%	0.042	36%	0.362	C	S	.	.			trans	-117	133.5	178.3	175.5	61.6	0	0	0	109.1	P84 F86 V95 I144	P84-L88 HydrophobicContact CB-CB 4.12Å; P84-L88 HydrophobicContact CB-CD2 4.38Å; P84-L88 HydrophobicContact CG-CB 4.28Å; P84-L88 HydrophobicContact CG-CD2 3.98Å; F86-L88 HydrophobicContact CD2-CB 4.23Å; F86-L88 HydrophobicContact CE2-CB 4.04Å; F86-L88 HydrophobicContact CE2-CD1 4.25Å; F86-L88 PolarHBondContact O-N 2.91Å; L88-V95 HydrophobicContact CB-CB 4.14Å; L88-V95 HydrophobicContact CB-CG2 4.4Å; L88-V95 HydrophobicContact CD2-CB 3.97Å; L88-V95 HydrophobicContact CD2-CG1 4.09Å; L88-V95 HydrophobicContact CD2-CG2 3.96Å; L88-V95 HydrophobicContact CG-CB 3.96Å; L88-V95 HydrophobicContact CG-CG2 3.76Å; L88-V95 PolarHBondContact O-N 3.11Å; L88-I144 HydrophobicContact CD1-CG2 3.5Å; L88-I144 VanDerWaalsContact CD1-CG2 3.5Å; L88-I144 HydrophobicContact CD2-CG2 3.82Å; L88-I144 HydrophobicContact CG-CG2 4.32Å
89	Q	91.2	Very high	89.9	Confident	87 Å²	87	66.4 Å²	66.4	41%	0.407	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	141.8	171.2	-71.2	-176.6	-12.8	0	0	110.3	Y55 A93 N94	Y55-Q89 PolarHBondContact OH-OE1 2.86Å; Q89-A93 CarbonylContact C-O 3.56Å; Q89-A93 VanDerWaalsContact CA-O 3.27Å; Q89-A93 WeakPolarHBondContact CA-O 3.17Å; Q89-N94 WeakPolarHBondContact CG-OD1 3.38Å; Q89-N94 PolarHBondContact NE2-OD1 2.92Å
90	F	91.6	Very high	90.1	Very high	2 Å²	2	63 Å²	63	1%	0.009	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	114.1	175.1	-170.7	-96.1	0	0	0	108.5	G92 A93 V95 M108 I114 I117 I150 F168 V169	F90-G92 PolarHBondContact O-N 3.48Å; F90-G92 VanDerWaalsContact O-N 3.17Å; F90-A93 PolarHBondContact N-O 3.47Å; F90-A93 PolarHBondContact O-N 2.78Å; F90-A93 VanDerWaalsContact O-N 3.1Å; F90-V95 HydrophobicContact CB-CG2 3.61Å; F90-M108 HydrophobicContact CB-CG 4.5Å; F90-M108 HydrophobicContact CD1-CB 4.11Å; F90-M108 HydrophobicContact CD1-CG 4.12Å; F90-M108 HydrophobicContact CD2-CE 4.47Å; F90-M108 HydrophobicContact CD2-CG 3.93Å; F90-M108 HydrophobicContact CE1-CG 4.33Å; F90-M108 HydrophobicContact CE2-CG 4.12Å; F90-M108 HydrophobicContact CG-CB 4.2Å; F90-M108 HydrophobicContact CG-CG 3.92Å; F90-M108 HydrophobicContact CZ-CG 4.33Å; F90-I114 HydrophobicContact CB-CD1 4.04Å; F90-I114 HydrophobicContact CD1-CD1 4.45Å; F90-I114 HydrophobicContact CD1-CG1 4.48Å; F90-I117 HydrophobicContact CE2-CD1 4.4Å; F90-I117 HydrophobicContact CE2-CG1 4.25Å; F90-I150 HydrophobicContact CD2-CD1 3.94Å; F90-I150 HydrophobicContact CE2-CD1 3.99Å; F90-F168 HydrophobicContact CD2-CZ 4.12Å; F90-F168 HydrophobicContact CE2-CD2 4.41Å; F90-F168 AromaticContact CE2-CE1 3.98Å; F90-F168 HydrophobicContact CE2-CE1 3.98Å; F90-F168 AromaticContact CE2-CE2 3.53Å; F90-F168 HydrophobicContact CE2-CE2 3.53Å; F90-F168 AromaticContact CE2-CZ 3.25Å; F90-F168 HydrophobicContact CE2-CZ 3.25Å; F90-F168 HydrophobicContact CZ-CD1 4.48Å; F90-F168 AromaticContact CZ-CE1 3.92Å; F90-F168 HydrophobicContact CZ-CE1 3.92Å; F90-F168 HydrophobicContact CZ-CE2 4.04Å; F90-F168 AromaticContact CZ-CZ 3.67Å; F90-F168 HydrophobicContact CZ-CZ 3.67Å; F90-V169 WeakPolarHBondContact CE1-O 3.34Å
91	Y	90.7	Very high	90.1	Very high	12 Å²	12	59.6 Å²	59.6	5%	0.047	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	34.7	-171.3	-74.6	-78.6	0	0	0	114	Y54 Y55 Y56 A93 F168 G170 F172 V182	Y54-Y91 HydrophobicContact CD1-CD1 4.19Å; Y54-Y91 HydrophobicContact CD1-CE1 4.47Å; Y55-Y91 HydrophobicContact CD1-CD1 4.33Å; Y55-Y91 HydrophobicContact CG-CD1 4.21Å; Y56-Y91 AromaticContact CD2-CD1 3.93Å; Y56-Y91 HydrophobicContact CD2-CD1 3.93Å; Y56-Y91 AromaticContact CD2-CE1 3.67Å; Y56-Y91 HydrophobicContact CD2-CE1 3.67Å; Y56-Y91 HydrophobicContact CD2-CE2 4.32Å; Y56-Y91 HydrophobicContact CD2-CG 4.37Å; Y56-Y91 AromaticContact CD2-CZ 3.91Å; Y56-Y91 AromaticContact CE2-CD1 3.88Å; Y56-Y91 HydrophobicContact CE2-CD1 3.88Å; Y56-Y91 AromaticContact CE2-CD2 3.9Å; Y56-Y91 HydrophobicContact CE2-CD2 3.9Å; Y56-Y91 AromaticContact CE2-CE1 3.98Å; Y56-Y91 HydrophobicContact CE2-CE1 3.98Å; Y56-Y91 HydrophobicContact CE2-CE2 4Å; Y56-Y91 AromaticContact CE2-CG 3.86Å; Y56-Y91 HydrophobicContact CE2-CG 3.86Å; Y56-Y91 PolarHBondContact OH-N 2.97Å; Y91-A93 VanDerWaalsContact C-N 3.27Å; Y91-A93 PolarHBondContact O-N 2.88Å; Y91-F168 HydrophobicContact CD2-CE1 4.24Å; Y91-F168 AromaticContact CE2-CD1 3.83Å; Y91-F168 HydrophobicContact CE2-CD1 3.83Å; Y91-F168 AromaticContact CE2-CE1 3.34Å; Y91-F168 HydrophobicContact CE2-CE1 3.34Å; Y91-F168 HydrophobicContact CE2-CZ 4.3Å; Y91-F168 AromaticContact CZ-CD1 3.88Å; Y91-F168 AromaticContact CZ-CE1 3.56Å; Y91-F168 WeakPolarHBondContact OH-CD1 3.4Å; Y91-G170 VanDerWaalsContact CD2-CA 3.44Å; Y91-G170 VanDerWaalsContact CE2-N 3.28Å; Y91-F172 HydrophobicContact CD1-CE2 4.45Å; Y91-F172 AromaticContact CD1-CZ 3.62Å; Y91-F172 HydrophobicContact CD1-CZ 3.62Å; Y91-F172 HydrophobicContact CD2-CZ 4.49Å; Y91-F172 HydrophobicContact CE1-CZ 4.36Å; Y91-F172 HydrophobicContact CG-CE1 4.39Å; Y91-F172 AromaticContact CG-CZ 3.68Å; Y91-F172 HydrophobicContact CG-CZ 3.68Å; Y91-V182 HydrophobicContact CE1-CB 4.11Å; Y91-V182 HydrophobicContact CE1-CG1 4.06Å; Y91-V182 PolarHBondContact OH-O 2.83Å
92	G	89.2	Confident	89.4	Confident	38 Å²	38	59.9 Å²	59.9	39%	0.392	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	88	-14.1	177.3	0	0	0	0	0	114.1	Y55 F90	Y55-G92 VanDerWaalsContact CZ-CA 3.4Å; Y55-G92 VanDerWaalsContact OH-CA 3.25Å; Y55-G92 WeakPolarHBondContact OH-CA 3.09Å; Y55-G92 PolarHBondContact OH-N 3.5Å; Y55-G92 VanDerWaalsContact OH-N 3.16Å; F90-G92 PolarHBondContact O-N 3.48Å; F90-G92 VanDerWaalsContact O-N 3.17Å
93	A	91	Very high	88.8	Confident	34 Å²	34	58.8 Å²	58.8	28%	0.281	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	135.4	174.6	0	0	0	0	0	110.8	Q89 F90 Y91 V95 I114	Q89-A93 CarbonylContact C-O 3.56Å; Q89-A93 VanDerWaalsContact CA-O 3.27Å; Q89-A93 WeakPolarHBondContact CA-O 3.17Å; F90-A93 PolarHBondContact N-O 3.47Å; F90-A93 PolarHBondContact O-N 2.78Å; F90-A93 VanDerWaalsContact O-N 3.1Å; Y91-A93 VanDerWaalsContact C-N 3.27Å; Y91-A93 PolarHBondContact O-N 2.88Å; A93-V95 PolarHBondContact O-N 3.17Å; A93-I114 HydrophobicContact CB-CD1 3.81Å; A93-I114 HydrophobicContact CB-CG2 4.2Å
94	N	93.5	Very high	88.1	Confident	104 Å²	104	52.7 Å²	52.7	56%	0.556	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.1	127.3	173	-67.7	-26	0	0	0	110.1	Q89 G110	Q89-N94 WeakPolarHBondContact CG-OD1 3.38Å; Q89-N94 PolarHBondContact NE2-OD1 2.92Å; N94-G110 VanDerWaalsContact O-CA 3.24Å; N94-G110 WeakPolarHBondContact O-CA 3.31Å
95	V	93	Very high	88	Confident	13 Å²	13	53.2 Å²	53.2	8%	0.079	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-83.1	123.3	175.7	-176.5	0	0	0	0	109	P84 L88 F90 A93 V98 M108 Y109 I114	P84-V95 HydrophobicContact CG-CB 4.42Å; P84-V95 HydrophobicContact CG-CG1 3.95Å; L88-V95 HydrophobicContact CB-CB 4.14Å; L88-V95 HydrophobicContact CB-CG2 4.4Å; L88-V95 HydrophobicContact CD2-CB 3.97Å; L88-V95 HydrophobicContact CD2-CG1 4.09Å; L88-V95 HydrophobicContact CD2-CG2 3.96Å; L88-V95 HydrophobicContact CG-CB 3.96Å; L88-V95 HydrophobicContact CG-CG2 3.76Å; L88-V95 PolarHBondContact O-N 3.11Å; F90-V95 HydrophobicContact CB-CG2 3.61Å; A93-V95 PolarHBondContact O-N 3.17Å; V95-V98 HydrophobicContact CG1-CG2 3.68Å; V95-M108 HydrophobicContact CG1-SD 4.37Å; V95-Y109 CarbonylContact C-O 3.49Å; V95-Y109 WeakPolarHBondContact CA-O 3.28Å; V95-I114 HydrophobicContact CG2-CD1 4.15Å
96	T	95.7	Very high	88.1	Confident	73 Å²	73	44.2 Å²	44.2	45%	0.448	24%	0.24	S	C	.	.			trans	-105.1	-24.9	177.7	61.4	0	0	0	0	111.9	Y109 G110	T96-Y109 PolarHBondContact N-O 2.74Å; T96-Y109 PolarHBondContact OG1-O 3.37Å; T96-G110 PolarHBondContact OG1-O 3.21Å
97	R	95	Very high	88.4	Confident	105 Å²	105	43.6 Å²	43.6	40%	0.396	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	141.4	177.9	-175.3	174.4	80	-131.8	8.8	110.3	E99 Y109	R97-E99 HydrophobicContact CG-CG 4.38Å; R97-E99 IonicContact CZ-OE1 3.14Å; R97-E99 IonicContact NE-OE1 2.73Å; R97-E99 PolarHBondContact NE-OE1 3.19Å; R97-E99 IonicContact NH2-OE1 2.78Å; R97-E99 PolarHBondContact NH2-OE1 3.22Å; R97-Y109 PolarHBondContact N-O 3.43Å; R97-Y109 WeakPolarHBondContact O-CB 3.26Å; R97-Y109 PolarHBondContact O-N 3.4Å
98	V	91	Very high	88.6	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	137	169.8	-175.3	0	0	0	0	107.2	G81 W82 P84 V95 I106 R107 M108	G81-V98 CarbonylContact C-O 3.6Å; G81-V98 WeakPolarHBondContact CA-O 3.29Å; W82-V98 HydrophobicContact CD2-CB 4.09Å; W82-V98 HydrophobicContact CD2-CG1 4.43Å; W82-V98 HydrophobicContact CH2-CB 4.32Å; W82-V98 HydrophobicContact CH2-CG1 3.62Å; W82-V98 HydrophobicContact CZ2-CB 3.8Å; W82-V98 HydrophobicContact CZ2-CG1 3.36Å; W82-V98 HydrophobicContact CZ3-CG1 4.25Å; W82-V98 PolarHBondContact N-O 3.38Å; W82-V98 PolarHBondContact O-N 2.87Å; P84-V98 HydrophobicContact CG-CG2 3.96Å; V95-V98 HydrophobicContact CG1-CG2 3.68Å; V98-I106 HydrophobicContact CG1-CG2 3.49Å; V98-I106 VanDerWaalsContact CG1-CG2 3.49Å; V98-R107 WeakPolarHBondContact CA-O 3.49Å; V98-M108 HydrophobicContact CB-SD 4.45Å; V98-M108 HydrophobicContact CG1-CE 4.38Å; V98-M108 HydrophobicContact CG1-SD 4.01Å; V98-M108 HydrophobicContact CG2-SD 3.78Å
99	E	91.8	Very high	88.9	Confident	38 Å²	38	39.2 Å²	39.2	18%	0.178	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	138.7	171.9	-65.3	171.8	-169.4	0	0	109.2	Q80 R97 I106 R107 Y109	Q80-E99 CarbonylContact O-C 3.6Å; Q80-E99 VanDerWaalsContact O-CA 3.31Å; Q80-E99 WeakPolarHBondContact O-CA 3.39Å; R97-E99 HydrophobicContact CG-CG 4.38Å; R97-E99 IonicContact CZ-OE1 3.14Å; R97-E99 IonicContact NE-OE1 2.73Å; R97-E99 PolarHBondContact NE-OE1 3.19Å; R97-E99 IonicContact NH2-OE1 2.78Å; R97-E99 PolarHBondContact NH2-OE1 3.22Å; E99-I106 CarbonylContact O-C 3.56Å; E99-I106 VanDerWaalsContact O-CA 3.32Å; E99-I106 WeakPolarHBondContact O-CA 3.45Å; E99-R107 HydrophobicContact CB-CB 4.33Å; E99-R107 PolarHBondContact N-O 3.28Å; E99-R107 PolarHBondContact O-N 3.06Å; E99-Y109 HydrophobicContact CB-CE2 4.04Å; E99-Y109 HydrophobicContact CG-CD2 4.25Å; E99-Y109 HydrophobicContact CG-CE2 3.76Å; E99-Y109 WeakPolarHBondContact OE2-CE2 3.48Å; E99-Y109 PolarHBondContact OE2-OH 2.67Å
100	M	85.4	Confident	89	Confident	26 Å²	26	35.6 Å²	35.6	13%	0.128	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	131.9	178.7	-173	165.8	176.3	0	0	109.5	L76 D79 Q80 W82 L105 I106 I131	L76-M100 HydrophobicContact CD1-CB 3.9Å; L76-M100 HydrophobicContact CD1-CE 3.84Å; L76-M100 HydrophobicContact CD1-CG 3.46Å; L76-M100 VanDerWaalsContact CD1-CG 3.46Å; L76-M100 HydrophobicContact CD1-SD 3.44Å; L76-M100 WeakPolarHBondContact CD1-SD 3.38Å; D79-M100 WeakPolarHBondContact CA-O 3.25Å; Q80-M100 PolarHBondContact N-O 2.94Å; Q80-M100 PolarHBondContact O-N 3.27Å; W82-M100 HydrophobicContact CH2-CB 3.77Å; W82-M100 HydrophobicContact CH2-SD 4.07Å; W82-M100 HydrophobicContact CZ3-CB 3.55Å; W82-M100 HydrophobicContact CZ3-SD 4.47Å; M100-L105 CarbonylContact C-O 3.58Å; M100-L105 VanDerWaalsContact CA-O 3.31Å; M100-L105 WeakPolarHBondContact CA-O 3.25Å; M100-I106 HydrophobicContact CE-CG1 4.44Å; M100-I106 HydrophobicContact CG-CG1 4Å; M100-I106 HydrophobicContact SD-CD1 4.4Å; M100-I106 HydrophobicContact SD-CG1 4.1Å; M100-I131 HydrophobicContact CE-CD1 3.12Å; M100-I131 HydrophobicContact CE-CG1 4.36Å; M100-I131 HydrophobicContact CE-CG2 4.46Å
101	T	83.6	Confident	88.8	Confident	5 Å²	5	45.4 Å²	45.4	3%	0.031	23%	0.234	C	C	.	.			trans	-91.4	158.8	174.8	75.3	0	0	0	0	110.1	D79 E103 G104 L105	D79-T101 WeakPolarHBondContact OD1-CB 3.4Å; D79-T101 VanDerWaalsContact OD1-CG2 3.32Å; D79-T101 WeakPolarHBondContact OD1-CG2 2.98Å; T101-E103 PolarHBondContact O-N 2.84Å; T101-E103 VanDerWaalsContact O-N 3.16Å; T101-E103 WeakPolarHBondContact OG1-CB 2.97Å; T101-E103 PolarHBondContact OG1-N 2.79Å; T101-E103 VanDerWaalsContact OG1-N 3.17Å; T101-G104 PolarHBondContact O-N 2.03Å; T101-L105 HydrophobicContact CG2-CB 4.03Å; T101-L105 HydrophobicContact CG2-CD2 4.35Å; T101-L105 PolarHBondContact N-O 2.95Å; T101-L105 WeakPolarHBondContact OG1-CB 3.13Å; T101-L105 PolarHBondContact OG1-N 3.32Å
102	D	74.3	Confident	88.8	Confident	59 Å²	59	46.7 Å²	46.7	32%	0.316	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	2.6	168.5	60.9	-5.5	0	0	0	113.2	G78 C129	G78-D102 PolarHBondContact N-OD2 3.28Å; D102-C129 CarbonylContact O-C 3.59Å
103	E	75.3	Confident	89	Confident	86 Å²	86	49.5 Å²	49.5	40%	0.402	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-4.7	172.1	-52.2	-174.6	170.2	0	0	113.1	T101 P126 C129	T101-E103 PolarHBondContact O-N 2.84Å; T101-E103 VanDerWaalsContact O-N 3.16Å; T101-E103 WeakPolarHBondContact OG1-CB 2.97Å; T101-E103 PolarHBondContact OG1-N 2.79Å; T101-E103 VanDerWaalsContact OG1-N 3.17Å; E103-P126 HydrophobicContact CB-CB 3.97Å; E103-P126 HydrophobicContact CB-CG 4.5Å; E103-P126 HydrophobicContact CG-CB 3.74Å; E103-P126 HydrophobicContact CG-CG 4.14Å; E103-P126 WeakPolarHBondContact OE1-CG 3.36Å; E103-P126 VanDerWaalsContact OE2-CG 3.26Å; E103-P126 WeakPolarHBondContact OE2-CG 3.34Å; E103-C129 HydrophobicContact CB-CB 4.49Å; E103-C129 WeakPolarHBondContact O-CB 3.37Å
104	G	76.6	Confident	89.1	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.243	C	C	.	.	S	Bend	trans	86	16.7	-177.8	0	0	0	0	0	115.2	T101 H119	T101-G104 PolarHBondContact O-N 2.03Å; G104-H119 PolarHBondContact O-CD2 3.48Å; G104-H119 PolarHBondContact O-N 3.31Å
105	L	85.8	Confident	89.1	Confident	30 Å²	30	44 Å²	44	16%	0.157	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	126.2	170.6	-175	73.7	0	0	0	109.8	M100 T101 R107 T116 N118	M100-L105 CarbonylContact C-O 3.58Å; M100-L105 VanDerWaalsContact CA-O 3.31Å; M100-L105 WeakPolarHBondContact CA-O 3.25Å; T101-L105 HydrophobicContact CG2-CB 4.03Å; T101-L105 HydrophobicContact CG2-CD2 4.35Å; T101-L105 PolarHBondContact N-O 2.95Å; T101-L105 WeakPolarHBondContact OG1-CB 3.13Å; T101-L105 PolarHBondContact OG1-N 3.32Å; L105-R107 HydrophobicContact CD2-CG 4.12Å; L105-R107 HydrophobicContact CG-CG 4.23Å; L105-T116 HydrophobicContact CD1-CG2 4.43Å; L105-T116 WeakPolarHBondContact CD1-OG1 3.29Å; L105-N118 HydrophobicContact CD1-CB 3.58Å
106	I	89.8	Confident	89.2	Confident	8 Å²	8	43.9 Å²	43.9	4%	0.041	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	109	176.3	-52.2	170.1	0	0	0	108.7	V98 E99 M100 M108 T116 I117 T142	V98-I106 HydrophobicContact CG1-CG2 3.49Å; V98-I106 VanDerWaalsContact CG1-CG2 3.49Å; E99-I106 CarbonylContact O-C 3.56Å; E99-I106 VanDerWaalsContact O-CA 3.32Å; E99-I106 WeakPolarHBondContact O-CA 3.45Å; M100-I106 HydrophobicContact CE-CG1 4.44Å; M100-I106 HydrophobicContact CG-CG1 4Å; M100-I106 HydrophobicContact SD-CD1 4.4Å; M100-I106 HydrophobicContact SD-CG1 4.1Å; I106-M108 HydrophobicContact CG2-CE 3.73Å; I106-T116 CarbonylContact O-C 3.19Å; I106-T116 WeakPolarHBondContact O-CA 3.41Å; I106-T116 PolarHBondContact O-OG1 3.39Å; I106-T116 VanDerWaalsContact O-OG1 3.09Å; I106-I117 HydrophobicContact CB-CB 4.18Å; I106-I117 PolarHBondContact N-O 3.28Å; I106-I117 PolarHBondContact O-N 3.16Å; I106-T142 HydrophobicContact CD1-CG2 4.03Å
107	R	93.3	Very high	88.9	Confident	64 Å²	64	40.4 Å²	40.4	24%	0.242	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	131.9	179.1	-59.1	-178	-174.7	114.5	2.2	110.6	D79 V98 E99 L105 Y109 Y113	D79-R107 IonicContact OD2-NH1 3.69Å; D79-R107 PolarHBondContact OD2-NH1 2.86Å; V98-R107 WeakPolarHBondContact CA-O 3.49Å; E99-R107 HydrophobicContact CB-CB 4.33Å; E99-R107 PolarHBondContact N-O 3.28Å; E99-R107 PolarHBondContact O-N 3.06Å; L105-R107 HydrophobicContact CD2-CG 4.12Å; L105-R107 HydrophobicContact CG-CG 4.23Å; R107-Y109 HydrophobicContact CB-CD2 4.37Å; R107-Y109 HydrophobicContact CB-CE2 3.52Å; R107-Y109 VanDerWaalsContact CD-OH 3.28Å; R107-Y109 WeakPolarHBondContact CD-OH 3.31Å; R107-Y113 HydrophobicContact CB-CD2 4.4Å; R107-Y113 HydrophobicContact CB-CE2 3.94Å; R107-Y113 HydrophobicContact CG-CE2 4.08Å
108	M	94	Very high	88.5	Confident	1 Å²	1	37 Å²	37	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	130	177.4	-58.9	-63.5	177.4	0	0	109.7	F90 V95 V98 I106 I114 G115 I117 I144	F90-M108 HydrophobicContact CB-CG 4.5Å; F90-M108 HydrophobicContact CD1-CB 4.11Å; F90-M108 HydrophobicContact CD1-CG 4.12Å; F90-M108 HydrophobicContact CD2-CE 4.47Å; F90-M108 HydrophobicContact CD2-CG 3.93Å; F90-M108 HydrophobicContact CE1-CG 4.33Å; F90-M108 HydrophobicContact CE2-CG 4.12Å; F90-M108 HydrophobicContact CG-CB 4.2Å; F90-M108 HydrophobicContact CG-CG 3.92Å; F90-M108 HydrophobicContact CZ-CG 4.33Å; V95-M108 HydrophobicContact CG1-SD 4.37Å; V98-M108 HydrophobicContact CB-SD 4.45Å; V98-M108 HydrophobicContact CG1-CE 4.38Å; V98-M108 HydrophobicContact CG1-SD 4.01Å; V98-M108 HydrophobicContact CG2-SD 3.78Å; I106-M108 HydrophobicContact CG2-CE 3.73Å; M108-I114 HydrophobicContact CB-CD1 4.22Å; M108-I114 HydrophobicContact CB-CG1 3.84Å; M108-I114 WeakPolarHBondContact O-CG1 3.12Å; M108-I114 PolarHBondContact O-N 2.99Å; M108-G115 PolarHBondContact N-O 2.71Å; M108-G115 PolarHBondContact O-N 3.27Å; M108-I117 HydrophobicContact CE-CD1 3.71Å; M108-I117 HydrophobicContact CE-CG1 4.36Å; M108-I144 HydrophobicContact CE-CD1 3.7Å
109	Y	95.1	Very high	88	Confident	39 Å²	39	37.3 Å²	37.3	15%	0.153	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.8	177.4	-62.4	-92.7	0	0	0	111	V95 T96 R97 E99 R107 G112 Y113	V95-Y109 CarbonylContact C-O 3.49Å; V95-Y109 WeakPolarHBondContact CA-O 3.28Å; T96-Y109 PolarHBondContact N-O 2.74Å; T96-Y109 PolarHBondContact OG1-O 3.37Å; R97-Y109 PolarHBondContact N-O 3.43Å; R97-Y109 WeakPolarHBondContact O-CB 3.26Å; R97-Y109 PolarHBondContact O-N 3.4Å; E99-Y109 HydrophobicContact CB-CE2 4.04Å; E99-Y109 HydrophobicContact CG-CD2 4.25Å; E99-Y109 HydrophobicContact CG-CE2 3.76Å; E99-Y109 WeakPolarHBondContact OE2-CE2 3.48Å; E99-Y109 PolarHBondContact OE2-OH 2.67Å; R107-Y109 HydrophobicContact CB-CD2 4.37Å; R107-Y109 HydrophobicContact CB-CE2 3.52Å; R107-Y109 VanDerWaalsContact CD-OH 3.28Å; R107-Y109 WeakPolarHBondContact CD-OH 3.31Å; Y109-G112 CarbonylContact C-O 3.58Å; Y109-G112 VanDerWaalsContact CA-O 3.27Å; Y109-G112 WeakPolarHBondContact CA-O 3.1Å; Y109-Y113 HydrophobicContact CD1-CD2 4.45Å; Y109-Y113 AromaticContact CE1-CD2 3.97Å; Y109-Y113 HydrophobicContact CE1-CD2 3.97Å; Y109-Y113 HydrophobicContact CE1-CG 4.41Å
110	G	92.6	Very high	87.1	Confident	10 Å²	10	37.8 Å²	37.8	10%	0.103	19%	0.187	C	C	.	.	S	Bend	trans	-113.6	-111.7	168.1	0	0	0	0	0	110.3	N94 T96 G112	N94-G110 VanDerWaalsContact O-CA 3.24Å; N94-G110 WeakPolarHBondContact O-CA 3.31Å; T96-G110 PolarHBondContact OG1-O 3.21Å; G110-G112 PolarHBondContact N-O 3.18Å
111	H	88	Confident	86.2	Confident	208 Å²	208	38 Å²	38	96%	0.963	19%	0.188	S	C	*	.	S	Bend	trans	-70.6	-24.1	166.3	-175	66.6	0	0	0	112.5
112	G	91.3	Very high	85.2	Confident	39 Å²	39	40.7 Å²	40.7	40%	0.402	21%	0.207	S	C	.	.	S	Bend	trans	-151.7	-162	172.7	0	0	0	0	0	109.2	Y109 G110 I114	Y109-G112 CarbonylContact C-O 3.58Å; Y109-G112 VanDerWaalsContact CA-O 3.27Å; Y109-G112 WeakPolarHBondContact CA-O 3.1Å; G110-G112 PolarHBondContact N-O 3.18Å; G112-I114 PolarHBondContact O-N 2.83Å
113	Y	92.2	Very high	84.1	Confident	98 Å²	98	41.9 Å²	41.9	38%	0.384	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	122.9	171.8	178.4	-115.1	0	0	0	110.2	R107 Y109 G115 T116 F171	R107-Y113 HydrophobicContact CB-CD2 4.4Å; R107-Y113 HydrophobicContact CB-CE2 3.94Å; R107-Y113 HydrophobicContact CG-CE2 4.08Å; Y109-Y113 HydrophobicContact CD1-CD2 4.45Å; Y109-Y113 AromaticContact CE1-CD2 3.97Å; Y109-Y113 HydrophobicContact CE1-CD2 3.97Å; Y109-Y113 HydrophobicContact CE1-CG 4.41Å; Y113-G115 WeakPolarHBondContact CE2-O 3.34Å; Y113-T116 VanDerWaalsContact OH-CB 3.24Å; Y113-T116 WeakPolarHBondContact OH-CB 3.49Å; Y113-T116 WeakPolarHBondContact OH-CG2 3.38Å; Y113-F171 AromaticContact CD1-CD2 4Å; Y113-F171 HydrophobicContact CD1-CD2 4Å; Y113-F171 HydrophobicContact CD1-CE2 4.23Å; Y113-F171 AromaticContact CE1-CD2 3.47Å; Y113-F171 HydrophobicContact CE1-CD2 3.47Å; Y113-F171 VanDerWaalsContact CE1-CD2 3.47Å; Y113-F171 AromaticContact CE1-CE2 3.27Å; Y113-F171 HydrophobicContact CE1-CE2 3.27Å; Y113-F171 HydrophobicContact CE1-CG 4.43Å; Y113-F171 HydrophobicContact CE1-CZ 4.06Å; Y113-F171 AromaticContact CZ-CE2 3.7Å
114	I	93.7	Very high	82.8	Confident	22 Å²	22	43.3 Å²	43.3	11%	0.113	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	-13.2	-174.7	57.2	169.9	0	0	0	113.1	F90 A93 V95 M108 G112 F171	F90-I114 HydrophobicContact CB-CD1 4.04Å; F90-I114 HydrophobicContact CD1-CD1 4.45Å; F90-I114 HydrophobicContact CD1-CG1 4.48Å; A93-I114 HydrophobicContact CB-CD1 3.81Å; A93-I114 HydrophobicContact CB-CG2 4.2Å; V95-I114 HydrophobicContact CG2-CD1 4.15Å; M108-I114 HydrophobicContact CB-CD1 4.22Å; M108-I114 HydrophobicContact CB-CG1 3.84Å; M108-I114 WeakPolarHBondContact O-CG1 3.12Å; M108-I114 PolarHBondContact O-N 2.99Å; G112-I114 PolarHBondContact O-N 2.83Å; I114-F171 PolarHBondContact O-N 3.49Å
115	G	94	Very high	81	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.1	175.4	-177.1	0	0	0	0	0	114.8	M108 Y113 V169	M108-G115 PolarHBondContact N-O 2.71Å; M108-G115 PolarHBondContact O-N 3.27Å; Y113-G115 WeakPolarHBondContact CE2-O 3.34Å; G115-V169 CarbonylContact C-O 3.36Å; G115-V169 WeakPolarHBondContact CA-O 3.29Å
116	T	94	Very high	78.8	Confident	11 Å²	11	50 Å²	50	7%	0.067	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	151.5	177.7	-172.3	0	0	0	0	112.2	L105 I106 Y113 V169	L105-T116 HydrophobicContact CD1-CG2 4.43Å; L105-T116 WeakPolarHBondContact CD1-OG1 3.29Å; I106-T116 CarbonylContact O-C 3.19Å; I106-T116 WeakPolarHBondContact O-CA 3.41Å; I106-T116 PolarHBondContact O-OG1 3.39Å; I106-T116 VanDerWaalsContact O-OG1 3.09Å; Y113-T116 VanDerWaalsContact OH-CB 3.24Å; Y113-T116 WeakPolarHBondContact OH-CB 3.49Å; Y113-T116 WeakPolarHBondContact OH-CG2 3.38Å; T116-V169 HydrophobicContact CG2-CB 4.01Å; T116-V169 HydrophobicContact CG2-CG2 4.29Å; T116-V169 PolarHBondContact N-O 2.84Å; T116-V169 PolarHBondContact O-N 3.11Å
117	I	90.8	Very high	76.1	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	121	163.2	-57.3	171.2	0	0	0	105.7	F90 I106 M108 T142 I150 F152 L166 Q167 F168	F90-I117 HydrophobicContact CE2-CD1 4.4Å; F90-I117 HydrophobicContact CE2-CG1 4.25Å; I106-I117 HydrophobicContact CB-CB 4.18Å; I106-I117 PolarHBondContact N-O 3.28Å; I106-I117 PolarHBondContact O-N 3.16Å; M108-I117 HydrophobicContact CE-CD1 3.71Å; M108-I117 HydrophobicContact CE-CG1 4.36Å; I117-T142 HydrophobicContact CD1-CG2 4.46Å; I117-I150 HydrophobicContact CD1-CD1 4.37Å; I117-I150 HydrophobicContact CD1-CG2 4.08Å; I117-F152 HydrophobicContact CD1-CZ 4.13Å; I117-F152 HydrophobicContact CG1-CZ 4.46Å; I117-F152 HydrophobicContact CG2-CE1 3.48Å; I117-F152 VanDerWaalsContact CG2-CE1 3.48Å; I117-F152 HydrophobicContact CG2-CZ 3.49Å; I117-F152 VanDerWaalsContact CG2-CZ 3.49Å; I117-L166 HydrophobicContact CG2-CD1 4Å; I117-Q167 CarbonylContact C-O 3.45Å; I117-Q167 WeakPolarHBondContact CA-O 3.35Å; I117-F168 HydrophobicContact CD1-CD2 4.22Å; I117-F168 HydrophobicContact CD1-CE2 4.03Å; I117-F168 HydrophobicContact CG1-CD2 3.76Å; I117-F168 HydrophobicContact CG1-CE2 3.95Å
118	N	87.1	Confident	73	Confident	34 Å²	34	57.9 Å²	57.9	18%	0.182	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	114.9	-175.4	-173.4	21.2	0	0	0	110.3	L105 F120 Q167	L105-N118 HydrophobicContact CD1-CB 3.58Å; N118-F120 WeakPolarHBondContact ND2-CD1 3.31Å; N118-Q167 HydrophobicContact CB-CB 4.14Å; N118-Q167 PolarHBondContact N-O 3.09Å; N118-Q167 PolarHBondContact ND2-OE1 3.29Å; N118-Q167 PolarHBondContact O-N 3.35Å
119	H	80	Confident	70	Confident	5 Å²	5	59 Å²	59	2%	0.023	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	103.4	168.3	-60.1	-95	0	0	0	107.8	G104 T142 F152 Y164	G104-H119 PolarHBondContact O-CD2 3.48Å; G104-H119 PolarHBondContact O-N 3.31Å; H119-T142 PolarHBondContact CE1-OG1 3.43Å; H119-T142 PolarHBondContact NE2-OG1 3.45Å; H119-F152 AromaticContact CE1-CD1 3.5Å; H119-F152 AromaticContact CE1-CE1 3.66Å; H119-F152 AromaticContact NE2-CD1 3.94Å; H119-F152 AromaticContact NE2-CE1 3.65Å; H119-Y164 HydrophobicContact CB-CE2 4.26Å; H119-Y164 WeakPolarHBondContact CB-OH 3.28Å; H119-Y164 PolarHBondContact ND1-OH 3.42Å
120	F	73.2	Confident	67.2	Low	48 Å²	48	59.7 Å²	59.7	21%	0.211	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	153.8	-179.2	79.6	-80.3	0	0	0	112.4	N118 Q165 Q167	N118-F120 WeakPolarHBondContact ND2-CD1 3.31Å; F120-Q165 HydrophobicContact CD1-CB 4.3Å; F120-Q165 WeakPolarHBondContact CD1-O 3.41Å; F120-Q165 HydrophobicContact CE1-CB 3.61Å; F120-Q165 HydrophobicContact CE1-CG 3.87Å; F120-Q165 HydrophobicContact CE2-CB 4.33Å; F120-Q165 HydrophobicContact CZ-CB 3.64Å; F120-Q165 HydrophobicContact CZ-CG 4Å; F120-Q165 PolarHBondContact N-O 3.33Å; F120-Q165 VanDerWaalsContact N-O 3.11Å; F120-Q165 PolarHBondContact O-N 2.89Å; F120-Q165 VanDerWaalsContact O-O 3.12Å; F120-Q167 HydrophobicContact CE1-CB 4.45Å; F120-Q167 HydrophobicContact CE1-CG 3.77Å; F120-Q167 VanDerWaalsContact CE1-OE1 3.3Å
121	I	66	Low	64.8	Low	31 Å²	31	63.1 Å²	63.1	16%	0.159	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	114.1	170.6	-60.6	166.8	0	0	0	106.8	G123 F124 Y161 N163 Y164	I121-G123 PolarHBondContact O-N 3.3Å; I121-F124 HydrophobicContact CB-CB 3.92Å; I121-F124 HydrophobicContact CG2-CB 4.03Å; I121-F124 WeakPolarHBondContact O-CB 3.44Å; I121-F124 PolarHBondContact O-N 3.46Å; I121-F124 VanDerWaalsContact O-N 3.09Å; I121-Y161 HydrophobicContact CD1-CD1 3.74Å; I121-Y161 HydrophobicContact CD1-CE1 3.78Å; I121-Y161 HydrophobicContact CG1-CD1 4.42Å; I121-N163 HydrophobicContact CG2-CB 4.23Å; I121-Y164 HydrophobicContact CG1-CD2 3.88Å
122	S	61.7	Low	62.2	Low	62 Å²	62	56.2 Å²	56.2	43%	0.434	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	130.5	178.2	-171.9	0	0	0	0	110.9	F124 N163	S122-F124 VanDerWaalsContact C-N 3.3Å; S122-F124 PolarHBondContact O-N 3.34Å; S122-N163 PolarHBondContact N-O 2.76Å; S122-N163 WeakPolarHBondContact O-CB 3.49Å; S122-N163 PolarHBondContact O-ND2 3.16Å
123	G	52.1	Low	59.8	Low	83 Å²	83	56.6 Å²	56.6	86%	0.856	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	-2.3	-177.1	0	0	0	0	0	115.2	I121	I121-G123 PolarHBondContact O-N 3.3Å
124	F	47.5	Very low	57	Low	117 Å²	117	57.9 Å²	57.9	51%	0.513	34%	0.344	S	S	.	.			trans	-91.1	125.2	168.9	-151.9	-102	0	0	0	109	I121 S122 P126	I121-F124 HydrophobicContact CB-CB 3.92Å; I121-F124 HydrophobicContact CG2-CB 4.03Å; I121-F124 WeakPolarHBondContact O-CB 3.44Å; I121-F124 PolarHBondContact O-N 3.46Å; I121-F124 VanDerWaalsContact O-N 3.09Å; S122-F124 VanDerWaalsContact C-N 3.3Å; S122-F124 PolarHBondContact O-N 3.34Å; F124-P126 WeakPolarHBondContact O-CD 3.44Å
125	V	38.9	Very low	54.5	Low	117 Å²	117	64.6 Å²	64.6	71%	0.709	38%	0.38	S	S	*	.			trans	-78.8	119.7	167.2	-171.3	0	0	0	0	105	S127	V125-S127 PolarHBondContact O-N 2.87Å
126	P	39.3	Very low	52.3	Low	52 Å²	52	66.1 Å²	66.1	34%	0.338	40%	0.396	S	S	.	.			trans	-73.2	72.9	-176.1	30	-33.8	0	0	0	109.6	E103 F124 E128 C129	E103-P126 HydrophobicContact CB-CB 3.97Å; E103-P126 HydrophobicContact CB-CG 4.5Å; E103-P126 HydrophobicContact CG-CB 3.74Å; E103-P126 HydrophobicContact CG-CG 4.14Å; E103-P126 WeakPolarHBondContact OE1-CG 3.36Å; E103-P126 VanDerWaalsContact OE2-CG 3.26Å; E103-P126 WeakPolarHBondContact OE2-CG 3.34Å; F124-P126 WeakPolarHBondContact O-CD 3.44Å; P126-E128 VanDerWaalsContact C-N 3.28Å; P126-C129 HydrophobicContact CB-CB 4.48Å
127	S	33.5	Very low	51	Low	101 Å²	101	67.5 Å²	67.5	71%	0.706	40%	0.404	S	S	*	.	S	Bend	trans	-77.5	-22.6	160.6	41.5	0	0	0	0	110.6	V125	V125-S127 PolarHBondContact O-N 2.87Å
128	E	28.6	Very low	50	Low	138 Å²	138	68.5 Å²	68.5	65%	0.645	41%	0.409	S	S	*	.			trans	-153.7	69.3	-174.7	-61.3	-178.9	175.6	0	0	112	P126 I133	P126-E128 VanDerWaalsContact C-N 3.28Å; E128-I133 WeakPolarHBondContact O-CD1 3.49Å
129	C	30.8	Very low	49.6	Very low	24 Å²	24	70.5 Å²	70.5	16%	0.162	42%	0.416	C	S	.	.			trans	-99.4	54.4	169.6	-149	0	0	0	0	111	D102 E103 P126 I131	D102-C129 CarbonylContact O-C 3.59Å; E103-C129 HydrophobicContact CB-CB 4.49Å; E103-C129 WeakPolarHBondContact O-CB 3.37Å; P126-C129 HydrophobicContact CB-CB 4.48Å; C129-I131 PolarHBondContact O-N 2.77Å
130	H	35.4	Very low	49.6	Very low	53 Å²	53	71 Å²	71	25%	0.245	42%	0.419	C	S	.	.			trans	-57.7	127.4	176.5	-108.9	72.5	0	0	0	110.5	Q75 S132 I133	Q75-H130 WeakPolarHBondContact CG-NE2 3.42Å; Q75-H130 PolarHBondContact NE2-CD2 2.94Å; Q75-H130 PolarHBondContact NE2-NE2 3.17Å; H130-S132 CarbonylContact O-C 3.56Å; H130-S132 PolarHBondContact O-N 2.83Å; H130-I133 HydrophobicContact CB-CG1 4.06Å; H130-I133 WeakPolarHBondContact O-CG1 3.16Å; H130-I133 PolarHBondContact O-N 2.78Å
131	I	42.7	Very low	50.1	Low	83 Å²	83	69.1 Å²	69.1	43%	0.426	41%	0.412	S	S	.	.	S	Bend	trans	-68.2	20.5	169	-80.7	168.2	0	0	0	113.3	M100 C129	M100-I131 HydrophobicContact CE-CD1 3.12Å; M100-I131 HydrophobicContact CE-CG1 4.36Å; M100-I131 HydrophobicContact CE-CG2 4.46Å; C129-I131 PolarHBondContact O-N 2.77Å
132	S	33.3	Very low	51.1	Low	62 Å²	62	69.4 Å²	69.4	43%	0.434	42%	0.415	S	S	.	.	S	Bend	trans	-149.9	79.3	155.8	55.2	0	0	0	0	109.2	H130 V134	H130-S132 CarbonylContact O-C 3.56Å; H130-S132 PolarHBondContact O-N 2.83Å; S132-V134 PolarHBondContact O-N 3.33Å
133	I	40.5	Very low	52.3	Low	48 Å²	48	68.7 Å²	68.7	25%	0.246	41%	0.406	C	S	.	.			trans	-79	117.6	-179.2	-49.3	-169.7	0	0	0	111.4	E128 H130 T137	E128-I133 WeakPolarHBondContact O-CD1 3.49Å; H130-I133 HydrophobicContact CB-CG1 4.06Å; H130-I133 WeakPolarHBondContact O-CG1 3.16Å; H130-I133 PolarHBondContact O-N 2.78Å; I133-T137 HydrophobicContact CB-CG2 4.4Å; I133-T137 WeakPolarHBondContact O-CB 3.09Å; I133-T137 WeakPolarHBondContact O-CG2 3.44Å; I133-T137 PolarHBondContact O-OG1 3.32Å
134	V	33.6	Very low	54	Low	124 Å²	124	67 Å²	67	75%	0.752	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	134.6	171.8	-179.8	0	0	0	0	110	S132	S132-V134 PolarHBondContact O-N 3.33Å
135	D	41.9	Very low	55.9	Low	163 Å²	163	65 Å²	65	87%	0.872	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	42.1	168.4	-84	-1.7	0	0	0	121.3
136	G	46.8	Very low	58	Low	32 Å²	32	63.6 Å²	63.6	33%	0.33	36%	0.364	S	S	.	.	S	Bend	trans	149.8	34.7	167.9	0	0	0	0	0	114.8	F138 T158 Y161	G136-F138 PolarHBondContact O-N 3.03Å; G136-T158 WeakPolarHBondContact O-CG2 3.39Å; G136-T158 PolarHBondContact O-OG1 2.86Å; G136-Y161 PolarHBondContact O-OH 3.01Å
137	T	66.4	Low	60.2	Low	41 Å²	41	66.3 Å²	66.3	25%	0.252	38%	0.376	S	S	.	.			trans	-76.6	106.9	-132.5	-45.4	0	0	0	0	115.5	I133 K139 Y156	I133-T137 HydrophobicContact CB-CG2 4.4Å; I133-T137 WeakPolarHBondContact O-CB 3.09Å; I133-T137 WeakPolarHBondContact O-CG2 3.44Å; I133-T137 PolarHBondContact O-OG1 3.32Å; T137-K139 HydrophobicContact CG2-CB 4.4Å; T137-K139 PolarHBondContact O-N 3.06Å; T137-Y156 WeakPolarHBondContact O-CB 3.32Å; T137-Y156 WeakPolarHBondContact O-CD1 3.41Å
138	F	70.8	Confident	62.7	Low	21 Å²	21	61.8 Å²	61.8	9%	0.092	35%	0.346	C	S	.	.			trans	-61.9	109.3	161.1	-173.7	-92.8	0	0	0	109	G136 T140 Y154 Y156 V157 Y161 Y164 V191	G136-F138 PolarHBondContact O-N 3.03Å; F138-T140 HydrophobicContact CD1-CG2 4.39Å; F138-T140 HydrophobicContact CE1-CG2 3.87Å; F138-Y154 HydrophobicContact CE1-CD1 4.36Å; F138-Y154 HydrophobicContact CE2-CD1 4.25Å; F138-Y154 AromaticContact CZ-CD1 3.56Å; F138-Y154 HydrophobicContact CZ-CD1 3.56Å; F138-Y154 AromaticContact CZ-CE1 3.75Å; F138-Y154 HydrophobicContact CZ-CE1 3.75Å; F138-Y156 CarbonylContact C-O 3.48Å; F138-Y156 VanDerWaalsContact CA-O 3.24Å; F138-Y156 WeakPolarHBondContact CA-O 3.48Å; F138-V157 HydrophobicContact CD2-CB 4.29Å; F138-V157 HydrophobicContact CD2-CG1 4.02Å; F138-V157 HydrophobicContact CD2-CG2 4.05Å; F138-V157 HydrophobicContact CE2-CB 4.26Å; F138-V157 HydrophobicContact CE2-CG1 3.92Å; F138-V157 HydrophobicContact CE2-CG2 3.65Å; F138-Y161 HydrophobicContact CB-CD1 4.35Å; F138-Y161 HydrophobicContact CB-CD2 3.98Å; F138-Y161 HydrophobicContact CB-CE1 4.04Å; F138-Y161 HydrophobicContact CB-CE2 3.59Å; F138-Y161 HydrophobicContact CB-CG 4.35Å; F138-Y161 AromaticContact CD2-CD2 3.78Å; F138-Y161 HydrophobicContact CD2-CD2 3.78Å; F138-Y161 HydrophobicContact CD2-CE2 4.26Å; F138-Y161 AromaticContact CD2-CG 3.97Å; F138-Y161 HydrophobicContact CD2-CG 3.97Å; F138-Y161 HydrophobicContact CG-CD2 4.33Å; F138-Y161 HydrophobicContact CG-CE2 4.41Å; F138-Y161 HydrophobicContact CG-CG 4.49Å; F138-Y164 HydrophobicContact CD1-CD2 4Å; F138-Y164 AromaticContact CD1-CE2 3.83Å; F138-Y164 HydrophobicContact CD1-CE2 3.83Å; F138-Y164 HydrophobicContact CE1-CD1 4.28Å; F138-Y164 AromaticContact CE1-CD2 3.47Å; F138-Y164 HydrophobicContact CE1-CD2 3.47Å; F138-Y164 VanDerWaalsContact CE1-CD2 3.47Å; F138-Y164 AromaticContact CE1-CE1 3.97Å; F138-Y164 HydrophobicContact CE1-CE1 3.97Å; F138-Y164 AromaticContact CE1-CE2 3.08Å; F138-Y164 HydrophobicContact CE1-CE2 3.08Å; F138-Y164 HydrophobicContact CE1-CG 4.04Å; F138-Y164 AromaticContact CE1-CZ 3.33Å; F138-Y164 HydrophobicContact CE2-CD1 4.15Å; F138-Y164 HydrophobicContact CE2-CD2 4.04Å; F138-Y164 HydrophobicContact CE2-CE2 4.4Å; F138-Y164 AromaticContact CE2-CG 3.89Å; F138-Y164 HydrophobicContact CE2-CG 3.89Å; F138-Y164 HydrophobicContact CG-CD2 4.5Å; F138-Y164 AromaticContact CZ-CD1 3.57Å; F138-Y164 HydrophobicContact CZ-CD1 3.57Å; F138-Y164 AromaticContact CZ-CD2 3.48Å; F138-Y164 HydrophobicContact CZ-CD2 3.48Å; F138-Y164 VanDerWaalsContact CZ-CD2 3.48Å; F138-Y164 AromaticContact CZ-CE1 3.52Å; F138-Y164 HydrophobicContact CZ-CE1 3.52Å; F138-Y164 AromaticContact CZ-CE2 3.43Å; F138-Y164 HydrophobicContact CZ-CE2 3.43Å; F138-Y164 VanDerWaalsContact CZ-CE2 3.43Å; F138-Y164 AromaticContact CZ-CG 3.53Å; F138-Y164 HydrophobicContact CZ-CG 3.53Å; F138-Y164 AromaticContact CZ-CZ 3.41Å; F138-Y164 VanDerWaalsContact CZ-CZ 3.41Å; F138-V191 HydrophobicContact CE2-CG1 3.96Å; F138-V191 HydrophobicContact CZ-CG1 4.26Å
139	K	78	Confident	65.6	Low	75 Å²	75	56 Å²	56	33%	0.326	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	117.5	177.7	-174.9	179.9	170	-156.8	0	109.7	T137 D155 Y156	T137-K139 HydrophobicContact CG2-CB 4.4Å; T137-K139 PolarHBondContact O-N 3.06Å; K139-D155 HydrophobicContact CB-CB 4.26Å; K139-D155 HydrophobicContact CD-CB 4.07Å; K139-D155 WeakPolarHBondContact CD-OD2 3.33Å; K139-D155 WeakPolarHBondContact CE-OD2 3.46Å; K139-D155 HydrophobicContact CG-CB 4.18Å; K139-D155 IonicContact NZ-OD2 2.75Å; K139-D155 PolarHBondContact NZ-OD2 3.36Å; K139-D155 PolarHBondContact O-N 3.2Å; K139-Y156 PolarHBondContact N-O 3.43Å
140	T	80.6	Confident	68.4	Low	16 Å²	16	54.9 Å²	54.9	10%	0.098	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	148.7	169.7	-173.7	0	0	0	0	109.8	F138 Y153	F138-T140 HydrophobicContact CD1-CG2 4.39Å; F138-T140 HydrophobicContact CE1-CG2 3.87Å; T140-Y153 CarbonylContact C-O 3.55Å; T140-Y153 VanDerWaalsContact CA-O 3.28Å; T140-Y153 WeakPolarHBondContact CA-O 3.42Å; T140-Y153 PolarHBondContact OG1-O 2.72Å
141	T	83.8	Confident	71.1	Confident	9 Å²	9	52.5 Å²	52.5	6%	0.055	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	133.8	173.9	-60.4	0	0	0	0	108.7	I68 L143 F152 Y153	I68-T141 HydrophobicContact CD1-CG2 3.43Å; I68-T141 VanDerWaalsContact CD1-CG2 3.43Å; I68-T141 WeakPolarHBondContact CD1-OG1 3.21Å; I68-T141 HydrophobicContact CG1-CG2 3.89Å; T141-L143 HydrophobicContact CG2-CD2 4.19Å; T141-L143 HydrophobicContact CG2-CG 4.02Å; T141-F152 CarbonylContact O-C 3.57Å; T141-F152 VanDerWaalsContact O-CA 3.26Å; T141-F152 WeakPolarHBondContact O-CA 3.38Å; T141-Y153 PolarHBondContact N-O 3.09Å; T141-Y153 PolarHBondContact O-N 2.98Å
142	T	86	Confident	73.3	Confident	37 Å²	37	48.5 Å²	48.5	23%	0.227	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.2	170.6	-59.6	0	0	0	0	109.4	I106 I117 H119 I144 I150 S151 F152	I106-T142 HydrophobicContact CD1-CG2 4.03Å; I117-T142 HydrophobicContact CD1-CG2 4.46Å; H119-T142 PolarHBondContact CE1-OG1 3.43Å; H119-T142 PolarHBondContact NE2-OG1 3.45Å; T142-I144 HydrophobicContact CG2-CG1 4.46Å; T142-I150 HydrophobicContact CG2-CG2 4.4Å; T142-S151 CarbonylContact C-O 3.6Å; T142-S151 WeakPolarHBondContact CA-O 3.09Å; T142-F152 HydrophobicContact CG2-CD1 3.95Å; T142-F152 HydrophobicContact CG2-CE1 3.44Å; T142-F152 VanDerWaalsContact CG2-CE1 3.44Å; T142-F152 HydrophobicContact CG2-CZ 4.21Å; T142-F152 WeakPolarHBondContact OG1-CD1 3.4Å; T142-F152 VanDerWaalsContact OG1-CE1 3.25Å; T142-F152 WeakPolarHBondContact OG1-CE1 3.32Å
143	L	86.8	Confident	75.9	Confident	47 Å²	47	46.2 Å²	46.2	25%	0.246	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	122.9	177.8	-65.4	166.6	0	0	0	108.5	P67 T141 I150 S151	P67-L143 HydrophobicContact CB-CD1 3.78Å; P67-L143 HydrophobicContact CG-CD1 3.49Å; P67-L143 VanDerWaalsContact CG-CD1 3.49Å; T141-L143 HydrophobicContact CG2-CD2 4.19Å; T141-L143 HydrophobicContact CG2-CG 4.02Å; L143-I150 CarbonylContact O-C 3.53Å; L143-I150 WeakPolarHBondContact O-CA 3.21Å; L143-S151 PolarHBondContact N-O 3.27Å; L143-S151 PolarHBondContact O-N 2.84Å
144	I	88.1	Confident	78.2	Confident	46 Å²	46	43.9 Å²	43.9	24%	0.236	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	111.8	173.8	-59.2	171	0	0	0	107.2	F86 L88 M108 T142 I150	F86-I144 HydrophobicContact CZ-CG2 4.42Å; L88-I144 HydrophobicContact CD1-CG2 3.5Å; L88-I144 VanDerWaalsContact CD1-CG2 3.5Å; L88-I144 HydrophobicContact CD2-CG2 3.82Å; L88-I144 HydrophobicContact CG-CG2 4.32Å; M108-I144 HydrophobicContact CE-CD1 3.7Å; T142-I144 HydrophobicContact CG2-CG1 4.46Å; I144-I150 HydrophobicContact CG1-CG1 4.45Å
145	H	87.1	Confident	80.4	Confident	76 Å²	76	40.1 Å²	40.1	35%	0.352	23%	0.226	S	C	.	.			trans	-88.6	151.5	-177.2	-62.7	-99.5	0	0	0	110.8	N147 G148 T149 S151	H145-N147 WeakPolarHBondContact CB-OD1 3.31Å; H145-N147 PolarHBondContact O-N 3.47Å; H145-N147 VanDerWaalsContact O-N 3.14Å; H145-G148 PolarHBondContact O-N 3.4Å; H145-T149 WeakPolarHBondContact CB-O 3.32Å; H145-T149 PolarHBondContact CD2-O 3.35Å; H145-T149 PolarHBondContact N-O 2.92Å; H145-S151 PolarHBondContact NE2-OG 2.88Å
146	S	84.6	Confident	82.1	Confident	87 Å²	87	38.6 Å²	38.6	61%	0.608	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-14.8	-179.7	63.3	0	0	0	0	114.6	G148	S146-G148 VanDerWaalsContact C-N 3.3Å
147	N	84.2	Confident	83.3	Confident	109 Å²	109	38.8 Å²	38.8	58%	0.583	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.7	2	172.7	69.3	-14.9	0	0	0	112.9	H145 T149	H145-N147 WeakPolarHBondContact CB-OD1 3.31Å; H145-N147 PolarHBondContact O-N 3.47Å; H145-N147 VanDerWaalsContact O-N 3.14Å; N147-T149 PolarHBondContact ND2-OG1 2.9Å; N147-T149 VanDerWaalsContact OD1-CB 3.3Å; N147-T149 WeakPolarHBondContact OD1-CB 3.03Å; N147-T149 PolarHBondContact OD1-N 2.86Å; N147-T149 PolarHBondContact OD1-OG1 2.81Å
148	G	86	Confident	83.4	Confident	7 Å²	7	38.7 Å²	38.7	7%	0.072	20%	0.204	C	C	.	.	S	Bend	trans	86.2	-1.5	-177.4	0	0	0	0	0	114.8	H145 S146	H145-G148 PolarHBondContact O-N 3.4Å; S146-G148 VanDerWaalsContact C-N 3.3Å
149	T	90.2	Very high	83	Confident	15 Å²	15	50.4 Å²	50.4	9%	0.092	25%	0.247	C	C	.	.			trans	-66.2	137.9	169.7	-61.1	0	0	0	0	109.8	H145 N147 Y199	H145-T149 WeakPolarHBondContact CB-O 3.32Å; H145-T149 PolarHBondContact CD2-O 3.35Å; H145-T149 PolarHBondContact N-O 2.92Å; N147-T149 PolarHBondContact ND2-OG1 2.9Å; N147-T149 VanDerWaalsContact OD1-CB 3.3Å; N147-T149 WeakPolarHBondContact OD1-CB 3.03Å; N147-T149 PolarHBondContact OD1-N 2.86Å; N147-T149 PolarHBondContact OD1-OG1 2.81Å; T149-Y199 CarbonylContact C-O 3.5Å; T149-Y199 VanDerWaalsContact CA-O 3.29Å; T149-Y199 WeakPolarHBondContact CA-O 2.97Å; T149-Y199 WeakPolarHBondContact CG2-O 3.24Å
150	I	90.6	Very high	82.2	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	123.1	175	-60	171	0	0	0	108.4	F90 I117 T142 L143 I144 F152 F168 Y199	F90-I150 HydrophobicContact CD2-CD1 3.94Å; F90-I150 HydrophobicContact CE2-CD1 3.99Å; I117-I150 HydrophobicContact CD1-CD1 4.37Å; I117-I150 HydrophobicContact CD1-CG2 4.08Å; T142-I150 HydrophobicContact CG2-CG2 4.4Å; L143-I150 CarbonylContact O-C 3.53Å; L143-I150 WeakPolarHBondContact O-CA 3.21Å; I144-I150 HydrophobicContact CG1-CG1 4.45Å; I150-F152 HydrophobicContact CG2-CE1 4.36Å; I150-F152 HydrophobicContact CG2-CE2 3.71Å; I150-F152 HydrophobicContact CG2-CZ 3.62Å; I150-F168 HydrophobicContact CB-CE2 4.39Å; I150-F168 HydrophobicContact CD1-CE2 3.61Å; I150-F168 HydrophobicContact CD1-CZ 3.82Å; I150-F168 HydrophobicContact CG2-CE2 4.25Å; I150-Y199 PolarHBondContact N-O 2.83Å; I150-Y199 PolarHBondContact O-N 3.09Å
151	S	90.1	Very high	81.4	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.021	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	140.7	-174.1	-55.7	0	0	0	0	111	T142 L143 H145 V197	T142-S151 CarbonylContact C-O 3.6Å; T142-S151 WeakPolarHBondContact CA-O 3.09Å; L143-S151 PolarHBondContact N-O 3.27Å; L143-S151 PolarHBondContact O-N 2.84Å; H145-S151 PolarHBondContact NE2-OG 2.88Å; S151-V197 CarbonylContact C-O 3.58Å; S151-V197 VanDerWaalsContact CA-O 3.3Å; S151-V197 WeakPolarHBondContact CA-O 3.33Å
152	F	89.2	Confident	80.3	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.5	177.6	-55.7	-80.6	0	0	0	109.7	I117 H119 T141 T142 I150 L166 F168 L196 V197 Y199	I117-F152 HydrophobicContact CD1-CZ 4.13Å; I117-F152 HydrophobicContact CG1-CZ 4.46Å; I117-F152 HydrophobicContact CG2-CE1 3.48Å; I117-F152 VanDerWaalsContact CG2-CE1 3.48Å; I117-F152 HydrophobicContact CG2-CZ 3.49Å; I117-F152 VanDerWaalsContact CG2-CZ 3.49Å; H119-F152 AromaticContact CE1-CD1 3.5Å; H119-F152 AromaticContact CE1-CE1 3.66Å; H119-F152 AromaticContact NE2-CD1 3.94Å; H119-F152 AromaticContact NE2-CE1 3.65Å; T141-F152 CarbonylContact O-C 3.57Å; T141-F152 VanDerWaalsContact O-CA 3.26Å; T141-F152 WeakPolarHBondContact O-CA 3.38Å; T142-F152 HydrophobicContact CG2-CD1 3.95Å; T142-F152 HydrophobicContact CG2-CE1 3.44Å; T142-F152 VanDerWaalsContact CG2-CE1 3.44Å; T142-F152 HydrophobicContact CG2-CZ 4.21Å; T142-F152 WeakPolarHBondContact OG1-CD1 3.4Å; T142-F152 VanDerWaalsContact OG1-CE1 3.25Å; T142-F152 WeakPolarHBondContact OG1-CE1 3.32Å; I150-F152 HydrophobicContact CG2-CE1 4.36Å; I150-F152 HydrophobicContact CG2-CE2 3.71Å; I150-F152 HydrophobicContact CG2-CZ 3.62Å; F152-L166 HydrophobicContact CB-CD2 4.06Å; F152-L166 HydrophobicContact CD1-CD1 4.26Å; F152-L166 HydrophobicContact CD1-CD2 3.86Å; F152-L166 HydrophobicContact CD2-CD2 3.53Å; F152-L166 HydrophobicContact CE1-CD1 3.97Å; F152-L166 HydrophobicContact CE1-CD2 4.09Å; F152-L166 HydrophobicContact CE2-CD2 3.81Å; F152-L166 HydrophobicContact CG-CD2 3.52Å; F152-L166 HydrophobicContact CZ-CD1 4.23Å; F152-L166 HydrophobicContact CZ-CD2 4.06Å; F152-F168 HydrophobicContact CE2-CD2 4.25Å; F152-F168 HydrophobicContact CZ-CD2 4.15Å; F152-L196 CarbonylContact O-C 3.51Å; F152-L196 WeakPolarHBondContact O-CA 3.3Å; F152-V197 HydrophobicContact CB-CB 4.2Å; F152-V197 HydrophobicContact CD2-CB 4.48Å; F152-V197 HydrophobicContact CD2-CG1 4.49Å; F152-V197 PolarHBondContact N-O 3.4Å; F152-V197 PolarHBondContact O-N 3.11Å; F152-Y199 AromaticContact CD2-CD2 3.72Å; F152-Y199 HydrophobicContact CD2-CD2 3.72Å; F152-Y199 AromaticContact CD2-CE2 3.46Å; F152-Y199 HydrophobicContact CD2-CE2 3.46Å; F152-Y199 VanDerWaalsContact CD2-CE2 3.46Å; F152-Y199 AromaticContact CE2-CD2 3.44Å; F152-Y199 HydrophobicContact CE2-CD2 3.44Å; F152-Y199 VanDerWaalsContact CE2-CD2 3.44Å; F152-Y199 AromaticContact CE2-CE2 3.29Å; F152-Y199 HydrophobicContact CE2-CE2 3.29Å
153	Y	88.9	Confident	79.5	Confident	13 Å²	13	61.1 Å²	61.1	5%	0.051	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	134.3	178	-177.1	-101.3	0	0	0	110.7	Q64 S66 P67 T140 T141 D155 T195 L196	Q64-Y153 PolarHBondContact O-OH 2.79Å; S66-Y153 VanDerWaalsContact CA-CZ 3.49Å; S66-Y153 PolarHBondContact N-OH 2.9Å; P67-Y153 HydrophobicContact CG-CG 4.31Å; T140-Y153 CarbonylContact C-O 3.55Å; T140-Y153 VanDerWaalsContact CA-O 3.28Å; T140-Y153 WeakPolarHBondContact CA-O 3.42Å; T140-Y153 PolarHBondContact OG1-O 2.72Å; T141-Y153 PolarHBondContact N-O 3.09Å; T141-Y153 PolarHBondContact O-N 2.98Å; Y153-D155 HydrophobicContact CD1-CB 3.87Å; Y153-D155 HydrophobicContact CE1-CB 3.58Å; Y153-T195 WeakPolarHBondContact CA-O 3.4Å; Y153-L196 HydrophobicContact CD2-CB 4.28Å; Y153-L196 HydrophobicContact CD2-CD1 4.36Å
154	Y	88.1	Confident	78.8	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	109	176.4	-60.1	-70.5	0	0	0	109.4	F138 Y164 V191 K192 N193 G194 T195 V197	F138-Y154 HydrophobicContact CE1-CD1 4.36Å; F138-Y154 HydrophobicContact CE2-CD1 4.25Å; F138-Y154 AromaticContact CZ-CD1 3.56Å; F138-Y154 HydrophobicContact CZ-CD1 3.56Å; F138-Y154 AromaticContact CZ-CE1 3.75Å; F138-Y154 HydrophobicContact CZ-CE1 3.75Å; Y154-Y164 HydrophobicContact CE1-CD1 4.22Å; Y154-Y164 AromaticContact CE1-CE1 3.48Å; Y154-Y164 HydrophobicContact CE1-CE1 3.48Å; Y154-Y164 VanDerWaalsContact CE1-CE1 3.48Å; Y154-V191 HydrophobicContact CD1-CG1 4.36Å; Y154-V191 HydrophobicContact CE1-CG1 4.24Å; Y154-K192 WeakPolarHBondContact CB-O 3.26Å; Y154-N193 CarbonylContact O-C 3.56Å; Y154-N193 PolarHBondContact O-OD1 3.15Å; Y154-G194 PolarHBondContact O-N 3.1Å; Y154-T195 HydrophobicContact CD2-CG2 4.05Å; Y154-T195 WeakPolarHBondContact CD2-O 3.47Å; Y154-T195 HydrophobicContact CE2-CG2 4.4Å; Y154-T195 PolarHBondContact N-O 2.98Å; Y154-V197 HydrophobicContact CE2-CG2 3.84Å
155	D	80.8	Confident	78.3	Confident	44 Å²	44	59.7 Å²	59.7	24%	0.235	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	-34	-168.5	-165.7	20.5	0	0	0	113.7	K139 Y153 N193	K139-D155 HydrophobicContact CB-CB 4.26Å; K139-D155 HydrophobicContact CD-CB 4.07Å; K139-D155 WeakPolarHBondContact CD-OD2 3.33Å; K139-D155 WeakPolarHBondContact CE-OD2 3.46Å; K139-D155 HydrophobicContact CG-CB 4.18Å; K139-D155 IonicContact NZ-OD2 2.75Å; K139-D155 PolarHBondContact NZ-OD2 3.36Å; K139-D155 PolarHBondContact O-N 3.2Å; Y153-D155 HydrophobicContact CD1-CB 3.87Å; Y153-D155 HydrophobicContact CE1-CB 3.58Å; D155-N193 VanDerWaalsContact O-CG 3.3Å; D155-N193 PolarHBondContact O-OD1 3.33Å
156	Y	77	Confident	78.1	Confident	131 Å²	131	56.1 Å²	56.1	51%	0.514	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	110	172.3	-163.4	-105.5	0	0	0	107.3	T137 F138 K139 T158	T137-Y156 WeakPolarHBondContact O-CB 3.32Å; T137-Y156 WeakPolarHBondContact O-CD1 3.41Å; F138-Y156 CarbonylContact C-O 3.48Å; F138-Y156 VanDerWaalsContact CA-O 3.24Å; F138-Y156 WeakPolarHBondContact CA-O 3.48Å; K139-Y156 PolarHBondContact N-O 3.43Å; Y156-T158 HydrophobicContact CD1-CG2 3.62Å; Y156-T158 HydrophobicContact CE1-CG2 3.11Å
157	V	72.3	Confident	78	Confident	36 Å²	36	54 Å²	54	22%	0.218	27%	0.267	C	S	.	.			trans	-117.1	104.8	176.5	-176.1	0	0	0	0	105.9	F138 Y161 V191	F138-V157 HydrophobicContact CD2-CB 4.29Å; F138-V157 HydrophobicContact CD2-CG1 4.02Å; F138-V157 HydrophobicContact CD2-CG2 4.05Å; F138-V157 HydrophobicContact CE2-CB 4.26Å; F138-V157 HydrophobicContact CE2-CG1 3.92Å; F138-V157 HydrophobicContact CE2-CG2 3.65Å; V157-Y161 HydrophobicContact CG1-CD2 4.37Å; V157-V191 HydrophobicContact CG1-CG1 4.41Å
158	T	68.9	Low	78.1	Confident	40 Å²	40	48.8 Å²	48.8	25%	0.245	24%	0.24	C	C	.	.			trans	-78.3	161.5	173.6	65.4	0	0	0	0	110.8	G136 Y156 Y161	G136-T158 WeakPolarHBondContact O-CG2 3.39Å; G136-T158 PolarHBondContact O-OG1 2.86Å; Y156-T158 HydrophobicContact CD1-CG2 3.62Å; Y156-T158 HydrophobicContact CE1-CG2 3.11Å; T158-Y161 WeakPolarHBondContact O-CD2 2.92Å; T158-Y161 WeakPolarHBondContact OG1-CE2 3.12Å
159	W	60.8	Low	78.4	Confident	266 Å²	266	49 Å²	49	100%	1.008	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	138	173.9	-70.9	-57.3	0	0	0	110.7
160	G	61.8	Low	78.5	Confident	65 Å²	65	48.3 Å²	48.3	67%	0.67	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	112.5	-9.6	-179.5	0	0	0	0	0	114.9	E162	G160-E162 VanDerWaalsContact C-N 3.26Å; G160-E162 PolarHBondContact O-N 3.32Å
161	Y	63.7	Low	78.6	Confident	54 Å²	54	51.5 Å²	51.5	21%	0.212	25%	0.249	C	C	.	.			trans	-89.1	29.8	174.8	-59.8	-63.7	0	0	0	113.6	I121 G136 F138 V157 T158 N163 Y164	I121-Y161 HydrophobicContact CD1-CD1 3.74Å; I121-Y161 HydrophobicContact CD1-CE1 3.78Å; I121-Y161 HydrophobicContact CG1-CD1 4.42Å; G136-Y161 PolarHBondContact O-OH 3.01Å; F138-Y161 HydrophobicContact CB-CD1 4.35Å; F138-Y161 HydrophobicContact CB-CD2 3.98Å; F138-Y161 HydrophobicContact CB-CE1 4.04Å; F138-Y161 HydrophobicContact CB-CE2 3.59Å; F138-Y161 HydrophobicContact CB-CG 4.35Å; F138-Y161 AromaticContact CD2-CD2 3.78Å; F138-Y161 HydrophobicContact CD2-CD2 3.78Å; F138-Y161 HydrophobicContact CD2-CE2 4.26Å; F138-Y161 AromaticContact CD2-CG 3.97Å; F138-Y161 HydrophobicContact CD2-CG 3.97Å; F138-Y161 HydrophobicContact CG-CD2 4.33Å; F138-Y161 HydrophobicContact CG-CE2 4.41Å; F138-Y161 HydrophobicContact CG-CG 4.49Å; V157-Y161 HydrophobicContact CG1-CD2 4.37Å; T158-Y161 WeakPolarHBondContact O-CD2 2.92Å; T158-Y161 WeakPolarHBondContact OG1-CE2 3.12Å; Y161-N163 PolarHBondContact O-N 3.48Å; Y161-Y164 VanDerWaalsContact O-CB 3.26Å; Y161-Y164 WeakPolarHBondContact O-CB 3.43Å; Y161-Y164 PolarHBondContact O-N 3.08Å
162	E	61.8	Low	78.5	Confident	149 Å²	149	52.8 Å²	52.8	70%	0.696	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-20	175.5	-62.2	-168.3	-176.9	0	0	112.9	G160	G160-E162 VanDerWaalsContact C-N 3.26Å; G160-E162 PolarHBondContact O-N 3.32Å
163	N	68.3	Low	78.3	Confident	94 Å²	94	59.4 Å²	59.4	50%	0.503	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	0.1	177.3	-66.2	-16.9	0	0	0	113.4	I121 S122 Y161 Q165	I121-N163 HydrophobicContact CG2-CB 4.23Å; S122-N163 PolarHBondContact N-O 2.76Å; S122-N163 WeakPolarHBondContact O-CB 3.49Å; S122-N163 PolarHBondContact O-ND2 3.16Å; Y161-N163 PolarHBondContact O-N 3.48Å; N163-Q165 PolarHBondContact O-N 3.32Å
164	Y	72.4	Confident	78.1	Confident	9 Å²	9	59.6 Å²	59.6	4%	0.035	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	131.3	174.2	179.6	-87.3	0	0	0	109.8	H119 I121 F138 Y154 Y161 L166 V191	H119-Y164 HydrophobicContact CB-CE2 4.26Å; H119-Y164 WeakPolarHBondContact CB-OH 3.28Å; H119-Y164 PolarHBondContact ND1-OH 3.42Å; I121-Y164 HydrophobicContact CG1-CD2 3.88Å; F138-Y164 HydrophobicContact CD1-CD2 4Å; F138-Y164 AromaticContact CD1-CE2 3.83Å; F138-Y164 HydrophobicContact CD1-CE2 3.83Å; F138-Y164 HydrophobicContact CE1-CD1 4.28Å; F138-Y164 AromaticContact CE1-CD2 3.47Å; F138-Y164 HydrophobicContact CE1-CD2 3.47Å; F138-Y164 VanDerWaalsContact CE1-CD2 3.47Å; F138-Y164 AromaticContact CE1-CE1 3.97Å; F138-Y164 HydrophobicContact CE1-CE1 3.97Å; F138-Y164 AromaticContact CE1-CE2 3.08Å; F138-Y164 HydrophobicContact CE1-CE2 3.08Å; F138-Y164 HydrophobicContact CE1-CG 4.04Å; F138-Y164 AromaticContact CE1-CZ 3.33Å; F138-Y164 HydrophobicContact CE2-CD1 4.15Å; F138-Y164 HydrophobicContact CE2-CD2 4.04Å; F138-Y164 HydrophobicContact CE2-CE2 4.4Å; F138-Y164 AromaticContact CE2-CG 3.89Å; F138-Y164 HydrophobicContact CE2-CG 3.89Å; F138-Y164 HydrophobicContact CG-CD2 4.5Å; F138-Y164 AromaticContact CZ-CD1 3.57Å; F138-Y164 HydrophobicContact CZ-CD1 3.57Å; F138-Y164 AromaticContact CZ-CD2 3.48Å; F138-Y164 HydrophobicContact CZ-CD2 3.48Å; F138-Y164 VanDerWaalsContact CZ-CD2 3.48Å; F138-Y164 AromaticContact CZ-CE1 3.52Å; F138-Y164 HydrophobicContact CZ-CE1 3.52Å; F138-Y164 AromaticContact CZ-CE2 3.43Å; F138-Y164 HydrophobicContact CZ-CE2 3.43Å; F138-Y164 VanDerWaalsContact CZ-CE2 3.43Å; F138-Y164 AromaticContact CZ-CG 3.53Å; F138-Y164 HydrophobicContact CZ-CG 3.53Å; F138-Y164 AromaticContact CZ-CZ 3.41Å; F138-Y164 VanDerWaalsContact CZ-CZ 3.41Å; Y154-Y164 HydrophobicContact CE1-CD1 4.22Å; Y154-Y164 AromaticContact CE1-CE1 3.48Å; Y154-Y164 HydrophobicContact CE1-CE1 3.48Å; Y154-Y164 VanDerWaalsContact CE1-CE1 3.48Å; Y161-Y164 VanDerWaalsContact O-CB 3.26Å; Y161-Y164 WeakPolarHBondContact O-CB 3.43Å; Y161-Y164 PolarHBondContact O-N 3.08Å; Y164-L166 HydrophobicContact CE1-CB 4.29Å; Y164-V191 HydrophobicContact CD1-CG1 3.67Å; Y164-V191 HydrophobicContact CD1-CG2 4.13Å; Y164-V191 HydrophobicContact CE1-CG1 4.43Å; Y164-V191 HydrophobicContact CG-CG1 4.31Å
165	Q	77.7	Confident	77.7	Confident	55 Å²	55	66.3 Å²	66.3	26%	0.257	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	133.4	177.6	-170.5	174.6	-24.8	0	0	109.4	F120 N163 V185	F120-Q165 HydrophobicContact CD1-CB 4.3Å; F120-Q165 WeakPolarHBondContact CD1-O 3.41Å; F120-Q165 HydrophobicContact CE1-CB 3.61Å; F120-Q165 HydrophobicContact CE1-CG 3.87Å; F120-Q165 HydrophobicContact CE2-CB 4.33Å; F120-Q165 HydrophobicContact CZ-CB 3.64Å; F120-Q165 HydrophobicContact CZ-CG 4Å; F120-Q165 PolarHBondContact N-O 3.33Å; F120-Q165 VanDerWaalsContact N-O 3.11Å; F120-Q165 PolarHBondContact O-N 2.89Å; F120-Q165 VanDerWaalsContact O-O 3.12Å; N163-Q165 PolarHBondContact O-N 3.32Å; Q165-V185 HydrophobicContact CG-CG1 3.62Å
166	L	82.1	Confident	77.8	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.3	166.4	176.6	64.3	0	0	0	108	I117 F152 Y164 V185 V186	I117-L166 HydrophobicContact CG2-CD1 4Å; F152-L166 HydrophobicContact CB-CD2 4.06Å; F152-L166 HydrophobicContact CD1-CD1 4.26Å; F152-L166 HydrophobicContact CD1-CD2 3.86Å; F152-L166 HydrophobicContact CD2-CD2 3.53Å; F152-L166 HydrophobicContact CE1-CD1 3.97Å; F152-L166 HydrophobicContact CE1-CD2 4.09Å; F152-L166 HydrophobicContact CE2-CD2 3.81Å; F152-L166 HydrophobicContact CG-CD2 3.52Å; F152-L166 HydrophobicContact CZ-CD1 4.23Å; F152-L166 HydrophobicContact CZ-CD2 4.06Å; Y164-L166 HydrophobicContact CE1-CB 4.29Å; L166-V185 WeakPolarHBondContact O-CA 3.22Å; L166-V186 HydrophobicContact CB-CB 4.37Å; L166-V186 HydrophobicContact CB-CG2 4.2Å; L166-V186 HydrophobicContact CD2-CG2 3.92Å; L166-V186 HydrophobicContact CG-CG2 4.44Å; L166-V186 PolarHBondContact O-N 2.78Å
167	Q	84	Confident	78.1	Confident	42 Å²	42	64.9 Å²	64.9	20%	0.196	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	133.4	171.5	-84.1	171.6	-19.1	0	0	110.1	I117 N118 F120 V169 E183 V185	I117-Q167 CarbonylContact C-O 3.45Å; I117-Q167 WeakPolarHBondContact CA-O 3.35Å; N118-Q167 HydrophobicContact CB-CB 4.14Å; N118-Q167 PolarHBondContact N-O 3.09Å; N118-Q167 PolarHBondContact ND2-OE1 3.29Å; N118-Q167 PolarHBondContact O-N 3.35Å; F120-Q167 HydrophobicContact CE1-CB 4.45Å; F120-Q167 HydrophobicContact CE1-CG 3.77Å; F120-Q167 VanDerWaalsContact CE1-OE1 3.3Å; Q167-V169 HydrophobicContact CB-CG2 4.31Å; Q167-E183 VanDerWaalsContact CD-OE1 3.25Å; Q167-E183 HydrophobicContact CG-CG 4.49Å; Q167-E183 VanDerWaalsContact CG-OE1 3.29Å; Q167-E183 WeakPolarHBondContact CG-OE1 3.39Å; Q167-E183 PolarHBondContact NE2-OE1 2.84Å; Q167-V185 HydrophobicContact CG-CG2 4.22Å
168	F	86	Confident	78.7	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	105.3	176.9	-176.3	-82	0	0	0	108.3	Y56 F90 Y91 I117 I150 F152 I184	Y56-F168 AromaticContact CD2-CE1 3.58Å; Y56-F168 HydrophobicContact CD2-CE1 3.58Å; Y56-F168 HydrophobicContact CD2-CZ 4.01Å; Y56-F168 HydrophobicContact CE1-CZ 4.49Å; Y56-F168 AromaticContact CE2-CE1 3.44Å; Y56-F168 HydrophobicContact CE2-CE1 3.44Å; Y56-F168 VanDerWaalsContact CE2-CE1 3.44Å; Y56-F168 AromaticContact CE2-CZ 3.54Å; Y56-F168 HydrophobicContact CE2-CZ 3.54Å; Y56-F168 HydrophobicContact CG-CE1 4.4Å; Y56-F168 AromaticContact CZ-CZ 3.81Å; F90-F168 HydrophobicContact CD2-CZ 4.12Å; F90-F168 HydrophobicContact CE2-CD2 4.41Å; F90-F168 AromaticContact CE2-CE1 3.98Å; F90-F168 HydrophobicContact CE2-CE1 3.98Å; F90-F168 AromaticContact CE2-CE2 3.53Å; F90-F168 HydrophobicContact CE2-CE2 3.53Å; F90-F168 AromaticContact CE2-CZ 3.25Å; F90-F168 HydrophobicContact CE2-CZ 3.25Å; F90-F168 HydrophobicContact CZ-CD1 4.48Å; F90-F168 AromaticContact CZ-CE1 3.92Å; F90-F168 HydrophobicContact CZ-CE1 3.92Å; F90-F168 HydrophobicContact CZ-CE2 4.04Å; F90-F168 AromaticContact CZ-CZ 3.67Å; F90-F168 HydrophobicContact CZ-CZ 3.67Å; Y91-F168 HydrophobicContact CD2-CE1 4.24Å; Y91-F168 AromaticContact CE2-CD1 3.83Å; Y91-F168 HydrophobicContact CE2-CD1 3.83Å; Y91-F168 AromaticContact CE2-CE1 3.34Å; Y91-F168 HydrophobicContact CE2-CE1 3.34Å; Y91-F168 HydrophobicContact CE2-CZ 4.3Å; Y91-F168 AromaticContact CZ-CD1 3.88Å; Y91-F168 AromaticContact CZ-CE1 3.56Å; Y91-F168 WeakPolarHBondContact OH-CD1 3.4Å; I117-F168 HydrophobicContact CD1-CD2 4.22Å; I117-F168 HydrophobicContact CD1-CE2 4.03Å; I117-F168 HydrophobicContact CG1-CD2 3.76Å; I117-F168 HydrophobicContact CG1-CE2 3.95Å; I150-F168 HydrophobicContact CB-CE2 4.39Å; I150-F168 HydrophobicContact CD1-CE2 3.61Å; I150-F168 HydrophobicContact CD1-CZ 3.82Å; I150-F168 HydrophobicContact CG2-CE2 4.25Å; F152-F168 HydrophobicContact CE2-CD2 4.25Å; F152-F168 HydrophobicContact CZ-CD2 4.15Å; F168-I184 HydrophobicContact CB-CB 4.25Å; F168-I184 HydrophobicContact CD1-CD1 4.03Å; F168-I184 PolarHBondContact N-O 2.82Å; F168-I184 PolarHBondContact O-N 3.03Å
169	V	91.8	Very high	79.5	Confident	12 Å²	12	66.6 Å²	66.6	7%	0.073	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	129.9	-166.1	-169.9	0	0	0	0	111.5	F90 G115 T116 Q167 F171 D181 V182 E183	F90-V169 WeakPolarHBondContact CE1-O 3.34Å; G115-V169 CarbonylContact C-O 3.36Å; G115-V169 WeakPolarHBondContact CA-O 3.29Å; T116-V169 HydrophobicContact CG2-CB 4.01Å; T116-V169 HydrophobicContact CG2-CG2 4.29Å; T116-V169 PolarHBondContact N-O 2.84Å; T116-V169 PolarHBondContact O-N 3.11Å; Q167-V169 HydrophobicContact CB-CG2 4.31Å; V169-F171 HydrophobicContact CB-CE2 4.41Å; V169-F171 HydrophobicContact CB-CZ 4.47Å; V169-F171 HydrophobicContact CG1-CD2 4.49Å; V169-F171 HydrophobicContact CG1-CE1 4.06Å; V169-F171 HydrophobicContact CG1-CE2 3.82Å; V169-F171 HydrophobicContact CG1-CZ 3.58Å; V169-D181 HydrophobicContact CG1-CB 4.32Å; V169-V182 CarbonylContact C-O 3.49Å; V169-V182 VanDerWaalsContact CA-O 3.26Å; V169-V182 WeakPolarHBondContact CA-O 3.35Å; V169-E183 HydrophobicContact CG2-CB 4.26Å; V169-E183 HydrophobicContact CG2-CG 4.04Å
170	G	92.8	Very high	80.9	Confident	0 Å²	0	58 Å²	58	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	141.5	169.3	0	0	0	0	0	111.3	Y91 D181 V182	Y91-G170 VanDerWaalsContact CD2-CA 3.44Å; Y91-G170 VanDerWaalsContact CE2-N 3.28Å; G170-D181 CarbonylContact O-C 3.6Å; G170-D181 WeakPolarHBondContact O-CA 3.3Å; G170-V182 PolarHBondContact N-O 2.79Å; G170-V182 PolarHBondContact O-N 3.17Å
171	F	91.2	Very high	82.2	Confident	68 Å²	68	58.1 Å²	58.1	30%	0.298	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	138.5	177	-61	-81.6	0	0	0	111.1	Y113 I114 V169 V179 D181	Y113-F171 AromaticContact CD1-CD2 4Å; Y113-F171 HydrophobicContact CD1-CD2 4Å; Y113-F171 HydrophobicContact CD1-CE2 4.23Å; Y113-F171 AromaticContact CE1-CD2 3.47Å; Y113-F171 HydrophobicContact CE1-CD2 3.47Å; Y113-F171 VanDerWaalsContact CE1-CD2 3.47Å; Y113-F171 AromaticContact CE1-CE2 3.27Å; Y113-F171 HydrophobicContact CE1-CE2 3.27Å; Y113-F171 HydrophobicContact CE1-CG 4.43Å; Y113-F171 HydrophobicContact CE1-CZ 4.06Å; Y113-F171 AromaticContact CZ-CE2 3.7Å; I114-F171 PolarHBondContact O-N 3.49Å; V169-F171 HydrophobicContact CB-CE2 4.41Å; V169-F171 HydrophobicContact CB-CZ 4.47Å; V169-F171 HydrophobicContact CG1-CD2 4.49Å; V169-F171 HydrophobicContact CG1-CE1 4.06Å; V169-F171 HydrophobicContact CG1-CE2 3.82Å; V169-F171 HydrophobicContact CG1-CZ 3.58Å; F171-V179 HydrophobicContact CD1-CG1 4.39Å; F171-D181 HydrophobicContact CD1-CB 3.9Å; F171-D181 HydrophobicContact CE1-CB 4.01Å
172	F	88.6	Confident	83.5	Confident	30 Å²	30	55.6 Å²	55.6	13%	0.132	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	131.2	-174.2	-53.4	-90.1	0	0	0	110.2	I33 Y54 Y91 V179 R180 V182	I33-F172 HydrophobicContact CD1-CB 3.87Å; I33-F172 HydrophobicContact CD1-CD1 3.76Å; I33-F172 HydrophobicContact CD1-CD2 3.49Å; I33-F172 VanDerWaalsContact CD1-CD2 3.49Å; I33-F172 HydrophobicContact CD1-CE1 4.13Å; I33-F172 HydrophobicContact CD1-CE2 3.9Å; I33-F172 HydrophobicContact CD1-CG 3.41Å; I33-F172 VanDerWaalsContact CD1-CG 3.41Å; I33-F172 HydrophobicContact CD1-CZ 4.18Å; I33-F172 HydrophobicContact CG1-CD2 4.47Å; Y54-F172 AromaticContact CD1-CZ 4Å; Y54-F172 HydrophobicContact CD1-CZ 4Å; Y54-F172 AromaticContact CE1-CE1 3.75Å; Y54-F172 HydrophobicContact CE1-CE1 3.75Å; Y54-F172 HydrophobicContact CE1-CE2 4.44Å; Y54-F172 AromaticContact CE1-CZ 3.63Å; Y54-F172 HydrophobicContact CE1-CZ 3.63Å; Y91-F172 HydrophobicContact CD1-CE2 4.45Å; Y91-F172 AromaticContact CD1-CZ 3.62Å; Y91-F172 HydrophobicContact CD1-CZ 3.62Å; Y91-F172 HydrophobicContact CD2-CZ 4.49Å; Y91-F172 HydrophobicContact CE1-CZ 4.36Å; Y91-F172 HydrophobicContact CG-CE1 4.39Å; Y91-F172 AromaticContact CG-CZ 3.68Å; Y91-F172 HydrophobicContact CG-CZ 3.68Å; F172-V179 CarbonylContact O-C 3.53Å; F172-V179 WeakPolarHBondContact O-CA 3.27Å; F172-R180 HydrophobicContact CB-CB 4.48Å; F172-R180 PolarHBondContact N-O 2.9Å; F172-R180 PolarHBondContact O-N 2.7Å; F172-V182 HydrophobicContact CE2-CB 4.21Å; F172-V182 HydrophobicContact CE2-CG2 3.77Å; F172-V182 HydrophobicContact CZ-CG2 4.48Å
173	L	85.1	Confident	84.8	Confident	139 Å²	139	52.5 Å²	52.5	73%	0.728	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86	122.5	170.5	-66.5	173.4	0	0	0	109.1	V179	L173-V179 HydrophobicContact CD2-CG2 4.12Å
174	C	84.2	Confident	85.9	Confident	17 Å²	17	48 Å²	48	12%	0.115	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-96.3	162.8	174.9	-53.2	0	0	0	0	111.2	C30 G177 G178 R180	C30-C174 HydrophobicContact CB-CB 3.98Å; C30-C174 WeakPolarHBondContact CB-SG 3.5Å; C30-C174 VanDerWaalsContact SG-CA 3.51Å; C30-C174 WeakPolarHBondContact SG-CB 3.4Å; C30-C174 CovalentContact SG-SG 2.03Å; C30-C174 PolarHBondContact SG-SG 3.14Å; C174-G177 PolarHBondContact O-N 2.85Å; C174-G177 VanDerWaalsContact O-N 3.11Å; C174-G178 WeakPolarHBondContact CB-O 3.2Å; C174-G178 PolarHBondContact N-O 2.98Å; C174-R180 WeakPolarHBondContact SG-CG 3.5Å
175	E	81	Confident	86.7	Confident	141 Å²	141	50 Å²	50	66%	0.659	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-57.7	141.9	169.8	-167.5	171.9	-179	0	0	110.8	G177	E175-G177 VanDerWaalsContact C-N 3.29Å
176	G	83.4	Confident	87.2	Confident	85 Å²	85	47.4 Å²	47.4	88%	0.876	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	81.1	2.7	-172	0	0	0	0	0	114.9	G178	G176-G178 VanDerWaalsContact C-N 3.35Å
177	G	82.6	Confident	87.5	Confident	61 Å²	61	51 Å²	51	63%	0.629	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	82.8	8.4	175.6	0	0	0	0	0	114.6	C174 E175	C174-G177 PolarHBondContact O-N 2.85Å; C174-G177 VanDerWaalsContact O-N 3.11Å; E175-G177 VanDerWaalsContact C-N 3.29Å
178	G	85.4	Confident	87.5	Confident	29 Å²	29	55.6 Å²	55.6	30%	0.299	32%	0.319	S	S	.	.			trans	-66	146.1	171.1	0	0	0	0	0	111.1	C174 G176	C174-G178 WeakPolarHBondContact CB-O 3.2Å; C174-G178 PolarHBondContact N-O 2.98Å; G176-G178 VanDerWaalsContact C-N 3.35Å
179	V	85.8	Confident	87.7	Confident	83 Å²	83	59.4 Å²	59.4	50%	0.503	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	139.3	171.4	-175.1	0	0	0	0	108.4	F171 F172 L173	F171-V179 HydrophobicContact CD1-CG1 4.39Å; F172-V179 CarbonylContact O-C 3.53Å; F172-V179 WeakPolarHBondContact O-CA 3.27Å; L173-V179 HydrophobicContact CD2-CG2 4.12Å
180	R	89.1	Confident	87.7	Confident	84 Å²	84	59.1 Å²	59.1	32%	0.317	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	149.4	165	-69	-66.7	-173.5	-75.5	-8.3	109.1	C30 I33 D34 F172 C174	C30-R180 HydrophobicContact CB-CG 4.31Å; I33-R180 HydrophobicContact CG2-CB 4.09Å; D34-R180 VanDerWaalsContact OD1-CD 3.24Å; D34-R180 WeakPolarHBondContact OD1-CD 3.09Å; D34-R180 IonicContact OD1-NE 3.91Å; D34-R180 PolarHBondContact OD1-NE 3.1Å; D34-R180 IonicContact OD2-CZ 2.7Å; D34-R180 IonicContact OD2-NE 3.77Å; D34-R180 PolarHBondContact OD2-NE 3.13Å; D34-R180 VanDerWaalsContact OD2-NE 3.09Å; D34-R180 IonicContact OD2-NH2 3.58Å; D34-R180 PolarHBondContact OD2-NH2 3.38Å; F172-R180 HydrophobicContact CB-CB 4.48Å; F172-R180 PolarHBondContact N-O 2.9Å; F172-R180 PolarHBondContact O-N 2.7Å; C174-R180 WeakPolarHBondContact SG-CG 3.5Å
181	D	89.1	Confident	87.4	Confident	69 Å²	69	59.9 Å²	59.9	37%	0.369	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	149.4	173.3	61.8	-59.4	0	0	0	111	V169 G170 F171	V169-D181 HydrophobicContact CG1-CB 4.32Å; G170-D181 CarbonylContact O-C 3.6Å; G170-D181 WeakPolarHBondContact O-CA 3.3Å; F171-D181 HydrophobicContact CD1-CB 3.9Å; F171-D181 HydrophobicContact CE1-CB 4.01Å
182	V	90.3	Very high	87.2	Confident	0 Å²	0	62 Å²	62	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	112.3	169	177.5	0	0	0	0	106.3	I33 R37 Y54 Y91 V169 G170 F172 I184	I33-V182 HydrophobicContact CB-CG2 4.46Å; I33-V182 HydrophobicContact CG1-CG2 4.23Å; I33-V182 HydrophobicContact CG2-CG2 3.62Å; R37-V182 HydrophobicContact CB-CG1 4.39Å; R37-V182 HydrophobicContact CB-CG2 3.99Å; Y54-V182 HydrophobicContact CD1-CG2 4.1Å; Y54-V182 HydrophobicContact CG-CG2 4.44Å; Y91-V182 HydrophobicContact CE1-CB 4.11Å; Y91-V182 HydrophobicContact CE1-CG1 4.06Å; Y91-V182 PolarHBondContact OH-O 2.83Å; V169-V182 CarbonylContact C-O 3.49Å; V169-V182 VanDerWaalsContact CA-O 3.26Å; V169-V182 WeakPolarHBondContact CA-O 3.35Å; G170-V182 PolarHBondContact N-O 2.79Å; G170-V182 PolarHBondContact O-N 3.17Å; F172-V182 HydrophobicContact CE2-CB 4.21Å; F172-V182 HydrophobicContact CE2-CG2 3.77Å; F172-V182 HydrophobicContact CZ-CG2 4.48Å; V182-I184 HydrophobicContact CG1-CG1 4.33Å
183	E	90.4	Very high	87.3	Confident	84 Å²	84	64.8 Å²	64.8	39%	0.393	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	122.8	176.4	178	178.6	-174.5	0	0	109.5	Q167 V169 V185	Q167-E183 VanDerWaalsContact CD-OE1 3.25Å; Q167-E183 HydrophobicContact CG-CG 4.49Å; Q167-E183 VanDerWaalsContact CG-OE1 3.29Å; Q167-E183 WeakPolarHBondContact CG-OE1 3.39Å; Q167-E183 PolarHBondContact NE2-OE1 2.84Å; V169-E183 HydrophobicContact CG2-CB 4.26Å; V169-E183 HydrophobicContact CG2-CG 4.04Å; E183-V185 HydrophobicContact CG-CG2 3.98Å
184	I	90.8	Very high	87.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.7	172.4	-50.8	170.7	0	0	0	109.2	Y53 F168 V182 Y199	Y53-I184 HydrophobicContact CD1-CD1 4.1Å; Y53-I184 HydrophobicContact CD1-CG1 3.77Å; Y53-I184 HydrophobicContact CD1-CG2 4.46Å; Y53-I184 HydrophobicContact CD2-CD1 3.75Å; Y53-I184 HydrophobicContact CD2-CG1 4.18Å; Y53-I184 HydrophobicContact CD2-CG2 4.16Å; Y53-I184 HydrophobicContact CE1-CB 4.44Å; Y53-I184 HydrophobicContact CE1-CG1 4.02Å; Y53-I184 HydrophobicContact CE1-CG2 3.93Å; Y53-I184 HydrophobicContact CE2-CD1 4.29Å; Y53-I184 HydrophobicContact CE2-CG1 4.38Å; Y53-I184 HydrophobicContact CE2-CG2 3.57Å; Y53-I184 HydrophobicContact CG-CD1 3.64Å; Y53-I184 HydrophobicContact CG-CG1 3.87Å; Y53-I184 VanDerWaalsContact CZ-CG2 3.44Å; F168-I184 HydrophobicContact CB-CB 4.25Å; F168-I184 HydrophobicContact CD1-CD1 4.03Å; F168-I184 PolarHBondContact N-O 2.82Å; F168-I184 PolarHBondContact O-N 3.03Å; V182-I184 HydrophobicContact CG1-CG1 4.33Å; I184-Y199 HydrophobicContact CB-CE1 4.18Å; I184-Y199 HydrophobicContact CD1-CD1 4.2Å; I184-Y199 HydrophobicContact CD1-CE1 3.92Å; I184-Y199 HydrophobicContact CG2-CE1 3.68Å
185	V	88.9	Confident	88	Confident	50 Å²	50	57.7 Å²	57.7	30%	0.303	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	135.7	179.5	178.5	0	0	0	0	110.2	R58 Q165 L166 Q167 E183	R58-V185 PolarHBondContact NH1-O 3.5Å; Q165-V185 HydrophobicContact CG-CG1 3.62Å; L166-V185 WeakPolarHBondContact O-CA 3.22Å; Q167-V185 HydrophobicContact CG-CG2 4.22Å; E183-V185 HydrophobicContact CG-CG2 3.98Å
186	V	89.2	Confident	88.6	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.012	30%	0.298	C	S	.	.			trans	-84.1	121.3	168.3	178.5	0	0	0	0	109.2	I60 L166 W190 V191 V197	I60-V186 HydrophobicContact CD1-CG1 4.07Å; L166-V186 HydrophobicContact CB-CB 4.37Å; L166-V186 HydrophobicContact CB-CG2 4.2Å; L166-V186 HydrophobicContact CD2-CG2 3.92Å; L166-V186 HydrophobicContact CG-CG2 4.44Å; L166-V186 PolarHBondContact O-N 2.78Å; V186-W190 HydrophobicContact CG1-CB 3.96Å; V186-V191 HydrophobicContact CG1-CG2 4.35Å; V186-V197 HydrophobicContact CG1-CG2 4.42Å; V186-V197 HydrophobicContact CG2-CG1 4.08Å; V186-V197 HydrophobicContact CG2-CG2 4.33Å
187	D	88	Confident	89.1	Confident	75 Å²	75	47.5 Å²	47.5	40%	0.401	26%	0.257	S	S	.	.			trans	-61.1	138.7	176.3	-171.9	-67.1	0	0	0	110.7	K189 W190	D187-K189 HydrophobicContact CB-CD 4.45Å; D187-K189 HydrophobicContact CB-CG 4.16Å; D187-K189 PolarHBondContact O-N 2.96Å; D187-K189 VanDerWaalsContact OD1-CB 3.32Å; D187-K189 WeakPolarHBondContact OD1-CB 3.26Å; D187-K189 VanDerWaalsContact OD1-CG 3.23Å; D187-K189 WeakPolarHBondContact OD1-CG 3.44Å; D187-K189 PolarHBondContact OD1-N 3.43Å; D187-W190 WeakPolarHBondContact O-CB 3.25Å; D187-W190 PolarHBondContact O-N 3.35Å
188	K	85.1	Confident	89.7	Confident	138 Å²	138	45.4 Å²	45.4	60%	0.6	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-52.3	-28.1	179.2	65.7	178.7	-176.6	175	0	114	W190 V191	K188-W190 PolarHBondContact O-N 3.33Å; K188-V191 PolarHBondContact O-N 3.2Å; K188-V191 VanDerWaalsContact O-N 3.08Å
189	K	88.9	Confident	90.1	Very high	80 Å²	80	44 Å²	44	35%	0.348	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-60.4	-25.5	178.1	77.5	-169.6	179.1	-177.8	0	112.7	E44 E49 D187 K192	E44-K189 IonicContact OE1-NZ 2.6Å; E44-K189 PolarHBondContact OE1-NZ 3.31Å; E44-K189 IonicContact OE2-NZ 3.79Å; E49-K189 IonicContact OE2-NZ 3.39Å; E49-K189 PolarHBondContact OE2-NZ 3.03Å; D187-K189 HydrophobicContact CB-CD 4.45Å; D187-K189 HydrophobicContact CB-CG 4.16Å; D187-K189 PolarHBondContact O-N 2.96Å; D187-K189 VanDerWaalsContact OD1-CB 3.32Å; D187-K189 WeakPolarHBondContact OD1-CB 3.26Å; D187-K189 VanDerWaalsContact OD1-CG 3.23Å; D187-K189 WeakPolarHBondContact OD1-CG 3.44Å; D187-K189 PolarHBondContact OD1-N 3.43Å; K189-K192 WeakPolarHBondContact O-CE 3.24Å; K189-K192 PolarHBondContact O-NZ 2.82Å
190	W	91.3	Very high	90.5	Very high	7 Å²	7	40.5 Å²	40.5	3%	0.027	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-92.7	-12.3	178.8	-60.7	121.9	0	0	0	113.3	E44 E49 I60 L62 V186 D187 K188 K192 T195	E44-W190 HydrophobicContact CG-CZ2 4.26Å; E49-W190 HydrophobicContact CB-CH2 4.27Å; E49-W190 HydrophobicContact CB-CZ2 3.57Å; E49-W190 VanDerWaalsContact CD-NE1 3.32Å; E49-W190 HydrophobicContact CG-CZ2 4.31Å; E49-W190 PolarHBondContact OE1-NE1 3.44Å; E49-W190 PolarHBondContact OE2-NE1 3.2Å; I60-W190 HydrophobicContact CB-CD2 4.49Å; I60-W190 HydrophobicContact CD1-CB 4.1Å; I60-W190 HydrophobicContact CD1-CD2 4.37Å; I60-W190 HydrophobicContact CD1-CG 3.75Å; I60-W190 HydrophobicContact CG2-CB 4Å; I60-W190 HydrophobicContact CG2-CD2 3.74Å; I60-W190 HydrophobicContact CG2-CE3 3.73Å; I60-W190 HydrophobicContact CG2-CG 3.86Å; L62-W190 HydrophobicContact CD1-CE3 4.29Å; L62-W190 HydrophobicContact CD1-CZ3 4Å; L62-W190 HydrophobicContact CD2-CE3 3.81Å; L62-W190 HydrophobicContact CD2-CZ3 4.24Å; L62-W190 HydrophobicContact CG-CE3 4Å; L62-W190 HydrophobicContact CG-CZ3 3.91Å; V186-W190 HydrophobicContact CG1-CB 3.96Å; D187-W190 WeakPolarHBondContact O-CB 3.25Å; D187-W190 PolarHBondContact O-N 3.35Å; K188-W190 PolarHBondContact O-N 3.33Å; W190-K192 VanDerWaalsContact C-N 3.33Å; W190-K192 PolarHBondContact O-N 2.74Å; W190-T195 WeakPolarHBondContact O-CB 3.45Å; W190-T195 VanDerWaalsContact O-CG2 3.22Å; W190-T195 WeakPolarHBondContact O-CG2 3.39Å; W190-T195 PolarHBondContact O-OG1 2.96Å; W190-T195 VanDerWaalsContact O-OG1 3.13Å
191	V	87.1	Confident	90.6	Very high	15 Å²	15	38.1 Å²	38.1	9%	0.091	19%	0.189	C	C	.	.			trans	-80.2	83	-178.6	-175.2	0	0	0	0	109.7	F138 Y154 V157 Y164 V186 K188	F138-V191 HydrophobicContact CE2-CG1 3.96Å; F138-V191 HydrophobicContact CZ-CG1 4.26Å; Y154-V191 HydrophobicContact CD1-CG1 4.36Å; Y154-V191 HydrophobicContact CE1-CG1 4.24Å; V157-V191 HydrophobicContact CG1-CG1 4.41Å; Y164-V191 HydrophobicContact CD1-CG1 3.67Å; Y164-V191 HydrophobicContact CD1-CG2 4.13Å; Y164-V191 HydrophobicContact CE1-CG1 4.43Å; Y164-V191 HydrophobicContact CG-CG1 4.31Å; V186-V191 HydrophobicContact CG1-CG2 4.35Å; K188-V191 PolarHBondContact O-N 3.2Å; K188-V191 VanDerWaalsContact O-N 3.08Å
192	K	87.8	Confident	90.7	Very high	112 Å²	112	35.1 Å²	35.1	49%	0.487	17%	0.173	S	C	.	.	S	Bend	trans	-139.9	156.6	-179.3	-63.4	175.5	-176.7	162.3	0	110.6	Y154 K189 W190 G194 T195	Y154-K192 WeakPolarHBondContact CB-O 3.26Å; K189-K192 WeakPolarHBondContact O-CE 3.24Å; K189-K192 PolarHBondContact O-NZ 2.82Å; W190-K192 VanDerWaalsContact C-N 3.33Å; W190-K192 PolarHBondContact O-N 2.74Å; K192-G194 PolarHBondContact O-N 3.09Å; K192-T195 VanDerWaalsContact O-CB 3.23Å; K192-T195 WeakPolarHBondContact O-CB 3.47Å; K192-T195 PolarHBondContact O-N 2.94Å; K192-T195 PolarHBondContact O-OG1 2.79Å
193	N	89.3	Confident	90.6	Very high	89 Å²	89	36.6 Å²	36.6	48%	0.476	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	139.1	173.2	-173.2	15.5	0	0	0	111.5	Y154 D155 T195	Y154-N193 CarbonylContact O-C 3.56Å; Y154-N193 PolarHBondContact O-OD1 3.15Å; D155-N193 VanDerWaalsContact O-CG 3.3Å; D155-N193 PolarHBondContact O-OD1 3.33Å; N193-T195 VanDerWaalsContact C-N 3.28Å; N193-T195 PolarHBondContact O-N 2.86Å
194	G	91.7	Very high	90.5	Very high	7 Å²	7	37.8 Å²	37.8	7%	0.072	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.1	16.9	-179.6	0	0	0	0	0	113.2	L62 N63 Q64 Y154 K192	L62-G194 CarbonylContact C-O 3.59Å; N63-G194 PolarHBondContact N-O 3.16Å; Q64-G194 PolarHBondContact N-O 3.31Å; Y154-G194 PolarHBondContact O-N 3.1Å; K192-G194 PolarHBondContact O-N 3.09Å
195	T	93.5	Very high	90.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	128.3	177.4	-53.9	0	0	0	0	110.5	I60 R61 L62 Y153 Y154 W190 K192 N193 V197	I60-T195 HydrophobicContact CG2-CG2 3.78Å; R61-T195 WeakPolarHBondContact O-CA 3.07Å; L62-T195 HydrophobicContact CD2-CG2 3.85Å; L62-T195 WeakPolarHBondContact CD2-OG1 3.4Å; Y153-T195 WeakPolarHBondContact CA-O 3.4Å; Y154-T195 HydrophobicContact CD2-CG2 4.05Å; Y154-T195 WeakPolarHBondContact CD2-O 3.47Å; Y154-T195 HydrophobicContact CE2-CG2 4.4Å; Y154-T195 PolarHBondContact N-O 2.98Å; W190-T195 WeakPolarHBondContact O-CB 3.45Å; W190-T195 VanDerWaalsContact O-CG2 3.22Å; W190-T195 WeakPolarHBondContact O-CG2 3.39Å; W190-T195 PolarHBondContact O-OG1 2.96Å; W190-T195 VanDerWaalsContact O-OG1 3.13Å; K192-T195 VanDerWaalsContact O-CB 3.23Å; K192-T195 WeakPolarHBondContact O-CB 3.47Å; K192-T195 PolarHBondContact O-N 2.94Å; K192-T195 PolarHBondContact O-OG1 2.79Å; N193-T195 VanDerWaalsContact C-N 3.28Å; N193-T195 PolarHBondContact O-N 2.86Å; T195-V197 HydrophobicContact CG2-CG2 4.3Å
196	L	94	Very high	90.5	Very high	12 Å²	12	37.1 Å²	37.1	6%	0.063	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	126.2	174.3	-179	61.6	0	0	0	109.1	I60 R61 Q64 P67 F152 Y153 E198	I60-L196 CarbonylContact C-O 3.58Å; I60-L196 WeakPolarHBondContact CA-O 3.3Å; R61-L196 PolarHBondContact N-O 3.24Å; R61-L196 PolarHBondContact O-N 2.99Å; Q64-L196 HydrophobicContact CB-CB 3.91Å; Q64-L196 HydrophobicContact CB-CD2 4.47Å; Q64-L196 HydrophobicContact CG-CB 3.81Å; Q64-L196 HydrophobicContact CG-CD2 4.41Å; P67-L196 HydrophobicContact CG-CD1 4.21Å; F152-L196 CarbonylContact O-C 3.51Å; F152-L196 WeakPolarHBondContact O-CA 3.3Å; Y153-L196 HydrophobicContact CD2-CB 4.28Å; Y153-L196 HydrophobicContact CD2-CD1 4.36Å; L196-E198 HydrophobicContact CD1-CG 4.2Å; L196-E198 HydrophobicContact CD2-CG 4.2Å; L196-E198 HydrophobicContact CG-CG 3.88Å
197	V	94.1	Very high	90.5	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	121.9	175.2	-177.4	0	0	0	0	107.8	R58 M59 I60 S151 F152 Y154 V186 T195 Y199	R58-V197 HydrophobicContact CG-CG1 3.74Å; M59-V197 CarbonylContact O-C 3.6Å; M59-V197 WeakPolarHBondContact O-CA 3.25Å; I60-V197 HydrophobicContact CD1-CG1 4.48Å; I60-V197 HydrophobicContact CD1-CG2 4.3Å; I60-V197 HydrophobicContact CG1-CB 4.38Å; I60-V197 HydrophobicContact CG1-CG1 3.98Å; I60-V197 HydrophobicContact CG1-CG2 4.01Å; I60-V197 HydrophobicContact CG2-CG2 4.38Å; S151-V197 CarbonylContact C-O 3.58Å; S151-V197 VanDerWaalsContact CA-O 3.3Å; S151-V197 WeakPolarHBondContact CA-O 3.33Å; F152-V197 HydrophobicContact CB-CB 4.2Å; F152-V197 HydrophobicContact CD2-CB 4.48Å; F152-V197 HydrophobicContact CD2-CG1 4.49Å; F152-V197 PolarHBondContact N-O 3.4Å; F152-V197 PolarHBondContact O-N 3.11Å; Y154-V197 HydrophobicContact CE2-CG2 3.84Å; V186-V197 HydrophobicContact CG1-CG2 4.42Å; V186-V197 HydrophobicContact CG2-CG1 4.08Å; V186-V197 HydrophobicContact CG2-CG2 4.33Å; T195-V197 HydrophobicContact CG2-CG2 4.3Å; V197-Y199 HydrophobicContact CG1-CD2 4.2Å; V197-Y199 HydrophobicContact CG1-CE2 3.49Å; V197-Y199 VanDerWaalsContact CG1-CE2 3.49Å
198	E	94.2	Very high	90.7	Very high	17 Å²	17	39.8 Å²	39.8	8%	0.079	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	127.1	-178	-59.6	175.4	101.1	0	0	110.1	R58 M59 R61 L196 N238 N241	R58-E198 CarbonylContact C-O 3.6Å; R58-E198 VanDerWaalsContact CA-O 3.27Å; R58-E198 WeakPolarHBondContact CA-O 3.14Å; M59-E198 PolarHBondContact N-O 2.94Å; M59-E198 PolarHBondContact O-N 3.1Å; R61-E198 IonicContact CZ-OE2 3.79Å; R61-E198 IonicContact NE-OE2 3.7Å; R61-E198 IonicContact NH2-OE1 2.71Å; R61-E198 IonicContact NH2-OE2 2.96Å; R61-E198 PolarHBondContact NH2-OE2 2.84Å; L196-E198 HydrophobicContact CD1-CG 4.2Å; L196-E198 HydrophobicContact CD2-CG 4.2Å; L196-E198 HydrophobicContact CG-CG 3.88Å; E198-N238 PolarHBondContact OE1-ND2 3.04Å; E198-N241 PolarHBondContact OE2-ND2 2.8Å; E198-N241 PolarHBondContact OE2-OD1 3.48Å
199	Y	94	Very high	91	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	112.7	172.5	-64.5	-94.5	0	0	0	108.3	S57 R58 T149 I150 F152 I184 V197	S57-Y199 CarbonylContact O-C 3.59Å; S57-Y199 WeakPolarHBondContact O-CA 3.3Å; R58-Y199 HydrophobicContact CB-CD1 4.06Å; R58-Y199 HydrophobicContact CB-CE1 3.93Å; R58-Y199 WeakPolarHBondContact CD-OH 3.25Å; R58-Y199 HydrophobicContact CG-CD1 4.21Å; R58-Y199 HydrophobicContact CG-CE1 3.84Å; R58-Y199 HydrophobicContact CG-CE2 4.39Å; T149-Y199 CarbonylContact C-O 3.5Å; T149-Y199 VanDerWaalsContact CA-O 3.29Å; T149-Y199 WeakPolarHBondContact CA-O 2.97Å; T149-Y199 WeakPolarHBondContact CG2-O 3.24Å; I150-Y199 PolarHBondContact N-O 2.83Å; I150-Y199 PolarHBondContact O-N 3.09Å; F152-Y199 AromaticContact CD2-CD2 3.72Å; F152-Y199 HydrophobicContact CD2-CD2 3.72Å; F152-Y199 AromaticContact CD2-CE2 3.46Å; F152-Y199 HydrophobicContact CD2-CE2 3.46Å; F152-Y199 VanDerWaalsContact CD2-CE2 3.46Å; F152-Y199 AromaticContact CE2-CD2 3.44Å; F152-Y199 HydrophobicContact CE2-CD2 3.44Å; F152-Y199 VanDerWaalsContact CE2-CD2 3.44Å; F152-Y199 AromaticContact CE2-CE2 3.29Å; F152-Y199 HydrophobicContact CE2-CE2 3.29Å; I184-Y199 HydrophobicContact CB-CE1 4.18Å; I184-Y199 HydrophobicContact CD1-CD1 4.2Å; I184-Y199 HydrophobicContact CD1-CE1 3.92Å; I184-Y199 HydrophobicContact CG2-CE1 3.68Å; V197-Y199 HydrophobicContact CG1-CD2 4.2Å; V197-Y199 HydrophobicContact CG1-CE2 3.49Å; V197-Y199 VanDerWaalsContact CG1-CE2 3.49Å
200	E	93.7	Very high	91.2	Very high	10 Å²	10	37.2 Å²	37.2	5%	0.047	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	138.7	179.2	-174.5	173.6	-160.4	0	0	109.3	Y56 S57 S202 V235 N237 N238 K245	Y56-E200 CarbonylContact C-O 3.49Å; Y56-E200 VanDerWaalsContact CA-O 3.31Å; Y56-E200 WeakPolarHBondContact CA-O 3.48Å; S57-E200 PolarHBondContact N-O 3.24Å; S57-E200 PolarHBondContact O-N 2.74Å; S57-E200 PolarHBondContact OG-O 3.27Å; E200-S202 PolarHBondContact O-N 3.09Å; E200-V235 HydrophobicContact CB-CG1 4.39Å; E200-V235 HydrophobicContact CG-CG1 4Å; E200-V235 HydrophobicContact CG-CG2 4.21Å; E200-N237 WeakPolarHBondContact OE1-CA 3.35Å; E200-N237 WeakPolarHBondContact OE1-CB 3.17Å; E200-N237 PolarHBondContact OE1-N 3.21Å; E200-N237 PolarHBondContact OE1-ND2 2.73Å; E200-N238 PolarHBondContact OE1-N 2.94Å; E200-K245 IonicContact OE2-NZ 2.86Å; E200-K245 PolarHBondContact OE2-NZ 2.87Å
201	V	92.1	Very high	91.3	Very high	34 Å²	34	39.7 Å²	39.7	21%	0.206	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	119.4	173.7	179.2	0	0	0	0	108.5	Y55 Y56 G203	Y55-V201 HydrophobicContact CE1-CG1 3.92Å; Y55-V201 HydrophobicContact CE1-CG2 4.02Å; Y56-V201 HydrophobicContact CD1-CG2 4.39Å; Y56-V201 HydrophobicContact CE1-CG2 3.92Å; V201-G203 VanDerWaalsContact C-N 3.25Å; V201-G203 PolarHBondContact O-N 3.17Å
202	S	90.7	Very high	91.6	Very high	5 Å²	5	44.9 Å²	44.9	4%	0.035	25%	0.245	C	C	.	.			trans	-67.6	-25.8	-176.1	-68.3	0	0	0	0	113.1	Y55 Y56 S57 E200 C205	Y55-S202 WeakPolarHBondContact O-CB 3.1Å; Y55-S202 PolarHBondContact O-N 3.26Å; Y55-S202 PolarHBondContact O-OG 3.19Å; Y56-S202 PolarHBondContact O-OG 3.16Å; S57-S202 PolarHBondContact N-OG 3.36Å; S57-S202 VanDerWaalsContact N-OG 3.16Å; E200-S202 PolarHBondContact O-N 3.09Å; S202-C205 PolarHBondContact O-N 3.21Å
203	G	87.5	Confident	91.9	Very high	31 Å²	31	42.1 Å²	42.1	32%	0.32	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	-142.6	-169.2	0	0	0	0	0	111.6	V201	V201-G203 VanDerWaalsContact C-N 3.25Å; V201-G203 PolarHBondContact O-N 3.17Å
204	D	88.3	Confident	92.1	Very high	109 Å²	109	37.9 Å²	37.9	58%	0.583	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.7	1.5	-176.7	-60.4	-19.4	0	0	0	113	A206 I207	D204-A206 PolarHBondContact O-N 2.8Å; D204-A206 VanDerWaalsContact O-N 3.11Å; D204-I207 HydrophobicContact CB-CD1 4.02Å; D204-I207 VanDerWaalsContact O-CB 3.29Å; D204-I207 WeakPolarHBondContact O-CB 3.38Å; D204-I207 PolarHBondContact O-N 3.47Å
205	C	92.3	Very high	92	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-53.4	-42	-173.3	-64.3	0	0	0	0	112.1	S202 I207 H208 T222 C224 C233	S202-C205 PolarHBondContact O-N 3.21Å; C205-I207 PolarHBondContact O-N 3.05Å; C205-I207 VanDerWaalsContact O-N 3.1Å; C205-H208 PolarHBondContact O-CD2 3.08Å; C205-H208 PolarHBondContact O-N 3.35Å; C205-H208 VanDerWaalsContact O-N 3.12Å; C205-T222 VanDerWaalsContact SG-CG2 3.59Å; C205-C224 WeakPolarHBondContact CA-SG 3.44Å; C205-C224 HydrophobicContact CB-CB 3.85Å; C205-C224 WeakPolarHBondContact CB-SG 3.4Å; C205-C224 VanDerWaalsContact SG-CA 3.56Å; C205-C224 WeakPolarHBondContact SG-CB 3.47Å; C205-C224 CovalentContact SG-SG 2.04Å; C205-C224 PolarHBondContact SG-SG 2.76Å; C205-C233 WeakPolarHBondContact O-CB 3.47Å; C205-C233 PolarHBondContact O-SG 2.75Å
206	A	88.9	Confident	91.8	Very high	37 Å²	37	48.6 Å²	48.6	31%	0.306	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-62.4	-18.7	-178.8	0	0	0	0	0	114.7	D204 H208	D204-A206 PolarHBondContact O-N 2.8Å; D204-A206 VanDerWaalsContact O-N 3.11Å; A206-H208 VanDerWaalsContact C-N 3.33Å
207	I	87.9	Confident	91.3	Very high	88 Å²	88	49.1 Å²	49.1	45%	0.451	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-74.2	-28.2	179.4	-58.2	176.3	0	0	0	110.7	D204 C205 N209	D204-I207 HydrophobicContact CB-CD1 4.02Å; D204-I207 VanDerWaalsContact O-CB 3.29Å; D204-I207 WeakPolarHBondContact O-CB 3.38Å; D204-I207 PolarHBondContact O-N 3.47Å; C205-I207 PolarHBondContact O-N 3.05Å; C205-I207 VanDerWaalsContact O-N 3.1Å; I207-N209 PolarHBondContact O-N 3.48Å
208	H	91.8	Very high	90.6	Very high	45 Å²	45	52.1 Å²	52.1	21%	0.208	30%	0.303	C	S	.	.			trans	-78.2	114.5	-179.3	-53.8	-58.5	0	0	0	110.9	C205 A206 C214 S217 C233	C205-H208 PolarHBondContact O-CD2 3.08Å; C205-H208 PolarHBondContact O-N 3.35Å; C205-H208 VanDerWaalsContact O-N 3.12Å; A206-H208 VanDerWaalsContact C-N 3.33Å; H208-C214 HydrophobicContact CB-CB 4.07Å; H208-S217 VanDerWaalsContact CD2-CB 3.43Å; H208-S217 WeakPolarHBondContact CD2-CB 3.42Å; H208-S217 PolarHBondContact CD2-OG 3.25Å; H208-S217 VanDerWaalsContact CE1-CB 3.46Å; H208-S217 WeakPolarHBondContact CE1-CB 3.47Å; H208-S217 WeakPolarHBondContact NE2-CB 3.44Å; H208-S217 PolarHBondContact NE2-OG 2.8Å; H208-C233 HydrophobicContact CB-CB 4.04Å; H208-C233 VanDerWaalsContact O-CB 3.25Å; H208-C233 WeakPolarHBondContact O-CB 3.06Å
209	N	92	Very high	89.9	Confident	134 Å²	134	55.2 Å²	55.2	72%	0.717	32%	0.323	S	S	*	.			trans	-103.1	7.5	-174	66.3	-0.1	0	0	0	113.6	I207 W226	I207-N209 PolarHBondContact O-N 3.48Å; N209-W226 WeakPolarHBondContact O-CH2 3.37Å
210	S	93.3	Very high	88.9	Confident	30 Å²	30	60.8 Å²	60.8	21%	0.21	36%	0.362	C	S	.	.	S	Bend	trans	-134.9	159	174.7	92.9	0	0	0	0	111.2	E212 T213 C214 W226	S210-E212 VanDerWaalsContact C-N 3.29Å; S210-E212 VanDerWaalsContact CB-OE2 3.26Å; S210-E212 WeakPolarHBondContact CB-OE2 3.45Å; S210-E212 PolarHBondContact O-N 3.05Å; S210-E212 PolarHBondContact OG-N 3.22Å; S210-E212 PolarHBondContact OG-OE2 3.08Å; S210-T213 PolarHBondContact N-OG1 3.45Å; S210-T213 PolarHBondContact O-N 3.27Å; S210-T213 PolarHBondContact O-OG1 2.9Å; S210-T213 PolarHBondContact OG-N 2.94Å; S210-T213 PolarHBondContact OG-OG1 3.37Å; S210-C214 VanDerWaalsContact O-CB 3.25Å; S210-C214 WeakPolarHBondContact O-CB 3.35Å; S210-C214 PolarHBondContact O-N 3.21Å; S210-W226 VanDerWaalsContact C-CZ3 3.43Å; S210-W226 WeakPolarHBondContact O-CZ3 3.45Å
211	I	93.4	Very high	88.1	Confident	58 Å²	58	66.7 Å²	66.7	30%	0.297	39%	0.394	S	S	.	.	H	α-helix	trans	-56.7	-47.2	177	-64.3	167.7	0	0	0	110.3	C214 Q215 W226	I211-C214 PolarHBondContact O-N 2.99Å; I211-Q215 HydrophobicContact CG2-CG 4.29Å; I211-Q215 WeakPolarHBondContact O-CB 3.07Å; I211-Q215 VanDerWaalsContact O-CG 3.29Å; I211-Q215 WeakPolarHBondContact O-CG 3.43Å; I211-Q215 PolarHBondContact O-N 2.02Å; I211-W226 HydrophobicContact CB-CD2 4.44Å; I211-W226 HydrophobicContact CB-CG 4.36Å; I211-W226 VanDerWaalsContact CG1-CD1 3.5Å; I211-W226 HydrophobicContact CG1-CD2 3.79Å; I211-W226 HydrophobicContact CG1-CG 3.73Å; I211-W226 HydrophobicContact CG1-CZ2 4.16Å; I211-W226 VanDerWaalsContact CG1-NE1 3.34Å
212	E	93.3	Very high	87.8	Confident	125 Å²	125	66.5 Å²	66.5	58%	0.584	39%	0.393	S	S	*	.	H	α-helix	trans	-65.9	-44.1	-174.3	-53.7	73.1	-158.1	0	0	111.1	S210 S216	S210-E212 VanDerWaalsContact C-N 3.29Å; S210-E212 VanDerWaalsContact CB-OE2 3.26Å; S210-E212 WeakPolarHBondContact CB-OE2 3.45Å; S210-E212 PolarHBondContact O-N 3.05Å; S210-E212 PolarHBondContact OG-N 3.22Å; S210-E212 PolarHBondContact OG-OE2 3.08Å; E212-S216 WeakPolarHBondContact O-CB 3.44Å; E212-S216 PolarHBondContact O-N 3.43Å; E212-S216 VanDerWaalsContact O-N 3.13Å; E212-S216 PolarHBondContact O-OG 3.3Å
213	T	94.2	Very high	87.9	Confident	53 Å²	53	71.4 Å²	71.4	33%	0.325	41%	0.413	S	S	.	.	H	α-helix	trans	-68.7	-36.5	177.8	54.1	0	0	0	0	111.7	S210 S216 S217	S210-T213 PolarHBondContact N-OG1 3.45Å; S210-T213 PolarHBondContact O-N 3.27Å; S210-T213 PolarHBondContact O-OG1 2.9Å; S210-T213 PolarHBondContact OG-N 2.94Å; S210-T213 PolarHBondContact OG-OG1 3.37Å; T213-S216 PolarHBondContact O-OG 2.95Å; T213-S217 WeakPolarHBondContact O-CB 3.42Å; T213-S217 PolarHBondContact O-N 2.85Å
214	C	94.4	Very high	88.2	Confident	1 Å²	1	71 Å²	71	1%	0.007	41%	0.406	C	S	.	.	H	α-helix	trans	-69.1	-41.2	176.8	-176.2	0	0	0	0	113.1	H208 S210 I211 S217 W226 C233	H208-C214 HydrophobicContact CB-CB 4.07Å; S210-C214 VanDerWaalsContact O-CB 3.25Å; S210-C214 WeakPolarHBondContact O-CB 3.35Å; S210-C214 PolarHBondContact O-N 3.21Å; I211-C214 PolarHBondContact O-N 2.99Å; C214-S217 PolarHBondContact O-OG 2.9Å; C214-W226 HydrophobicContact CB-CB 4.38Å; C214-W226 HydrophobicContact CB-CE3 3.71Å; C214-W226 HydrophobicContact CB-CZ3 4.45Å; C214-C233 VanDerWaalsContact CA-SG 3.51Å; C214-C233 HydrophobicContact CB-CB 3.57Å; C214-C233 WeakPolarHBondContact CB-SG 3.39Å; C214-C233 VanDerWaalsContact SG-CA 3.53Å; C214-C233 WeakPolarHBondContact SG-CB 3.22Å; C214-C233 CovalentContact SG-SG 2.03Å; C214-C233 PolarHBondContact SG-SG 3.47Å
215	Q	89.4	Confident	88.4	Confident	136 Å²	136	68.2 Å²	68.2	64%	0.636	39%	0.388	S	S	*	.	H	α-helix	trans	-74.7	-29	-178.5	-72.7	176.6	-17.7	0	0	112.6	I211	I211-Q215 HydrophobicContact CG2-CG 4.29Å; I211-Q215 WeakPolarHBondContact O-CB 3.07Å; I211-Q215 VanDerWaalsContact O-CG 3.29Å; I211-Q215 WeakPolarHBondContact O-CG 3.43Å; I211-Q215 PolarHBondContact O-N 2.02Å
216	S	88.6	Confident	88.5	Confident	95 Å²	95	69 Å²	69	66%	0.664	39%	0.392	S	S	*	.	H	α-helix	trans	-87.9	-6.5	179.6	57.9	0	0	0	0	114.5	E212 T213	E212-S216 WeakPolarHBondContact O-CB 3.44Å; E212-S216 PolarHBondContact O-N 3.43Å; E212-S216 VanDerWaalsContact O-N 3.13Å; E212-S216 PolarHBondContact O-OG 3.3Å; T213-S216 PolarHBondContact O-OG 2.95Å
217	S	84.1	Confident	88.8	Confident	23 Å²	23	67.3 Å²	67.3	16%	0.161	38%	0.377	C	S	.	.			trans	-87.4	-0.7	-175.2	65.7	0	0	0	0	115.5	H208 T213 C214 T219 C224	H208-S217 VanDerWaalsContact CD2-CB 3.43Å; H208-S217 WeakPolarHBondContact CD2-CB 3.42Å; H208-S217 PolarHBondContact CD2-OG 3.25Å; H208-S217 VanDerWaalsContact CE1-CB 3.46Å; H208-S217 WeakPolarHBondContact CE1-CB 3.47Å; H208-S217 WeakPolarHBondContact NE2-CB 3.44Å; H208-S217 PolarHBondContact NE2-OG 2.8Å; T213-S217 WeakPolarHBondContact O-CB 3.42Å; T213-S217 PolarHBondContact O-N 2.85Å; C214-S217 PolarHBondContact O-OG 2.9Å; S217-T219 WeakPolarHBondContact O-CG2 3.44Å; S217-T219 PolarHBondContact O-N 3.05Å; S217-T219 VanDerWaalsContact O-N 3.13Å; S217-C224 PolarHBondContact OG-SG 2.88Å
218	A	79.7	Confident	89.1	Confident	64 Å²	64	68.4 Å²	68.4	53%	0.529	38%	0.38	S	S	.	.			trans	-56	121	-179.2	0	0	0	0	0	111.1
219	T	78.3	Confident	89.1	Confident	82 Å²	82	73.3 Å²	73.3	50%	0.503	40%	0.397	S	S	.	.			trans	-103.6	178	173.9	67.2	0	0	0	0	110.6	S217 N221 T222	S217-T219 WeakPolarHBondContact O-CG2 3.44Å; S217-T219 PolarHBondContact O-N 3.05Å; S217-T219 VanDerWaalsContact O-N 3.13Å; T219-N221 PolarHBondContact O-N 2.81Å; T219-N221 PolarHBondContact OG1-N 3.34Å; T219-T222 PolarHBondContact N-O 2.82Å; T219-T222 PolarHBondContact OG1-N 2.81Å; T219-T222 PolarHBondContact OG1-O 2.96Å
220	S	72.8	Confident	89.2	Confident	116 Å²	116	68 Å²	68	81%	0.811	37%	0.372	S	S	*	.	S	Bend	trans	-60	-27.1	174.5	55.5	0	0	0	0	113.4
221	N	76.7	Confident	89.2	Confident	134 Å²	134	72.1 Å²	72.1	72%	0.717	39%	0.392	S	S	*	.	S	Bend	trans	-111.6	-22.9	-170.9	-61.6	-12.8	0	0	0	113	T219 N237	T219-N221 PolarHBondContact O-N 2.81Å; T219-N221 PolarHBondContact OG1-N 3.34Å; N221-N237 PolarHBondContact O-OD1 3.2Å
222	T	86.3	Confident	89.2	Confident	30 Å²	30	73 Å²	73	18%	0.184	39%	0.391	C	S	.	.			trans	-130.2	119	-175.1	-50.4	0	0	0	0	110.5	C205 T219 V235 N237	C205-T222 VanDerWaalsContact SG-CG2 3.59Å; T219-T222 PolarHBondContact N-O 2.82Å; T219-T222 PolarHBondContact OG1-N 2.81Å; T219-T222 PolarHBondContact OG1-O 2.96Å; T222-V235 HydrophobicContact CG2-CG2 4.18Å; T222-N237 VanDerWaalsContact CA-OD1 3.29Å; T222-N237 WeakPolarHBondContact CA-OD1 3.41Å
223	K	92.1	Very high	89.3	Confident	108 Å²	108	67.1 Å²	67.1	47%	0.47	36%	0.364	S	S	.	.			trans	-98.8	135.9	168.9	-65.8	-179.2	-178.2	179.2	0	108.9	V235 D236 N237	K223-V235 CarbonylContact O-C 3.54Å; K223-D236 WeakPolarHBondContact CB-O 3.44Å; K223-D236 PolarHBondContact O-N 2.71Å; K223-N237 PolarHBondContact N-OD1 3.13Å
224	C	93.8	Very high	89.4	Confident	23 Å²	23	64.6 Å²	64.6	16%	0.155	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	149.8	176.6	-53.7	0	0	0	0	110.5	C205 S217 C233 I234	C205-C224 WeakPolarHBondContact CA-SG 3.44Å; C205-C224 HydrophobicContact CB-CB 3.85Å; C205-C224 WeakPolarHBondContact CB-SG 3.4Å; C205-C224 VanDerWaalsContact SG-CA 3.56Å; C205-C224 WeakPolarHBondContact SG-CB 3.47Å; C205-C224 CovalentContact SG-SG 2.04Å; C205-C224 PolarHBondContact SG-SG 2.76Å; S217-C224 PolarHBondContact OG-SG 2.88Å; C224-C233 VanDerWaalsContact CB-SG 3.51Å; C224-I234 CarbonylContact C-O 3.6Å; C224-I234 VanDerWaalsContact CA-O 3.29Å; C224-I234 WeakPolarHBondContact CA-O 3.28Å
225	F	92.7	Very high	89.4	Confident	50 Å²	50	64.6 Å²	64.6	22%	0.219	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	136.1	179.2	170.6	-101.6	0	0	0	109.4	I234 D236 V246 C249	F225-I234 HydrophobicContact CB-CG1 4.31Å; F225-I234 HydrophobicContact CD1-CD1 3.98Å; F225-I234 HydrophobicContact CD1-CG1 3.91Å; F225-I234 PolarHBondContact N-O 3.28Å; F225-I234 WeakPolarHBondContact O-CG1 3.29Å; F225-I234 PolarHBondContact O-N 2.75Å; F225-D236 HydrophobicContact CB-CB 3.87Å; F225-V246 HydrophobicContact CE2-CG2 3.99Å; F225-V246 HydrophobicContact CZ-CB 4.46Å; F225-V246 HydrophobicContact CZ-CG2 3.92Å; F225-C249 HydrophobicContact CE1-CB 3.74Å; F225-C249 HydrophobicContact CZ-CB 4.34Å
226	W	94.9	Very high	89.5	Confident	18 Å²	18	59 Å²	59	7%	0.068	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	122.4	177.5	-176.8	-95.6	0	0	0	111.2	N209 S210 I211 C214 N231 C233	N209-W226 WeakPolarHBondContact O-CH2 3.37Å; S210-W226 VanDerWaalsContact C-CZ3 3.43Å; S210-W226 WeakPolarHBondContact O-CZ3 3.45Å; I211-W226 HydrophobicContact CB-CD2 4.44Å; I211-W226 HydrophobicContact CB-CG 4.36Å; I211-W226 VanDerWaalsContact CG1-CD1 3.5Å; I211-W226 HydrophobicContact CG1-CD2 3.79Å; I211-W226 HydrophobicContact CG1-CG 3.73Å; I211-W226 HydrophobicContact CG1-CZ2 4.16Å; I211-W226 VanDerWaalsContact CG1-NE1 3.34Å; C214-W226 HydrophobicContact CB-CB 4.38Å; C214-W226 HydrophobicContact CB-CE3 3.71Å; C214-W226 HydrophobicContact CB-CZ3 4.45Å; W226-N231 WeakPolarHBondContact CZ2-OD1 3.26Å; W226-C233 HydrophobicContact CE3-CB 3.95Å; W226-C233 HydrophobicContact CZ3-CB 4.19Å
227	C	95.6	Very high	89.6	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	99.6	175.7	-167.8	0	0	0	0	110.7	V42 R229 A230 N231 R232 I234 C249	V42-C227 HydrophobicContact CG1-CB 4.14Å; V42-C227 WeakPolarHBondContact CG1-SG 3.44Å; C227-R229 PolarHBondContact O-N 2.91Å; C227-A230 HydrophobicContact CB-CB 4.24Å; C227-A230 PolarHBondContact O-N 2.97Å; C227-N231 WeakPolarHBondContact O-CA 2.87Å; C227-N231 PolarHBondContact O-N 2.95Å; C227-R232 WeakPolarHBondContact CA-O 3.47Å; C227-R232 WeakPolarHBondContact CB-O 3.24Å; C227-R232 PolarHBondContact N-O 2.94Å; C227-R232 PolarHBondContact O-N 2.76Å; C227-R232 VanDerWaalsContact O-N 3.16Å; C227-I234 HydrophobicContact CB-CD1 4.43Å; C227-I234 HydrophobicContact CB-CG2 4.44Å; C227-C249 VanDerWaalsContact CA-SG 3.55Å; C227-C249 HydrophobicContact CB-CB 3.78Å; C227-C249 WeakPolarHBondContact CB-SG 3.47Å; C227-C249 WeakPolarHBondContact SG-CA 3.36Å; C227-C249 WeakPolarHBondContact SG-CB 3.17Å; C227-C249 CovalentContact SG-SG 2.02Å; C227-C249 PolarHBondContact SG-SG 2.92Å
228	E	93.1	Very high	89.8	Confident	112 Å²	112	57.5 Å²	57.5	52%	0.523	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-45.7	-178.6	-68.9	-172.8	170.1	0	0	112.5	A230 N231 I251	E228-A230 PolarHBondContact O-N 3.42Å; E228-N231 PolarHBondContact O-N 3.37Å; E228-I251 HydrophobicContact CB-CD1 4.1Å; E228-I251 HydrophobicContact CB-CG1 4.18Å
229	R	92.2	Very high	90.2	Very high	147 Å²	147	62.3 Å²	62.3	56%	0.555	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-41.1	178.3	-179.3	-175.4	178.8	129.6	-3.1	113	C227 G248 C249	C227-R229 PolarHBondContact O-N 2.91Å; R229-G248 WeakPolarHBondContact CD-O 3.32Å; R229-C249 VanDerWaalsContact CB-O 3.3Å; R229-C249 WeakPolarHBondContact CB-O 2.9Å; R229-C249 PolarHBondContact N-O 2.79Å; R229-C249 VanDerWaalsContact N-O 3.08Å
230	A	94.1	Very high	90.6	Very high	24 Å²	24	64.1 Å²	64.1	20%	0.198	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-5.8	-178.6	0	0	0	0	0	113.3	V42 C227 E228 R232	V42-A230 HydrophobicContact CB-CB 4.25Å; V42-A230 HydrophobicContact CG1-CB 3.51Å; C227-A230 HydrophobicContact CB-CB 4.24Å; C227-A230 PolarHBondContact O-N 2.97Å; E228-A230 PolarHBondContact O-N 3.42Å; A230-R232 VanDerWaalsContact C-N 3.31Å; A230-R232 HydrophobicContact CB-CB 4.33Å; A230-R232 WeakPolarHBondContact O-CG 3.5Å; A230-R232 PolarHBondContact O-N 3.11Å
231	N	93.8	Very high	91.4	Very high	116 Å²	116	58.8 Å²	58.8	62%	0.62	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	48.7	-172.3	-168.1	55.4	0	0	0	112.5	W226 C227 E228	W226-N231 WeakPolarHBondContact CZ2-OD1 3.26Å; C227-N231 WeakPolarHBondContact O-CA 2.87Å; C227-N231 PolarHBondContact O-N 2.95Å; E228-N231 PolarHBondContact O-N 3.37Å
232	R	93.7	Very high	92.1	Very high	76 Å²	76	55.7 Å²	55.7	29%	0.287	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	149.6	-170.7	-77.9	172.2	-169.5	-74.1	-16.4	112.6	R40 C227 A230	R40-R232 VanDerWaalsContact CD-CZ 3.45Å; R40-R232 VanDerWaalsContact CD-NH1 3.26Å; C227-R232 WeakPolarHBondContact CA-O 3.47Å; C227-R232 WeakPolarHBondContact CB-O 3.24Å; C227-R232 PolarHBondContact N-O 2.94Å; C227-R232 PolarHBondContact O-N 2.76Å; C227-R232 VanDerWaalsContact O-N 3.16Å; A230-R232 VanDerWaalsContact C-N 3.31Å; A230-R232 HydrophobicContact CB-CB 4.33Å; A230-R232 WeakPolarHBondContact O-CG 3.5Å; A230-R232 PolarHBondContact O-N 3.11Å
233	C	95	Very high	92.4	Very high	2 Å²	2	59.4 Å²	59.4	1%	0.014	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	126	167.9	-169.4	0	0	0	0	110.7	Q52 C205 H208 C214 C224 W226	Q52-C233 PolarHBondContact NE2-O 2.72Å; C205-C233 WeakPolarHBondContact O-CB 3.47Å; C205-C233 PolarHBondContact O-SG 2.75Å; H208-C233 HydrophobicContact CB-CB 4.04Å; H208-C233 VanDerWaalsContact O-CB 3.25Å; H208-C233 WeakPolarHBondContact O-CB 3.06Å; C214-C233 VanDerWaalsContact CA-SG 3.51Å; C214-C233 HydrophobicContact CB-CB 3.57Å; C214-C233 WeakPolarHBondContact CB-SG 3.39Å; C214-C233 VanDerWaalsContact SG-CA 3.53Å; C214-C233 WeakPolarHBondContact SG-CB 3.22Å; C214-C233 CovalentContact SG-SG 2.03Å; C214-C233 PolarHBondContact SG-SG 3.47Å; C224-C233 VanDerWaalsContact CB-SG 3.51Å; W226-C233 HydrophobicContact CE3-CB 3.95Å; W226-C233 HydrophobicContact CZ3-CB 4.19Å
234	I	95.4	Very high	92.4	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	156.7	-178.4	64.9	170.5	0	0	0	110.6	V42 Y50 C224 F225 C227 K245	V42-I234 HydrophobicContact CG1-CG2 4.1Å; V42-I234 HydrophobicContact CG2-CG2 4.21Å; Y50-I234 HydrophobicContact CE1-CB 4.09Å; Y50-I234 HydrophobicContact CE1-CD1 4.25Å; Y50-I234 HydrophobicContact CE1-CG2 3.9Å; C224-I234 CarbonylContact C-O 3.6Å; C224-I234 VanDerWaalsContact CA-O 3.29Å; C224-I234 WeakPolarHBondContact CA-O 3.28Å; F225-I234 HydrophobicContact CB-CG1 4.31Å; F225-I234 HydrophobicContact CD1-CD1 3.98Å; F225-I234 HydrophobicContact CD1-CG1 3.91Å; F225-I234 PolarHBondContact N-O 3.28Å; F225-I234 WeakPolarHBondContact O-CG1 3.29Å; F225-I234 PolarHBondContact O-N 2.75Å; C227-I234 HydrophobicContact CB-CD1 4.43Å; C227-I234 HydrophobicContact CB-CG2 4.44Å; I234-K245 HydrophobicContact CD1-CB 4.12Å; I234-K245 HydrophobicContact CD1-CD 4.19Å; I234-K245 HydrophobicContact CD1-CG 4.11Å
235	V	94.6	Very high	92.4	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	149.6	175.3	62.7	0	0	0	0	110.8	Y50 S57 E200 T222 K223 N237 K245	Y50-V235 WeakPolarHBondContact OH-CG1 3.12Å; S57-V235 WeakPolarHBondContact OG-CG1 3.47Å; E200-V235 HydrophobicContact CB-CG1 4.39Å; E200-V235 HydrophobicContact CG-CG1 4Å; E200-V235 HydrophobicContact CG-CG2 4.21Å; T222-V235 HydrophobicContact CG2-CG2 4.18Å; K223-V235 CarbonylContact O-C 3.54Å; V235-N237 WeakPolarHBondContact CG2-ND2 3.45Å; V235-K245 WeakPolarHBondContact O-CE 3.23Å; V235-K245 PolarHBondContact O-NZ 3.09Å
236	D	93	Very high	92.4	Very high	19 Å²	19	55.4 Å²	55.4	10%	0.102	27%	0.266	C	S	.	.			trans	-148.9	51.3	-177.4	-168.3	39.4	0	0	0	112.5	K223 F225 H242	K223-D236 WeakPolarHBondContact CB-O 3.44Å; K223-D236 PolarHBondContact O-N 2.71Å; F225-D236 HydrophobicContact CB-CB 3.87Å; D236-H242 IonicContact OD1-ND1 3.53Å; D236-H242 IonicContact OD2-CE1 3.38Å; D236-H242 PolarHBondContact OD2-CE1 3.08Å; D236-H242 IonicContact OD2-CG 3.8Å; D236-H242 IonicContact OD2-ND1 2.67Å; D236-H242 PolarHBondContact OD2-ND1 3.42Å
237	N	89.9	Confident	92.2	Very high	51 Å²	51	59.2 Å²	59.2	27%	0.273	29%	0.288	S	S	.	.			trans	-83.1	-34.3	178.6	-49.7	-50.9	0	0	0	112.1	E200 N221 T222 K223 V235 K239	E200-N237 WeakPolarHBondContact OE1-CA 3.35Å; E200-N237 WeakPolarHBondContact OE1-CB 3.17Å; E200-N237 PolarHBondContact OE1-N 3.21Å; E200-N237 PolarHBondContact OE1-ND2 2.73Å; N221-N237 PolarHBondContact O-OD1 3.2Å; T222-N237 VanDerWaalsContact CA-OD1 3.29Å; T222-N237 WeakPolarHBondContact CA-OD1 3.41Å; K223-N237 PolarHBondContact N-OD1 3.13Å; V235-N237 WeakPolarHBondContact CG2-ND2 3.45Å; N237-K239 PolarHBondContact O-N 3.43Å
238	N	87.6	Confident	92.1	Very high	36 Å²	36	59.6 Å²	59.6	19%	0.193	29%	0.292	C	S	.	.			trans	-79.9	108.2	178.3	-170.1	-9.9	0	0	0	111.8	E198 E200 D240 N241 H242	E198-N238 PolarHBondContact OE1-ND2 3.04Å; E200-N238 PolarHBondContact OE1-N 2.94Å; N238-D240 PolarHBondContact O-N 3.5Å; N238-D240 WeakPolarHBondContact OD1-CB 3.24Å; N238-D240 PolarHBondContact OD1-N 3.18Å; N238-N241 HydrophobicContact CB-CB 4.25Å; N238-N241 PolarHBondContact ND2-ND2 2.85Å; N238-N241 PolarHBondContact O-N 2.82Å; N238-H242 PolarHBondContact O-N 2.91Å
239	K	87.8	Confident	92.1	Very high	165 Å²	165	54.5 Å²	54.5	72%	0.717	27%	0.268	S	S	*	.	H	α-helix	trans	-58.6	-33.4	177.1	-68.1	-179.2	-179.9	177.7	0	113.2	N237 N241 H242	N237-K239 PolarHBondContact O-N 3.43Å; K239-N241 PolarHBondContact O-N 3.39Å; K239-H242 WeakPolarHBondContact O-CB 2.87Å; K239-H242 PolarHBondContact O-N 2.95Å
240	D	87.1	Confident	91.9	Very high	120 Å²	120	52.4 Å²	52.4	64%	0.642	27%	0.265	S	S	*	.	H	α-helix	trans	-69.4	-16.4	-179.4	-59.1	-23.4	0	0	0	112	R61 N238	R61-D240 PolarHBondContact NH1-O 3.46Å; N238-D240 PolarHBondContact O-N 3.5Å; N238-D240 WeakPolarHBondContact OD1-CB 3.24Å; N238-D240 PolarHBondContact OD1-N 3.18Å
241	N	89.6	Confident	91.1	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-100.3	-10.9	178	-68	-16.7	0	0	0	113.1	R61 E198 N238 K239 D243 F244 K245	R61-N241 PolarHBondContact NE-OD1 3.13Å; R61-N241 VanDerWaalsContact NE-OD1 3.17Å; R61-N241 PolarHBondContact NH1-OD1 2.8Å; R61-N241 VanDerWaalsContact NH1-OD1 3.11Å; R61-N241 PolarHBondContact NH2-OD1 2.91Å; E198-N241 PolarHBondContact OE2-ND2 2.8Å; E198-N241 PolarHBondContact OE2-OD1 3.48Å; N238-N241 HydrophobicContact CB-CB 4.25Å; N238-N241 PolarHBondContact ND2-ND2 2.85Å; N238-N241 PolarHBondContact O-N 2.82Å; K239-N241 PolarHBondContact O-N 3.39Å; N241-D243 PolarHBondContact O-N 3.03Å; N241-F244 PolarHBondContact O-N 2.94Å; N241-K245 HydrophobicContact CB-CD 4.49Å; N241-K245 WeakPolarHBondContact O-CG 3.26Å; N241-K245 PolarHBondContact O-N 3.46Å
242	H	92.1	Very high	89.6	Confident	69 Å²	69	53.5 Å²	53.5	32%	0.319	28%	0.278	S	S	.	.	H	α-helix	trans	-57	-52.8	-172.7	-179.3	70.5	0	0	0	112.1	D236 N238 K239 F244 K245 V246	D236-H242 IonicContact OD1-ND1 3.53Å; D236-H242 IonicContact OD2-CE1 3.38Å; D236-H242 PolarHBondContact OD2-CE1 3.08Å; D236-H242 IonicContact OD2-CG 3.8Å; D236-H242 IonicContact OD2-ND1 2.67Å; D236-H242 PolarHBondContact OD2-ND1 3.42Å; N238-H242 PolarHBondContact O-N 2.91Å; K239-H242 WeakPolarHBondContact O-CB 2.87Å; K239-H242 PolarHBondContact O-N 2.95Å; H242-F244 VanDerWaalsContact C-N 3.3Å; H242-F244 PolarHBondContact O-N 2.68Å; H242-K245 WeakPolarHBondContact O-CB 3.47Å; H242-K245 PolarHBondContact O-N 2.87Å; H242-K245 VanDerWaalsContact O-N 3.08Å; H242-V246 WeakPolarHBondContact O-CG2 3.17Å; H242-V246 PolarHBondContact O-N 3.35Å
243	D	92.2	Very high	87.3	Confident	109 Å²	109	56.8 Å²	56.8	58%	0.583	30%	0.301	S	S	*	.	H	α-helix	trans	-63.3	-36.9	-177	-67.3	-13.4	0	0	0	112	N241 V246 N247	N241-D243 PolarHBondContact O-N 3.03Å; D243-V246 PolarHBondContact O-N 2.7Å; D243-N247 WeakPolarHBondContact O-CB 3.17Å; D243-N247 PolarHBondContact O-N 2.94Å; D243-N247 PolarHBondContact O-ND2 3.27Å; D243-N247 VanDerWaalsContact O-ND2 3.08Å
244	F	91.8	Very high	84.7	Confident	62 Å²	62	65.3 Å²	65.3	27%	0.272	34%	0.343	S	S	.	.	H	α-helix	trans	-63.5	-42.8	174.5	-67.3	-82.2	0	0	0	111.6	H48 M59 N241 H242 G248	H48-F244 AromaticContact CD2-CD1 3.7Å; M59-F244 HydrophobicContact CE-CB 3.59Å; M59-F244 HydrophobicContact CE-CD1 4.35Å; M59-F244 HydrophobicContact CE-CG 4.04Å; N241-F244 PolarHBondContact O-N 2.94Å; H242-F244 VanDerWaalsContact C-N 3.3Å; H242-F244 PolarHBondContact O-N 2.68Å; F244-G248 PolarHBondContact O-N 3.17Å
245	K	94	Very high	82.2	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-65.1	-46.4	177.3	-71	173	-178.3	-179.7	0	111.1	F43 Y50 E200 I234 V235 N241 H242 G248 C249	F43-K245 HydrophobicContact CE1-CG 4.48Å; F43-K245 HydrophobicContact CZ-CG 4.28Å; Y50-K245 HydrophobicContact CE2-CD 4.41Å; Y50-K245 VanDerWaalsContact CE2-CE 3.48Å; E200-K245 IonicContact OE2-NZ 2.86Å; E200-K245 PolarHBondContact OE2-NZ 2.87Å; I234-K245 HydrophobicContact CD1-CB 4.12Å; I234-K245 HydrophobicContact CD1-CD 4.19Å; I234-K245 HydrophobicContact CD1-CG 4.11Å; V235-K245 WeakPolarHBondContact O-CE 3.23Å; V235-K245 PolarHBondContact O-NZ 3.09Å; N241-K245 HydrophobicContact CB-CD 4.49Å; N241-K245 WeakPolarHBondContact O-CG 3.26Å; N241-K245 PolarHBondContact O-N 3.46Å; H242-K245 WeakPolarHBondContact O-CB 3.47Å; H242-K245 PolarHBondContact O-N 2.87Å; H242-K245 VanDerWaalsContact O-N 3.08Å; K245-G248 PolarHBondContact O-N 2.96Å; K245-C249 WeakPolarHBondContact O-CB 3.46Å; K245-C249 PolarHBondContact O-N 2.63Å; K245-C249 PolarHBondContact O-SG 3.48Å
246	V	92.7	Very high	79.5	Confident	35 Å²	35	76.6 Å²	76.6	21%	0.212	41%	0.406	C	S	.	.	H	α-helix	trans	-58.7	-52.2	176.7	172.2	0	0	0	0	110.6	F225 H242 D243 G248 C249 Q250	F225-V246 HydrophobicContact CE2-CG2 3.99Å; F225-V246 HydrophobicContact CZ-CB 4.46Å; F225-V246 HydrophobicContact CZ-CG2 3.92Å; H242-V246 WeakPolarHBondContact O-CG2 3.17Å; H242-V246 PolarHBondContact O-N 3.35Å; D243-V246 PolarHBondContact O-N 2.7Å; V246-G248 PolarHBondContact O-N 2.78Å; V246-C249 PolarHBondContact O-N 2.77Å; V246-Q250 WeakPolarHBondContact O-CG 3.4Å; V246-Q250 PolarHBondContact O-N 3.29Å
247	N	92	Very high	76.8	Confident	98 Å²	98	85.1 Å²	85.1	52%	0.524	45%	0.445	S	S	.	.	H	α-helix	trans	-64.4	-41.1	-178.7	-69.2	-29.4	0	0	0	112.5	D243 C249	D243-N247 WeakPolarHBondContact O-CB 3.17Å; D243-N247 PolarHBondContact O-N 2.94Å; D243-N247 PolarHBondContact O-ND2 3.27Å; D243-N247 VanDerWaalsContact O-ND2 3.08Å; N247-C249 PolarHBondContact O-N 2.6Å
248	G	92.7	Very high	74.5	Confident	8 Å²	8	92.4 Å²	92.4	8%	0.082	47%	0.469	C	S	.	.	H	α-helix	trans	-65.5	-28.1	176.7	0	0	0	0	0	113.4	F43 R229 F244 K245 V246	F43-G248 WeakPolarHBondContact CB-O 3.23Å; R229-G248 WeakPolarHBondContact CD-O 3.32Å; F244-G248 PolarHBondContact O-N 3.17Å; K245-G248 PolarHBondContact O-N 2.96Å; V246-G248 PolarHBondContact O-N 2.78Å
249	C	93.5	Very high	71.9	Confident	4 Å²	4	97.8 Å²	97.8	3%	0.027	50%	0.497	C	S	.	.	H	α-helix	trans	-94.2	-11.6	-177.6	-74.4	0	0	0	0	115.3	F225 C227 R229 K245 V246 N247 I251	F225-C249 HydrophobicContact CE1-CB 3.74Å; F225-C249 HydrophobicContact CZ-CB 4.34Å; C227-C249 VanDerWaalsContact CA-SG 3.55Å; C227-C249 HydrophobicContact CB-CB 3.78Å; C227-C249 WeakPolarHBondContact CB-SG 3.47Å; C227-C249 WeakPolarHBondContact SG-CA 3.36Å; C227-C249 WeakPolarHBondContact SG-CB 3.17Å; C227-C249 CovalentContact SG-SG 2.02Å; C227-C249 PolarHBondContact SG-SG 2.92Å; R229-C249 VanDerWaalsContact CB-O 3.3Å; R229-C249 WeakPolarHBondContact CB-O 2.9Å; R229-C249 PolarHBondContact N-O 2.79Å; R229-C249 VanDerWaalsContact N-O 3.08Å; K245-C249 WeakPolarHBondContact O-CB 3.46Å; K245-C249 PolarHBondContact O-N 2.63Å; K245-C249 PolarHBondContact O-SG 3.48Å; V246-C249 PolarHBondContact O-N 2.77Å; N247-C249 PolarHBondContact O-N 2.6Å; C249-I251 PolarHBondContact O-N 3.06Å
250	Q	87.9	Confident	69.5	Low	104 Å²	104	99.5 Å²	99.5	49%	0.486	51%	0.508	S	S	.	.	S	Bend	trans	-61.3	129.9	170.6	-77.3	171.1	8.2	0	0	109.2	V246 G252	V246-Q250 WeakPolarHBondContact O-CG 3.4Å; V246-Q250 PolarHBondContact O-N 3.29Å; Q250-G252 PolarHBondContact O-N 3.33Å
251	I	76.1	Confident	67	Low	113 Å²	113	96.8 Å²	96.8	58%	0.579	51%	0.508	S	S	*	.			trans	-68	97.6	158.9	-57.8	171.9	0	0	0	103.7	E228 C249 N253	E228-I251 HydrophobicContact CB-CD1 4.1Å; E228-I251 HydrophobicContact CB-CG1 4.18Å; C249-I251 PolarHBondContact O-N 3.06Å; I251-N253 PolarHBondContact O-N 3Å; I251-N253 VanDerWaalsContact O-N 3.13Å
252	G	62.2	Low	64.6	Low	49 Å²	49	104.5 Å²	104.5	51%	0.505	55%	0.55	S	S	.	.			trans	-50.1	130.1	171.5	0	0	0	0	0	107.3	Q250 M254	Q250-G252 PolarHBondContact O-N 3.33Å; G252-M254 PolarHBondContact O-N 3.19Å
253	N	45.5	Very low	61.8	Low	145 Å²	145	104.3 Å²	104.3	78%	0.775	57%	0.566	S	S	*	*			trans	-57.7	98.1	147.9	-78.9	-22.7	0	0	0	103.2	I251 I255	I251-N253 PolarHBondContact O-N 3Å; I251-N253 VanDerWaalsContact O-N 3.13Å; N253-I255 HydrophobicContact CB-CG1 3.8Å; N253-I255 PolarHBondContact O-N 3.49Å
254	M	41.5	Very low	59.1	Low	181 Å²	181	106.8 Å²	106.8	89%	0.892	57%	0.574	S	S	*	*			trans	-57	83.5	140.6	-76.1	-157.2	-179.7	0	0	103.3	G252 T256	G252-M254 PolarHBondContact O-N 3.19Å; M254-T256 PolarHBondContact O-N 3.48Å
255	I	42.1	Very low	56.6	Low	132 Å²	132	113.2 Å²	113.2	68%	0.677	60%	0.597	S	S	*	*			trans	-54.9	103.5	157.7	-62.4	179	0	0	0	100.2	N253 E257	N253-I255 HydrophobicContact CB-CG1 3.8Å; N253-I255 PolarHBondContact O-N 3.49Å; I255-E257 PolarHBondContact O-N 2.74Å
256	T	38	Very low	54.2	Low	106 Å²	106	125.8 Å²	125.8	65%	0.65	66%	0.656	S	S	*	*			trans	-44.1	97.4	162.2	33.7	0	0	0	0	105.9	M254 R258	M254-T256 PolarHBondContact O-N 3.48Å; T256-R258 HydrophobicContact CG2-CB 4.48Å; T256-R258 PolarHBondContact O-N 2.8Å
257	E	36.8	Very low	52.2	Low	198 Å²	198	130.4 Å²	130.4	93%	0.925	68%	0.678	S	S	*	*			trans	-66.1	60.6	143	-73.7	-170.9	168.7	0	0	107	I255	I255-E257 PolarHBondContact O-N 2.74Å
258	R	41.1	Very low	50.1	Low	204 Å²	204	132.1 Å²	132.1	77%	0.77	69%	0.686	S	S	*	*			trans	-142.7	77.1	164.3	-114.8	-170.2	-169.3	165.9	5.7	102.8	T256	T256-R258 HydrophobicContact CG2-CB 4.48Å; T256-R258 PolarHBondContact O-N 2.8Å
259	N	34.1	Very low	47.8	Very low	148 Å²	148	138.9 Å²	138.9	79%	0.791	72%	0.719	S	S	*	*			trans	158.9	78.2	138.6	-75.5	-19.5	0	0	0	109.9
260	E	37.4	Very low	45.1	Very low	201 Å²	201	146.9 Å²	146.9	94%	0.939	76%	0.76	S	S	*	*				-128.7	74.7	128.2	-75.9	-163.3	160.7	0	0	107.5
261	G	34.4	Very low	42.4	Very low	63 Å²	63	149.6 Å²	149.6	65%	0.649	78%	0.777	S	S	*	*			trans	-70.9	123	146.9	0	0	0	0	0	108.2
262	N	38.3	Very low	40.2	Very low	166 Å²	166	152 Å²	152	89%	0.888	79%	0.79	S	S	*	*			trans	-178.6	106.1	144.8	-94.5	-20.3	0	0	0	104.5
263	G	33.8	Very low	38.6	Very low	64 Å²	64	159.4 Å²	159.4	66%	0.66	81%	0.811	S	S	*	*			cis	96.3	138.6	47.4	0	0	0	0	0	108.4
264	Q	36.1	Very low	38.1	Very low	162 Å²	162	160.5 Å²	160.5	76%	0.757	81%	0.814	S	S	*	*			trans	94.7	133.2	173.3	-55.8	-179.6	-20.3	0	0	115.4
265	R	39.5	Very low	37.8	Very low	196 Å²	196	158.8 Å²	158.8	74%	0.74	81%	0.807	S	S	*	*			cis	-170.3	146.7	0.1	-114.3	166.7	-173.8	176.7	-0.4	106.7
266	E	41.7	Very low	37.4	Very low	265 Å²	265	161.2 Å²	161.2	100%	1.238	82%	0.819	S	S	*	*			trans	56.1	0	155	-65.8	176.4	175.1	0	0	119.2

Retrieved 266 of 266 residues in 263.2 ms (Link to these results)

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