G4LV63_SCHMA Loading...

Smp_201330 AlphaSync

AlphaFold DB , UniProt , Accession G4LV63, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 289 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.8	Very low	56.5	Low	209 Å²	209	131.4 Å²	131.4	100%	1.03	65%	0.645	S	S	*	*				0	110.2	0	-82.7	171.1	164.1	0	0	108.7	Y3	M1-Y3 HydrophobicContact CB-CD2 4.31Å; M1-Y3 HydrophobicContact CB-CE2 4.19Å; M1-Y3 PolarHBondContact O-N 3.08Å; M1-Y3 HydrophobicContact SD-CE2 4.23Å
2	R	51.9	Low	56.6	Low	243 Å²	243	128.3 Å²	128.3	92%	0.917	63%	0.632	S	S	*	*			trans	-86.1	103.3	167.1	-71.5	-177	179.4	178.6	0.3	106.4	N4	R2-N4 PolarHBondContact O-N 3.48Å; R2-N4 VanDerWaalsContact O-N 3.08Å
3	Y	57	Low	57	Low	191 Å²	191	123.7 Å²	123.7	75%	0.749	61%	0.611	S	S	*	*			trans	-70.6	101.3	172.7	-86.6	-90.6	0	0	0	108	M1 V5	M1-Y3 HydrophobicContact CB-CD2 4.31Å; M1-Y3 HydrophobicContact CB-CE2 4.19Å; M1-Y3 PolarHBondContact O-N 3.08Å; M1-Y3 HydrophobicContact SD-CE2 4.23Å; Y3-V5 VanDerWaalsContact C-N 3.3Å; Y3-V5 PolarHBondContact O-N 3.03Å
4	N	54.8	Low	57	Low	159 Å²	159	126 Å²	126	85%	0.85	61%	0.611	S	S	*	*			trans	-71.8	92.3	164.4	-82.8	-19.9	0	0	0	107.3	R2 S6	R2-N4 PolarHBondContact O-N 3.48Å; R2-N4 VanDerWaalsContact O-N 3.08Å; N4-S6 PolarHBondContact O-N 3.15Å; N4-S6 VanDerWaalsContact O-N 3.15Å
5	V	55.3	Low	57	Low	71 Å²	71	122.9 Å²	122.9	43%	0.43	60%	0.598	S	S	.	*			trans	-64.2	115.7	170.5	-177	0	0	0	0	107.1	Y3 L9	Y3-V5 VanDerWaalsContact C-N 3.3Å; Y3-V5 PolarHBondContact O-N 3.03Å; V5-L9 HydrophobicContact CG1-CB 3.75Å; V5-L9 HydrophobicContact CG1-CD1 4.22Å
6	S	62.2	Low	57.1	Low	58 Å²	58	124.4 Å²	124.4	41%	0.406	60%	0.601	S	S	.	*			trans	-52.7	137.1	-179.8	174.4	0	0	0	0	110.7	N4 C8 L9	N4-S6 PolarHBondContact O-N 3.15Å; N4-S6 VanDerWaalsContact O-N 3.15Å; S6-C8 PolarHBondContact O-N 3.27Å; S6-L9 WeakPolarHBondContact O-CB 3.44Å; S6-L9 PolarHBondContact O-N 2.93Å
7	P	62.7	Low	56.9	Low	95 Å²	95	125.2 Å²	125.2	62%	0.617	60%	0.601	S	S	*	*	H	α-helix	trans	-51.2	-29.9	177.9	-26.5	33.3	0	0	0	113.9	L9 W10 I11	P7-L9 VanDerWaalsContact C-N 3.33Å; P7-L9 PolarHBondContact O-N 3.15Å; P7-W10 PolarHBondContact O-N 3.44Å; P7-I11 WeakPolarHBondContact O-CG1 3.45Å; P7-I11 PolarHBondContact O-N 3.01Å; P7-I11 VanDerWaalsContact O-N 3.15Å
8	C	59.2	Low	56.5	Low	81 Å²	81	122.7 Å²	122.7	55%	0.547	59%	0.594	S	S	.	*	H	α-helix	trans	-64.5	-32.6	177.2	-63.4	0	0	0	0	113.5	S6 I11 L12	S6-C8 PolarHBondContact O-N 3.27Å; C8-I11 PolarHBondContact O-N 2.87Å; C8-L12 WeakPolarHBondContact O-CG 3.46Å; C8-L12 PolarHBondContact O-N 2.96Å
9	L	55.5	Low	56.1	Low	93 Å²	93	124.6 Å²	124.6	49%	0.487	60%	0.595	S	S	.	*	H	α-helix	trans	-68.7	-38.2	176	-93.9	145.1	0	0	0	111.2	V5 S6 P7 L12 I13	V5-L9 HydrophobicContact CG1-CB 3.75Å; V5-L9 HydrophobicContact CG1-CD1 4.22Å; S6-L9 WeakPolarHBondContact O-CB 3.44Å; S6-L9 PolarHBondContact O-N 2.93Å; P7-L9 VanDerWaalsContact C-N 3.33Å; P7-L9 PolarHBondContact O-N 3.15Å; L9-L12 PolarHBondContact O-N 3.21Å; L9-I13 WeakPolarHBondContact O-CB 3.15Å; L9-I13 WeakPolarHBondContact O-CD1 3.36Å; L9-I13 WeakPolarHBondContact O-CG1 3.19Å; L9-I13 PolarHBondContact O-N 3.42Å
10	W	55	Low	55.5	Low	143 Å²	143	121.4 Å²	121.4	54%	0.542	58%	0.584	S	S	.	*	H	α-helix	trans	-64.5	-41.3	174.2	-73.1	101	0	0	0	111.9	P7 I13 Y14	P7-W10 PolarHBondContact O-N 3.44Å; W10-I13 PolarHBondContact O-N 2.86Å; W10-Y14 WeakPolarHBondContact O-CB 3.18Å; W10-Y14 WeakPolarHBondContact O-CD2 3.45Å; W10-Y14 PolarHBondContact O-N 3.05Å
11	I	63	Low	55.1	Low	102 Å²	102	123.7 Å²	123.7	52%	0.523	59%	0.589	S	S	.	*	H	α-helix	trans	-63.7	-44.5	176.8	-65.3	166.2	0	0	0	111	P7 C8 Y14 I15	P7-I11 WeakPolarHBondContact O-CG1 3.45Å; P7-I11 PolarHBondContact O-N 3.01Å; P7-I11 VanDerWaalsContact O-N 3.15Å; C8-I11 PolarHBondContact O-N 2.87Å; I11-Y14 PolarHBondContact O-N 3.43Å; I11-I15 HydrophobicContact CG2-CD1 3.77Å; I11-I15 HydrophobicContact CG2-CG1 4.41Å; I11-I15 VanDerWaalsContact O-CG1 3.27Å; I11-I15 WeakPolarHBondContact O-CG1 3.37Å; I11-I15 PolarHBondContact O-N 3.31Å
12	L	58.3	Low	55.1	Low	94 Å²	94	121.4 Å²	121.4	49%	0.492	57%	0.573	S	S	.	*	H	α-helix	trans	-61.8	-47.1	176.7	-77.1	166.6	0	0	0	111.4	C8 L9 Y14 I15 F16	C8-L12 WeakPolarHBondContact O-CG 3.46Å; C8-L12 PolarHBondContact O-N 2.96Å; L9-L12 PolarHBondContact O-N 3.21Å; L12-Y14 VanDerWaalsContact C-N 3.34Å; L12-Y14 PolarHBondContact O-N 3.42Å; L12-I15 PolarHBondContact O-N 3.43Å; L12-F16 WeakPolarHBondContact O-CD2 2.87Å; L12-F16 PolarHBondContact O-N 3.36Å
13	I	61.9	Low	54.7	Low	69 Å²	69	118.6 Å²	118.6	35%	0.354	56%	0.562	S	S	.	*	H	α-helix	trans	-57	-48.1	176	-73.3	169.3	0	0	0	110.3	L9 W10 I15 F16 F17	L9-I13 WeakPolarHBondContact O-CB 3.15Å; L9-I13 WeakPolarHBondContact O-CD1 3.36Å; L9-I13 WeakPolarHBondContact O-CG1 3.19Å; L9-I13 PolarHBondContact O-N 3.42Å; W10-I13 PolarHBondContact O-N 2.86Å; I13-I15 PolarHBondContact O-N 2.76Å; I13-F16 PolarHBondContact O-N 3.34Å; I13-F17 HydrophobicContact CG2-CD2 3.54Å; I13-F17 HydrophobicContact CG2-CE2 3.63Å; I13-F17 WeakPolarHBondContact O-CD2 3.48Å; I13-F17 PolarHBondContact O-N 2.89Å
14	Y	57.1	Low	54	Low	156 Å²	156	116.6 Å²	116.6	61%	0.612	56%	0.558	S	S	*	*	H	α-helix	trans	-62.4	-38.9	176.2	-96.7	-87.3	0	0	0	113	W10 I11 L12 F17 V18	W10-Y14 WeakPolarHBondContact O-CB 3.18Å; W10-Y14 WeakPolarHBondContact O-CD2 3.45Å; W10-Y14 PolarHBondContact O-N 3.05Å; I11-Y14 PolarHBondContact O-N 3.43Å; L12-Y14 VanDerWaalsContact C-N 3.34Å; L12-Y14 PolarHBondContact O-N 3.42Å; Y14-F17 PolarHBondContact O-N 3.4Å; Y14-V18 HydrophobicContact CD1-CG2 4.2Å; Y14-V18 WeakPolarHBondContact O-CB 3.21Å; Y14-V18 WeakPolarHBondContact O-CG2 3.11Å; Y14-V18 PolarHBondContact O-N 3.48Å
15	I	57.1	Low	53.6	Low	80 Å²	80	112.2 Å²	112.2	41%	0.41	53%	0.534	S	S	.	.	H	α-helix	trans	-64.8	-44.3	174.5	-68.7	166.6	0	0	0	110	I11 L12 I13 F17 W19	I11-I15 HydrophobicContact CG2-CD1 3.77Å; I11-I15 HydrophobicContact CG2-CG1 4.41Å; I11-I15 VanDerWaalsContact O-CG1 3.27Å; I11-I15 WeakPolarHBondContact O-CG1 3.37Å; I11-I15 PolarHBondContact O-N 3.31Å; L12-I15 PolarHBondContact O-N 3.43Å; I13-I15 PolarHBondContact O-N 2.76Å; I15-F17 VanDerWaalsContact C-N 3.31Å; I15-F17 PolarHBondContact O-N 3.39Å; I15-W19 HydrophobicContact CG2-CE3 3.97Å; I15-W19 WeakPolarHBondContact O-CB 3.27Å; I15-W19 PolarHBondContact O-N 2.85Å
16	F	57.6	Low	53.6	Low	147 Å²	147	113 Å²	113	65%	0.645	54%	0.542	S	S	*	.	H	α-helix	trans	-64.9	-31.1	177	-84.4	-71	0	0	0	113.5	L12 I13 P20	L12-F16 WeakPolarHBondContact O-CD2 2.87Å; L12-F16 PolarHBondContact O-N 3.36Å; I13-F16 PolarHBondContact O-N 3.34Å; F16-P20 WeakPolarHBondContact O-CD 3.47Å; F16-P20 WeakPolarHBondContact O-CG 3.16Å
17	F	53.2	Low	53.7	Low	137 Å²	137	112.3 Å²	112.3	60%	0.601	53%	0.534	S	S	*	.	H	α-helix	trans	-86.3	-39	176.3	-78	-70.2	0	0	0	112.6	I13 Y14 I15 P20 Y21	I13-F17 HydrophobicContact CG2-CD2 3.54Å; I13-F17 HydrophobicContact CG2-CE2 3.63Å; I13-F17 WeakPolarHBondContact O-CD2 3.48Å; I13-F17 PolarHBondContact O-N 2.89Å; Y14-F17 PolarHBondContact O-N 3.4Å; I15-F17 VanDerWaalsContact C-N 3.31Å; I15-F17 PolarHBondContact O-N 3.39Å; F17-P20 WeakPolarHBondContact O-CD 3.05Å; F17-Y21 WeakPolarHBondContact O-CD2 2.99Å
18	V	51	Low	54	Low	80 Å²	80	111.3 Å²	111.3	49%	0.485	52%	0.521	S	S	.	.	H	α-helix	trans	-77.1	-34.2	-178.5	176.3	0	0	0	0	111.9	Y14 Y21 K22	Y14-V18 HydrophobicContact CD1-CG2 4.2Å; Y14-V18 WeakPolarHBondContact O-CB 3.21Å; Y14-V18 WeakPolarHBondContact O-CG2 3.11Å; Y14-V18 PolarHBondContact O-N 3.48Å; V18-Y21 PolarHBondContact O-N 3.17Å; V18-K22 PolarHBondContact O-N 2.96Å
19	W	47.8	Very low	54.8	Low	159 Å²	159	107.5 Å²	107.5	60%	0.602	50%	0.495	S	S	*	.	H	α-helix	trans	-64.1	-45.3	-176.5	-164	2.6	0	0	0	114.6	I15 R23	I15-W19 HydrophobicContact CG2-CE3 3.97Å; I15-W19 WeakPolarHBondContact O-CB 3.27Å; I15-W19 PolarHBondContact O-N 2.85Å; W19-R23 PolarHBondContact O-N 3.36Å
20	P	44.3	Very low	55.9	Low	60 Å²	60	103.8 Å²	103.8	39%	0.39	48%	0.477	S	S	.	.	H	α-helix	trans	-67.6	-36.3	174.6	24.3	-31.3	0	0	0	112.1	F16 F17 K22 R23 F24	F16-P20 WeakPolarHBondContact O-CD 3.47Å; F16-P20 WeakPolarHBondContact O-CG 3.16Å; F17-P20 WeakPolarHBondContact O-CD 3.05Å; P20-K22 PolarHBondContact O-N 3.43Å; P20-R23 PolarHBondContact O-N 2.94Å; P20-F24 WeakPolarHBondContact O-CD2 3.48Å
21	Y	48.2	Very low	57	Low	171 Å²	171	101.6 Å²	101.6	67%	0.671	48%	0.476	S	S	*	.	H	α-helix	trans	-65.4	-39	178	-84.2	-98.3	0	0	0	112.1	F17 V18 R23 F24	F17-Y21 WeakPolarHBondContact O-CD2 2.99Å; V18-Y21 PolarHBondContact O-N 3.17Å; Y21-R23 VanDerWaalsContact C-N 3.27Å; Y21-R23 PolarHBondContact O-N 3.44Å; Y21-F24 PolarHBondContact O-N 3.49Å
22	K	43.4	Very low	57.6	Low	161 Å²	161	101.8 Å²	101.8	70%	0.7	47%	0.474	S	S	*	.	H	α-helix	trans	-67.6	-28	177.3	-141	177.2	-173.4	-177.6	0	112.7	V18 P20 C26	V18-K22 PolarHBondContact O-N 2.96Å; P20-K22 PolarHBondContact O-N 3.43Å; K22-C26 PolarHBondContact O-SG 3.37Å; K22-C26 VanDerWaalsContact O-SG 3.38Å
23	R	44.8	Very low	58.2	Low	183 Å²	183	100.8 Å²	100.8	69%	0.691	47%	0.473	S	S	*	.	H	α-helix	trans	-69.6	-31.5	178.5	-103.7	-175.6	174.1	174.3	-0.2	113.9	W19 P20 Y21 N25	W19-R23 PolarHBondContact O-N 3.36Å; P20-R23 PolarHBondContact O-N 2.94Å; Y21-R23 VanDerWaalsContact C-N 3.27Å; Y21-R23 PolarHBondContact O-N 3.44Å; R23-N25 VanDerWaalsContact C-N 3.29Å; R23-N25 PolarHBondContact O-N 3.44Å
24	F	41.8	Very low	58.7	Low	150 Å²	150	104.5 Å²	104.5	66%	0.658	49%	0.494	S	S	*	.	H	α-helix	trans	-72.9	-22.6	-179.8	-85.9	-81	0	0	0	113.2	P20 Y21	P20-F24 WeakPolarHBondContact O-CD2 3.48Å; Y21-F24 PolarHBondContact O-N 3.49Å
25	N	45.7	Very low	59.4	Low	66 Å²	66	98.1 Å²	98.1	35%	0.353	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	10.9	-177.3	-115.1	-37.8	0	0	0	114.2	R23 N27 N31	R23-N25 VanDerWaalsContact C-N 3.29Å; R23-N25 PolarHBondContact O-N 3.44Å; N25-N27 PolarHBondContact O-N 2.77Å; N25-N31 PolarHBondContact OD1-ND2 3.46Å; N25-N31 VanDerWaalsContact OD1-ND2 3.14Å
26	C	55.5	Low	60.2	Low	89 Å²	89	98.8 Å²	98.8	60%	0.601	47%	0.468	S	S	*	.			trans	-66.5	-21.9	-175.9	-72.2	0	0	0	0	114.3	K22 E28	K22-C26 PolarHBondContact O-SG 3.37Å; K22-C26 VanDerWaalsContact O-SG 3.38Å; C26-E28 PolarHBondContact O-N 3.25Å
27	N	64.9	Low	61.2	Low	42 Å²	42	97.9 Å²	97.9	23%	0.225	47%	0.47	C	S	.	.			trans	-90.1	107.5	-172.8	-66.9	12.3	0	0	0	110.5	N25 I29 C30 I194	N25-N27 PolarHBondContact O-N 2.77Å; N27-I29 PolarHBondContact O-N 3.34Å; N27-I29 VanDerWaalsContact O-N 3.08Å; N27-C30 VanDerWaalsContact O-CB 3.3Å; N27-C30 WeakPolarHBondContact O-CB 3.04Å; N27-C30 PolarHBondContact O-N 2.71Å; N27-I194 HydrophobicContact CB-CD1 4.48Å; N27-I194 HydrophobicContact CB-CG2 3.79Å; N27-I194 VanDerWaalsContact ND2-CG2 3.35Å; N27-I194 WeakPolarHBondContact ND2-CG2 3.42Å
28	E	69.4	Low	62.6	Low	75 Å²	75	95.7 Å²	95.7	35%	0.35	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-50	-36.3	-176.9	-166.1	-177.9	176.3	0	0	113.6	C26 C30 N31 H32 V35 Y54	C26-E28 PolarHBondContact O-N 3.25Å; E28-C30 PolarHBondContact O-N 2.04Å; E28-C30 VanDerWaalsContact O-N 3.1Å; E28-N31 PolarHBondContact O-N 3.1Å; E28-H32 HydrophobicContact CG-CB 4.25Å; E28-H32 PolarHBondContact O-N 3.14Å; E28-V35 HydrophobicContact CG-CG2 4.1Å; E28-Y54 HydrophobicContact CB-CE2 4.15Å; E28-Y54 PolarHBondContact N-OH 3.06Å; E28-Y54 VanDerWaalsContact N-OH 3.16Å
29	I	75.2	Confident	64.5	Low	0 Å²	0	96.2 Å²	96.2	0%	0	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-56.2	-27.5	176.6	-74.1	179.7	0	0	0	113.2	N27 N31 V35 Y54 I194 K202 F204	N27-I29 PolarHBondContact O-N 3.34Å; N27-I29 VanDerWaalsContact O-N 3.08Å; I29-N31 VanDerWaalsContact C-N 3.3Å; I29-N31 PolarHBondContact O-N 2.9Å; I29-V35 HydrophobicContact CG1-CB 4.2Å; I29-V35 HydrophobicContact CG1-CG1 4.28Å; I29-Y54 HydrophobicContact CD1-CD1 3.35Å; I29-Y54 HydrophobicContact CD1-CD2 4.32Å; I29-Y54 HydrophobicContact CD1-CE1 3.28Å; I29-Y54 HydrophobicContact CD1-CE2 4.27Å; I29-Y54 HydrophobicContact CD1-CG 3.86Å; I29-Y54 HydrophobicContact CG1-CD1 4.14Å; I29-Y54 HydrophobicContact CG1-CD2 4.39Å; I29-Y54 HydrophobicContact CG1-CE1 3.73Å; I29-Y54 HydrophobicContact CG1-CE2 4Å; I29-Y54 HydrophobicContact CG1-CG 4.42Å; I29-Y54 PolarHBondContact N-OH 2.88Å; I29-I194 HydrophobicContact CB-CD1 3.93Å; I29-I194 HydrophobicContact CD1-CD1 3.74Å; I29-I194 HydrophobicContact CG1-CD1 4.31Å; I29-I194 HydrophobicContact CG2-CD1 4.15Å; I29-K202 HydrophobicContact CG2-CB 3.85Å; I29-K202 HydrophobicContact CG2-CD 3.86Å; I29-K202 VanDerWaalsContact O-CD 3.23Å; I29-K202 WeakPolarHBondContact O-CD 3.05Å; I29-K202 PolarHBondContact O-NZ 2.78Å; I29-F204 HydrophobicContact CD1-CB 3.77Å; I29-F204 HydrophobicContact CD1-CD1 3.98Å; I29-F204 HydrophobicContact CD1-CG 4.15Å
30	C	78.3	Confident	66.4	Low	16 Å²	16	90.7 Å²	90.7	11%	0.108	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-65.5	-33.5	177	-67.4	0	0	0	0	112.5	N27 E28 C196 K202	N27-C30 VanDerWaalsContact O-CB 3.3Å; N27-C30 WeakPolarHBondContact O-CB 3.04Å; N27-C30 PolarHBondContact O-N 2.71Å; E28-C30 PolarHBondContact O-N 2.04Å; E28-C30 VanDerWaalsContact O-N 3.1Å; C30-C196 WeakPolarHBondContact CA-SG 3.42Å; C30-C196 HydrophobicContact CB-CB 3.78Å; C30-C196 WeakPolarHBondContact CB-SG 3.07Å; C30-C196 WeakPolarHBondContact SG-CA 3.1Å; C30-C196 WeakPolarHBondContact SG-CB 3.42Å; C30-C196 CovalentContact SG-SG 2.04Å; C30-C196 PolarHBondContact SG-SG 2.98Å; C30-K202 VanDerWaalsContact C-NZ 3.32Å; C30-K202 PolarHBondContact O-NZ 2.97Å
31	N	78	Confident	68.7	Low	97 Å²	97	90.4 Å²	90.4	52%	0.519	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-28.6	-178.4	-63.2	-45.3	0	0	0	112.9	N25 E28 I29	N25-N31 PolarHBondContact OD1-ND2 3.46Å; N25-N31 VanDerWaalsContact OD1-ND2 3.14Å; E28-N31 PolarHBondContact O-N 3.1Å; I29-N31 VanDerWaalsContact C-N 3.3Å; I29-N31 PolarHBondContact O-N 2.9Å
32	H	76	Confident	70.7	Confident	106 Å²	106	83.5 Å²	83.5	49%	0.491	41%	0.409	S	S	.	.			trans	-123	89.4	-177.9	-56.9	102.7	0	0	0	110.8	E28 N34 V35	E28-H32 HydrophobicContact CG-CB 4.25Å; E28-H32 PolarHBondContact O-N 3.14Å; H32-N34 PolarHBondContact O-N 3.28Å; H32-V35 HydrophobicContact CB-CG2 3.71Å; H32-V35 WeakPolarHBondContact O-CB 3.04Å; H32-V35 WeakPolarHBondContact O-CG2 3.43Å; H32-V35 PolarHBondContact O-N 3.38Å
33	P	71.3	Confident	72.9	Confident	73 Å²	73	76.7 Å²	76.7	47%	0.474	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-62.9	-24.7	-176.8	24.2	-32.8	0	0	0	113.6	V35 R36	P33-V35 PolarHBondContact O-N 2.8Å; P33-V35 VanDerWaalsContact O-N 3.16Å; P33-R36 WeakPolarHBondContact O-CB 3.23Å; P33-R36 PolarHBondContact O-N 3.44Å; P33-R36 VanDerWaalsContact O-N 3.12Å
34	N	72.1	Confident	75.2	Confident	147 Å²	147	71.4 Å²	71.4	79%	0.786	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-61.4	-23.6	178.6	-64.8	-14.3	0	0	0	113.2	H32 R36	H32-N34 PolarHBondContact O-N 3.28Å; N34-R36 PolarHBondContact O-N 2.79Å
35	V	72.3	Confident	77.7	Confident	21 Å²	21	67.9 Å²	67.9	13%	0.127	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-70.4	-18.4	-179.4	-175.6	0	0	0	0	111.8	E28 I29 H32 P33 N37 Y38 Y54	E28-V35 HydrophobicContact CG-CG2 4.1Å; I29-V35 HydrophobicContact CG1-CB 4.2Å; I29-V35 HydrophobicContact CG1-CG1 4.28Å; H32-V35 HydrophobicContact CB-CG2 3.71Å; H32-V35 WeakPolarHBondContact O-CB 3.04Å; H32-V35 WeakPolarHBondContact O-CG2 3.43Å; H32-V35 PolarHBondContact O-N 3.38Å; P33-V35 PolarHBondContact O-N 2.8Å; P33-V35 VanDerWaalsContact O-N 3.16Å; V35-N37 VanDerWaalsContact C-N 3.25Å; V35-N37 PolarHBondContact O-N 2.78Å; V35-Y38 VanDerWaalsContact O-CB 3.29Å; V35-Y38 WeakPolarHBondContact O-CB 3.41Å; V35-Y38 PolarHBondContact O-N 2.99Å; V35-Y38 VanDerWaalsContact O-N 3.09Å; V35-Y54 HydrophobicContact CB-CD2 4.47Å; V35-Y54 HydrophobicContact CG1-CD2 3.12Å; V35-Y54 HydrophobicContact CG1-CE2 3.33Å; V35-Y54 HydrophobicContact CG1-CG 4.09Å
36	R	73.3	Confident	80.1	Confident	95 Å²	95	71.6 Å²	71.6	36%	0.358	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-52.3	-42.1	177.6	-175.9	-175.8	-69	-167.3	-4.6	113.3	P33 N34 F203 F204	P33-R36 WeakPolarHBondContact O-CB 3.23Å; P33-R36 PolarHBondContact O-N 3.44Å; P33-R36 VanDerWaalsContact O-N 3.12Å; N34-R36 PolarHBondContact O-N 2.79Å; R36-F203 WeakPolarHBondContact CD-O 3.32Å; R36-F203 VanDerWaalsContact CG-O 3.24Å; R36-F203 WeakPolarHBondContact CG-O 3.25Å; R36-F203 PolarHBondContact NE-O 2.81Å; R36-F204 HydrophobicContact CG-CB 3.99Å
37	N	78.4	Confident	82	Confident	127 Å²	127	70.3 Å²	70.3	68%	0.679	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-106.9	17.7	-175.6	-59.4	-16.6	0	0	0	111.1	V35 E39	V35-N37 VanDerWaalsContact C-N 3.25Å; V35-N37 PolarHBondContact O-N 2.78Å; N37-E39 PolarHBondContact O-N 3.08Å; N37-E39 VanDerWaalsContact O-N 3.15Å
38	Y	83.4	Confident	83.6	Confident	92 Å²	92	69.2 Å²	69.2	36%	0.361	35%	0.354	S	S	.	.			trans	-59.6	123.5	179.4	175.3	-98.2	0	0	0	109.3	V35 N40 H53	V35-Y38 VanDerWaalsContact O-CB 3.29Å; V35-Y38 WeakPolarHBondContact O-CB 3.41Å; V35-Y38 PolarHBondContact O-N 2.99Å; V35-Y38 VanDerWaalsContact O-N 3.09Å; Y38-N40 HydrophobicContact CE1-CB 4.21Å; Y38-N40 HydrophobicContact CE2-CB 4.42Å; Y38-N40 WeakPolarHBondContact OH-CB 3.35Å; Y38-H53 VanDerWaalsContact O-CA 3.29Å; Y38-H53 WeakPolarHBondContact O-CA 3.3Å
39	E	90.2	Very high	84.9	Confident	91 Å²	91	66.3 Å²	66.3	43%	0.425	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	135.4	172.2	176.6	175.5	-142.7	0	0	108.3	N37 V41 R49 H52 H53	N37-E39 PolarHBondContact O-N 3.08Å; N37-E39 VanDerWaalsContact O-N 3.15Å; E39-V41 HydrophobicContact CG-CG2 4.32Å; E39-R49 IonicContact OE1-CZ 3.34Å; E39-R49 VanDerWaalsContact OE1-CZ 3.25Å; E39-R49 IonicContact OE1-NH1 3.81Å; E39-R49 PolarHBondContact OE1-NH1 3.1Å; E39-R49 IonicContact OE1-NH2 3.5Å; E39-R49 PolarHBondContact OE1-NH2 3.36Å; E39-R49 IonicContact OE2-NH2 2.72Å; E39-H52 CarbonylContact C-O 3.36Å; E39-H52 WeakPolarHBondContact CA-O 3.35Å; E39-H53 IonicContact OE1-CE1 3.89Å; E39-H53 PolarHBondContact OE1-CE1 2.99Å; E39-H53 IonicContact OE1-NE2 3.92Å
40	N	88.2	Confident	85.8	Confident	42 Å²	42	66.8 Å²	66.8	23%	0.225	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	103.1	172.1	168.4	69.3	0	0	0	108.8	Y38 I42 S51 H52 K255	Y38-N40 HydrophobicContact CE1-CB 4.21Å; Y38-N40 HydrophobicContact CE2-CB 4.42Å; Y38-N40 WeakPolarHBondContact OH-CB 3.35Å; N40-I42 PolarHBondContact O-N 3.2Å; N40-S51 WeakPolarHBondContact O-CA 3.24Å; N40-H52 PolarHBondContact N-O 3.36Å; N40-H52 PolarHBondContact O-N 2.74Å; N40-K255 PolarHBondContact ND2-NZ 3.12Å; N40-K255 PolarHBondContact OD1-NZ 3.16Å
41	V	92.3	Very high	86.6	Confident	55 Å²	55	66 Å²	66	33%	0.333	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	119.8	173.9	-176.1	0	0	0	0	108.7	E39 E44 R49	E39-V41 HydrophobicContact CG-CG2 4.32Å; V41-E44 HydrophobicContact CG1-CB 3.8Å; V41-R49 HydrophobicContact CG1-CG 4.44Å
42	I	89.6	Confident	87.2	Confident	26 Å²	26	62.2 Å²	62.2	13%	0.133	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-41.9	-179	-61.9	165.6	0	0	0	110.1	N40 Y50 H52 K253	N40-I42 PolarHBondContact O-N 3.2Å; I42-Y50 HydrophobicContact CB-CD1 4.03Å; I42-Y50 HydrophobicContact CD1-CD1 3.61Å; I42-Y50 HydrophobicContact CD1-CE1 3.45Å; I42-Y50 VanDerWaalsContact CD1-CE1 3.45Å; I42-Y50 HydrophobicContact CG1-CD1 4.38Å; I42-Y50 HydrophobicContact CG2-CD1 4.36Å; I42-Y50 PolarHBondContact N-O 3.17Å; I42-H52 HydrophobicContact CD1-CB 4.48Å; I42-H52 WeakPolarHBondContact CD1-CD2 3.22Å; I42-H52 VanDerWaalsContact CD1-CE1 3.46Å; I42-H52 WeakPolarHBondContact CD1-CE1 3.4Å; I42-H52 VanDerWaalsContact CD1-NE2 3.33Å; I42-H52 WeakPolarHBondContact CD1-NE2 3.1Å; I42-K253 PolarHBondContact O-NZ 2.9Å
43	I	89.2	Confident	87.8	Confident	18 Å²	18	57.5 Å²	57.5	9%	0.092	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	134.8	-176.1	-55.8	166.2	0	0	0	107.7	Y48 R49 Y50 D271	I43-Y48 HydrophobicContact CG2-CD1 4.14Å; I43-Y48 HydrophobicContact CG2-CE1 4.4Å; I43-R49 WeakPolarHBondContact O-CA 3.32Å; I43-Y50 PolarHBondContact N-O 2.87Å; I43-Y50 PolarHBondContact O-N 2.95Å; I43-D271 HydrophobicContact CD1-CB 3.82Å; I43-D271 WeakPolarHBondContact CD1-OD2 3.46Å; I43-D271 HydrophobicContact CG1-CB 3.84Å; I43-D271 WeakPolarHBondContact CG1-OD2 3.15Å; I43-D271 WeakPolarHBondContact CG2-OD2 3.45Å
44	E	94.5	Very high	88.3	Confident	72 Å²	72	55 Å²	55	34%	0.336	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	130.7	171.7	-171.4	166.2	167	0	0	110.2	V41 Y48 R49 K211 W212	V41-E44 HydrophobicContact CG1-CB 3.8Å; E44-Y48 CarbonylContact C-O 3.5Å; E44-Y48 WeakPolarHBondContact CA-O 3.25Å; E44-R49 HydrophobicContact CB-CG 4.27Å; E44-R49 HydrophobicContact CG-CB 4.23Å; E44-R49 HydrophobicContact CG-CG 4.05Å; E44-R49 IonicContact OE1-NE 2.63Å; E44-R49 WeakPolarHBondContact OE2-CD 3.18Å; E44-R49 IonicContact OE2-CZ 3.25Å; E44-R49 IonicContact OE2-NE 3.4Å; E44-R49 PolarHBondContact OE2-NE 2.91Å; E44-R49 IonicContact OE2-NH2 2.99Å; E44-K211 WeakPolarHBondContact OE1-CE 3.39Å; E44-K211 IonicContact OE1-NZ 3.77Å; E44-K211 PolarHBondContact OE1-NZ 2.89Å; E44-W212 HydrophobicContact CG-CZ2 4.04Å
45	N	94.9	Very high	88.6	Confident	75 Å²	75	49.8 Å²	49.8	40%	0.401	25%	0.246	S	C	.	.			trans	-139.5	-172	168.4	68.1	44.4	0	0	0	109	T47 Y48 W212	N45-T47 PolarHBondContact O-N 3.16Å; N45-T47 VanDerWaalsContact O-N 3.15Å; N45-T47 PolarHBondContact OD1-N 3.09Å; N45-T47 PolarHBondContact OD1-OG1 3.44Å; N45-Y48 PolarHBondContact N-O 3.48Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.34Å; N45-Y48 PolarHBondContact OD1-N 2.91Å; N45-W212 WeakPolarHBondContact O-CH2 3.46Å; N45-W212 WeakPolarHBondContact O-CZ2 3.43Å
46	D	94.7	Very high	89.5	Confident	144 Å²	144	48.8 Å²	48.8	77%	0.77	24%	0.24	S	C	*	.	S	Bend	trans	-66.6	-16.9	-174.2	-63.3	-25.6	0	0	0	115.3	R62	D46-R62 VanDerWaalsContact O-CD 3.31Å; D46-R62 WeakPolarHBondContact O-CD 3.17Å
47	T	96.6	Very high	90.3	Very high	63 Å²	63	44.7 Å²	44.7	39%	0.387	23%	0.226	S	C	.	.	S	Bend	trans	-127.1	-12.3	-173.4	61.7	0	0	0	0	114.1	N45 Q61 R62	N45-T47 PolarHBondContact O-N 3.16Å; N45-T47 VanDerWaalsContact O-N 3.15Å; N45-T47 PolarHBondContact OD1-N 3.09Å; N45-T47 PolarHBondContact OD1-OG1 3.44Å; T47-Q61 CarbonylContact O-C 3.57Å; T47-Q61 WeakPolarHBondContact O-CA 3.43Å; T47-R62 PolarHBondContact O-N 3.15Å
48	Y	96.7	Very high	91.2	Very high	19 Å²	19	38.7 Å²	38.7	8%	0.075	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	135.1	-175.3	-173.9	-90.9	0	0	0	111.5	I43 E44 N45 R59 I60 Q61	I43-Y48 HydrophobicContact CG2-CD1 4.14Å; I43-Y48 HydrophobicContact CG2-CE1 4.4Å; E44-Y48 CarbonylContact C-O 3.5Å; E44-Y48 WeakPolarHBondContact CA-O 3.25Å; N45-Y48 PolarHBondContact N-O 3.48Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.34Å; N45-Y48 PolarHBondContact OD1-N 2.91Å; Y48-R59 HydrophobicContact CE2-CG 3.99Å; Y48-I60 WeakPolarHBondContact CA-O 3.26Å; Y48-Q61 HydrophobicContact CD2-CG 3.83Å; Y48-Q61 HydrophobicContact CE2-CG 3.98Å
49	R	97.4	Very high	91.8	Very high	14 Å²	14	36.7 Å²	36.7	5%	0.053	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	136.6	168.8	-175.1	174.6	-166.8	-114.4	13.6	110.2	E39 V41 I43 E44 R59 I60 W212	E39-R49 IonicContact OE1-CZ 3.34Å; E39-R49 VanDerWaalsContact OE1-CZ 3.25Å; E39-R49 IonicContact OE1-NH1 3.81Å; E39-R49 PolarHBondContact OE1-NH1 3.1Å; E39-R49 IonicContact OE1-NH2 3.5Å; E39-R49 PolarHBondContact OE1-NH2 3.36Å; E39-R49 IonicContact OE2-NH2 2.72Å; V41-R49 HydrophobicContact CG1-CG 4.44Å; I43-R49 WeakPolarHBondContact O-CA 3.32Å; E44-R49 HydrophobicContact CB-CG 4.27Å; E44-R49 HydrophobicContact CG-CB 4.23Å; E44-R49 HydrophobicContact CG-CG 4.05Å; E44-R49 IonicContact OE1-NE 2.63Å; E44-R49 WeakPolarHBondContact OE2-CD 3.18Å; E44-R49 IonicContact OE2-CZ 3.25Å; E44-R49 IonicContact OE2-NE 3.4Å; E44-R49 PolarHBondContact OE2-NE 2.91Å; E44-R49 IonicContact OE2-NH2 2.99Å; R49-R59 CarbonylContact O-C 3.5Å; R49-R59 WeakPolarHBondContact O-CA 3.44Å; R49-I60 HydrophobicContact CB-CB 4.08Å; R49-I60 HydrophobicContact CB-CD1 4.3Å; R49-I60 HydrophobicContact CB-CG1 4.28Å; R49-I60 PolarHBondContact N-O 3.09Å; R49-I60 PolarHBondContact O-N 3.4Å; R49-W212 HydrophobicContact CB-CH2 4.07Å; R49-W212 HydrophobicContact CB-CZ2 3.67Å
50	Y	95.4	Very high	92.2	Very high	10 Å²	10	32.4 Å²	32.4	4%	0.039	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	120.4	170.7	-175.8	-115.7	0	0	0	110	I42 I43 H52 M58 R59	I42-Y50 HydrophobicContact CB-CD1 4.03Å; I42-Y50 HydrophobicContact CD1-CD1 3.61Å; I42-Y50 HydrophobicContact CD1-CE1 3.45Å; I42-Y50 VanDerWaalsContact CD1-CE1 3.45Å; I42-Y50 HydrophobicContact CG1-CD1 4.38Å; I42-Y50 HydrophobicContact CG2-CD1 4.36Å; I42-Y50 PolarHBondContact N-O 3.17Å; I43-Y50 PolarHBondContact N-O 2.87Å; I43-Y50 PolarHBondContact O-N 2.95Å; Y50-H52 AromaticContact CE1-NE2 3.64Å; Y50-H52 AromaticContact CZ-CD2 3.98Å; Y50-H52 AromaticContact CZ-NE2 3.64Å; Y50-H52 PolarHBondContact OH-NE2 2.89Å; Y50-M58 WeakPolarHBondContact CA-O 3.4Å; Y50-M58 WeakPolarHBondContact CD2-O 3.42Å; Y50-R59 HydrophobicContact CD2-CB 4.23Å
51	S	93.7	Very high	92.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	149.3	-178.7	50.7	0	0	0	0	111.3	N40 H53 S57 M58	N40-S51 WeakPolarHBondContact O-CA 3.24Å; S51-H53 PolarHBondContact OG-NE2 2.85Å; S51-S57 WeakPolarHBondContact O-CA 3.29Å; S51-M58 PolarHBondContact N-O 3.24Å; S51-M58 PolarHBondContact O-N 3.23Å
52	H	90.2	Very high	93	Very high	16 Å²	16	32.9 Å²	32.9	7%	0.074	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	129.6	167.4	-72	-179.1	0	0	0	108.6	E39 N40 I42 Y50 M224	E39-H52 CarbonylContact C-O 3.36Å; E39-H52 WeakPolarHBondContact CA-O 3.35Å; N40-H52 PolarHBondContact N-O 3.36Å; N40-H52 PolarHBondContact O-N 2.74Å; I42-H52 HydrophobicContact CD1-CB 4.48Å; I42-H52 WeakPolarHBondContact CD1-CD2 3.22Å; I42-H52 VanDerWaalsContact CD1-CE1 3.46Å; I42-H52 WeakPolarHBondContact CD1-CE1 3.4Å; I42-H52 VanDerWaalsContact CD1-NE2 3.33Å; I42-H52 WeakPolarHBondContact CD1-NE2 3.1Å; Y50-H52 AromaticContact CE1-NE2 3.64Å; Y50-H52 AromaticContact CZ-CD2 3.98Å; Y50-H52 AromaticContact CZ-NE2 3.64Å; Y50-H52 PolarHBondContact OH-NE2 2.89Å; H52-M224 HydrophobicContact CB-SD 4.36Å; H52-M224 VanDerWaalsContact CE1-CE 3.45Å; H52-M224 WeakPolarHBondContact CE1-CE 3.19Å
53	H	89.4	Confident	93.3	Very high	7 Å²	7	37.7 Å²	37.7	3%	0.032	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	172.4	168.5	-57.4	-93.8	0	0	0	107.4	Y38 E39 S51 E55 Y56 M58 I206	Y38-H53 VanDerWaalsContact O-CA 3.29Å; Y38-H53 WeakPolarHBondContact O-CA 3.3Å; E39-H53 IonicContact OE1-CE1 3.89Å; E39-H53 PolarHBondContact OE1-CE1 2.99Å; E39-H53 IonicContact OE1-NE2 3.92Å; S51-H53 PolarHBondContact OG-NE2 2.85Å; H53-E55 PolarHBondContact O-N 3.26Å; H53-Y56 CarbonylContact C-O 3.53Å; H53-Y56 WeakPolarHBondContact CA-O 3.22Å; H53-Y56 PolarHBondContact N-O 3.36Å; H53-Y56 PolarHBondContact O-N 2.83Å; H53-M58 WeakPolarHBondContact NE2-CE 3.33Å; H53-I206 HydrophobicContact CB-CD1 3.79Å; H53-I206 HydrophobicContact CB-CG1 4.03Å; H53-I206 HydrophobicContact CB-CG2 3.93Å; H53-I206 VanDerWaalsContact CG-CG2 3.48Å
54	Y	80.8	Confident	93.7	Very high	20 Å²	20	39.9 Å²	39.9	8%	0.078	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-26.9	-80.3	-172.1	-179.9	-130.1	0	0	0	115.9	E28 I29 V35 H92 I194 F204	E28-Y54 HydrophobicContact CB-CE2 4.15Å; E28-Y54 PolarHBondContact N-OH 3.06Å; E28-Y54 VanDerWaalsContact N-OH 3.16Å; I29-Y54 HydrophobicContact CD1-CD1 3.35Å; I29-Y54 HydrophobicContact CD1-CD2 4.32Å; I29-Y54 HydrophobicContact CD1-CE1 3.28Å; I29-Y54 HydrophobicContact CD1-CE2 4.27Å; I29-Y54 HydrophobicContact CD1-CG 3.86Å; I29-Y54 HydrophobicContact CG1-CD1 4.14Å; I29-Y54 HydrophobicContact CG1-CD2 4.39Å; I29-Y54 HydrophobicContact CG1-CE1 3.73Å; I29-Y54 HydrophobicContact CG1-CE2 4Å; I29-Y54 HydrophobicContact CG1-CG 4.42Å; I29-Y54 PolarHBondContact N-OH 2.88Å; V35-Y54 HydrophobicContact CB-CD2 4.47Å; V35-Y54 HydrophobicContact CG1-CD2 3.12Å; V35-Y54 HydrophobicContact CG1-CE2 3.33Å; V35-Y54 HydrophobicContact CG1-CG 4.09Å; Y54-H92 AromaticContact CE1-NE2 3.76Å; Y54-I194 HydrophobicContact CE1-CD1 4.01Å; Y54-F204 HydrophobicContact CD1-CD1 4.29Å; Y54-F204 HydrophobicContact CD1-CG 4.44Å
55	E	80.3	Confident	93.8	Very high	38 Å²	38	41.5 Å²	41.5	18%	0.178	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	14.9	177.1	-75.8	-174.1	-165.6	0	0	112.8	H53 H92 A223 M224	H53-E55 PolarHBondContact O-N 3.26Å; E55-H92 IonicContact OE1-CE1 3.53Å; E55-H92 IonicContact OE1-NE2 3.26Å; E55-H92 PolarHBondContact OE1-NE2 3.38Å; E55-H92 IonicContact OE2-CD2 3.03Å; E55-H92 PolarHBondContact OE2-CD2 2.91Å; E55-H92 IonicContact OE2-CE1 3.36Å; E55-H92 PolarHBondContact OE2-CE1 3.06Å; E55-H92 IonicContact OE2-CG 3.5Å; E55-H92 IonicContact OE2-ND1 3.67Å; E55-H92 IonicContact OE2-NE2 3.06Å; E55-H92 PolarHBondContact OE2-NE2 2.85Å; E55-A223 CarbonylContact O-C 3.48Å; E55-A223 WeakPolarHBondContact O-CA 3.32Å; E55-M224 PolarHBondContact O-N 3.03Å
56	Y	89.3	Confident	93.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	139.2	-169.9	-81	-94.7	0	0	0	111.3	H53 H92 I190 F204 I206 F221 Q222 A223	H53-Y56 CarbonylContact C-O 3.53Å; H53-Y56 WeakPolarHBondContact CA-O 3.22Å; H53-Y56 PolarHBondContact N-O 3.36Å; H53-Y56 PolarHBondContact O-N 2.83Å; Y56-H92 HydrophobicContact CE2-CB 4.17Å; Y56-H92 PolarHBondContact OH-N 3.17Å; Y56-I190 HydrophobicContact CD1-CD1 3.76Å; Y56-I190 HydrophobicContact CD2-CD1 4.27Å; Y56-I190 HydrophobicContact CE1-CD1 3.75Å; Y56-I190 HydrophobicContact CE2-CD1 4.29Å; Y56-I190 HydrophobicContact CG-CD1 4.01Å; Y56-F204 HydrophobicContact CD2-CE2 4.2Å; Y56-F204 HydrophobicContact CD2-CZ 4.41Å; Y56-F204 HydrophobicContact CE2-CE2 4.19Å; Y56-F204 HydrophobicContact CE2-CZ 4.04Å; Y56-I206 HydrophobicContact CD2-CD1 3.78Å; Y56-I206 HydrophobicContact CG-CD1 3.85Å; Y56-F221 HydrophobicContact CD1-CB 3.96Å; Y56-F221 HydrophobicContact CE1-CB 4.37Å; Y56-Q222 WeakPolarHBondContact CA-O 3.39Å; Y56-A223 HydrophobicContact CE1-CB 4.22Å
57	S	92	Very high	93.8	Very high	10 Å²	10	36.6 Å²	36.6	7%	0.07	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	141.9	159.5	63.7	0	0	0	0	109.1	S51 F221 Q222	S51-S57 WeakPolarHBondContact O-CA 3.29Å; S57-F221 WeakPolarHBondContact O-CA 3.07Å; S57-Q222 PolarHBondContact N-O 2.86Å; S57-Q222 PolarHBondContact O-N 3.49Å; S57-Q222 PolarHBondContact OG-O 2.6Å
58	M	96	Very high	93.8	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	127.8	172	-174.2	-158.7	-63.1	0	0	108.5	Y50 S51 H53 I60 I206 P207 V219 E220 F221	Y50-M58 WeakPolarHBondContact CA-O 3.4Å; Y50-M58 WeakPolarHBondContact CD2-O 3.42Å; S51-M58 PolarHBondContact N-O 3.24Å; S51-M58 PolarHBondContact O-N 3.23Å; H53-M58 WeakPolarHBondContact NE2-CE 3.33Å; M58-I60 HydrophobicContact CG-CG1 4.24Å; M58-I60 HydrophobicContact SD-CD1 3.79Å; M58-I60 HydrophobicContact SD-CG1 3.93Å; M58-I206 HydrophobicContact CE-CG2 3.45Å; M58-I206 VanDerWaalsContact CE-CG2 3.45Å; M58-P207 WeakPolarHBondContact CE-O 3.4Å; M58-V219 HydrophobicContact CG-CG1 3.8Å; M58-V219 HydrophobicContact SD-CG1 4.21Å; M58-E220 CarbonylContact C-O 3.51Å; M58-E220 WeakPolarHBondContact CA-O 3.34Å; M58-F221 HydrophobicContact CB-CD1 4.26Å; M58-F221 HydrophobicContact CB-CE1 4.39Å; M58-F221 HydrophobicContact CE-CD1 4.37Å; M58-F221 HydrophobicContact CE-CE1 3.49Å; M58-F221 VanDerWaalsContact CE-CE1 3.49Å; M58-F221 HydrophobicContact CE-CZ 4.11Å; M58-F221 HydrophobicContact CG-CD1 4.12Å; M58-F221 HydrophobicContact CG-CE1 3.9Å; M58-F221 HydrophobicContact CG-CZ 4.4Å; M58-F221 HydrophobicContact SD-CE1 4.32Å
59	R	97.2	Very high	93.7	Very high	51 Å²	51	36.3 Å²	36.3	19%	0.192	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127.5	172.5	177.1	170.7	73.8	159.6	7.1	108.8	Y48 R49 Y50 Q61 V219 E220 N261	Y48-R59 HydrophobicContact CE2-CG 3.99Å; R49-R59 CarbonylContact O-C 3.5Å; R49-R59 WeakPolarHBondContact O-CA 3.44Å; Y50-R59 HydrophobicContact CD2-CB 4.23Å; R59-Q61 HydrophobicContact CG-CG 4.16Å; R59-V219 CarbonylContact O-C 3.58Å; R59-V219 WeakPolarHBondContact O-CA 3.3Å; R59-E220 IonicContact CZ-OE2 2.79Å; R59-E220 PolarHBondContact N-O 2.84Å; R59-E220 IonicContact NE-OE2 2.8Å; R59-E220 PolarHBondContact NE-OE2 3.49Å; R59-E220 IonicContact NH2-OE1 2.6Å; R59-E220 IonicContact NH2-OE2 3.52Å; R59-E220 PolarHBondContact NH2-OE2 2.95Å; R59-E220 PolarHBondContact O-N 2.78Å; R59-N261 PolarHBondContact NH1-ND2 3.29Å
60	I	98.5	Very high	93.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	132.1	174.2	-46.6	-177.1	0	0	0	108.7	Y48 R49 M58 V208 W212 T217 L218 V219	Y48-I60 WeakPolarHBondContact CA-O 3.26Å; R49-I60 HydrophobicContact CB-CB 4.08Å; R49-I60 HydrophobicContact CB-CD1 4.3Å; R49-I60 HydrophobicContact CB-CG1 4.28Å; R49-I60 PolarHBondContact N-O 3.09Å; R49-I60 PolarHBondContact O-N 3.4Å; M58-I60 HydrophobicContact CG-CG1 4.24Å; M58-I60 HydrophobicContact SD-CD1 3.79Å; M58-I60 HydrophobicContact SD-CG1 3.93Å; I60-V208 HydrophobicContact CD1-CG1 4.21Å; I60-W212 HydrophobicContact CB-CD2 4.33Å; I60-W212 HydrophobicContact CB-CE3 4.1Å; I60-W212 HydrophobicContact CB-CZ3 4.46Å; I60-W212 HydrophobicContact CD1-CB 3.96Å; I60-W212 HydrophobicContact CD1-CD2 4.08Å; I60-W212 HydrophobicContact CD1-CG 3.72Å; I60-W212 HydrophobicContact CG2-CB 4.08Å; I60-W212 HydrophobicContact CG2-CD2 3.75Å; I60-W212 HydrophobicContact CG2-CE3 3.3Å; I60-W212 HydrophobicContact CG2-CG 4.09Å; I60-W212 HydrophobicContact CG2-CZ3 3.96Å; I60-T217 HydrophobicContact CG2-CG2 3.38Å; I60-L218 CarbonylContact C-O 3.57Å; I60-L218 WeakPolarHBondContact CA-O 3.41Å; I60-V219 HydrophobicContact CG1-CG1 4.26Å; I60-V219 HydrophobicContact CG1-CG2 4.18Å; I60-V219 HydrophobicContact CG2-CG2 4.07Å
61	Q	98.4	Very high	93.7	Very high	38 Å²	38	43.4 Å²	43.4	18%	0.178	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	127.7	178	-65.5	-178.1	-119.9	0	0	109.9	T47 Y48 R59 Q64 T217 L218	T47-Q61 CarbonylContact O-C 3.57Å; T47-Q61 WeakPolarHBondContact O-CA 3.43Å; Y48-Q61 HydrophobicContact CD2-CG 3.83Å; Y48-Q61 HydrophobicContact CE2-CG 3.98Å; R59-Q61 HydrophobicContact CG-CG 4.16Å; Q61-Q64 HydrophobicContact CB-CG 3.63Å; Q61-Q64 WeakPolarHBondContact O-CG 3.16Å; Q61-T217 WeakPolarHBondContact O-CA 3.46Å; Q61-L218 PolarHBondContact N-O 3.01Å; Q61-L218 PolarHBondContact O-N 2.83Å
62	R	97.8	Very high	93.9	Very high	69 Å²	69	47 Å²	47	26%	0.26	24%	0.244	S	C	.	.	S	Bend	trans	-88.2	166.1	171.8	-71.3	-170	65.5	-146.8	-7.6	112.1	D46 T47 Q64 W212 G216 T217	D46-R62 VanDerWaalsContact O-CD 3.31Å; D46-R62 WeakPolarHBondContact O-CD 3.17Å; T47-R62 PolarHBondContact O-N 3.15Å; R62-Q64 PolarHBondContact O-N 3.48Å; R62-Q64 PolarHBondContact O-NE2 2.82Å; R62-W212 HydrophobicContact CG-CE3 3.94Å; R62-W212 HydrophobicContact CG-CZ3 3.75Å; R62-G216 CarbonylContact C-O 3.58Å; R62-T217 HydrophobicContact CG-CG2 4.26Å
63	H	97	Very high	94.3	Very high	127 Å²	127	46.8 Å²	46.8	59%	0.588	24%	0.242	S	C	*	.	S	Bend	trans	58.5	34.7	177.1	-48.7	-66.8	0	0	0	112.8	G216	H63-G216 PolarHBondContact N-O 2.82Å
64	Q	97.8	Very high	94.6	Very high	64 Å²	64	52.2 Å²	52.2	30%	0.299	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-92.9	138.7	176.9	-56.9	-56	-66.1	0	0	109.6	Q61 R62 Y173 G216 L218	Q61-Q64 HydrophobicContact CB-CG 3.63Å; Q61-Q64 WeakPolarHBondContact O-CG 3.16Å; R62-Q64 PolarHBondContact O-N 3.48Å; R62-Q64 PolarHBondContact O-NE2 2.82Å; Q64-Y173 HydrophobicContact CB-CE2 4.3Å; Q64-Y173 WeakPolarHBondContact O-CE2 3.36Å; Q64-Y173 PolarHBondContact O-OH 2.86Å; Q64-G216 PolarHBondContact N-O 3.18Å; Q64-L218 HydrophobicContact CB-CB 3.99Å; Q64-L218 HydrophobicContact CG-CB 3.89Å
65	S	96	Very high	95.4	Very high	107 Å²	107	53.7 Å²	53.7	75%	0.748	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-66.8	160.9	168.5	-57.5	0	0	0	0	110.9	Y173	S65-Y173 VanDerWaalsContact C-OH 3.3Å
66	Q	94.6	Very high	96.3	Very high	61 Å²	61	57.8 Å²	57.8	29%	0.285	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-55.9	125.4	175.8	-161.2	-176.1	13.6	0	0	109.7	V68 S70 Y173 D175	Q66-V68 WeakPolarHBondContact CG-O 3.48Å; Q66-V68 PolarHBondContact NE2-O 2.83Å; Q66-V68 PolarHBondContact O-N 3.25Å; Q66-V68 PolarHBondContact OE1-O 2.98Å; Q66-S70 PolarHBondContact NE2-OG 3.06Å; Q66-S70 PolarHBondContact OE1-OG 2.98Å; Q66-Y173 HydrophobicContact CB-CE1 3.91Å; Q66-Y173 HydrophobicContact CG-CD1 4.07Å; Q66-Y173 HydrophobicContact CG-CE1 3.81Å; Q66-Y173 PolarHBondContact N-OH 3.37Å; Q66-D175 VanDerWaalsContact CD-OD1 3.29Å; Q66-D175 WeakPolarHBondContact CG-OD1 3.34Å; Q66-D175 PolarHBondContact NE2-OD1 3.33Å
67	P	95	Very high	96.7	Very high	55 Å²	55	58.9 Å²	58.9	36%	0.357	30%	0.303	S	S	.	.	S	Bend	trans	-69.1	-19.6	-175.4	26.7	-35.3	0	0	0	112.8	L163 Y173 L218	P67-L163 HydrophobicContact CB-CD1 4.16Å; P67-L163 HydrophobicContact CG-CD1 3.73Å; P67-Y173 VanDerWaalsContact CD-CG 3.46Å; P67-Y173 HydrophobicContact CG-CD2 4.47Å; P67-Y173 HydrophobicContact CG-CG 4.12Å; P67-L218 HydrophobicContact CG-CD1 4.38Å
68	V	96	Very high	96.8	Very high	6 Å²	6	65.1 Å²	65.1	4%	0.036	34%	0.336	C	S	.	.	S	Bend	trans	-143.3	131.7	-178.1	-174.3	0	0	0	0	109.1	Q66 R72 F73 L135 L140 L163	Q66-V68 WeakPolarHBondContact CG-O 3.48Å; Q66-V68 PolarHBondContact NE2-O 2.83Å; Q66-V68 PolarHBondContact O-N 3.25Å; Q66-V68 PolarHBondContact OE1-O 2.98Å; V68-R72 HydrophobicContact CG1-CB 4.08Å; V68-R72 HydrophobicContact CG1-CG 4.46Å; V68-F73 HydrophobicContact CB-CE2 4.17Å; V68-F73 HydrophobicContact CG1-CE2 4.12Å; V68-L135 HydrophobicContact CG1-CD1 3.57Å; V68-L140 HydrophobicContact CG1-CD2 4.38Å; V68-L140 HydrophobicContact CG2-CD2 3.6Å; V68-L163 HydrophobicContact CG2-CD1 3.65Å; V68-L163 HydrophobicContact CG2-CD2 3.95Å; V68-L163 HydrophobicContact CG2-CG 4.49Å
69	P	96	Very high	96.8	Very high	69 Å²	69	66.7 Å²	66.7	45%	0.448	35%	0.352	S	S	.	.			trans	-55.1	139.8	174	-27.5	35.5	0	0	0	113.2	D71 R72	P69-D71 VanDerWaalsContact C-N 3.29Å; P69-D71 WeakPolarHBondContact CB-OD1 3.29Å; P69-D71 PolarHBondContact O-N 3.4Å; P69-R72 HydrophobicContact CB-CG 4.49Å; P69-R72 WeakPolarHBondContact O-CB 3.23Å; P69-R72 PolarHBondContact O-N 2.82Å
70	S	95.1	Very high	96.9	Very high	47 Å²	47	68.6 Å²	68.6	33%	0.329	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-64.7	-28.7	-174.2	-70.6	0	0	0	0	114.3	Q66 R72 F73 K144	Q66-S70 PolarHBondContact NE2-OG 3.06Å; Q66-S70 PolarHBondContact OE1-OG 2.98Å; S70-R72 PolarHBondContact O-N 2.98Å; S70-F73 PolarHBondContact O-N 2.83Å; S70-K144 PolarHBondContact OG-NZ 3.26Å
71	D	96.4	Very high	96.8	Very high	127 Å²	127	70.8 Å²	70.8	68%	0.679	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-65.9	-18.7	177.7	57.8	-61.2	0	0	0	113.4	P69 F73	P69-D71 VanDerWaalsContact C-N 3.29Å; P69-D71 WeakPolarHBondContact CB-OD1 3.29Å; P69-D71 PolarHBondContact O-N 3.4Å; D71-F73 VanDerWaalsContact C-N 3.29Å; D71-F73 PolarHBondContact O-N 2.59Å
72	R	97.8	Very high	96.8	Very high	75 Å²	75	71.3 Å²	71.3	28%	0.283	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-75.2	-17.4	175	-65	-176.3	57.1	-164.1	-13.2	113.5	V68 P69 S70 N74 L135 E137	V68-R72 HydrophobicContact CG1-CB 4.08Å; V68-R72 HydrophobicContact CG1-CG 4.46Å; P69-R72 HydrophobicContact CB-CG 4.49Å; P69-R72 WeakPolarHBondContact O-CB 3.23Å; P69-R72 PolarHBondContact O-N 2.82Å; S70-R72 PolarHBondContact O-N 2.98Å; R72-N74 PolarHBondContact O-N 2.8Å; R72-L135 HydrophobicContact CB-CD1 3.75Å; R72-L135 HydrophobicContact CB-CG 4.44Å; R72-E137 IonicContact CZ-OE1 2.75Å; R72-E137 IonicContact CZ-OE2 3.03Å; R72-E137 IonicContact NE-OE1 3.14Å; R72-E137 PolarHBondContact NE-OE1 3.2Å; R72-E137 IonicContact NE-OE2 3.44Å; R72-E137 IonicContact NH2-OE1 2.61Å; R72-E137 PolarHBondContact NH2-OE1 2.98Å; R72-E137 IonicContact NH2-OE2 3.77Å; R72-E137 PolarHBondContact NH2-OE2 3.07Å
73	F	98.2	Very high	96.7	Very high	11 Å²	11	68.1 Å²	68.1	5%	0.048	37%	0.369	C	S	.	.			trans	-86.5	81.7	171.1	-63.2	-94.4	0	0	0	108.9	V68 S70 D71 A133 L135 K144 T161 L163	V68-F73 HydrophobicContact CB-CE2 4.17Å; V68-F73 HydrophobicContact CG1-CE2 4.12Å; S70-F73 PolarHBondContact O-N 2.83Å; D71-F73 VanDerWaalsContact C-N 3.29Å; D71-F73 PolarHBondContact O-N 2.59Å; F73-A133 HydrophobicContact CB-CB 3.74Å; F73-A133 WeakPolarHBondContact CD1-O 3.38Å; F73-A133 WeakPolarHBondContact O-CB 3.48Å; F73-L135 HydrophobicContact CD1-CB 3.62Å; F73-L135 HydrophobicContact CE1-CB 3.75Å; F73-L135 HydrophobicContact CE1-CD1 4.4Å; F73-L135 HydrophobicContact CE2-CD1 4.25Å; F73-L135 HydrophobicContact CG-CB 4.14Å; F73-L135 HydrophobicContact CZ-CB 4.36Å; F73-L135 HydrophobicContact CZ-CD1 4.19Å; F73-K144 HydrophobicContact CB-CB 4.33Å; F73-K144 HydrophobicContact CD1-CB 3.59Å; F73-K144 HydrophobicContact CD2-CB 4.19Å; F73-K144 HydrophobicContact CD2-CD 4.27Å; F73-K144 HydrophobicContact CE1-CB 3.83Å; F73-K144 HydrophobicContact CE2-CB 4.4Å; F73-K144 HydrophobicContact CG-CB 3.78Å; F73-K144 HydrophobicContact CG-CD 4.48Å; F73-K144 HydrophobicContact CZ-CB 4.24Å; F73-T161 HydrophobicContact CE1-CG2 4Å; F73-T161 HydrophobicContact CE2-CG2 4.23Å; F73-T161 HydrophobicContact CZ-CG2 3.43Å; F73-T161 VanDerWaalsContact CZ-CG2 3.43Å; F73-L163 HydrophobicContact CE1-CD2 4.42Å; F73-L163 HydrophobicContact CZ-CD2 3.92Å
74	N	96.9	Very high	96.6	Very high	121 Å²	121	68.2 Å²	68.2	65%	0.647	37%	0.365	S	S	*	.			trans	-107.1	-4.2	-168.1	62.1	-0.4	0	0	0	114.4	R72 V134	R72-N74 PolarHBondContact O-N 2.8Å; N74-V134 PolarHBondContact N-O 2.78Å
75	I	98	Very high	96.2	Very high	52 Å²	52	66.1 Å²	66.1	27%	0.267	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	98.7	178.6	-55.6	170.1	0	0	0	109.2	I77 A133 V134 D136	I75-I77 HydrophobicContact CG2-CG2 4.1Å; I75-A133 CarbonylContact O-C 3.46Å; I75-A133 VanDerWaalsContact O-CA 3.28Å; I75-A133 WeakPolarHBondContact O-CA 3.24Å; I75-V134 HydrophobicContact CB-CB 4.13Å; I75-V134 PolarHBondContact N-O 3.26Å; I75-V134 PolarHBondContact O-N 2.88Å; I75-D136 HydrophobicContact CD1-CB 3.84Å
76	K	98.1	Very high	95.5	Very high	123 Å²	123	67.8 Å²	67.8	54%	0.535	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	137.6	175.9	-67.9	-69.6	-178.8	176.9	0	111.9	D131 T132 A133	K76-D131 WeakPolarHBondContact CD-OD1 3.45Å; K76-D131 IonicContact NZ-OD1 2.76Å; K76-D131 PolarHBondContact NZ-OD1 3.12Å; K76-D131 IonicContact NZ-OD2 2.82Å; K76-D131 PolarHBondContact NZ-OD2 3.45Å; K76-T132 WeakPolarHBondContact CA-O 3.47Å; K76-A133 HydrophobicContact CD-CB 4.02Å
77	I	97.7	Very high	94.6	Very high	24 Å²	24	66.4 Å²	66.4	12%	0.123	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	145	-175.8	67	162.8	0	0	0	111.4	I75 H81 F101 A103 T132 V134	I75-I77 HydrophobicContact CG2-CG2 4.1Å; I77-H81 HydrophobicContact CD1-CB 4.14Å; I77-H81 HydrophobicContact CG2-CB 3.71Å; I77-F101 HydrophobicContact CD1-CB 4.48Å; I77-A103 HydrophobicContact CD1-CB 4.01Å; I77-A103 HydrophobicContact CG1-CB 3.91Å; I77-T132 HydrophobicContact CD1-CG2 3.86Å; I77-T132 HydrophobicContact CG1-CG2 3.7Å; I77-T132 PolarHBondContact N-O 3.41Å; I77-V134 HydrophobicContact CD1-CG2 3.8Å; I77-V134 HydrophobicContact CG1-CG2 4.29Å; I77-V134 HydrophobicContact CG2-CG2 4.21Å
78	N	95.4	Very high	93.5	Very high	141 Å²	141	69 Å²	69	75%	0.754	36%	0.361	S	S	*	.	S	Bend	trans	-129	32.8	175.3	-168.8	18.5	0	0	0	111.5	F130	N78-F130 VanDerWaalsContact OD1-CZ 3.24Å; N78-F130 WeakPolarHBondContact OD1-CZ 3.23Å
79	G	96.2	Very high	92.3	Very high	32 Å²	32	68.8 Å²	68.8	33%	0.33	36%	0.36	S	S	.	.	S	Bend	trans	-175.4	-120.5	-173.4	0	0	0	0	0	109.1	Y102 A103	G79-Y102 CarbonylContact O-C 3.54Å; G79-A103 WeakPolarHBondContact O-CB 3.24Å; G79-A103 PolarHBondContact O-N 3.44Å
80	I	97.4	Very high	91.3	Very high	92 Å²	92	68.2 Å²	68.2	47%	0.472	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	135.4	-178.1	-50.3	173.8	0	0	0	110.1	M100 F101 Y102	I80-M100 HydrophobicContact CD1-CE 4.11Å; I80-M100 HydrophobicContact CG2-CB 3.97Å; I80-M100 HydrophobicContact CG2-CE 3.77Å; I80-M100 HydrophobicContact CG2-CG 4.43Å; I80-F101 WeakPolarHBondContact CA-O 2.96Å; I80-Y102 HydrophobicContact CD1-CD1 3.79Å; I80-Y102 HydrophobicContact CD1-CE1 3.32Å; I80-Y102 HydrophobicContact CG1-CD1 3.57Å; I80-Y102 HydrophobicContact CG1-CE1 3.68Å; I80-Y102 HydrophobicContact CG1-CG 4.22Å
81	H	97.7	Very high	90.2	Very high	45 Å²	45	66 Å²	66	21%	0.208	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	120.3	168.5	-174.6	84.4	0	0	0	110.2	I77 F101 V134	I77-H81 HydrophobicContact CD1-CB 4.14Å; I77-H81 HydrophobicContact CG2-CB 3.71Å; H81-F101 PolarHBondContact N-O 3Å; H81-F101 PolarHBondContact O-N 3.03Å; H81-V134 HydrophobicContact CB-CG2 4.29Å
82	T	97.6	Very high	89.1	Confident	50 Å²	50	60.2 Å²	60.2	31%	0.307	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	121.7	-178.3	-58.8	0	0	0	0	109.8	Y84 K98 I99 M100	T82-Y84 HydrophobicContact CG2-CD2 4.47Å; T82-Y84 HydrophobicContact CG2-CE2 3.79Å; T82-K98 HydrophobicContact CG2-CB 4.08Å; T82-K98 HydrophobicContact CG2-CD 3.87Å; T82-I99 WeakPolarHBondContact CA-O 3.46Å; T82-M100 HydrophobicContact CG2-CG 4.26Å
83	V	96	Very high	87.8	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.006	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	150.3	174.9	-59.2	0	0	0	0	111.1	K98 I99 F101 V134 D136 L141	V83-K98 WeakPolarHBondContact O-CA 3.39Å; V83-K98 WeakPolarHBondContact O-CB 3.23Å; V83-I99 HydrophobicContact CG2-CB 3.76Å; V83-I99 HydrophobicContact CG2-CD1 4.07Å; V83-I99 PolarHBondContact N-O 2.85Å; V83-I99 PolarHBondContact O-N 2.87Å; V83-F101 HydrophobicContact CB-CE2 4.3Å; V83-F101 HydrophobicContact CG1-CD2 3.94Å; V83-F101 HydrophobicContact CG1-CE2 3.82Å; V83-F101 HydrophobicContact CG2-CD2 3.99Å; V83-F101 HydrophobicContact CG2-CE2 3.45Å; V83-F101 VanDerWaalsContact CG2-CE2 3.45Å; V83-F101 HydrophobicContact CG2-CZ 4.22Å; V83-V134 HydrophobicContact CG1-CG1 4.31Å; V83-D136 HydrophobicContact CG1-CB 4Å; V83-L141 HydrophobicContact CB-CD2 4.32Å; V83-L141 HydrophobicContact CG2-CD1 3.91Å; V83-L141 HydrophobicContact CG2-CD2 4.39Å
84	Y	94.4	Very high	86.9	Confident	129 Å²	129	62.8 Å²	62.8	51%	0.506	33%	0.331	S	S	.	.			trans	-120.2	104.1	175.8	-66.3	-93.1	0	0	0	108.3	T82 Q86 R97 K98	T82-Y84 HydrophobicContact CG2-CD2 4.47Å; T82-Y84 HydrophobicContact CG2-CE2 3.79Å; Y84-Q86 PolarHBondContact O-N 2.96Å; Y84-Q86 VanDerWaalsContact O-N 3.17Å; Y84-R97 HydrophobicContact CD1-CG 4.49Å; Y84-R97 VanDerWaalsContact CD1-O 3.31Å; Y84-R97 WeakPolarHBondContact CD1-O 2.9Å; Y84-K98 HydrophobicContact CD1-CB 3.91Å; Y84-K98 HydrophobicContact CE1-CB 3.79Å; Y84-K98 HydrophobicContact CE1-CD 4.44Å
85	P	89.3	Confident	86.3	Confident	21 Å²	21	63.4 Å²	63.4	14%	0.136	33%	0.325	C	S	.	.			trans	-52.4	124.3	179.7	-24	30.5	0	0	0	112	F87 I96 I99 L141	P85-F87 HydrophobicContact CB-CD1 4.46Å; P85-F87 HydrophobicContact CB-CD2 4.18Å; P85-F87 HydrophobicContact CB-CE1 4.34Å; P85-F87 HydrophobicContact CB-CE2 4.06Å; P85-F87 HydrophobicContact CB-CG 4.44Å; P85-F87 HydrophobicContact CB-CZ 4.16Å; P85-F87 PolarHBondContact O-N 2.83Å; P85-I96 HydrophobicContact CG-CB 4.44Å; P85-I96 HydrophobicContact CG-CG2 3.92Å; P85-I99 HydrophobicContact CG-CD1 3.81Å; P85-L141 HydrophobicContact CB-CD1 3.94Å; P85-L141 HydrophobicContact CG-CD1 3.63Å
86	Q	81.1	Confident	85.8	Confident	141 Å²	141	61.2 Å²	61.2	66%	0.659	31%	0.314	S	S	*	.	S	Bend	trans	-82.7	13.7	174.5	-60.3	-175.8	8	0	0	112.5	Y84 K138	Y84-Q86 PolarHBondContact O-N 2.96Å; Y84-Q86 VanDerWaalsContact O-N 3.17Å; Q86-K138 HydrophobicContact CB-CG 4.33Å
87	F	76.2	Confident	85.6	Confident	33 Å²	33	60.7 Å²	60.7	15%	0.145	31%	0.308	C	S	.	.	S	Bend	trans	-136.7	153.4	-177.2	50.5	-96.5	0	0	0	109.8	P85 C89 K138 L141 I164 P166	P85-F87 HydrophobicContact CB-CD1 4.46Å; P85-F87 HydrophobicContact CB-CD2 4.18Å; P85-F87 HydrophobicContact CB-CE1 4.34Å; P85-F87 HydrophobicContact CB-CE2 4.06Å; P85-F87 HydrophobicContact CB-CG 4.44Å; P85-F87 HydrophobicContact CB-CZ 4.16Å; P85-F87 PolarHBondContact O-N 2.83Å; F87-C89 HydrophobicContact CD2-CB 3.61Å; F87-C89 HydrophobicContact CE2-CB 3.53Å; F87-C89 WeakPolarHBondContact CE2-SG 3.45Å; F87-C89 PolarHBondContact O-N 2.77Å; F87-K138 VanDerWaalsContact CD1-O 3.24Å; F87-K138 WeakPolarHBondContact CD1-O 3.47Å; F87-L141 HydrophobicContact CE1-CD1 4.19Å; F87-L141 HydrophobicContact CE1-CG 4Å; F87-L141 HydrophobicContact CZ-CD1 3.86Å; F87-L141 HydrophobicContact CZ-CG 3.88Å; F87-I164 HydrophobicContact CE2-CG2 4.41Å; F87-P166 HydrophobicContact CB-CB 4.25Å; F87-P166 HydrophobicContact CD1-CG 4.42Å; F87-P166 VanDerWaalsContact CD2-CA 3.41Å; F87-P166 HydrophobicContact CD2-CB 4Å; F87-P166 HydrophobicContact CD2-CG 4.39Å; F87-P166 HydrophobicContact CE2-CB 4.46Å; F87-P166 HydrophobicContact CG-CB 4.08Å; F87-P166 HydrophobicContact CG-CG 4.27Å
88	T	71.4	Confident	85.4	Confident	109 Å²	109	62 Å²	62	67%	0.669	31%	0.313	S	S	*	.			trans	-76.4	95.9	176	-51	0	0	0	0	110	Y95	T88-Y95 HydrophobicContact CG2-CD1 3.46Å; T88-Y95 VanDerWaalsContact CG2-CD1 3.46Å; T88-Y95 HydrophobicContact CG2-CE1 3.25Å
89	C	71.8	Confident	85.5	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.007	28%	0.277	C	S	.	.			trans	-112.9	147.6	171.5	53	0	0	0	0	111.8	F87 I96	F87-C89 HydrophobicContact CD2-CB 3.61Å; F87-C89 HydrophobicContact CE2-CB 3.53Å; F87-C89 WeakPolarHBondContact CE2-SG 3.45Å; F87-C89 PolarHBondContact O-N 2.77Å; C89-I96 HydrophobicContact CB-CD1 4.16Å; C89-I96 PolarHBondContact O-N 2.82Å; C89-I96 VanDerWaalsContact SG-CD1 3.54Å
90	N	74.5	Confident	85.6	Confident	58 Å²	58	55 Å²	55	31%	0.31	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	142.1	179	-64.6	-26.3	0	0	0	110.9	K94 Y95 G168	N90-K94 CarbonylContact C-O 3.54Å; N90-K94 VanDerWaalsContact CA-O 3.23Å; N90-K94 WeakPolarHBondContact CA-O 3.4Å; N90-Y95 WeakPolarHBondContact OD1-CD1 3.29Å; N90-Y95 VanDerWaalsContact OD1-CE1 3.23Å; N90-Y95 WeakPolarHBondContact OD1-CE1 3.45Å; N90-G168 WeakPolarHBondContact O-CA 3.25Å
91	Y	72.2	Confident	85.6	Confident	1 Å²	1	50.6 Å²	50.6	0%	0.004	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	115.7	163	-167.4	-79.4	0	0	0	107	S93 K94 V109 T119 M120 I170 V191	Y91-S93 PolarHBondContact O-N 2.74Å; Y91-K94 PolarHBondContact N-O 3.19Å; Y91-K94 WeakPolarHBondContact O-CB 3.47Å; Y91-K94 PolarHBondContact O-N 2.85Å; Y91-V109 HydrophobicContact CD2-CB 4.41Å; Y91-V109 HydrophobicContact CD2-CG1 4.21Å; Y91-V109 HydrophobicContact CD2-CG2 4.03Å; Y91-V109 HydrophobicContact CE2-CG2 4.1Å; Y91-V109 HydrophobicContact CG-CG1 4.18Å; Y91-T119 PolarHBondContact OH-O 3.4Å; Y91-M120 HydrophobicContact CE2-CG 4.06Å; Y91-I170 HydrophobicContact CD2-CD1 3.77Å; Y91-I170 HydrophobicContact CE2-CD1 3.51Å; Y91-V191 VanDerWaalsContact OH-C 3.25Å; Y91-V191 PolarHBondContact OH-N 3.03Å; Y91-V191 PolarHBondContact OH-O 3.01Å
92	H	72.6	Confident	85.6	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.019	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.7	57.9	-176.6	-178.1	-82.8	0	0	0	111.5	Y54 E55 Y56 K94 F204	Y54-H92 AromaticContact CE1-NE2 3.76Å; E55-H92 IonicContact OE1-CE1 3.53Å; E55-H92 IonicContact OE1-NE2 3.26Å; E55-H92 PolarHBondContact OE1-NE2 3.38Å; E55-H92 IonicContact OE2-CD2 3.03Å; E55-H92 PolarHBondContact OE2-CD2 2.91Å; E55-H92 IonicContact OE2-CE1 3.36Å; E55-H92 PolarHBondContact OE2-CE1 3.06Å; E55-H92 IonicContact OE2-CG 3.5Å; E55-H92 IonicContact OE2-ND1 3.67Å; E55-H92 IonicContact OE2-NE2 3.06Å; E55-H92 PolarHBondContact OE2-NE2 2.85Å; Y56-H92 HydrophobicContact CE2-CB 4.17Å; Y56-H92 PolarHBondContact OH-N 3.17Å; H92-K94 PolarHBondContact O-N 3.26Å; H92-F204 HydrophobicContact CB-CZ 4.22Å; H92-F204 AromaticContact CD2-CE1 3.1Å; H92-F204 WeakPolarHBondContact CD2-CE1 3.38Å; H92-F204 AromaticContact CD2-CZ 3.22Å; H92-F204 WeakPolarHBondContact CD2-CZ 2.83Å; H92-F204 AromaticContact CG-CE1 3.85Å; H92-F204 AromaticContact CG-CZ 3.94Å; H92-F204 AromaticContact NE2-CE1 3.4Å; H92-F204 WeakPolarHBondContact NE2-CE1 3.46Å
93	S	71.3	Confident	85.5	Confident	88 Å²	88	48.8 Å²	48.8	62%	0.615	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.8	12.8	178.9	-53.8	0	0	0	0	115.8	Y91	Y91-S93 PolarHBondContact O-N 2.74Å
94	K	78.8	Confident	85.4	Confident	52 Å²	52	51.2 Å²	51.2	23%	0.226	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	136	175.9	-63.4	176	-173.9	171.3	0	110.7	N90 Y91 H92 I96 I117 S193	N90-K94 CarbonylContact C-O 3.54Å; N90-K94 VanDerWaalsContact CA-O 3.23Å; N90-K94 WeakPolarHBondContact CA-O 3.4Å; Y91-K94 PolarHBondContact N-O 3.19Å; Y91-K94 WeakPolarHBondContact O-CB 3.47Å; Y91-K94 PolarHBondContact O-N 2.85Å; H92-K94 PolarHBondContact O-N 3.26Å; K94-I96 PolarHBondContact O-N 2.99Å; K94-I117 HydrophobicContact CB-CD1 3.95Å; K94-I117 HydrophobicContact CD-CB 4.05Å; K94-I117 HydrophobicContact CD-CG2 3.55Å; K94-S193 PolarHBondContact NZ-O 3.42Å
95	Y	84.3	Confident	85.4	Confident	135 Å²	135	48.5 Å²	48.5	53%	0.529	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	126.9	176.5	-63.5	-66.6	0	0	0	111.6	T88 N90 D111	T88-Y95 HydrophobicContact CG2-CD1 3.46Å; T88-Y95 VanDerWaalsContact CG2-CD1 3.46Å; T88-Y95 HydrophobicContact CG2-CE1 3.25Å; N90-Y95 WeakPolarHBondContact OD1-CD1 3.29Å; N90-Y95 VanDerWaalsContact OD1-CE1 3.23Å; N90-Y95 WeakPolarHBondContact OD1-CE1 3.45Å; Y95-D111 WeakPolarHBondContact O-CA 3.49Å
96	I	88.2	Confident	85.8	Confident	6 Å²	6	48 Å²	48	3%	0.031	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	128	175.8	-57.4	165.8	0	0	0	109	P85 C89 K94 I99 V109 F112	P85-I96 HydrophobicContact CG-CB 4.44Å; P85-I96 HydrophobicContact CG-CG2 3.92Å; C89-I96 HydrophobicContact CB-CD1 4.16Å; C89-I96 PolarHBondContact O-N 2.82Å; C89-I96 VanDerWaalsContact SG-CD1 3.54Å; K94-I96 PolarHBondContact O-N 2.99Å; I96-I99 HydrophobicContact CG2-CD1 3.97Å; I96-I99 HydrophobicContact CG2-CG1 3.89Å; I96-V109 HydrophobicContact CB-CG1 4.31Å; I96-V109 HydrophobicContact CD1-CG1 4.07Å; I96-V109 HydrophobicContact CG1-CG1 3.67Å; I96-V109 HydrophobicContact CG2-CG1 3.79Å; I96-F112 VanDerWaalsContact O-CE2 3.26Å; I96-F112 WeakPolarHBondContact O-CE2 2.93Å
97	R	93	Very high	86.5	Confident	111 Å²	111	41.2 Å²	41.2	42%	0.419	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-45	168.8	173.5	171.6	172.4	-177.2	1.6	112	Y84 Y110 D111 F112	Y84-R97 HydrophobicContact CD1-CG 4.49Å; Y84-R97 VanDerWaalsContact CD1-O 3.31Å; Y84-R97 WeakPolarHBondContact CD1-O 2.9Å; R97-Y110 PolarHBondContact N-O 3.29Å; R97-D111 VanDerWaalsContact CB-C 3.45Å; R97-D111 VanDerWaalsContact CB-O 3.3Å; R97-D111 WeakPolarHBondContact CB-O 3.19Å; R97-F112 HydrophobicContact CB-CB 4.45Å; R97-F112 HydrophobicContact CB-CD1 4.01Å; R97-F112 HydrophobicContact CB-CD2 3.99Å; R97-F112 HydrophobicContact CB-CE1 4.19Å; R97-F112 HydrophobicContact CB-CE2 4.17Å; R97-F112 HydrophobicContact CB-CG 3.91Å; R97-F112 HydrophobicContact CB-CZ 4.27Å; R97-F112 HydrophobicContact CG-CD1 4.06Å; R97-F112 HydrophobicContact CG-CE1 4.18Å; R97-F112 HydrophobicContact CG-CG 4.44Å; R97-F112 PolarHBondContact NH1-O 2.02Å; R97-F112 VanDerWaalsContact NH1-O 3.09Å
98	K	94.9	Very high	87.6	Confident	51 Å²	51	41 Å²	41	22%	0.222	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	152	179.9	64.5	169	-176.5	162.5	0	111.4	T82 V83 Y84 Y110	T82-K98 HydrophobicContact CG2-CB 4.08Å; T82-K98 HydrophobicContact CG2-CD 3.87Å; V83-K98 WeakPolarHBondContact O-CA 3.39Å; V83-K98 WeakPolarHBondContact O-CB 3.23Å; Y84-K98 HydrophobicContact CD1-CB 3.91Å; Y84-K98 HydrophobicContact CE1-CB 3.79Å; Y84-K98 HydrophobicContact CE1-CD 4.44Å; K98-Y110 HydrophobicContact CD-CD2 4.41Å; K98-Y110 HydrophobicContact CG-CD2 4.1Å; K98-Y110 HydrophobicContact CG-CG 4.23Å; K98-Y110 PolarHBondContact N-O 2.96Å; K98-Y110 PolarHBondContact O-N 3.1Å
99	I	96.6	Very high	88.7	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	137.7	165.9	-59.6	124.7	0	0	0	107.4	T82 V83 P85 I96 F101 D107 D108 V109 M120 L141 I164	T82-I99 WeakPolarHBondContact CA-O 3.46Å; V83-I99 HydrophobicContact CG2-CB 3.76Å; V83-I99 HydrophobicContact CG2-CD1 4.07Å; V83-I99 PolarHBondContact N-O 2.85Å; V83-I99 PolarHBondContact O-N 2.87Å; P85-I99 HydrophobicContact CG-CD1 3.81Å; I96-I99 HydrophobicContact CG2-CD1 3.97Å; I96-I99 HydrophobicContact CG2-CG1 3.89Å; I99-F101 HydrophobicContact CG2-CD1 3.99Å; I99-F101 HydrophobicContact CG2-CE1 3.73Å; I99-F101 HydrophobicContact CG2-CE2 4.35Å; I99-F101 HydrophobicContact CG2-CG 4.38Å; I99-F101 HydrophobicContact CG2-CZ 3.92Å; I99-D107 HydrophobicContact CG2-CB 4.26Å; I99-D108 CarbonylContact C-O 3.52Å; I99-D108 VanDerWaalsContact CA-O 3.3Å; I99-D108 WeakPolarHBondContact CA-O 3.3Å; I99-V109 HydrophobicContact CG1-CG1 4.35Å; I99-V109 HydrophobicContact CG1-CG2 4.34Å; I99-M120 HydrophobicContact CG2-CE 4.34Å; I99-L141 HydrophobicContact CD1-CD1 3.82Å; I99-I164 HydrophobicContact CD1-CD1 3.36Å; I99-I164 HydrophobicContact CG1-CD1 3.74Å
100	M	97.8	Very high	89.8	Confident	26 Å²	26	37.7 Å²	37.7	13%	0.128	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	107	171.3	-67.7	175.4	60.8	0	0	107.4	I80 T82 Y102 D107 D108 Y110	I80-M100 HydrophobicContact CD1-CE 4.11Å; I80-M100 HydrophobicContact CG2-CB 3.97Å; I80-M100 HydrophobicContact CG2-CE 3.77Å; I80-M100 HydrophobicContact CG2-CG 4.43Å; T82-M100 HydrophobicContact CG2-CG 4.26Å; M100-Y102 HydrophobicContact CB-CD2 4.37Å; M100-Y102 HydrophobicContact CB-CE2 3.83Å; M100-Y102 WeakPolarHBondContact O-CD2 3.24Å; M100-D107 CarbonylContact O-C 3.54Å; M100-D107 WeakPolarHBondContact O-CA 3.48Å; M100-D108 HydrophobicContact CB-CB 4.4Å; M100-D108 PolarHBondContact N-O 2.93Å; M100-D108 PolarHBondContact O-N 3.24Å; M100-Y110 HydrophobicContact CG-CE2 4.13Å; M100-Y110 HydrophobicContact SD-CD2 4.32Å; M100-Y110 HydrophobicContact SD-CE2 3.56Å; M100-Y110 VanDerWaalsContact SD-CE2 3.56Å
101	F	98.2	Very high	90.6	Very high	1 Å²	1	35.9 Å²	35.9	0%	0.004	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	117.2	172.3	-65	-62.1	0	0	0	108.5	I77 I80 H81 V83 I99 D107 M120 V134 L141 V143	I77-F101 HydrophobicContact CD1-CB 4.48Å; I80-F101 WeakPolarHBondContact CA-O 2.96Å; H81-F101 PolarHBondContact N-O 3Å; H81-F101 PolarHBondContact O-N 3.03Å; V83-F101 HydrophobicContact CB-CE2 4.3Å; V83-F101 HydrophobicContact CG1-CD2 3.94Å; V83-F101 HydrophobicContact CG1-CE2 3.82Å; V83-F101 HydrophobicContact CG2-CD2 3.99Å; V83-F101 HydrophobicContact CG2-CE2 3.45Å; V83-F101 VanDerWaalsContact CG2-CE2 3.45Å; V83-F101 HydrophobicContact CG2-CZ 4.22Å; I99-F101 HydrophobicContact CG2-CD1 3.99Å; I99-F101 HydrophobicContact CG2-CE1 3.73Å; I99-F101 HydrophobicContact CG2-CE2 4.35Å; I99-F101 HydrophobicContact CG2-CG 4.38Å; I99-F101 HydrophobicContact CG2-CZ 3.92Å; F101-D107 HydrophobicContact CD1-CB 3.99Å; F101-D107 VanDerWaalsContact CD1-OD1 3.31Å; F101-D107 WeakPolarHBondContact CD1-OD1 2.97Å; F101-D107 HydrophobicContact CE1-CB 4.32Å; F101-M120 HydrophobicContact CE1-CE 4.1Å; F101-V134 HydrophobicContact CB-CG2 4.1Å; F101-V134 HydrophobicContact CD2-CG1 3.83Å; F101-V134 HydrophobicContact CD2-CG2 4.13Å; F101-V134 HydrophobicContact CE2-CG1 4.05Å; F101-V134 HydrophobicContact CG-CG2 4.33Å; F101-L141 HydrophobicContact CZ-CB 4.33Å; F101-V143 HydrophobicContact CB-CB 4.48Å; F101-V143 HydrophobicContact CD1-CB 3.76Å; F101-V143 HydrophobicContact CD1-CG1 3.57Å; F101-V143 HydrophobicContact CE1-CB 4.16Å; F101-V143 HydrophobicContact CE1-CG1 3.85Å; F101-V143 HydrophobicContact CG-CB 4.15Å; F101-V143 HydrophobicContact CG-CG1 4.41Å
102	Y	97.8	Very high	91.4	Very high	56 Å²	56	42 Å²	42	22%	0.22	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	140	173.8	-66.9	-109.4	0	0	0	108.7	G79 I80 M100 D104 A106 D108 R145	G79-Y102 CarbonylContact O-C 3.54Å; I80-Y102 HydrophobicContact CD1-CD1 3.79Å; I80-Y102 HydrophobicContact CD1-CE1 3.32Å; I80-Y102 HydrophobicContact CG1-CD1 3.57Å; I80-Y102 HydrophobicContact CG1-CE1 3.68Å; I80-Y102 HydrophobicContact CG1-CG 4.22Å; M100-Y102 HydrophobicContact CB-CD2 4.37Å; M100-Y102 HydrophobicContact CB-CE2 3.83Å; M100-Y102 WeakPolarHBondContact O-CD2 3.24Å; Y102-D104 VanDerWaalsContact C-N 3.31Å; Y102-D104 PolarHBondContact O-N 2.78Å; Y102-A106 WeakPolarHBondContact CD2-O 3.33Å; Y102-D108 HydrophobicContact CE2-CB 4.14Å; Y102-D108 WeakPolarHBondContact CE2-OD2 3.44Å; Y102-D108 PolarHBondContact OH-OD2 3.43Å; Y102-R145 PolarHBondContact O-NE 3.38Å; Y102-R145 PolarHBondContact O-NH2 3.2Å
103	A	96.2	Very high	92.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	-63.6	-39.6	-170.4	0	0	0	0	0	112	I77 G79 F130 T132 R145	I77-A103 HydrophobicContact CD1-CB 4.01Å; I77-A103 HydrophobicContact CG1-CB 3.91Å; G79-A103 WeakPolarHBondContact O-CB 3.24Å; G79-A103 PolarHBondContact O-N 3.44Å; A103-F130 HydrophobicContact CB-CD2 4.21Å; A103-F130 HydrophobicContact CB-CE2 3.45Å; A103-F130 VanDerWaalsContact CB-CE2 3.45Å; A103-F130 HydrophobicContact CB-CZ 4.13Å; A103-T132 WeakPolarHBondContact O-CB 3.41Å; A103-T132 PolarHBondContact O-OG1 2.96Å; A103-R145 PolarHBondContact O-NE 2.85Å
104	D	93.8	Very high	93	Very high	52 Å²	52	49 Å²	49	28%	0.278	22%	0.222	S	C	.	.	S	Bend	trans	-122	0.7	-173.3	59.3	-16.3	0	0	0	114.4	Y102 Y127 F130 F147	Y102-D104 VanDerWaalsContact C-N 3.31Å; Y102-D104 PolarHBondContact O-N 2.78Å; D104-Y127 HydrophobicContact CB-CE1 4.41Å; D104-Y127 HydrophobicContact CB-CE2 4.29Å; D104-Y127 WeakPolarHBondContact CB-OH 3.46Å; D104-Y127 VanDerWaalsContact CG-OH 3.28Å; D104-Y127 PolarHBondContact OD2-OH 3.23Å; D104-F130 HydrophobicContact CB-CD1 3.72Å; D104-F130 HydrophobicContact CB-CD2 4.13Å; D104-F130 HydrophobicContact CB-CE1 3.71Å; D104-F130 HydrophobicContact CB-CE2 4.18Å; D104-F130 HydrophobicContact CB-CG 3.91Å; D104-F130 HydrophobicContact CB-CZ 3.94Å; D104-F147 HydrophobicContact CB-CE1 4.44Å
105	D	94	Very high	93.6	Very high	73 Å²	73	51 Å²	51	39%	0.39	23%	0.228	S	C	.	.	S	Bend	trans	-129.8	-165	-177.9	-159.5	-5.7	0	0	0	111.1	Y123 R145	D105-Y123 WeakPolarHBondContact OD1-CE1 3.42Å; D105-Y123 PolarHBondContact OD1-OH 2.87Å; D105-R145 VanDerWaalsContact O-CZ 3.26Å; D105-R145 PolarHBondContact O-NE 2.75Å; D105-R145 PolarHBondContact O-NH2 2.04Å
106	A	96.4	Very high	94	Very high	9 Å²	9	47.1 Å²	47.1	7%	0.074	21%	0.213	C	C	.	.			trans	-74.1	161.3	-174.1	0	0	0	0	0	114.4	Y102 T119 I121 Y123	Y102-A106 WeakPolarHBondContact CD2-O 3.33Å; A106-T119 HydrophobicContact CB-CG2 3.21Å; A106-I121 HydrophobicContact CB-CB 4.45Å; A106-I121 HydrophobicContact CB-CG1 3.55Å; A106-Y123 HydrophobicContact CB-CE1 4.14Å
107	D	97.6	Very high	94.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	104.2	-175.1	-54	-45.3	0	0	0	111.5	I99 M100 F101 T119 M120 V143 R145	I99-D107 HydrophobicContact CG2-CB 4.26Å; M100-D107 CarbonylContact O-C 3.54Å; M100-D107 WeakPolarHBondContact O-CA 3.48Å; F101-D107 HydrophobicContact CD1-CB 3.99Å; F101-D107 VanDerWaalsContact CD1-OD1 3.31Å; F101-D107 WeakPolarHBondContact CD1-OD1 2.97Å; F101-D107 HydrophobicContact CE1-CB 4.32Å; D107-T119 CarbonylContact O-C 3.49Å; D107-T119 VanDerWaalsContact O-CA 3.25Å; D107-T119 WeakPolarHBondContact O-CA 3.46Å; D107-M120 HydrophobicContact CB-CB 4.12Å; D107-M120 HydrophobicContact CB-CE 3.54Å; D107-M120 PolarHBondContact N-O 3.15Å; D107-M120 PolarHBondContact O-N 3.23Å; D107-V143 WeakPolarHBondContact OD2-CG1 3.03Å; D107-R145 IonicContact OD1-CZ 2.68Å; D107-R145 IonicContact OD1-NH1 2.62Å; D107-R145 IonicContact OD1-NH2 3.96Å; D107-R145 PolarHBondContact OD1-NH2 3.39Å; D107-R145 IonicContact OD2-NH1 3.65Å; D107-R145 PolarHBondContact OD2-NH1 3.27Å; D107-R145 IonicContact OD2-NH2 3.61Å
108	D	97.5	Very high	94.2	Very high	27 Å²	27	41.6 Å²	41.6	14%	0.144	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	137.1	-177.4	-72	-27.7	0	0	0	112.5	I99 M100 Y102 Y110 Y116 T119	I99-D108 CarbonylContact C-O 3.52Å; I99-D108 VanDerWaalsContact CA-O 3.3Å; I99-D108 WeakPolarHBondContact CA-O 3.3Å; M100-D108 HydrophobicContact CB-CB 4.4Å; M100-D108 PolarHBondContact N-O 2.93Å; M100-D108 PolarHBondContact O-N 3.24Å; Y102-D108 HydrophobicContact CE2-CB 4.14Å; Y102-D108 WeakPolarHBondContact CE2-OD2 3.44Å; Y102-D108 PolarHBondContact OH-OD2 3.43Å; D108-Y110 HydrophobicContact CB-CD2 4.39Å; D108-Y110 HydrophobicContact CB-CE2 3.53Å; D108-Y116 HydrophobicContact CB-CD2 4.49Å; D108-Y116 HydrophobicContact CB-CE2 4.38Å; D108-T119 PolarHBondContact OD1-OG1 3.06Å
109	V	95.7	Very high	94.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	130.5	-176.4	-169.5	0	0	0	0	109.9	Y91 I96 I99 I117 G118	Y91-V109 HydrophobicContact CD2-CB 4.41Å; Y91-V109 HydrophobicContact CD2-CG1 4.21Å; Y91-V109 HydrophobicContact CD2-CG2 4.03Å; Y91-V109 HydrophobicContact CE2-CG2 4.1Å; Y91-V109 HydrophobicContact CG-CG1 4.18Å; I96-V109 HydrophobicContact CB-CG1 4.31Å; I96-V109 HydrophobicContact CD1-CG1 4.07Å; I96-V109 HydrophobicContact CG1-CG1 3.67Å; I96-V109 HydrophobicContact CG2-CG1 3.79Å; I99-V109 HydrophobicContact CG1-CG1 4.35Å; I99-V109 HydrophobicContact CG1-CG2 4.34Å; V109-I117 HydrophobicContact CB-CG1 4.15Å; V109-I117 HydrophobicContact CG1-CD1 3.94Å; V109-I117 HydrophobicContact CG1-CG1 3.87Å; V109-I117 VanDerWaalsContact O-CG1 3.29Å; V109-I117 WeakPolarHBondContact O-CG1 3.35Å; V109-I117 PolarHBondContact O-N 3.17Å; V109-G118 WeakPolarHBondContact CB-O 3.3Å; V109-G118 PolarHBondContact N-O 3.4Å; V109-G118 PolarHBondContact O-N 3.48Å
110	Y	94.6	Very high	94.4	Very high	41 Å²	41	39.7 Å²	39.7	16%	0.161	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	145.7	-177.9	-62	-100	0	0	0	112.4	R97 K98 M100 D108 Y115	R97-Y110 PolarHBondContact N-O 3.29Å; K98-Y110 HydrophobicContact CD-CD2 4.41Å; K98-Y110 HydrophobicContact CG-CD2 4.1Å; K98-Y110 HydrophobicContact CG-CG 4.23Å; K98-Y110 PolarHBondContact N-O 2.96Å; K98-Y110 PolarHBondContact O-N 3.1Å; M100-Y110 HydrophobicContact CG-CE2 4.13Å; M100-Y110 HydrophobicContact SD-CD2 4.32Å; M100-Y110 HydrophobicContact SD-CE2 3.56Å; M100-Y110 VanDerWaalsContact SD-CE2 3.56Å; D108-Y110 HydrophobicContact CB-CD2 4.39Å; D108-Y110 HydrophobicContact CB-CE2 3.53Å; Y110-Y115 CarbonylContact C-O 3.55Å; Y110-Y115 VanDerWaalsContact CA-O 3.25Å; Y110-Y115 WeakPolarHBondContact CA-O 3.35Å
111	D	91.2	Very high	94.4	Very high	21 Å²	21	39.4 Å²	39.4	11%	0.112	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	177.6	174.8	75.3	13.1	0	0	0	113.8	Y95 R97 R113 G114 Y115 I117	Y95-D111 WeakPolarHBondContact O-CA 3.49Å; R97-D111 VanDerWaalsContact CB-C 3.45Å; R97-D111 VanDerWaalsContact CB-O 3.3Å; R97-D111 WeakPolarHBondContact CB-O 3.19Å; D111-R113 PolarHBondContact O-N 2.89Å; D111-R113 VanDerWaalsContact OD1-CA 3.32Å; D111-R113 WeakPolarHBondContact OD1-CA 3.4Å; D111-R113 WeakPolarHBondContact OD1-CB 3.31Å; D111-R113 PolarHBondContact OD1-N 2.8Å; D111-G114 PolarHBondContact O-N 3.39Å; D111-G114 PolarHBondContact OD1-N 2.83Å; D111-G114 VanDerWaalsContact OD1-N 3.1Å; D111-Y115 PolarHBondContact N-O 3.38Å; D111-Y115 PolarHBondContact OD1-N 3.36Å; D111-I117 HydrophobicContact CB-CD1 4.27Å; D111-I117 HydrophobicContact CB-CG2 3.76Å
112	F	88.7	Confident	94.4	Very high	130 Å²	130	39.4 Å²	39.4	57%	0.57	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-22.2	179.7	-81.1	-88.9	0	0	0	115.1	I96 R97 G114	I96-F112 VanDerWaalsContact O-CE2 3.26Å; I96-F112 WeakPolarHBondContact O-CE2 2.93Å; R97-F112 HydrophobicContact CB-CB 4.45Å; R97-F112 HydrophobicContact CB-CD1 4.01Å; R97-F112 HydrophobicContact CB-CD2 3.99Å; R97-F112 HydrophobicContact CB-CE1 4.19Å; R97-F112 HydrophobicContact CB-CE2 4.17Å; R97-F112 HydrophobicContact CB-CG 3.91Å; R97-F112 HydrophobicContact CB-CZ 4.27Å; R97-F112 HydrophobicContact CG-CD1 4.06Å; R97-F112 HydrophobicContact CG-CE1 4.18Å; R97-F112 HydrophobicContact CG-CG 4.44Å; R97-F112 PolarHBondContact NH1-O 2.02Å; R97-F112 VanDerWaalsContact NH1-O 3.09Å; F112-G114 PolarHBondContact O-N 3.44Å
113	R	87.9	Confident	94.3	Very high	199 Å²	199	38.8 Å²	38.8	75%	0.751	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-1.2	174	-59.5	179.3	177.8	-176	-2.8	112.1	D111 Y115	D111-R113 PolarHBondContact O-N 2.89Å; D111-R113 VanDerWaalsContact OD1-CA 3.32Å; D111-R113 WeakPolarHBondContact OD1-CA 3.4Å; D111-R113 WeakPolarHBondContact OD1-CB 3.31Å; D111-R113 PolarHBondContact OD1-N 2.8Å; R113-Y115 VanDerWaalsContact C-N 3.29Å; R113-Y115 HydrophobicContact CB-CD2 3.46Å; R113-Y115 VanDerWaalsContact CB-CD2 3.46Å; R113-Y115 HydrophobicContact CB-CE2 3.48Å; R113-Y115 VanDerWaalsContact CB-CE2 3.48Å; R113-Y115 HydrophobicContact CB-CG 4.18Å; R113-Y115 HydrophobicContact CG-CD2 4.36Å; R113-Y115 HydrophobicContact CG-CE2 4.2Å
114	G	89.9	Confident	94.3	Very high	38 Å²	38	38.8 Å²	38.8	39%	0.392	18%	0.181	S	C	.	.	S	Bend	trans	80.3	12.1	-177.9	0	0	0	0	0	113	D111 F112	D111-G114 PolarHBondContact O-N 3.39Å; D111-G114 PolarHBondContact OD1-N 2.83Å; D111-G114 VanDerWaalsContact OD1-N 3.1Å; F112-G114 PolarHBondContact O-N 3.44Å
115	Y	90.8	Very high	94.4	Very high	94 Å²	94	38.2 Å²	38.2	37%	0.369	18%	0.18	S	C	.	.			trans	-85.2	138.9	179.3	-58.5	-42.8	0	0	0	110.8	Y110 D111 R113 I117 R195	Y110-Y115 CarbonylContact C-O 3.55Å; Y110-Y115 VanDerWaalsContact CA-O 3.25Å; Y110-Y115 WeakPolarHBondContact CA-O 3.35Å; D111-Y115 PolarHBondContact N-O 3.38Å; D111-Y115 PolarHBondContact OD1-N 3.36Å; R113-Y115 VanDerWaalsContact C-N 3.29Å; R113-Y115 HydrophobicContact CB-CD2 3.46Å; R113-Y115 VanDerWaalsContact CB-CD2 3.46Å; R113-Y115 HydrophobicContact CB-CE2 3.48Å; R113-Y115 VanDerWaalsContact CB-CE2 3.48Å; R113-Y115 HydrophobicContact CB-CG 4.18Å; R113-Y115 HydrophobicContact CG-CD2 4.36Å; R113-Y115 HydrophobicContact CG-CE2 4.2Å; Y115-I117 PolarHBondContact O-N 3.16Å; Y115-R195 VanDerWaalsContact CE1-NH1 3.33Å; Y115-R195 VanDerWaalsContact CG-CZ 3.46Å
116	Y	92.7	Very high	94.4	Very high	54 Å²	54	40 Å²	40	21%	0.212	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	126.4	167.2	171.5	-86.4	0	0	0	110.1	D108 G118 T119 S193 F203	D108-Y116 HydrophobicContact CB-CD2 4.49Å; D108-Y116 HydrophobicContact CB-CE2 4.38Å; Y116-G118 WeakPolarHBondContact CE2-O 3.34Å; Y116-G118 VanDerWaalsContact CZ-C 3.45Å; Y116-G118 VanDerWaalsContact OH-C 3.26Å; Y116-T119 WeakPolarHBondContact CE2-OG1 3.21Å; Y116-T119 VanDerWaalsContact CZ-OG1 3.26Å; Y116-T119 WeakPolarHBondContact OH-CB 3.41Å; Y116-T119 PolarHBondContact OH-N 3.35Å; Y116-T119 PolarHBondContact OH-OG1 3.01Å; Y116-S193 PolarHBondContact O-OG 3.02Å; Y116-F203 HydrophobicContact CD1-CE1 4.46Å; Y116-F203 HydrophobicContact CE1-CD1 4.41Å; Y116-F203 AromaticContact CE1-CE1 3.75Å; Y116-F203 HydrophobicContact CE1-CE1 3.75Å
117	I	92.1	Very high	94.4	Very high	2 Å²	2	43 Å²	43	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	-11	-178.6	60.8	171	0	0	0	113.9	K94 V109 D111 Y115 S193	K94-I117 HydrophobicContact CB-CD1 3.95Å; K94-I117 HydrophobicContact CD-CB 4.05Å; K94-I117 HydrophobicContact CD-CG2 3.55Å; V109-I117 HydrophobicContact CB-CG1 4.15Å; V109-I117 HydrophobicContact CG1-CD1 3.94Å; V109-I117 HydrophobicContact CG1-CG1 3.87Å; V109-I117 VanDerWaalsContact O-CG1 3.29Å; V109-I117 WeakPolarHBondContact O-CG1 3.35Å; V109-I117 PolarHBondContact O-N 3.17Å; D111-I117 HydrophobicContact CB-CD1 4.27Å; D111-I117 HydrophobicContact CB-CG2 3.76Å; Y115-I117 PolarHBondContact O-N 3.16Å; I117-S193 PolarHBondContact O-N 3.1Å
118	G	94.5	Very high	94.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.6	-179.9	175.3	0	0	0	0	0	113	V109 Y116 V191	V109-G118 WeakPolarHBondContact CB-O 3.3Å; V109-G118 PolarHBondContact N-O 3.4Å; V109-G118 PolarHBondContact O-N 3.48Å; Y116-G118 WeakPolarHBondContact CE2-O 3.34Å; Y116-G118 VanDerWaalsContact CZ-C 3.45Å; Y116-G118 VanDerWaalsContact OH-C 3.26Å; G118-V191 CarbonylContact C-O 3.55Å; G118-V191 WeakPolarHBondContact CA-O 3.41Å
119	T	96.5	Very high	94.4	Very high	11 Å²	11	51.2 Å²	51.2	7%	0.067	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	142.2	179.6	-59.4	0	0	0	0	109	Y91 A106 D107 D108 Y116 I121 V191	Y91-T119 PolarHBondContact OH-O 3.4Å; A106-T119 HydrophobicContact CB-CG2 3.21Å; D107-T119 CarbonylContact O-C 3.49Å; D107-T119 VanDerWaalsContact O-CA 3.25Å; D107-T119 WeakPolarHBondContact O-CA 3.46Å; D108-T119 PolarHBondContact OD1-OG1 3.06Å; Y116-T119 WeakPolarHBondContact CE2-OG1 3.21Å; Y116-T119 VanDerWaalsContact CZ-OG1 3.26Å; Y116-T119 WeakPolarHBondContact OH-CB 3.41Å; Y116-T119 PolarHBondContact OH-N 3.35Å; Y116-T119 PolarHBondContact OH-OG1 3.01Å; T119-I121 HydrophobicContact CG2-CD1 4.48Å; T119-I121 HydrophobicContact CG2-CG1 3.91Å; T119-V191 PolarHBondContact N-O 3.25Å; T119-V191 PolarHBondContact O-N 2.84Å
120	M	97.5	Very high	94.5	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	124	165.7	-49.4	176.5	-62.5	0	0	108.5	Y91 I99 F101 D107 I164 I170 F172	Y91-M120 HydrophobicContact CE2-CG 4.06Å; I99-M120 HydrophobicContact CG2-CE 4.34Å; F101-M120 HydrophobicContact CE1-CE 4.1Å; D107-M120 HydrophobicContact CB-CB 4.12Å; D107-M120 HydrophobicContact CB-CE 3.54Å; D107-M120 PolarHBondContact N-O 3.15Å; D107-M120 PolarHBondContact O-N 3.23Å; M120-I164 HydrophobicContact CE-CD1 3.37Å; M120-I164 HydrophobicContact CE-CG1 3.81Å; M120-I164 HydrophobicContact SD-CD1 3.58Å; M120-I164 VanDerWaalsContact SD-CD1 3.58Å; M120-I164 HydrophobicContact SD-CG1 3.58Å; M120-I164 VanDerWaalsContact SD-CG1 3.58Å; M120-I170 HydrophobicContact CG-CD1 4.34Å; M120-I170 HydrophobicContact CG-CG2 4.42Å; M120-I170 HydrophobicContact SD-CD1 4.14Å; M120-I170 HydrophobicContact SD-CG1 4.14Å; M120-I170 HydrophobicContact SD-CG2 3.7Å; M120-F172 HydrophobicContact CB-CE1 4.09Å; M120-F172 HydrophobicContact CB-CZ 4Å
121	I	98.2	Very high	94.6	Very high	20 Å²	20	54.8 Å²	54.8	10%	0.103	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	121	-178.1	-68.3	166	0	0	0	106.7	A106 T119 Y123 F172 Q187 S188 K189 V191	A106-I121 HydrophobicContact CB-CB 4.45Å; A106-I121 HydrophobicContact CB-CG1 3.55Å; T119-I121 HydrophobicContact CG2-CD1 4.48Å; T119-I121 HydrophobicContact CG2-CG1 3.91Å; I121-Y123 HydrophobicContact CG2-CD1 3.88Å; I121-Y123 HydrophobicContact CG2-CE1 3.63Å; I121-F172 WeakPolarHBondContact O-CE2 3.12Å; I121-Q187 HydrophobicContact CG2-CB 3.61Å; I121-S188 CarbonylContact O-C 3.54Å; I121-S188 VanDerWaalsContact O-CA 3.24Å; I121-S188 WeakPolarHBondContact O-CA 3.45Å; I121-K189 HydrophobicContact CB-CG 3.76Å; I121-K189 HydrophobicContact CD1-CD 4.14Å; I121-K189 HydrophobicContact CD1-CG 3.78Å; I121-K189 HydrophobicContact CG1-CG 4.28Å; I121-K189 HydrophobicContact CG2-CG 4.12Å; I121-K189 PolarHBondContact N-O 3.47Å; I121-K189 PolarHBondContact O-N 2.63Å; I121-K189 VanDerWaalsContact O-O 3.08Å; I121-V191 HydrophobicContact CD1-CG2 3.83Å
122	N	98	Very high	95	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	74.4	177.4	-164.2	35.2	0	0	0	108.3	M160 T161 S162 F172 Y174 Q187 S188	N122-M160 VanDerWaalsContact C-CE 3.45Å; N122-M160 HydrophobicContact CB-CE 4.33Å; N122-M160 WeakPolarHBondContact OD1-CE 3.47Å; N122-T161 PolarHBondContact ND2-O 2.89Å; N122-S162 WeakPolarHBondContact CB-OG 3.46Å; N122-S162 PolarHBondContact ND2-OG 3.37Å; N122-S162 VanDerWaalsContact ND2-OG 3.11Å; N122-F172 HydrophobicContact CB-CD1 4.04Å; N122-F172 HydrophobicContact CB-CD2 4.36Å; N122-F172 HydrophobicContact CB-CE1 4.03Å; N122-F172 HydrophobicContact CB-CE2 4.33Å; N122-F172 HydrophobicContact CB-CG 4.23Å; N122-F172 HydrophobicContact CB-CZ 4.17Å; N122-Y174 WeakPolarHBondContact OD1-CE1 3.42Å; N122-Q187 CarbonylContact C-O 3.59Å; N122-Q187 WeakPolarHBondContact CA-O 3.25Å; N122-Q187 PolarHBondContact N-O 2.78Å; N122-S188 PolarHBondContact OD1-OG 2.83Å
123	Y	96.8	Very high	95.4	Very high	43 Å²	43	47.9 Å²	47.9	17%	0.169	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	172	-176.6	67.2	-104.6	0	0	0	112.2	D105 A106 I121 V125 Q187	D105-Y123 WeakPolarHBondContact OD1-CE1 3.42Å; D105-Y123 PolarHBondContact OD1-OH 2.87Å; A106-Y123 HydrophobicContact CB-CE1 4.14Å; I121-Y123 HydrophobicContact CG2-CD1 3.88Å; I121-Y123 HydrophobicContact CG2-CE1 3.63Å; Y123-V125 HydrophobicContact CD2-CG1 4.31Å; Y123-V125 HydrophobicContact CE2-CG1 3.62Å; Y123-Q187 HydrophobicContact CD2-CB 4.26Å; Y123-Q187 HydrophobicContact CD2-CG 4.48Å; Y123-Q187 HydrophobicContact CE1-CB 4.43Å; Y123-Q187 HydrophobicContact CE2-CB 4.04Å; Y123-Q187 HydrophobicContact CE2-CG 3.94Å; Y123-Q187 PolarHBondContact N-O 2.81Å; Y123-Q187 PolarHBondContact O-N 2.91Å
124	L	96.4	Very high	95.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	137	176.1	-171.3	77.7	0	0	0	110.1	Y127 F147 I149 A158 I181 K185 F186	L124-Y127 VanDerWaalsContact O-CD1 3.22Å; L124-Y127 WeakPolarHBondContact O-CD1 3.4Å; L124-F147 HydrophobicContact CB-CB 3.93Å; L124-F147 HydrophobicContact CB-CD1 4.36Å; L124-F147 HydrophobicContact CB-CD2 3.74Å; L124-F147 HydrophobicContact CB-CE2 4.32Å; L124-F147 HydrophobicContact CB-CG 3.76Å; L124-F147 HydrophobicContact CD2-CB 3.77Å; L124-I149 HydrophobicContact CD2-CB 3.86Å; L124-I149 HydrophobicContact CD2-CD1 3.95Å; L124-I149 HydrophobicContact CD2-CG2 3.82Å; L124-I149 HydrophobicContact CG-CD1 4.49Å; L124-A158 HydrophobicContact CD2-CB 4.5Å; L124-I181 HydrophobicContact CD1-CG2 3.92Å; L124-K185 CarbonylContact C-O 3.58Å; L124-K185 WeakPolarHBondContact CA-O 3.27Å; L124-K185 HydrophobicContact CD1-CB 3.63Å; L124-K185 HydrophobicContact CG-CB 4.4Å; L124-F186 HydrophobicContact CD1-CD1 3.58Å; L124-F186 HydrophobicContact CD1-CD2 4.4Å; L124-F186 HydrophobicContact CD1-CE1 3.48Å; L124-F186 VanDerWaalsContact CD1-CE1 3.48Å; L124-F186 HydrophobicContact CD1-CE2 4.32Å; L124-F186 HydrophobicContact CD1-CG 4.06Å; L124-F186 HydrophobicContact CD1-CZ 3.86Å
125	V	96.1	Very high	96.3	Very high	41 Å²	41	36.6 Å²	36.6	25%	0.248	18%	0.176	C	C	.	.	S	Bend	trans	-91.7	155.1	171.8	-66.6	0	0	0	0	112	Y123 Y127 K185 Q187	Y123-V125 HydrophobicContact CD2-CG1 4.31Å; Y123-V125 HydrophobicContact CE2-CG1 3.62Å; V125-Y127 VanDerWaalsContact C-N 3.31Å; V125-Y127 PolarHBondContact O-N 3.49Å; V125-K185 HydrophobicContact CG2-CB 4.36Å; V125-K185 HydrophobicContact CG2-CD 4.18Å; V125-K185 WeakPolarHBondContact CG2-O 3.36Å; V125-K185 PolarHBondContact N-O 2.85Å; V125-Q187 HydrophobicContact CG1-CG 3.94Å
126	N	94.3	Very high	96.6	Very high	110 Å²	110	35.1 Å²	35.1	59%	0.588	18%	0.175	S	C	*	.	S	Bend	trans	60.6	35	-179.7	-47.4	-62.6	0	0	0	113.8	I149 K185	N126-I149 WeakPolarHBondContact O-CD1 3.21Å; N126-I149 WeakPolarHBondContact O-CG1 3.39Å; N126-K185 PolarHBondContact ND2-NZ 3.09Å
127	Y	95.9	Very high	96.7	Very high	73 Å²	73	36.1 Å²	36.1	29%	0.286	18%	0.181	S	C	.	.			trans	-71	159.3	169.2	59	-85.6	0	0	0	110.8	D104 L124 V125 F130 F147 S148	D104-Y127 HydrophobicContact CB-CE1 4.41Å; D104-Y127 HydrophobicContact CB-CE2 4.29Å; D104-Y127 WeakPolarHBondContact CB-OH 3.46Å; D104-Y127 VanDerWaalsContact CG-OH 3.28Å; D104-Y127 PolarHBondContact OD2-OH 3.23Å; L124-Y127 VanDerWaalsContact O-CD1 3.22Å; L124-Y127 WeakPolarHBondContact O-CD1 3.4Å; V125-Y127 VanDerWaalsContact C-N 3.31Å; V125-Y127 PolarHBondContact O-N 3.49Å; Y127-F130 HydrophobicContact CD2-CB 4.41Å; Y127-F130 HydrophobicContact CD2-CD1 4.09Å; Y127-F130 AromaticContact CE2-CD1 3.52Å; Y127-F130 HydrophobicContact CE2-CD1 3.52Å; Y127-F130 HydrophobicContact CE2-CE1 4.18Å; Y127-F130 HydrophobicContact CE2-CG 4.42Å; Y127-F147 AromaticContact CD1-CD1 3.83Å; Y127-F147 HydrophobicContact CD1-CD1 3.83Å; Y127-F147 HydrophobicContact CD1-CE1 4.07Å; Y127-F147 HydrophobicContact CD2-CD1 4.27Å; Y127-F147 HydrophobicContact CE1-CD1 4.44Å; Y127-F147 HydrophobicContact CE1-CE1 4.26Å; Y127-F147 AromaticContact CG-CD1 3.74Å; Y127-F147 HydrophobicContact CG-CD1 3.74Å; Y127-F147 HydrophobicContact CG-CE1 4.35Å; Y127-S148 CarbonylContact C-O 3.57Å; Y127-S148 WeakPolarHBondContact CA-O 3.4Å; Y127-S148 WeakPolarHBondContact CB-O 3.4Å
128	M	96.8	Very high	96.6	Very high	98 Å²	98	42.8 Å²	42.8	48%	0.483	21%	0.21	S	C	.	.	S	Bend	trans	-93.1	-39.4	171.1	-59.1	-170	-52.4	0	0	111.7	S148 N150 E155	M128-S148 PolarHBondContact N-O 2.84Å; M128-N150 HydrophobicContact CE-CB 4.46Å; M128-N150 HydrophobicContact SD-CB 3.73Å; M128-E155 HydrophobicContact CE-CB 4.1Å; M128-E155 HydrophobicContact CE-CG 3.61Å
129	D	97.3	Very high	96.4	Very high	100 Å²	100	50.4 Å²	50.4	54%	0.535	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	161.3	-177.4	-162.2	11.4	0	0	0	110.1	S148	D129-S148 PolarHBondContact O-N 2.88Å
130	F	97.8	Very high	96.3	Very high	39 Å²	39	50.7 Å²	50.7	17%	0.171	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	149.8	177.1	68.2	-88.3	0	0	0	112.3	N78 A103 D104 Y127 T146 F147	N78-F130 VanDerWaalsContact OD1-CZ 3.24Å; N78-F130 WeakPolarHBondContact OD1-CZ 3.23Å; A103-F130 HydrophobicContact CB-CD2 4.21Å; A103-F130 HydrophobicContact CB-CE2 3.45Å; A103-F130 VanDerWaalsContact CB-CE2 3.45Å; A103-F130 HydrophobicContact CB-CZ 4.13Å; D104-F130 HydrophobicContact CB-CD1 3.72Å; D104-F130 HydrophobicContact CB-CD2 4.13Å; D104-F130 HydrophobicContact CB-CE1 3.71Å; D104-F130 HydrophobicContact CB-CE2 4.18Å; D104-F130 HydrophobicContact CB-CG 3.91Å; D104-F130 HydrophobicContact CB-CZ 3.94Å; Y127-F130 HydrophobicContact CD2-CB 4.41Å; Y127-F130 HydrophobicContact CD2-CD1 4.09Å; Y127-F130 AromaticContact CE2-CD1 3.52Å; Y127-F130 HydrophobicContact CE2-CD1 3.52Å; Y127-F130 HydrophobicContact CE2-CE1 4.18Å; Y127-F130 HydrophobicContact CE2-CG 4.42Å; F130-T146 CarbonylContact C-O 3.6Å; F130-T146 VanDerWaalsContact CA-O 3.23Å; F130-T146 WeakPolarHBondContact CA-O 3.45Å; F130-F147 HydrophobicContact CB-CD1 3.81Å; F130-F147 HydrophobicContact CB-CE1 4.03Å
131	D	97.9	Very high	96.3	Very high	78 Å²	78	50.7 Å²	50.7	42%	0.417	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	122.3	169.5	172.2	57.9	0	0	0	109.1	K76 T146	K76-D131 WeakPolarHBondContact CD-OD1 3.45Å; K76-D131 IonicContact NZ-OD1 2.76Å; K76-D131 PolarHBondContact NZ-OD1 3.12Å; K76-D131 IonicContact NZ-OD2 2.82Å; K76-D131 PolarHBondContact NZ-OD2 3.45Å; D131-T146 PolarHBondContact N-O 2.89Å; D131-T146 PolarHBondContact O-N 2.88Å
132	T	98.5	Very high	96.3	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	132.9	-174.5	-63.8	0	0	0	0	111.7	K76 I77 A103 V143 K144 R145	K76-T132 WeakPolarHBondContact CA-O 3.47Å; I77-T132 HydrophobicContact CD1-CG2 3.86Å; I77-T132 HydrophobicContact CG1-CG2 3.7Å; I77-T132 PolarHBondContact N-O 3.41Å; A103-T132 WeakPolarHBondContact O-CB 3.41Å; A103-T132 PolarHBondContact O-OG1 2.96Å; T132-V143 HydrophobicContact CG2-CG2 3.35Å; T132-K144 WeakPolarHBondContact CA-O 3.03Å; T132-R145 HydrophobicContact CG2-CG 3.95Å
133	A	98.4	Very high	96.3	Very high	4 Å²	4	49.8 Å²	49.8	3%	0.033	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	138.7	177.3	0	0	0	0	0	111.2	F73 I75 K76 V143 K144	F73-A133 HydrophobicContact CB-CB 3.74Å; F73-A133 WeakPolarHBondContact CD1-O 3.38Å; F73-A133 WeakPolarHBondContact O-CB 3.48Å; I75-A133 CarbonylContact O-C 3.46Å; I75-A133 VanDerWaalsContact O-CA 3.28Å; I75-A133 WeakPolarHBondContact O-CA 3.24Å; K76-A133 HydrophobicContact CD-CB 4.02Å; A133-V143 WeakPolarHBondContact O-CA 3.33Å; A133-K144 PolarHBondContact N-O 3.38Å; A133-K144 PolarHBondContact O-N 2.98Å
134	V	98.5	Very high	96.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	143.2	179.3	174.5	0	0	0	0	110.2	N74 I75 I77 H81 V83 F101 D136 G142 V143	N74-V134 PolarHBondContact N-O 2.78Å; I75-V134 HydrophobicContact CB-CB 4.13Å; I75-V134 PolarHBondContact N-O 3.26Å; I75-V134 PolarHBondContact O-N 2.88Å; I77-V134 HydrophobicContact CD1-CG2 3.8Å; I77-V134 HydrophobicContact CG1-CG2 4.29Å; I77-V134 HydrophobicContact CG2-CG2 4.21Å; H81-V134 HydrophobicContact CB-CG2 4.29Å; V83-V134 HydrophobicContact CG1-CG1 4.31Å; F101-V134 HydrophobicContact CB-CG2 4.1Å; F101-V134 HydrophobicContact CD2-CG1 3.83Å; F101-V134 HydrophobicContact CD2-CG2 4.13Å; F101-V134 HydrophobicContact CE2-CG1 4.05Å; F101-V134 HydrophobicContact CG-CG2 4.33Å; V134-D136 HydrophobicContact CG1-CB 4.36Å; V134-G142 CarbonylContact C-O 3.53Å; V134-G142 WeakPolarHBondContact CA-O 3.46Å; V134-G142 WeakPolarHBondContact CG1-O 3.38Å; V134-V143 HydrophobicContact CG2-CB 4.44Å; V134-V143 HydrophobicContact CG2-CG2 4.26Å
135	L	97.7	Very high	96.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	112.6	165.5	-176.1	164.8	0	0	0	107.1	V68 R72 F73 E137 L140 L141 G142	V68-L135 HydrophobicContact CG1-CD1 3.57Å; R72-L135 HydrophobicContact CB-CD1 3.75Å; R72-L135 HydrophobicContact CB-CG 4.44Å; F73-L135 HydrophobicContact CD1-CB 3.62Å; F73-L135 HydrophobicContact CE1-CB 3.75Å; F73-L135 HydrophobicContact CE1-CD1 4.4Å; F73-L135 HydrophobicContact CE2-CD1 4.25Å; F73-L135 HydrophobicContact CG-CB 4.14Å; F73-L135 HydrophobicContact CZ-CB 4.36Å; F73-L135 HydrophobicContact CZ-CD1 4.19Å; L135-E137 HydrophobicContact CD2-CB 3.94Å; L135-E137 HydrophobicContact CD2-CG 3.89Å; L135-E137 HydrophobicContact CG-CG 4.39Å; L135-L140 HydrophobicContact CD1-CD2 4.19Å; L135-L140 HydrophobicContact CD2-CB 3.94Å; L135-L140 HydrophobicContact CD2-CD2 4.3Å; L135-L140 HydrophobicContact CD2-CG 3.99Å; L135-L140 WeakPolarHBondContact CD2-O 3.35Å; L135-L141 CarbonylContact O-C 3.56Å; L135-L141 VanDerWaalsContact O-CA 3.3Å; L135-L141 WeakPolarHBondContact O-CA 3.41Å; L135-G142 PolarHBondContact N-O 3.3Å; L135-G142 PolarHBondContact O-N 2.88Å
136	D	95.9	Very high	96.5	Very high	64 Å²	64	48.8 Å²	48.8	34%	0.342	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	82.7	177.4	-175.9	13	0	0	0	109.9	I75 V83 V134 L141	I75-D136 HydrophobicContact CD1-CB 3.84Å; V83-D136 HydrophobicContact CG1-CB 4Å; V134-D136 HydrophobicContact CG1-CB 4.36Å; D136-L141 HydrophobicContact CB-CD2 4.38Å; D136-L141 WeakPolarHBondContact OD1-CD2 2.98Å
137	E	94.7	Very high	96.7	Very high	74 Å²	74	43.6 Å²	43.6	35%	0.346	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	156.1	-180	-70.1	-178.3	-142	0	0	112.3	R72 L135 K139 L140	R72-E137 IonicContact CZ-OE1 2.75Å; R72-E137 IonicContact CZ-OE2 3.03Å; R72-E137 IonicContact NE-OE1 3.14Å; R72-E137 PolarHBondContact NE-OE1 3.2Å; R72-E137 IonicContact NE-OE2 3.44Å; R72-E137 IonicContact NH2-OE1 2.61Å; R72-E137 PolarHBondContact NH2-OE1 2.98Å; R72-E137 IonicContact NH2-OE2 3.77Å; R72-E137 PolarHBondContact NH2-OE2 3.07Å; L135-E137 HydrophobicContact CD2-CB 3.94Å; L135-E137 HydrophobicContact CD2-CG 3.89Å; L135-E137 HydrophobicContact CG-CG 4.39Å; E137-K139 PolarHBondContact O-N 2.98Å; E137-L140 CarbonylContact C-O 3.52Å; E137-L140 WeakPolarHBondContact CA-O 3.18Å; E137-L140 WeakPolarHBondContact CB-O 3.23Å; E137-L140 PolarHBondContact N-O 2.83Å; E137-L140 CarbonylContact O-C 3.59Å; E137-L140 PolarHBondContact O-N 2.69Å
138	K	90.2	Very high	96.8	Very high	143 Å²	143	40.6 Å²	40.6	62%	0.622	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-24	-178.4	-178.2	169.7	-178.1	176.6	0	115	Q86 F87	Q86-K138 HydrophobicContact CB-CG 4.33Å; F87-K138 VanDerWaalsContact CD1-O 3.24Å; F87-K138 WeakPolarHBondContact CD1-O 3.47Å
139	K	91.5	Very high	96.8	Very high	160 Å²	160	36.3 Å²	36.3	70%	0.696	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-126.4	7.8	-177.8	-68.1	-172.6	178.3	-179.4	0	113.5	E137 P166	E137-K139 PolarHBondContact O-N 2.98Å; K139-P166 HydrophobicContact CB-CG 4.27Å; K139-P166 WeakPolarHBondContact O-CD 3.19Å; K139-P166 WeakPolarHBondContact O-CG 3.17Å
140	L	94.8	Very high	96.8	Very high	16 Å²	16	35.5 Å²	35.5	8%	0.084	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	134	-179.7	-170.4	61.5	0	0	0	108.7	V68 L135 E137 L163	V68-L140 HydrophobicContact CG1-CD2 4.38Å; V68-L140 HydrophobicContact CG2-CD2 3.6Å; L135-L140 HydrophobicContact CD1-CD2 4.19Å; L135-L140 HydrophobicContact CD2-CB 3.94Å; L135-L140 HydrophobicContact CD2-CD2 4.3Å; L135-L140 HydrophobicContact CD2-CG 3.99Å; L135-L140 WeakPolarHBondContact CD2-O 3.35Å; E137-L140 CarbonylContact C-O 3.52Å; E137-L140 WeakPolarHBondContact CA-O 3.18Å; E137-L140 WeakPolarHBondContact CB-O 3.23Å; E137-L140 PolarHBondContact N-O 2.83Å; E137-L140 CarbonylContact O-C 3.59Å; E137-L140 PolarHBondContact O-N 2.69Å; L140-L163 HydrophobicContact CD1-CB 4.47Å; L140-L163 HydrophobicContact CD1-CD2 4.38Å; L140-L163 HydrophobicContact CD2-CD2 4.32Å; L140-L163 HydrophobicContact CG-CD2 4.33Å
141	L	96.9	Very high	96.6	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	149.4	172.3	-59.8	173.4	0	0	0	108.5	V83 P85 F87 I99 F101 L135 D136 L163 I164	V83-L141 HydrophobicContact CB-CD2 4.32Å; V83-L141 HydrophobicContact CG2-CD1 3.91Å; V83-L141 HydrophobicContact CG2-CD2 4.39Å; P85-L141 HydrophobicContact CB-CD1 3.94Å; P85-L141 HydrophobicContact CG-CD1 3.63Å; F87-L141 HydrophobicContact CE1-CD1 4.19Å; F87-L141 HydrophobicContact CE1-CG 4Å; F87-L141 HydrophobicContact CZ-CD1 3.86Å; F87-L141 HydrophobicContact CZ-CG 3.88Å; I99-L141 HydrophobicContact CD1-CD1 3.82Å; F101-L141 HydrophobicContact CZ-CB 4.33Å; L135-L141 CarbonylContact O-C 3.56Å; L135-L141 VanDerWaalsContact O-CA 3.3Å; L135-L141 WeakPolarHBondContact O-CA 3.41Å; D136-L141 HydrophobicContact CB-CD2 4.38Å; D136-L141 WeakPolarHBondContact OD1-CD2 2.98Å; L141-L163 CarbonylContact O-C 3.58Å; L141-L163 WeakPolarHBondContact O-CA 3.48Å; L141-I164 HydrophobicContact CB-CB 4.47Å; L141-I164 PolarHBondContact N-O 3.34Å; L141-I164 VanDerWaalsContact N-O 3.14Å; L141-I164 PolarHBondContact O-N 2.99Å
142	G	97.3	Very high	96.4	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.1	171.8	174	0	0	0	0	0	114.7	V134 L135 S162	V134-G142 CarbonylContact C-O 3.53Å; V134-G142 WeakPolarHBondContact CA-O 3.46Å; V134-G142 WeakPolarHBondContact CG1-O 3.38Å; L135-G142 PolarHBondContact N-O 3.3Å; L135-G142 PolarHBondContact O-N 2.88Å; G142-S162 CarbonylContact C-O 3.53Å; G142-S162 WeakPolarHBondContact CA-O 3.26Å
143	V	98.2	Very high	96.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	134.2	177	58.6	0	0	0	0	108.7	F101 D107 T132 A133 V134 R145 T161 S162	F101-V143 HydrophobicContact CB-CB 4.48Å; F101-V143 HydrophobicContact CD1-CB 3.76Å; F101-V143 HydrophobicContact CD1-CG1 3.57Å; F101-V143 HydrophobicContact CE1-CB 4.16Å; F101-V143 HydrophobicContact CE1-CG1 3.85Å; F101-V143 HydrophobicContact CG-CB 4.15Å; F101-V143 HydrophobicContact CG-CG1 4.41Å; D107-V143 WeakPolarHBondContact OD2-CG1 3.03Å; T132-V143 HydrophobicContact CG2-CG2 3.35Å; A133-V143 WeakPolarHBondContact O-CA 3.33Å; V134-V143 HydrophobicContact CG2-CB 4.44Å; V134-V143 HydrophobicContact CG2-CG2 4.26Å; V143-R145 VanDerWaalsContact CG1-NH1 3.32Å; V143-R145 HydrophobicContact CG2-CG 4.1Å; V143-T161 CarbonylContact O-C 3.53Å; V143-T161 WeakPolarHBondContact O-CA 3.04Å; V143-S162 PolarHBondContact N-O 2.68Å; V143-S162 PolarHBondContact O-N 2.85Å
144	K	98.2	Very high	96	Very high	41 Å²	41	45.2 Å²	45.2	18%	0.178	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	126.2	173.9	179	178.8	-178.2	-168.4	0	107.7	S70 F73 T132 A133 T159	S70-K144 PolarHBondContact OG-NZ 3.26Å; F73-K144 HydrophobicContact CB-CB 4.33Å; F73-K144 HydrophobicContact CD1-CB 3.59Å; F73-K144 HydrophobicContact CD2-CB 4.19Å; F73-K144 HydrophobicContact CD2-CD 4.27Å; F73-K144 HydrophobicContact CE1-CB 3.83Å; F73-K144 HydrophobicContact CE2-CB 4.4Å; F73-K144 HydrophobicContact CG-CB 3.78Å; F73-K144 HydrophobicContact CG-CD 4.48Å; F73-K144 HydrophobicContact CZ-CB 4.24Å; T132-K144 WeakPolarHBondContact CA-O 3.03Å; A133-K144 PolarHBondContact N-O 3.38Å; A133-K144 PolarHBondContact O-N 2.98Å; K144-T159 HydrophobicContact CD-CG2 4.33Å; K144-T159 HydrophobicContact CG-CG2 4.08Å
145	R	98.3	Very high	95.9	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	132.5	-179.3	-55.1	-171	172.5	82.2	8.3	109.6	Y102 A103 D105 D107 T132 V143 F147 T159 M160	Y102-R145 PolarHBondContact O-NE 3.38Å; Y102-R145 PolarHBondContact O-NH2 3.2Å; A103-R145 PolarHBondContact O-NE 2.85Å; D105-R145 VanDerWaalsContact O-CZ 3.26Å; D105-R145 PolarHBondContact O-NE 2.75Å; D105-R145 PolarHBondContact O-NH2 2.04Å; D107-R145 IonicContact OD1-CZ 2.68Å; D107-R145 IonicContact OD1-NH1 2.62Å; D107-R145 IonicContact OD1-NH2 3.96Å; D107-R145 PolarHBondContact OD1-NH2 3.39Å; D107-R145 IonicContact OD2-NH1 3.65Å; D107-R145 PolarHBondContact OD2-NH1 3.27Å; D107-R145 IonicContact OD2-NH2 3.61Å; T132-R145 HydrophobicContact CG2-CG 3.95Å; V143-R145 VanDerWaalsContact CG1-NH1 3.32Å; V143-R145 HydrophobicContact CG2-CG 4.1Å; R145-F147 HydrophobicContact CB-CD2 4.15Å; R145-F147 HydrophobicContact CB-CE2 3.45Å; R145-F147 VanDerWaalsContact CB-CE2 3.45Å; R145-F147 HydrophobicContact CB-CZ 3.86Å; R145-F147 HydrophobicContact CG-CE2 4.27Å; R145-F147 HydrophobicContact CG-CZ 4.31Å; R145-T159 CarbonylContact O-C 3.6Å; R145-T159 VanDerWaalsContact O-CA 3.25Å; R145-T159 WeakPolarHBondContact O-CA 3.22Å; R145-M160 PolarHBondContact N-O 2.76Å; R145-M160 PolarHBondContact O-N 2.05Å
146	T	98.2	Very high	95.8	Very high	23 Å²	23	52.3 Å²	52.3	14%	0.141	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	124.6	166	-60.5	0	0	0	0	107.6	F130 D131 E157 A158 T159	F130-T146 CarbonylContact C-O 3.6Å; F130-T146 VanDerWaalsContact CA-O 3.23Å; F130-T146 WeakPolarHBondContact CA-O 3.45Å; D131-T146 PolarHBondContact N-O 2.89Å; D131-T146 PolarHBondContact O-N 2.88Å; T146-E157 HydrophobicContact CG2-CB 4.11Å; T146-E157 HydrophobicContact CG2-CG 4.32Å; T146-A158 CarbonylContact C-O 3.54Å; T146-A158 WeakPolarHBondContact CA-O 3.47Å; T146-T159 PolarHBondContact OG1-OG1 3.17Å; T146-T159 VanDerWaalsContact OG1-OG1 3.09Å
147	F	98.2	Very high	95.9	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128.7	178	-64.4	-81.2	0	0	0	109.5	D104 L124 Y127 F130 R145 E157 A158	D104-F147 HydrophobicContact CB-CE1 4.44Å; L124-F147 HydrophobicContact CB-CB 3.93Å; L124-F147 HydrophobicContact CB-CD1 4.36Å; L124-F147 HydrophobicContact CB-CD2 3.74Å; L124-F147 HydrophobicContact CB-CE2 4.32Å; L124-F147 HydrophobicContact CB-CG 3.76Å; L124-F147 HydrophobicContact CD2-CB 3.77Å; Y127-F147 AromaticContact CD1-CD1 3.83Å; Y127-F147 HydrophobicContact CD1-CD1 3.83Å; Y127-F147 HydrophobicContact CD1-CE1 4.07Å; Y127-F147 HydrophobicContact CD2-CD1 4.27Å; Y127-F147 HydrophobicContact CE1-CD1 4.44Å; Y127-F147 HydrophobicContact CE1-CE1 4.26Å; Y127-F147 AromaticContact CG-CD1 3.74Å; Y127-F147 HydrophobicContact CG-CD1 3.74Å; Y127-F147 HydrophobicContact CG-CE1 4.35Å; F130-F147 HydrophobicContact CB-CD1 3.81Å; F130-F147 HydrophobicContact CB-CE1 4.03Å; R145-F147 HydrophobicContact CB-CD2 4.15Å; R145-F147 HydrophobicContact CB-CE2 3.45Å; R145-F147 VanDerWaalsContact CB-CE2 3.45Å; R145-F147 HydrophobicContact CB-CZ 3.86Å; R145-F147 HydrophobicContact CG-CE2 4.27Å; R145-F147 HydrophobicContact CG-CZ 4.31Å; F147-E157 CarbonylContact O-C 3.5Å; F147-E157 VanDerWaalsContact O-CA 3.25Å; F147-E157 WeakPolarHBondContact O-CA 3.45Å; F147-A158 PolarHBondContact N-O 3.4Å; F147-A158 PolarHBondContact O-N 2.72Å
148	S	97.9	Very high	96.1	Very high	11 Å²	11	49.6 Å²	49.6	8%	0.077	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	132.2	166.6	-77.1	0	0	0	0	109.8	Y127 M128 D129 E155 V156	Y127-S148 CarbonylContact C-O 3.57Å; Y127-S148 WeakPolarHBondContact CA-O 3.4Å; Y127-S148 WeakPolarHBondContact CB-O 3.4Å; M128-S148 PolarHBondContact N-O 2.84Å; D129-S148 PolarHBondContact O-N 2.88Å; S148-E155 WeakPolarHBondContact CB-OE1 3.32Å; S148-E155 PolarHBondContact OG-OE1 3.05Å; S148-V156 WeakPolarHBondContact CA-O 3.31Å
149	I	97.1	Very high	96.5	Very high	7 Å²	7	43.4 Å²	43.4	4%	0.036	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	144.8	176.6	-173.7	164.9	0	0	0	110.4	L124 N126 V151 V156 I181 K185	L124-I149 HydrophobicContact CD2-CB 3.86Å; L124-I149 HydrophobicContact CD2-CD1 3.95Å; L124-I149 HydrophobicContact CD2-CG2 3.82Å; L124-I149 HydrophobicContact CG-CD1 4.49Å; N126-I149 WeakPolarHBondContact O-CD1 3.21Å; N126-I149 WeakPolarHBondContact O-CG1 3.39Å; I149-V151 HydrophobicContact CG2-CG2 4.28Å; I149-V156 HydrophobicContact CG2-CG2 3.64Å; I149-V156 PolarHBondContact N-O 2.66Å; I149-V156 PolarHBondContact O-N 2.79Å; I149-I181 HydrophobicContact CG2-CD1 3.63Å; I149-I181 HydrophobicContact CG2-CG1 3.91Å; I149-K185 HydrophobicContact CD1-CD 4.42Å; I149-K185 HydrophobicContact CD1-CG 4.45Å
150	N	96.1	Very high	96.8	Very high	83 Å²	83	35.8 Å²	35.8	44%	0.444	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	122.7	171.4	-166.8	-76	0	0	0	110.1	M128 G153 S154	M128-N150 HydrophobicContact CE-CB 4.46Å; M128-N150 HydrophobicContact SD-CB 3.73Å; N150-G153 WeakPolarHBondContact OD1-CA 3.24Å; N150-G153 PolarHBondContact OD1-N 2.87Å; N150-S154 WeakPolarHBondContact CA-O 3.42Å
151	V	95.1	Very high	96.9	Very high	26 Å²	26	35.1 Å²	35.1	16%	0.158	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	115.2	170.3	-179	0	0	0	0	107.6	I149 G153 S154 V156 E180 I181	I149-V151 HydrophobicContact CG2-CG2 4.28Å; V151-G153 PolarHBondContact O-N 3.26Å; V151-G153 VanDerWaalsContact O-N 3.13Å; V151-S154 PolarHBondContact N-O 2.62Å; V151-S154 PolarHBondContact O-N 3.06Å; V151-V156 HydrophobicContact CB-CG2 4.25Å; V151-V156 HydrophobicContact CG2-CG2 3.62Å; V151-E180 HydrophobicContact CG1-CB 3.97Å; V151-E180 WeakPolarHBondContact CG1-O 3.35Å; V151-I181 HydrophobicContact CG2-CG1 4.03Å
152	D	93	Very high	97	Very high	164 Å²	164	35.1 Å²	35.1	88%	0.877	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.4	40.9	178.1	-59.3	-36	0	0	0	114.3	S154	D152-S154 VanDerWaalsContact C-N 3.31Å; D152-S154 PolarHBondContact O-N 3.35Å
153	G	93.1	Very high	97	Very high	62 Å²	62	35.2 Å²	35.2	64%	0.639	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	85	-3.8	179.2	0	0	0	0	0	114.8	N150 V151	N150-G153 WeakPolarHBondContact OD1-CA 3.24Å; N150-G153 PolarHBondContact OD1-N 2.87Å; V151-G153 PolarHBondContact O-N 3.26Å; V151-G153 VanDerWaalsContact O-N 3.13Å
154	S	94.9	Very high	96.9	Very high	74 Å²	74	35.2 Å²	35.2	52%	0.517	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	134.8	175.5	-59.4	0	0	0	0	111	N150 V151 D152	N150-S154 WeakPolarHBondContact CA-O 3.42Å; V151-S154 PolarHBondContact N-O 2.62Å; V151-S154 PolarHBondContact O-N 3.06Å; D152-S154 VanDerWaalsContact C-N 3.31Å; D152-S154 PolarHBondContact O-N 3.35Å
155	E	95.9	Very high	96.6	Very high	121 Å²	121	35.1 Å²	35.1	57%	0.565	21%	0.205	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	124.8	171.8	-176.6	173.5	178.3	0	0	110.1	M128 S148	M128-E155 HydrophobicContact CE-CB 4.1Å; M128-E155 HydrophobicContact CE-CG 3.61Å; S148-E155 WeakPolarHBondContact CB-OE1 3.32Å; S148-E155 PolarHBondContact OG-OE1 3.05Å
156	V	97.2	Very high	96	Very high	28 Å²	28	37.5 Å²	37.5	17%	0.17	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	149.3	176.6	-62.2	0	0	0	0	110.1	S148 I149 V151 P178 I181	S148-V156 WeakPolarHBondContact CA-O 3.31Å; I149-V156 HydrophobicContact CG2-CG2 3.64Å; I149-V156 PolarHBondContact N-O 2.66Å; I149-V156 PolarHBondContact O-N 2.79Å; V151-V156 HydrophobicContact CB-CG2 4.25Å; V151-V156 HydrophobicContact CG2-CG2 3.62Å; V156-P178 HydrophobicContact CB-CB 4.46Å; V156-P178 HydrophobicContact CB-CG 4.23Å; V156-I181 HydrophobicContact CG2-CD1 3.9Å; V156-I181 HydrophobicContact CG2-CG1 3.74Å
157	E	97.7	Very high	95.3	Very high	82 Å²	82	41 Å²	41	38%	0.383	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	134.9	-178.6	-63.7	174.5	139	0	0	111.7	T146 F147 K176 P178	T146-E157 HydrophobicContact CG2-CB 4.11Å; T146-E157 HydrophobicContact CG2-CG 4.32Å; F147-E157 CarbonylContact O-C 3.5Å; F147-E157 VanDerWaalsContact O-CA 3.25Å; F147-E157 WeakPolarHBondContact O-CA 3.45Å; E157-K176 WeakPolarHBondContact O-CE 3.45Å; E157-K176 IonicContact OE2-NZ 3.88Å; E157-K176 PolarHBondContact OE2-NZ 3.25Å; E157-P178 VanDerWaalsContact O-CD 3.25Å; E157-P178 WeakPolarHBondContact O-CD 3.35Å; E157-P178 WeakPolarHBondContact O-CG 3.41Å
158	A	98.1	Very high	94.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.8	167.5	0	0	0	0	0	110.9	L124 T146 F147 K176 I177 I181 F186	L124-A158 HydrophobicContact CD2-CB 4.5Å; T146-A158 CarbonylContact C-O 3.54Å; T146-A158 WeakPolarHBondContact CA-O 3.47Å; F147-A158 PolarHBondContact N-O 3.4Å; F147-A158 PolarHBondContact O-N 2.72Å; A158-K176 CarbonylContact C-O 3.51Å; A158-K176 VanDerWaalsContact CA-O 3.22Å; A158-K176 WeakPolarHBondContact CA-O 2.92Å; A158-I177 HydrophobicContact CB-CD1 4.33Å; A158-I181 HydrophobicContact CB-CD1 3.9Å; A158-F186 HydrophobicContact CB-CE1 3.9Å; A158-F186 HydrophobicContact CB-CZ 4.35Å
159	T	98.2	Very high	94.3	Very high	12 Å²	12	42.8 Å²	42.8	7%	0.074	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.5	178.3	-56.8	0	0	0	0	110.4	K144 R145 T146 D175 K176	K144-T159 HydrophobicContact CD-CG2 4.33Å; K144-T159 HydrophobicContact CG-CG2 4.08Å; R145-T159 CarbonylContact O-C 3.6Å; R145-T159 VanDerWaalsContact O-CA 3.25Å; R145-T159 WeakPolarHBondContact O-CA 3.22Å; T146-T159 PolarHBondContact OG1-OG1 3.17Å; T146-T159 VanDerWaalsContact OG1-OG1 3.09Å; T159-D175 HydrophobicContact CG2-CB 3.69Å; T159-D175 PolarHBondContact O-N 2.99Å; T159-K176 PolarHBondContact N-O 3.47Å; T159-K176 PolarHBondContact O-N 3.4Å
160	M	98	Very high	94.3	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	137.3	-174.7	-58.1	168.1	60.6	0	0	109.8	N122 R145 Y174 I177 F186	N122-M160 VanDerWaalsContact C-CE 3.45Å; N122-M160 HydrophobicContact CB-CE 4.33Å; N122-M160 WeakPolarHBondContact OD1-CE 3.47Å; R145-M160 PolarHBondContact N-O 2.76Å; R145-M160 PolarHBondContact O-N 2.05Å; M160-Y174 HydrophobicContact CE-CD1 4.28Å; M160-Y174 HydrophobicContact CE-CE1 4.03Å; M160-Y174 HydrophobicContact CG-CD1 4.18Å; M160-I177 HydrophobicContact CG-CD1 3.93Å; M160-I177 HydrophobicContact SD-CD1 4.5Å; M160-F186 HydrophobicContact CE-CD1 4.46Å; M160-F186 HydrophobicContact SD-CD1 3.87Å; M160-F186 HydrophobicContact SD-CE1 4.26Å
161	T	98.2	Very high	94.4	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.012	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	133.5	-176.7	-60.4	0	0	0	0	110.6	F73 N122 V143 L163 F172 Y173 D175	F73-T161 HydrophobicContact CE1-CG2 4Å; F73-T161 HydrophobicContact CE2-CG2 4.23Å; F73-T161 HydrophobicContact CZ-CG2 3.43Å; F73-T161 VanDerWaalsContact CZ-CG2 3.43Å; N122-T161 PolarHBondContact ND2-O 2.89Å; V143-T161 CarbonylContact O-C 3.53Å; V143-T161 WeakPolarHBondContact O-CA 3.04Å; T161-L163 HydrophobicContact CG2-CD2 4.31Å; T161-L163 HydrophobicContact CG2-CG 4.16Å; T161-F172 CarbonylContact O-C 3.5Å; T161-F172 VanDerWaalsContact O-CA 3.32Å; T161-F172 WeakPolarHBondContact O-CA 3.44Å; T161-Y173 PolarHBondContact N-O 3.35Å; T161-Y173 PolarHBondContact O-N 3.35Å; T161-D175 WeakPolarHBondContact CB-OD2 3.24Å; T161-D175 PolarHBondContact OG1-OD2 3.34Å
162	S	98.2	Very high	94.5	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.007	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	136.6	171.6	-61.8	0	0	0	0	110.4	N122 G142 V143 S171 F172	N122-S162 WeakPolarHBondContact CB-OG 3.46Å; N122-S162 PolarHBondContact ND2-OG 3.37Å; N122-S162 VanDerWaalsContact ND2-OG 3.11Å; G142-S162 CarbonylContact C-O 3.53Å; G142-S162 WeakPolarHBondContact CA-O 3.26Å; V143-S162 PolarHBondContact N-O 2.68Å; V143-S162 PolarHBondContact O-N 2.85Å; S162-S171 CarbonylContact C-O 3.58Å; S162-S171 WeakPolarHBondContact CA-O 3.1Å; S162-F172 WeakPolarHBondContact OG-CD1 3.2Å; S162-F172 WeakPolarHBondContact OG-CE1 3.5Å
163	L	97.3	Very high	94.8	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	142.2	-179.5	-62.3	167.9	0	0	0	110.9	P67 V68 F73 L140 L141 T161 I170 S171	P67-L163 HydrophobicContact CB-CD1 4.16Å; P67-L163 HydrophobicContact CG-CD1 3.73Å; V68-L163 HydrophobicContact CG2-CD1 3.65Å; V68-L163 HydrophobicContact CG2-CD2 3.95Å; V68-L163 HydrophobicContact CG2-CG 4.49Å; F73-L163 HydrophobicContact CE1-CD2 4.42Å; F73-L163 HydrophobicContact CZ-CD2 3.92Å; L140-L163 HydrophobicContact CD1-CB 4.47Å; L140-L163 HydrophobicContact CD1-CD2 4.38Å; L140-L163 HydrophobicContact CD2-CD2 4.32Å; L140-L163 HydrophobicContact CG-CD2 4.33Å; L141-L163 CarbonylContact O-C 3.58Å; L141-L163 WeakPolarHBondContact O-CA 3.48Å; T161-L163 HydrophobicContact CG2-CD2 4.31Å; T161-L163 HydrophobicContact CG2-CG 4.16Å; L163-I170 CarbonylContact O-C 3.57Å; L163-I170 WeakPolarHBondContact O-CA 3.35Å; L163-S171 PolarHBondContact N-O 3.1Å; L163-S171 PolarHBondContact O-N 3.48Å
164	I	95.1	Very high	95.1	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	123.4	166.8	-64.8	170.4	0	0	0	108.8	F87 I99 M120 L141 I170	F87-I164 HydrophobicContact CE2-CG2 4.41Å; I99-I164 HydrophobicContact CD1-CD1 3.36Å; I99-I164 HydrophobicContact CG1-CD1 3.74Å; M120-I164 HydrophobicContact CE-CD1 3.37Å; M120-I164 HydrophobicContact CE-CG1 3.81Å; M120-I164 HydrophobicContact SD-CD1 3.58Å; M120-I164 VanDerWaalsContact SD-CD1 3.58Å; M120-I164 HydrophobicContact SD-CG1 3.58Å; M120-I164 VanDerWaalsContact SD-CG1 3.58Å; L141-I164 HydrophobicContact CB-CB 4.47Å; L141-I164 PolarHBondContact N-O 3.34Å; L141-I164 VanDerWaalsContact N-O 3.14Å; L141-I164 PolarHBondContact O-N 2.99Å; I164-I170 HydrophobicContact CG1-CG1 4.48Å
165	H	92.6	Very high	95.2	Very high	39 Å²	39	25.5 Å²	25.5	18%	0.181	13%	0.131	C	C	.	.			trans	-96.1	160.6	-179.7	-62.1	-98.7	0	0	0	111.9	N167 G168 K169 S171	H165-N167 WeakPolarHBondContact CB-OD1 3.42Å; H165-N167 PolarHBondContact O-N 2.87Å; H165-N167 VanDerWaalsContact O-N 3.1Å; H165-G168 PolarHBondContact O-N 3.11Å; H165-K169 HydrophobicContact CB-CB 4.09Å; H165-K169 PolarHBondContact CD2-O 3.35Å; H165-K169 VanDerWaalsContact CD2-O 3.32Å; H165-K169 PolarHBondContact N-O 3.06Å; H165-S171 PolarHBondContact NE2-OG 2.95Å
166	P	86.7	Confident	95.2	Very high	50 Å²	50	24.2 Å²	24.2	33%	0.325	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-28.2	-179.5	-29.1	37.8	0	0	0	115.6	F87 K139 G168	F87-P166 HydrophobicContact CB-CB 4.25Å; F87-P166 HydrophobicContact CD1-CG 4.42Å; F87-P166 VanDerWaalsContact CD2-CA 3.41Å; F87-P166 HydrophobicContact CD2-CB 4Å; F87-P166 HydrophobicContact CD2-CG 4.39Å; F87-P166 HydrophobicContact CE2-CB 4.46Å; F87-P166 HydrophobicContact CG-CB 4.08Å; F87-P166 HydrophobicContact CG-CG 4.27Å; K139-P166 HydrophobicContact CB-CG 4.27Å; K139-P166 WeakPolarHBondContact O-CD 3.19Å; K139-P166 WeakPolarHBondContact O-CG 3.17Å; P166-G168 PolarHBondContact O-N 3.49Å
167	N	81.8	Confident	95.2	Very high	95 Å²	95	23.5 Å²	23.5	51%	0.508	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	10.2	177.6	70.3	-18.6	0	0	0	113.6	H165 K169 Q222	H165-N167 WeakPolarHBondContact CB-OD1 3.42Å; H165-N167 PolarHBondContact O-N 2.87Å; H165-N167 VanDerWaalsContact O-N 3.1Å; N167-K169 PolarHBondContact O-N 2.92Å; N167-K169 WeakPolarHBondContact OD1-CB 3.37Å; N167-K169 PolarHBondContact OD1-N 3.32Å; N167-Q222 PolarHBondContact ND2-OE1 2.79Å
168	G	85.7	Confident	95.2	Very high	4 Å²	4	20.6 Å²	20.6	4%	0.041	11%	0.106	C	C	.	.	S	Bend	trans	74.9	5.4	-175.9	0	0	0	0	0	114.5	N90 H165 P166 I170	N90-G168 WeakPolarHBondContact O-CA 3.25Å; H165-G168 PolarHBondContact O-N 3.11Å; P166-G168 PolarHBondContact O-N 3.49Å; G168-I170 PolarHBondContact O-N 2.89Å
169	K	91.3	Very high	95	Very high	45 Å²	45	29.7 Å²	29.7	20%	0.196	15%	0.149	C	C	.	.			trans	-64	135.2	170.6	-170.8	175.4	62.5	168.2	0	109.1	H165 N167 E220 F221	H165-K169 HydrophobicContact CB-CB 4.09Å; H165-K169 PolarHBondContact CD2-O 3.35Å; H165-K169 VanDerWaalsContact CD2-O 3.32Å; H165-K169 PolarHBondContact N-O 3.06Å; N167-K169 PolarHBondContact O-N 2.92Å; N167-K169 WeakPolarHBondContact OD1-CB 3.37Å; N167-K169 PolarHBondContact OD1-N 3.32Å; K169-E220 HydrophobicContact CD-CB 4.3Å; K169-E220 HydrophobicContact CD-CG 4.27Å; K169-E220 WeakPolarHBondContact CE-OE1 3.11Å; K169-E220 HydrophobicContact CG-CB 4.49Å; K169-E220 IonicContact NZ-OE1 3.06Å; K169-E220 PolarHBondContact NZ-OE1 2.72Å; K169-F221 WeakPolarHBondContact CA-O 3.36Å; K169-F221 WeakPolarHBondContact CG-O 3.38Å
170	I	95.7	Very high	94.9	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	134.3	172.7	-59.1	164.2	0	0	0	107.1	Y91 M120 L163 I164 G168 F172 I190 E220 F221	Y91-I170 HydrophobicContact CD2-CD1 3.77Å; Y91-I170 HydrophobicContact CE2-CD1 3.51Å; M120-I170 HydrophobicContact CG-CD1 4.34Å; M120-I170 HydrophobicContact CG-CG2 4.42Å; M120-I170 HydrophobicContact SD-CD1 4.14Å; M120-I170 HydrophobicContact SD-CG1 4.14Å; M120-I170 HydrophobicContact SD-CG2 3.7Å; L163-I170 CarbonylContact O-C 3.57Å; L163-I170 WeakPolarHBondContact O-CA 3.35Å; I164-I170 HydrophobicContact CG1-CG1 4.48Å; G168-I170 PolarHBondContact O-N 2.89Å; I170-F172 HydrophobicContact CG2-CD1 4.31Å; I170-F172 HydrophobicContact CG2-CE1 3.81Å; I170-F172 HydrophobicContact CG2-CZ 4.33Å; I170-I190 HydrophobicContact CD1-CG2 4.15Å; I170-I190 HydrophobicContact CG2-CG2 4.22Å; I170-E220 CarbonylContact O-C 3.53Å; I170-E220 WeakPolarHBondContact O-CA 3.36Å; I170-F221 HydrophobicContact CB-CB 4.27Å; I170-F221 HydrophobicContact CB-CD2 4.33Å; I170-F221 HydrophobicContact CG2-CD2 4.28Å; I170-F221 PolarHBondContact N-O 2.93Å; I170-F221 PolarHBondContact O-N 2.88Å
171	S	97.9	Very high	94.8	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.021	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	132.3	175.1	-51.5	0	0	0	0	110.7	S162 L163 H165 V219	S162-S171 CarbonylContact C-O 3.58Å; S162-S171 WeakPolarHBondContact CA-O 3.1Å; L163-S171 PolarHBondContact N-O 3.1Å; L163-S171 PolarHBondContact O-N 3.48Å; H165-S171 PolarHBondContact NE2-OG 2.95Å; S171-V219 CarbonylContact C-O 3.55Å; S171-V219 WeakPolarHBondContact CA-O 2.99Å
172	F	98.7	Very high	94.6	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	131.3	163.5	-59.1	-25.7	0	0	0	108.6	M120 I121 N122 T161 S162 I170 S188 I190 V208 V219 F221	M120-F172 HydrophobicContact CB-CE1 4.09Å; M120-F172 HydrophobicContact CB-CZ 4Å; I121-F172 WeakPolarHBondContact O-CE2 3.12Å; N122-F172 HydrophobicContact CB-CD1 4.04Å; N122-F172 HydrophobicContact CB-CD2 4.36Å; N122-F172 HydrophobicContact CB-CE1 4.03Å; N122-F172 HydrophobicContact CB-CE2 4.33Å; N122-F172 HydrophobicContact CB-CG 4.23Å; N122-F172 HydrophobicContact CB-CZ 4.17Å; T161-F172 CarbonylContact O-C 3.5Å; T161-F172 VanDerWaalsContact O-CA 3.32Å; T161-F172 WeakPolarHBondContact O-CA 3.44Å; S162-F172 WeakPolarHBondContact OG-CD1 3.2Å; S162-F172 WeakPolarHBondContact OG-CE1 3.5Å; I170-F172 HydrophobicContact CG2-CD1 4.31Å; I170-F172 HydrophobicContact CG2-CE1 3.81Å; I170-F172 HydrophobicContact CG2-CZ 4.33Å; F172-S188 VanDerWaalsContact CD2-OG 3.23Å; F172-S188 WeakPolarHBondContact CD2-OG 3.42Å; F172-I190 HydrophobicContact CE2-CG2 4.1Å; F172-I190 HydrophobicContact CZ-CG2 3.74Å; F172-V208 HydrophobicContact CD2-CG2 4.2Å; F172-V219 HydrophobicContact CB-CB 4.3Å; F172-V219 PolarHBondContact N-O 3.08Å; F172-V219 PolarHBondContact O-N 3.28Å; F172-F221 AromaticContact CD2-CE2 3.64Å; F172-F221 HydrophobicContact CD2-CE2 3.64Å; F172-F221 HydrophobicContact CD2-CZ 4.25Å; F172-F221 AromaticContact CE2-CE2 3.7Å; F172-F221 HydrophobicContact CE2-CE2 3.7Å; F172-F221 HydrophobicContact CE2-CZ 4.16Å; F172-F221 HydrophobicContact CG-CE2 4.28Å; F172-F221 HydrophobicContact CZ-CE2 4.37Å
173	Y	98.6	Very high	94.5	Very high	16 Å²	16	45.9 Å²	45.9	6%	0.063	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	138.1	174	-177	-105.4	0	0	0	109.1	Q64 S65 Q66 P67 T161 D175 T217 L218	Q64-Y173 HydrophobicContact CB-CE2 4.3Å; Q64-Y173 WeakPolarHBondContact O-CE2 3.36Å; Q64-Y173 PolarHBondContact O-OH 2.86Å; S65-Y173 VanDerWaalsContact C-OH 3.3Å; Q66-Y173 HydrophobicContact CB-CE1 3.91Å; Q66-Y173 HydrophobicContact CG-CD1 4.07Å; Q66-Y173 HydrophobicContact CG-CE1 3.81Å; Q66-Y173 PolarHBondContact N-OH 3.37Å; P67-Y173 VanDerWaalsContact CD-CG 3.46Å; P67-Y173 HydrophobicContact CG-CD2 4.47Å; P67-Y173 HydrophobicContact CG-CG 4.12Å; T161-Y173 PolarHBondContact N-O 3.35Å; T161-Y173 PolarHBondContact O-N 3.35Å; Y173-D175 HydrophobicContact CD1-CB 4.29Å; Y173-D175 VanDerWaalsContact CD1-CG 3.48Å; Y173-D175 WeakPolarHBondContact CD1-OD2 3.39Å; Y173-D175 HydrophobicContact CE1-CB 4.11Å; Y173-T217 WeakPolarHBondContact CD2-O 3.34Å; Y173-L218 HydrophobicContact CD2-CB 4.1Å; Y173-L218 HydrophobicContact CD2-CD1 4.26Å
174	Y	98.5	Very high	94.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	95.4	179.7	-52.3	-66.6	0	0	0	108.8	N122 M160 I177 S188 V208 I213 S215 G216 T217 V219	N122-Y174 WeakPolarHBondContact OD1-CE1 3.42Å; M160-Y174 HydrophobicContact CE-CD1 4.28Å; M160-Y174 HydrophobicContact CE-CE1 4.03Å; M160-Y174 HydrophobicContact CG-CD1 4.18Å; Y174-I177 HydrophobicContact CD1-CD1 4.31Å; Y174-I177 HydrophobicContact CG-CG1 4.35Å; Y174-S188 WeakPolarHBondContact OH-CB 3.46Å; Y174-S188 PolarHBondContact OH-OG 2.71Å; Y174-V208 WeakPolarHBondContact OH-CG1 3.24Å; Y174-I213 HydrophobicContact CD1-CG2 3.83Å; Y174-I213 HydrophobicContact CE1-CB 4.45Å; Y174-I213 HydrophobicContact CE1-CG1 4.33Å; Y174-I213 HydrophobicContact CE1-CG2 3.73Å; Y174-I213 HydrophobicContact CE2-CB 4.43Å; Y174-I213 HydrophobicContact CE2-CG1 4.28Å; Y174-I213 HydrophobicContact CE2-CG2 4.44Å; Y174-I213 HydrophobicContact CG-CG2 4.24Å; Y174-S215 CarbonylContact O-C 3.53Å; Y174-S215 WeakPolarHBondContact O-CA 3.34Å; Y174-G216 PolarHBondContact O-N 2.81Å; Y174-T217 HydrophobicContact CD2-CG2 4.35Å; Y174-T217 WeakPolarHBondContact CD2-O 3.23Å; Y174-T217 PolarHBondContact N-O 2.7Å; Y174-T217 VanDerWaalsContact N-O 3.08Å; Y174-V219 HydrophobicContact CE2-CG2 3.77Å
175	D	97.1	Very high	94.4	Very high	33 Å²	33	51.9 Å²	51.9	18%	0.176	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	-49.9	-173.4	-57.9	-109.1	0	0	0	111.6	Q66 T159 T161 Y173	Q66-D175 VanDerWaalsContact CD-OD1 3.29Å; Q66-D175 WeakPolarHBondContact CG-OD1 3.34Å; Q66-D175 PolarHBondContact NE2-OD1 3.33Å; T159-D175 HydrophobicContact CG2-CB 3.69Å; T159-D175 PolarHBondContact O-N 2.99Å; T161-D175 WeakPolarHBondContact CB-OD2 3.24Å; T161-D175 PolarHBondContact OG1-OD2 3.34Å; Y173-D175 HydrophobicContact CD1-CB 4.29Å; Y173-D175 VanDerWaalsContact CD1-CG 3.48Å; Y173-D175 WeakPolarHBondContact CD1-OD2 3.39Å; Y173-D175 HydrophobicContact CE1-CB 4.11Å
176	K	96.6	Very high	94.6	Very high	93 Å²	93	50.7 Å²	50.7	40%	0.404	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	112.6	-179	178.2	-176.4	170.2	-171.7	0	108.4	E157 A158 T159	E157-K176 WeakPolarHBondContact O-CE 3.45Å; E157-K176 IonicContact OE2-NZ 3.88Å; E157-K176 PolarHBondContact OE2-NZ 3.25Å; A158-K176 CarbonylContact C-O 3.51Å; A158-K176 VanDerWaalsContact CA-O 3.22Å; A158-K176 WeakPolarHBondContact CA-O 2.92Å; T159-K176 PolarHBondContact N-O 3.47Å; T159-K176 PolarHBondContact O-N 3.4Å
177	I	97.6	Very high	95.1	Very high	13 Å²	13	51.1 Å²	51.1	7%	0.067	25%	0.251	C	S	.	.			trans	-126.2	99.2	176.1	-54.9	-64.2	0	0	0	107.8	A158 M160 Y174 F186 I213 S215	A158-I177 HydrophobicContact CB-CD1 4.33Å; M160-I177 HydrophobicContact CG-CD1 3.93Å; M160-I177 HydrophobicContact SD-CD1 4.5Å; Y174-I177 HydrophobicContact CD1-CD1 4.31Å; Y174-I177 HydrophobicContact CG-CG1 4.35Å; I177-F186 HydrophobicContact CD1-CD1 4.29Å; I177-F186 HydrophobicContact CD1-CE1 3.65Å; I177-F186 HydrophobicContact CD1-CZ 4.23Å; I177-F186 HydrophobicContact CG2-CE1 4.03Å; I177-F186 HydrophobicContact CG2-CE2 3.98Å; I177-F186 HydrophobicContact CG2-CZ 3.52Å; I177-I213 HydrophobicContact CD1-CG2 4.31Å; I177-I213 HydrophobicContact CG1-CG2 4.47Å; I177-S215 PolarHBondContact N-OG 3.31Å; I177-S215 PolarHBondContact O-OG 2.81Å
178	P	96.7	Very high	95.9	Very high	21 Å²	21	47 Å²	47	14%	0.136	23%	0.23	C	C	.	.			trans	-58.1	141.7	172.4	-19.8	30.1	0	0	0	111.2	V156 E157 E180 I181	V156-P178 HydrophobicContact CB-CB 4.46Å; V156-P178 HydrophobicContact CB-CG 4.23Å; E157-P178 VanDerWaalsContact O-CD 3.25Å; E157-P178 WeakPolarHBondContact O-CD 3.35Å; E157-P178 WeakPolarHBondContact O-CG 3.41Å; P178-E180 VanDerWaalsContact C-N 3.25Å; P178-E180 WeakPolarHBondContact CA-OE2 3.49Å; P178-E180 WeakPolarHBondContact CB-OE2 3.43Å; P178-E180 PolarHBondContact O-N 3.23Å; P178-I181 HydrophobicContact CB-CD1 4.18Å; P178-I181 HydrophobicContact CB-CG1 4.24Å; P178-I181 HydrophobicContact CG-CD1 3.91Å; P178-I181 HydrophobicContact CG-CG1 4.49Å
179	Q	95.4	Very high	96.5	Very high	192 Å²	192	48.6 Å²	48.6	90%	0.897	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-18.3	-177.2	-66.8	-175.2	9.5	0	0	112.6	I181	Q179-I181 VanDerWaalsContact C-N 3.27Å
180	E	94.9	Very high	96.7	Very high	121 Å²	121	46.5 Å²	46.5	57%	0.565	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-20	-178.8	-49.7	79.5	-174.8	0	0	111.6	V151 P178 E182	V151-E180 HydrophobicContact CG1-CB 3.97Å; V151-E180 WeakPolarHBondContact CG1-O 3.35Å; P178-E180 VanDerWaalsContact C-N 3.25Å; P178-E180 WeakPolarHBondContact CA-OE2 3.49Å; P178-E180 WeakPolarHBondContact CB-OE2 3.43Å; P178-E180 PolarHBondContact O-N 3.23Å; E180-E182 PolarHBondContact O-N 2.95Å
181	I	95.6	Very high	96.7	Very high	8 Å²	8	46.9 Å²	46.9	4%	0.041	23%	0.229	C	C	.	.	S	Bend	trans	-78.7	123.8	177	-56.7	174	0	0	0	109.3	L124 I149 V151 V156 A158 P178 Q179 E183 K185 F186	L124-I181 HydrophobicContact CD1-CG2 3.92Å; I149-I181 HydrophobicContact CG2-CD1 3.63Å; I149-I181 HydrophobicContact CG2-CG1 3.91Å; V151-I181 HydrophobicContact CG2-CG1 4.03Å; V156-I181 HydrophobicContact CG2-CD1 3.9Å; V156-I181 HydrophobicContact CG2-CG1 3.74Å; A158-I181 HydrophobicContact CB-CD1 3.9Å; P178-I181 HydrophobicContact CB-CD1 4.18Å; P178-I181 HydrophobicContact CB-CG1 4.24Å; P178-I181 HydrophobicContact CG-CD1 3.91Å; P178-I181 HydrophobicContact CG-CG1 4.49Å; Q179-I181 VanDerWaalsContact C-N 3.27Å; I181-E183 PolarHBondContact O-N 3.03Å; I181-K185 HydrophobicContact CG2-CB 3.96Å; I181-K185 HydrophobicContact CG2-CG 4.22Å; I181-F186 HydrophobicContact CB-CE2 3.8Å; I181-F186 HydrophobicContact CB-CZ 3.8Å; I181-F186 HydrophobicContact CD1-CZ 4Å; I181-F186 HydrophobicContact CG2-CD2 4.33Å; I181-F186 HydrophobicContact CG2-CE2 3.42Å; I181-F186 VanDerWaalsContact CG2-CE2 3.42Å; I181-F186 HydrophobicContact CG2-CZ 3.53Å
182	E	95.3	Very high	96.4	Very high	123 Å²	123	46.8 Å²	46.8	58%	0.575	23%	0.228	S	C	*	.			trans	-57	135	176	-64.2	179.7	175.2	0	0	112.3	E180 S184 K185	E180-E182 PolarHBondContact O-N 2.95Å; E182-S184 PolarHBondContact O-N 3.44Å; E182-S184 PolarHBondContact OE2-OG 3.31Å; E182-K185 HydrophobicContact CB-CG 4.13Å; E182-K185 WeakPolarHBondContact O-CB 3.48Å; E182-K185 WeakPolarHBondContact O-CG 3.32Å; E182-K185 PolarHBondContact O-N 2.86Å
183	E	94.8	Very high	95.9	Very high	104 Å²	104	46.8 Å²	46.8	49%	0.486	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-51.8	-32	177.4	-76.3	-170	-175.6	0	0	113.3	I181 K185 F186 A210	I181-E183 PolarHBondContact O-N 3.03Å; E183-K185 PolarHBondContact O-N 2.79Å; E183-F186 PolarHBondContact O-N 2.96Å; E183-A210 HydrophobicContact CB-CB 3.89Å; E183-A210 HydrophobicContact CG-CB 4.27Å; E183-A210 WeakPolarHBondContact OE2-CB 3.38Å
184	S	94.7	Very high	95.2	Very high	75 Å²	75	46 Å²	46	52%	0.524	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-63.2	-22.4	179.4	70.4	0	0	0	0	113.8	E182	E182-S184 PolarHBondContact O-N 3.44Å; E182-S184 PolarHBondContact OE2-OG 3.31Å
185	K	96.3	Very high	94.4	Very high	53 Å²	53	51.3 Å²	51.3	23%	0.23	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-79	-22.2	-178.2	-57.6	-70.1	178.6	171.3	0	112.2	L124 V125 N126 I149 I181 E182 E183	L124-K185 CarbonylContact C-O 3.58Å; L124-K185 WeakPolarHBondContact CA-O 3.27Å; L124-K185 HydrophobicContact CD1-CB 3.63Å; L124-K185 HydrophobicContact CG-CB 4.4Å; V125-K185 HydrophobicContact CG2-CB 4.36Å; V125-K185 HydrophobicContact CG2-CD 4.18Å; V125-K185 WeakPolarHBondContact CG2-O 3.36Å; V125-K185 PolarHBondContact N-O 2.85Å; N126-K185 PolarHBondContact ND2-NZ 3.09Å; I149-K185 HydrophobicContact CD1-CD 4.42Å; I149-K185 HydrophobicContact CD1-CG 4.45Å; I181-K185 HydrophobicContact CG2-CB 3.96Å; I181-K185 HydrophobicContact CG2-CG 4.22Å; E182-K185 HydrophobicContact CB-CG 4.13Å; E182-K185 WeakPolarHBondContact O-CB 3.48Å; E182-K185 WeakPolarHBondContact O-CG 3.32Å; E182-K185 PolarHBondContact O-N 2.86Å; E183-K185 PolarHBondContact O-N 2.79Å
186	F	97.2	Very high	93.7	Very high	13 Å²	13	50.3 Å²	50.3	6%	0.057	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	124.9	-179.8	-63	-79.3	0	0	0	111.1	L124 A158 M160 I177 I181 E183 I213	L124-F186 HydrophobicContact CD1-CD1 3.58Å; L124-F186 HydrophobicContact CD1-CD2 4.4Å; L124-F186 HydrophobicContact CD1-CE1 3.48Å; L124-F186 VanDerWaalsContact CD1-CE1 3.48Å; L124-F186 HydrophobicContact CD1-CE2 4.32Å; L124-F186 HydrophobicContact CD1-CG 4.06Å; L124-F186 HydrophobicContact CD1-CZ 3.86Å; A158-F186 HydrophobicContact CB-CE1 3.9Å; A158-F186 HydrophobicContact CB-CZ 4.35Å; M160-F186 HydrophobicContact CE-CD1 4.46Å; M160-F186 HydrophobicContact SD-CD1 3.87Å; M160-F186 HydrophobicContact SD-CE1 4.26Å; I177-F186 HydrophobicContact CD1-CD1 4.29Å; I177-F186 HydrophobicContact CD1-CE1 3.65Å; I177-F186 HydrophobicContact CD1-CZ 4.23Å; I177-F186 HydrophobicContact CG2-CE1 4.03Å; I177-F186 HydrophobicContact CG2-CE2 3.98Å; I177-F186 HydrophobicContact CG2-CZ 3.52Å; I181-F186 HydrophobicContact CB-CE2 3.8Å; I181-F186 HydrophobicContact CB-CZ 3.8Å; I181-F186 HydrophobicContact CD1-CZ 4Å; I181-F186 HydrophobicContact CG2-CD2 4.33Å; I181-F186 HydrophobicContact CG2-CE2 3.42Å; I181-F186 VanDerWaalsContact CG2-CE2 3.42Å; I181-F186 HydrophobicContact CG2-CZ 3.53Å; E183-F186 PolarHBondContact O-N 2.96Å; F186-I213 HydrophobicContact CB-CD1 3.73Å; F186-I213 HydrophobicContact CB-CG2 3.98Å; F186-I213 HydrophobicContact CD1-CG2 3.93Å; F186-I213 HydrophobicContact CD2-CG2 4.34Å; F186-I213 HydrophobicContact CG-CG2 3.81Å
187	Q	97.4	Very high	92.9	Very high	60 Å²	60	52 Å²	52	28%	0.28	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	111.9	171	-61.8	-58.6	-48.8	0	0	108.5	I121 N122 Y123 V125	I121-Q187 HydrophobicContact CG2-CB 3.61Å; N122-Q187 CarbonylContact C-O 3.59Å; N122-Q187 WeakPolarHBondContact CA-O 3.25Å; N122-Q187 PolarHBondContact N-O 2.78Å; Y123-Q187 HydrophobicContact CD2-CB 4.26Å; Y123-Q187 HydrophobicContact CD2-CG 4.48Å; Y123-Q187 HydrophobicContact CE1-CB 4.43Å; Y123-Q187 HydrophobicContact CE2-CB 4.04Å; Y123-Q187 HydrophobicContact CE2-CG 3.94Å; Y123-Q187 PolarHBondContact N-O 2.81Å; Y123-Q187 PolarHBondContact O-N 2.91Å; V125-Q187 HydrophobicContact CG1-CG 3.94Å
188	S	98.2	Very high	92.2	Very high	7 Å²	7	55.3 Å²	55.3	5%	0.049	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	107.6	178.4	-174.8	0	0	0	0	111.7	I121 N122 F172 Y174 V208	I121-S188 CarbonylContact O-C 3.54Å; I121-S188 VanDerWaalsContact O-CA 3.24Å; I121-S188 WeakPolarHBondContact O-CA 3.45Å; N122-S188 PolarHBondContact OD1-OG 2.83Å; F172-S188 VanDerWaalsContact CD2-OG 3.23Å; F172-S188 WeakPolarHBondContact CD2-OG 3.42Å; Y174-S188 WeakPolarHBondContact OH-CB 3.46Å; Y174-S188 PolarHBondContact OH-OG 2.71Å; S188-V208 PolarHBondContact O-N 2.8Å; S188-V208 WeakPolarHBondContact OG-CG2 3.41Å
189	K	97.2	Very high	91.4	Very high	39 Å²	39	57.4 Å²	57.4	17%	0.17	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	159.1	-178.3	61.7	-172.6	177	-179.4	0	112.2	I121 V191 E205 I206 P207	I121-K189 HydrophobicContact CB-CG 3.76Å; I121-K189 HydrophobicContact CD1-CD 4.14Å; I121-K189 HydrophobicContact CD1-CG 3.78Å; I121-K189 HydrophobicContact CG1-CG 4.28Å; I121-K189 HydrophobicContact CG2-CG 4.12Å; I121-K189 PolarHBondContact N-O 3.47Å; I121-K189 PolarHBondContact O-N 2.63Å; I121-K189 VanDerWaalsContact O-O 3.08Å; K189-V191 HydrophobicContact CD-CG2 4.33Å; K189-V191 HydrophobicContact CG-CG2 4.2Å; K189-E205 WeakPolarHBondContact CD-OE2 3.36Å; K189-E205 IonicContact NZ-OE1 3.6Å; K189-E205 IonicContact NZ-OE2 2.74Å; K189-E205 PolarHBondContact NZ-OE2 2.82Å; K189-I206 VanDerWaalsContact CA-O 3.27Å; K189-I206 WeakPolarHBondContact CA-O 3.45Å; K189-I206 WeakPolarHBondContact CB-O 3.41Å; K189-P207 HydrophobicContact CB-CB 4.3Å
190	I	96.3	Very high	90.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	140.8	162.9	62.9	167.3	0	0	0	109.7	Y56 I170 F172 E205 I206 F221	Y56-I190 HydrophobicContact CD1-CD1 3.76Å; Y56-I190 HydrophobicContact CD2-CD1 4.27Å; Y56-I190 HydrophobicContact CE1-CD1 3.75Å; Y56-I190 HydrophobicContact CE2-CD1 4.29Å; Y56-I190 HydrophobicContact CG-CD1 4.01Å; I170-I190 HydrophobicContact CD1-CG2 4.15Å; I170-I190 HydrophobicContact CG2-CG2 4.22Å; F172-I190 HydrophobicContact CE2-CG2 4.1Å; F172-I190 HydrophobicContact CZ-CG2 3.74Å; I190-E205 WeakPolarHBondContact O-CA 3.3Å; I190-I206 HydrophobicContact CD1-CB 4.45Å; I190-I206 HydrophobicContact CD1-CD1 3.97Å; I190-I206 HydrophobicContact CG1-CB 3.74Å; I190-I206 HydrophobicContact CG1-CD1 4.1Å; I190-I206 HydrophobicContact CG1-CG1 4.22Å; I190-I206 PolarHBondContact N-O 3.27Å; I190-I206 VanDerWaalsContact N-O 3.12Å; I190-I206 PolarHBondContact O-N 2.85Å; I190-F221 HydrophobicContact CD1-CB 3.81Å; I190-F221 HydrophobicContact CD1-CD1 3.52Å; I190-F221 HydrophobicContact CD1-CE1 4.16Å; I190-F221 HydrophobicContact CD1-CG 3.72Å; I190-F221 HydrophobicContact CG1-CD1 3.8Å; I190-F221 HydrophobicContact CG1-CE1 3.9Å; I190-F221 HydrophobicContact CG1-CG 4.23Å; I190-F221 HydrophobicContact CG1-CZ 4.44Å; I190-F221 HydrophobicContact CG2-CD2 4.02Å; I190-F221 HydrophobicContact CG2-CE1 4.5Å; I190-F221 HydrophobicContact CG2-CE2 4.03Å; I190-F221 HydrophobicContact CG2-CG 4.27Å; I190-F221 HydrophobicContact CG2-CZ 4.26Å
191	V	94.8	Very high	90.4	Very high	11 Å²	11	52 Å²	52	7%	0.067	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	120.1	-178	-178	0	0	0	0	109.4	Y91 G118 T119 I121 K189 F203 F204 E205	Y91-V191 VanDerWaalsContact OH-C 3.25Å; Y91-V191 PolarHBondContact OH-N 3.03Å; Y91-V191 PolarHBondContact OH-O 3.01Å; G118-V191 CarbonylContact C-O 3.55Å; G118-V191 WeakPolarHBondContact CA-O 3.41Å; T119-V191 PolarHBondContact N-O 3.25Å; T119-V191 PolarHBondContact O-N 2.84Å; I121-V191 HydrophobicContact CD1-CG2 3.83Å; K189-V191 HydrophobicContact CD-CG2 4.33Å; K189-V191 HydrophobicContact CG-CG2 4.2Å; V191-F203 HydrophobicContact CG1-CB 4.38Å; V191-F203 HydrophobicContact CG1-CD1 4.23Å; V191-F204 CarbonylContact C-O 3.54Å; V191-F204 VanDerWaalsContact CA-O 3.25Å; V191-F204 WeakPolarHBondContact CA-O 3.49Å; V191-E205 HydrophobicContact CG1-CG 4.34Å; V191-E205 HydrophobicContact CG2-CG 4.05Å
192	G	91.5	Very high	90	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	148.6	174	0	0	0	0	0	113.5	F203 F204	G192-F203 CarbonylContact O-C 3.56Å; G192-F203 WeakPolarHBondContact O-CA 3.45Å; G192-F204 VanDerWaalsContact CA-CZ 3.46Å; G192-F204 PolarHBondContact N-O 3.23Å; G192-F204 PolarHBondContact O-N 3.35Å
193	S	89.5	Confident	89.7	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.007	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	126	-179.8	152.7	0	0	0	0	111.5	K94 Y116 I117 Q201	K94-S193 PolarHBondContact NZ-O 3.42Å; Y116-S193 PolarHBondContact O-OG 3.02Å; I117-S193 PolarHBondContact O-N 3.1Å; S193-Q201 PolarHBondContact OG-NE2 3.24Å
194	I	84	Confident	89.4	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	129.9	-179.1	-63.1	172.3	0	0	0	108.4	N27 I29 Y54 Q201 K202 F204	N27-I194 HydrophobicContact CB-CD1 4.48Å; N27-I194 HydrophobicContact CB-CG2 3.79Å; N27-I194 VanDerWaalsContact ND2-CG2 3.35Å; N27-I194 WeakPolarHBondContact ND2-CG2 3.42Å; I29-I194 HydrophobicContact CB-CD1 3.93Å; I29-I194 HydrophobicContact CD1-CD1 3.74Å; I29-I194 HydrophobicContact CG1-CD1 4.31Å; I29-I194 HydrophobicContact CG2-CD1 4.15Å; Y54-I194 HydrophobicContact CE1-CD1 4.01Å; I194-Q201 CarbonylContact O-C 3.45Å; I194-Q201 WeakPolarHBondContact O-CA 3.03Å; I194-K202 PolarHBondContact N-O 2.82Å; I194-K202 PolarHBondContact O-N 3.06Å; I194-F204 HydrophobicContact CD1-CD1 3.99Å; I194-F204 HydrophobicContact CD1-CE1 4.26Å; I194-F204 HydrophobicContact CG1-CD1 4.46Å; I194-F204 HydrophobicContact CG1-CE1 4.46Å
195	R	82.1	Confident	89.4	Confident	110 Å²	110	46.6 Å²	46.6	42%	0.415	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	123	169.2	-71.8	-175.4	177.1	179.7	-1.2	109	Y115	Y115-R195 VanDerWaalsContact CE1-NH1 3.33Å; Y115-R195 VanDerWaalsContact CG-CZ 3.46Å
196	C	82.1	Confident	89.3	Confident	12 Å²	12	44.1 Å²	44.1	8%	0.081	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-98.2	172.9	173.5	-58.2	0	0	0	0	110.3	C30 G199 L200	C30-C196 WeakPolarHBondContact CA-SG 3.42Å; C30-C196 HydrophobicContact CB-CB 3.78Å; C30-C196 WeakPolarHBondContact CB-SG 3.07Å; C30-C196 WeakPolarHBondContact SG-CA 3.1Å; C30-C196 WeakPolarHBondContact SG-CB 3.42Å; C30-C196 CovalentContact SG-SG 2.04Å; C30-C196 PolarHBondContact SG-SG 2.98Å; C196-G199 PolarHBondContact O-N 3.33Å; C196-L200 HydrophobicContact CB-CB 4.32Å; C196-L200 PolarHBondContact N-O 2.96Å
197	E	79.3	Confident	89.3	Confident	129 Å²	129	46.9 Å²	46.9	60%	0.603	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-55.8	148.7	174	-167.4	169.1	-171.1	0	0	111.7	G199	E197-G199 PolarHBondContact O-N 2.82Å
198	G	82.8	Confident	89.3	Confident	82 Å²	82	44.3 Å²	44.3	85%	0.845	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	74.8	6.9	-174.8	0	0	0	0	0	114.9	L200	G198-L200 VanDerWaalsContact C-N 3.28Å; G198-L200 PolarHBondContact O-N 2.99Å
199	G	79.8	Confident	89.3	Confident	66 Å²	66	45.5 Å²	45.5	68%	0.68	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	81.5	5.4	179.8	0	0	0	0	0	114.1	C196 E197 Q201	C196-G199 PolarHBondContact O-N 3.33Å; E197-G199 PolarHBondContact O-N 2.82Å; G199-Q201 PolarHBondContact O-N 2.87Å
200	L	83.2	Confident	89.2	Confident	117 Å²	117	45.3 Å²	45.3	61%	0.613	27%	0.266	S	S	*	.			trans	-64.5	130.7	176.7	-69.1	174.3	0	0	0	110.7	C196 G198	C196-L200 HydrophobicContact CB-CB 4.32Å; C196-L200 PolarHBondContact N-O 2.96Å; G198-L200 VanDerWaalsContact C-N 3.28Å; G198-L200 PolarHBondContact O-N 2.99Å
201	Q	86.1	Confident	89.2	Confident	81 Å²	81	50.3 Å²	50.3	38%	0.379	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	124.2	175.6	-166	172.3	-12.9	0	0	109.5	S193 I194 G199 F203	S193-Q201 PolarHBondContact OG-NE2 3.24Å; I194-Q201 CarbonylContact O-C 3.45Å; I194-Q201 WeakPolarHBondContact O-CA 3.03Å; G199-Q201 PolarHBondContact O-N 2.87Å; Q201-F203 HydrophobicContact CB-CE2 4.37Å; Q201-F203 HydrophobicContact CB-CZ 4.49Å; Q201-F203 HydrophobicContact CG-CE1 4.32Å; Q201-F203 HydrophobicContact CG-CE2 3.97Å; Q201-F203 HydrophobicContact CG-CZ 3.73Å
202	K	87.3	Confident	89.3	Confident	41 Å²	41	50.2 Å²	50.2	18%	0.178	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	147.7	172.9	-66.6	-168	-176.4	-173.3	0	109.4	I29 C30 I194	I29-K202 HydrophobicContact CG2-CB 3.85Å; I29-K202 HydrophobicContact CG2-CD 3.86Å; I29-K202 VanDerWaalsContact O-CD 3.23Å; I29-K202 WeakPolarHBondContact O-CD 3.05Å; I29-K202 PolarHBondContact O-NZ 2.78Å; C30-K202 VanDerWaalsContact C-NZ 3.32Å; C30-K202 PolarHBondContact O-NZ 2.97Å; I194-K202 PolarHBondContact N-O 2.82Å; I194-K202 PolarHBondContact O-N 3.06Å
203	F	89.2	Confident	89.6	Confident	72 Å²	72	50.8 Å²	50.8	32%	0.316	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	153.9	179.3	-57	-96.1	0	0	0	109.7	R36 Y116 V191 G192 Q201	R36-F203 WeakPolarHBondContact CD-O 3.32Å; R36-F203 VanDerWaalsContact CG-O 3.24Å; R36-F203 WeakPolarHBondContact CG-O 3.25Å; R36-F203 PolarHBondContact NE-O 2.81Å; Y116-F203 HydrophobicContact CD1-CE1 4.46Å; Y116-F203 HydrophobicContact CE1-CD1 4.41Å; Y116-F203 AromaticContact CE1-CE1 3.75Å; Y116-F203 HydrophobicContact CE1-CE1 3.75Å; V191-F203 HydrophobicContact CG1-CB 4.38Å; V191-F203 HydrophobicContact CG1-CD1 4.23Å; G192-F203 CarbonylContact O-C 3.56Å; G192-F203 WeakPolarHBondContact O-CA 3.45Å; Q201-F203 HydrophobicContact CB-CE2 4.37Å; Q201-F203 HydrophobicContact CB-CZ 4.49Å; Q201-F203 HydrophobicContact CG-CE1 4.32Å; Q201-F203 HydrophobicContact CG-CE2 3.97Å; Q201-F203 HydrophobicContact CG-CZ 3.73Å
204	F	89.2	Confident	90	Very high	0 Å²	0	55 Å²	55	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	151.6	160.9	66.3	-88.1	0	0	0	109.5	I29 R36 Y54 Y56 H92 V191 G192 I194 I206	I29-F204 HydrophobicContact CD1-CB 3.77Å; I29-F204 HydrophobicContact CD1-CD1 3.98Å; I29-F204 HydrophobicContact CD1-CG 4.15Å; R36-F204 HydrophobicContact CG-CB 3.99Å; Y54-F204 HydrophobicContact CD1-CD1 4.29Å; Y54-F204 HydrophobicContact CD1-CG 4.44Å; Y56-F204 HydrophobicContact CD2-CE2 4.2Å; Y56-F204 HydrophobicContact CD2-CZ 4.41Å; Y56-F204 HydrophobicContact CE2-CE2 4.19Å; Y56-F204 HydrophobicContact CE2-CZ 4.04Å; H92-F204 HydrophobicContact CB-CZ 4.22Å; H92-F204 AromaticContact CD2-CE1 3.1Å; H92-F204 WeakPolarHBondContact CD2-CE1 3.38Å; H92-F204 AromaticContact CD2-CZ 3.22Å; H92-F204 WeakPolarHBondContact CD2-CZ 2.83Å; H92-F204 AromaticContact CG-CE1 3.85Å; H92-F204 AromaticContact CG-CZ 3.94Å; H92-F204 AromaticContact NE2-CE1 3.4Å; H92-F204 WeakPolarHBondContact NE2-CE1 3.46Å; V191-F204 CarbonylContact C-O 3.54Å; V191-F204 VanDerWaalsContact CA-O 3.25Å; V191-F204 WeakPolarHBondContact CA-O 3.49Å; G192-F204 VanDerWaalsContact CA-CZ 3.46Å; G192-F204 PolarHBondContact N-O 3.23Å; G192-F204 PolarHBondContact O-N 3.35Å; I194-F204 HydrophobicContact CD1-CD1 3.99Å; I194-F204 HydrophobicContact CD1-CE1 4.26Å; I194-F204 HydrophobicContact CG1-CD1 4.46Å; I194-F204 HydrophobicContact CG1-CE1 4.46Å; F204-I206 HydrophobicContact CD2-CD1 4.03Å; F204-I206 HydrophobicContact CD2-CG1 3.91Å; F204-I206 HydrophobicContact CE2-CD1 3.79Å; F204-I206 HydrophobicContact CE2-CG1 4.11Å
205	E	93.4	Very high	90.7	Very high	84 Å²	84	57.8 Å²	57.8	39%	0.393	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	139	-179.2	-54.9	-166.7	177.4	0	0	108.9	K189 I190 V191	K189-E205 WeakPolarHBondContact CD-OE2 3.36Å; K189-E205 IonicContact NZ-OE1 3.6Å; K189-E205 IonicContact NZ-OE2 2.74Å; K189-E205 PolarHBondContact NZ-OE2 2.82Å; I190-E205 WeakPolarHBondContact O-CA 3.3Å; V191-E205 HydrophobicContact CG1-CG 4.34Å; V191-E205 HydrophobicContact CG2-CG 4.05Å
206	I	95.3	Very high	91.4	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.01	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	90.1	176.4	-53.3	177.8	0	0	0	106.9	H53 Y56 M58 K189 I190 F204 F221	H53-I206 HydrophobicContact CB-CD1 3.79Å; H53-I206 HydrophobicContact CB-CG1 4.03Å; H53-I206 HydrophobicContact CB-CG2 3.93Å; H53-I206 VanDerWaalsContact CG-CG2 3.48Å; Y56-I206 HydrophobicContact CD2-CD1 3.78Å; Y56-I206 HydrophobicContact CG-CD1 3.85Å; M58-I206 HydrophobicContact CE-CG2 3.45Å; M58-I206 VanDerWaalsContact CE-CG2 3.45Å; K189-I206 VanDerWaalsContact CA-O 3.27Å; K189-I206 WeakPolarHBondContact CA-O 3.45Å; K189-I206 WeakPolarHBondContact CB-O 3.41Å; I190-I206 HydrophobicContact CD1-CB 4.45Å; I190-I206 HydrophobicContact CD1-CD1 3.97Å; I190-I206 HydrophobicContact CG1-CB 3.74Å; I190-I206 HydrophobicContact CG1-CD1 4.1Å; I190-I206 HydrophobicContact CG1-CG1 4.22Å; I190-I206 PolarHBondContact N-O 3.27Å; I190-I206 VanDerWaalsContact N-O 3.12Å; I190-I206 PolarHBondContact O-N 2.85Å; F204-I206 HydrophobicContact CD2-CD1 4.03Å; F204-I206 HydrophobicContact CD2-CG1 3.91Å; F204-I206 HydrophobicContact CE2-CD1 3.79Å; F204-I206 HydrophobicContact CE2-CG1 4.11Å; I206-F221 HydrophobicContact CB-CE1 4.28Å; I206-F221 HydrophobicContact CG2-CD1 4.15Å; I206-F221 HydrophobicContact CG2-CE1 3.73Å
207	P	96.6	Very high	92.2	Very high	70 Å²	70	52.5 Å²	52.5	46%	0.455	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	141.7	-179.8	31.3	-34.3	0	0	0	111.6	M58 K189	M58-P207 WeakPolarHBondContact CE-O 3.4Å; K189-P207 HydrophobicContact CB-CB 4.3Å
208	V	98	Very high	93.2	Very high	7 Å²	7	47.2 Å²	47.2	4%	0.042	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-74.9	124.5	160.9	-175.3	0	0	0	0	107.2	I60 F172 Y174 S188 A210 W212 I213 V219 F221	I60-V208 HydrophobicContact CD1-CG1 4.21Å; F172-V208 HydrophobicContact CD2-CG2 4.2Å; Y174-V208 WeakPolarHBondContact OH-CG1 3.24Å; S188-V208 PolarHBondContact O-N 2.8Å; S188-V208 WeakPolarHBondContact OG-CG2 3.41Å; V208-A210 PolarHBondContact O-N 2.87Å; V208-W212 HydrophobicContact CG1-CB 4.29Å; V208-I213 HydrophobicContact CG1-CG1 4.24Å; V208-V219 HydrophobicContact CG1-CG2 3.81Å; V208-V219 HydrophobicContact CG2-CB 4.41Å; V208-V219 HydrophobicContact CG2-CG1 3.88Å; V208-V219 HydrophobicContact CG2-CG2 4.14Å; V208-F221 HydrophobicContact CG2-CE2 4.36Å; V208-F221 HydrophobicContact CG2-CZ 3.72Å
209	P	97	Very high	93.9	Very high	32 Å²	32	43.3 Å²	43.3	21%	0.208	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-62.2	132.1	177.8	-18.9	29.4	0	0	0	110.6	K211 W212	P209-K211 PolarHBondContact O-N 2.77Å; P209-K211 VanDerWaalsContact O-N 3.09Å; P209-W212 WeakPolarHBondContact O-CB 3.34Å; P209-W212 PolarHBondContact O-N 2.93Å
210	A	96.2	Very high	94.8	Very high	35 Å²	35	40.9 Å²	40.9	29%	0.289	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-56.8	-34.1	-168.5	0	0	0	0	0	113.9	E183 V208 W212 I213	E183-A210 HydrophobicContact CB-CB 3.89Å; E183-A210 HydrophobicContact CG-CB 4.27Å; E183-A210 WeakPolarHBondContact OE2-CB 3.38Å; V208-A210 PolarHBondContact O-N 2.87Å; A210-W212 PolarHBondContact O-N 3.18Å; A210-I213 WeakPolarHBondContact O-CB 3.3Å; A210-I213 PolarHBondContact O-N 2.84Å
211	K	95.6	Very high	95.4	Very high	105 Å²	105	35.3 Å²	35.3	46%	0.457	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-56.1	-18.7	174.6	74.3	178.4	-172.9	175.4	0	115.4	E44 P209 K214	E44-K211 WeakPolarHBondContact OE1-CE 3.39Å; E44-K211 IonicContact OE1-NZ 3.77Å; E44-K211 PolarHBondContact OE1-NZ 2.89Å; P209-K211 PolarHBondContact O-N 2.77Å; P209-K211 VanDerWaalsContact O-N 3.09Å; K211-K214 WeakPolarHBondContact O-CD 3.44Å; K211-K214 WeakPolarHBondContact O-CE 3.48Å; K211-K214 PolarHBondContact O-NZ 2.89Å
212	W	97.8	Very high	95.6	Very high	9 Å²	9	33.6 Å²	33.6	3%	0.034	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-96.7	-8.1	177.5	-70.8	97.4	0	0	0	113.5	E44 N45 R49 I60 R62 V208 P209 A210 K214 T217	E44-W212 HydrophobicContact CG-CZ2 4.04Å; N45-W212 WeakPolarHBondContact O-CH2 3.46Å; N45-W212 WeakPolarHBondContact O-CZ2 3.43Å; R49-W212 HydrophobicContact CB-CH2 4.07Å; R49-W212 HydrophobicContact CB-CZ2 3.67Å; I60-W212 HydrophobicContact CB-CD2 4.33Å; I60-W212 HydrophobicContact CB-CE3 4.1Å; I60-W212 HydrophobicContact CB-CZ3 4.46Å; I60-W212 HydrophobicContact CD1-CB 3.96Å; I60-W212 HydrophobicContact CD1-CD2 4.08Å; I60-W212 HydrophobicContact CD1-CG 3.72Å; I60-W212 HydrophobicContact CG2-CB 4.08Å; I60-W212 HydrophobicContact CG2-CD2 3.75Å; I60-W212 HydrophobicContact CG2-CE3 3.3Å; I60-W212 HydrophobicContact CG2-CG 4.09Å; I60-W212 HydrophobicContact CG2-CZ3 3.96Å; R62-W212 HydrophobicContact CG-CE3 3.94Å; R62-W212 HydrophobicContact CG-CZ3 3.75Å; V208-W212 HydrophobicContact CG1-CB 4.29Å; P209-W212 WeakPolarHBondContact O-CB 3.34Å; P209-W212 PolarHBondContact O-N 2.93Å; A210-W212 PolarHBondContact O-N 3.18Å; W212-K214 VanDerWaalsContact C-N 3.27Å; W212-K214 PolarHBondContact O-N 2.84Å; W212-T217 HydrophobicContact CE3-CG2 4.41Å; W212-T217 WeakPolarHBondContact O-CB 3.08Å; W212-T217 VanDerWaalsContact O-CG2 3.26Å; W212-T217 WeakPolarHBondContact O-CG2 3Å; W212-T217 PolarHBondContact O-OG1 2.58Å
213	I	97.9	Very high	95.5	Very high	11 Å²	11	32.8 Å²	32.8	6%	0.056	18%	0.179	C	C	.	.			trans	-79.4	81.3	176.1	-54.4	179.7	0	0	0	107.7	Y174 I177 F186 V208 A210	Y174-I213 HydrophobicContact CD1-CG2 3.83Å; Y174-I213 HydrophobicContact CE1-CB 4.45Å; Y174-I213 HydrophobicContact CE1-CG1 4.33Å; Y174-I213 HydrophobicContact CE1-CG2 3.73Å; Y174-I213 HydrophobicContact CE2-CB 4.43Å; Y174-I213 HydrophobicContact CE2-CG1 4.28Å; Y174-I213 HydrophobicContact CE2-CG2 4.44Å; Y174-I213 HydrophobicContact CG-CG2 4.24Å; I177-I213 HydrophobicContact CD1-CG2 4.31Å; I177-I213 HydrophobicContact CG1-CG2 4.47Å; F186-I213 HydrophobicContact CB-CD1 3.73Å; F186-I213 HydrophobicContact CB-CG2 3.98Å; F186-I213 HydrophobicContact CD1-CG2 3.93Å; F186-I213 HydrophobicContact CD2-CG2 4.34Å; F186-I213 HydrophobicContact CG-CG2 3.81Å; V208-I213 HydrophobicContact CG1-CG1 4.24Å; A210-I213 WeakPolarHBondContact O-CB 3.3Å; A210-I213 PolarHBondContact O-N 2.84Å
214	K	97.5	Very high	94.8	Very high	90 Å²	90	31.8 Å²	31.8	39%	0.391	18%	0.176	S	C	.	.			trans	-139.8	149.8	-176.2	-67.7	178.3	176.6	165.1	0	110.2	K211 W212 G216 T217	K211-K214 WeakPolarHBondContact O-CD 3.44Å; K211-K214 WeakPolarHBondContact O-CE 3.48Å; K211-K214 PolarHBondContact O-NZ 2.89Å; W212-K214 VanDerWaalsContact C-N 3.27Å; W212-K214 PolarHBondContact O-N 2.84Å; K214-G216 PolarHBondContact O-N 3.14Å; K214-T217 WeakPolarHBondContact O-CB 3.23Å; K214-T217 PolarHBondContact O-N 2.82Å; K214-T217 VanDerWaalsContact O-N 3.08Å; K214-T217 PolarHBondContact O-OG1 2.82Å
215	S	98.1	Very high	93.4	Very high	58 Å²	58	33.8 Å²	33.8	41%	0.406	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45.9	132.9	176.3	-56.1	0	0	0	0	112.3	Y174 I177 T217	Y174-S215 CarbonylContact O-C 3.53Å; Y174-S215 WeakPolarHBondContact O-CA 3.34Å; I177-S215 PolarHBondContact N-OG 3.31Å; I177-S215 PolarHBondContact O-OG 2.81Å; S215-T217 VanDerWaalsContact C-N 3.33Å
216	G	98.1	Very high	91.5	Very high	12 Å²	12	38.6 Å²	38.6	12%	0.124	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	20.9	-180	0	0	0	0	0	114.4	R62 H63 Q64 Y174 K214	R62-G216 CarbonylContact C-O 3.58Å; H63-G216 PolarHBondContact N-O 2.82Å; Q64-G216 PolarHBondContact N-O 3.18Å; Y174-G216 PolarHBondContact O-N 2.81Å; K214-G216 PolarHBondContact O-N 3.14Å
217	T	98.6	Very high	89.4	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	128	175.1	-51.5	0	0	0	0	110.6	I60 Q61 R62 Y173 Y174 W212 K214 S215	I60-T217 HydrophobicContact CG2-CG2 3.38Å; Q61-T217 WeakPolarHBondContact O-CA 3.46Å; R62-T217 HydrophobicContact CG-CG2 4.26Å; Y173-T217 WeakPolarHBondContact CD2-O 3.34Å; Y174-T217 HydrophobicContact CD2-CG2 4.35Å; Y174-T217 WeakPolarHBondContact CD2-O 3.23Å; Y174-T217 PolarHBondContact N-O 2.7Å; Y174-T217 VanDerWaalsContact N-O 3.08Å; W212-T217 HydrophobicContact CE3-CG2 4.41Å; W212-T217 WeakPolarHBondContact O-CB 3.08Å; W212-T217 VanDerWaalsContact O-CG2 3.26Å; W212-T217 WeakPolarHBondContact O-CG2 3Å; W212-T217 PolarHBondContact O-OG1 2.58Å; K214-T217 WeakPolarHBondContact O-CB 3.23Å; K214-T217 PolarHBondContact O-N 2.82Å; K214-T217 VanDerWaalsContact O-N 3.08Å; K214-T217 PolarHBondContact O-OG1 2.82Å; S215-T217 VanDerWaalsContact C-N 3.33Å
218	L	98.7	Very high	87.3	Confident	18 Å²	18	37.2 Å²	37.2	9%	0.094	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	124.5	174.3	178.6	64.8	0	0	0	109.1	I60 Q61 Q64 P67 Y173 E220	I60-L218 CarbonylContact C-O 3.57Å; I60-L218 WeakPolarHBondContact CA-O 3.41Å; Q61-L218 PolarHBondContact N-O 3.01Å; Q61-L218 PolarHBondContact O-N 2.83Å; Q64-L218 HydrophobicContact CB-CB 3.99Å; Q64-L218 HydrophobicContact CG-CB 3.89Å; P67-L218 HydrophobicContact CG-CD1 4.38Å; Y173-L218 HydrophobicContact CD2-CB 4.1Å; Y173-L218 HydrophobicContact CD2-CD1 4.26Å; L218-E220 HydrophobicContact CD1-CG 4.39Å; L218-E220 HydrophobicContact CD2-CG 4.37Å; L218-E220 HydrophobicContact CG-CG 4.15Å
219	V	98.7	Very high	85	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	132.8	171.8	-176.2	0	0	0	0	108.3	M58 R59 I60 S171 F172 Y174 V208 F221	M58-V219 HydrophobicContact CG-CG1 3.8Å; M58-V219 HydrophobicContact SD-CG1 4.21Å; R59-V219 CarbonylContact O-C 3.58Å; R59-V219 WeakPolarHBondContact O-CA 3.3Å; I60-V219 HydrophobicContact CG1-CG1 4.26Å; I60-V219 HydrophobicContact CG1-CG2 4.18Å; I60-V219 HydrophobicContact CG2-CG2 4.07Å; S171-V219 CarbonylContact C-O 3.55Å; S171-V219 WeakPolarHBondContact CA-O 2.99Å; F172-V219 HydrophobicContact CB-CB 4.3Å; F172-V219 PolarHBondContact N-O 3.08Å; F172-V219 PolarHBondContact O-N 3.28Å; Y174-V219 HydrophobicContact CE2-CG2 3.77Å; V208-V219 HydrophobicContact CG1-CG2 3.81Å; V208-V219 HydrophobicContact CG2-CB 4.41Å; V208-V219 HydrophobicContact CG2-CG1 3.88Å; V208-V219 HydrophobicContact CG2-CG2 4.14Å; V219-F221 HydrophobicContact CB-CE2 4.49Å; V219-F221 HydrophobicContact CG1-CD2 4.22Å; V219-F221 HydrophobicContact CG1-CE1 4.5Å; V219-F221 HydrophobicContact CG1-CE2 3.58Å; V219-F221 HydrophobicContact CG1-CZ 3.76Å
220	E	98	Very high	82.8	Confident	14 Å²	14	44.9 Å²	44.9	7%	0.065	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	127.2	176.3	-70.7	170.5	116.1	0	0	110.8	M58 R59 K169 I170 L218	M58-E220 CarbonylContact C-O 3.51Å; M58-E220 WeakPolarHBondContact CA-O 3.34Å; R59-E220 IonicContact CZ-OE2 2.79Å; R59-E220 PolarHBondContact N-O 2.84Å; R59-E220 IonicContact NE-OE2 2.8Å; R59-E220 PolarHBondContact NE-OE2 3.49Å; R59-E220 IonicContact NH2-OE1 2.6Å; R59-E220 IonicContact NH2-OE2 3.52Å; R59-E220 PolarHBondContact NH2-OE2 2.95Å; R59-E220 PolarHBondContact O-N 2.78Å; K169-E220 HydrophobicContact CD-CB 4.3Å; K169-E220 HydrophobicContact CD-CG 4.27Å; K169-E220 WeakPolarHBondContact CE-OE1 3.11Å; K169-E220 HydrophobicContact CG-CB 4.49Å; K169-E220 IonicContact NZ-OE1 3.06Å; K169-E220 PolarHBondContact NZ-OE1 2.72Å; I170-E220 CarbonylContact O-C 3.53Å; I170-E220 WeakPolarHBondContact O-CA 3.36Å; L218-E220 HydrophobicContact CD1-CG 4.39Å; L218-E220 HydrophobicContact CD2-CG 4.37Å; L218-E220 HydrophobicContact CG-CG 4.15Å
221	F	95.7	Very high	80.5	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	126.3	172.2	-54.1	-95.3	0	0	0	108.9	Y56 S57 M58 K169 I170 F172 I190 I206 V208 V219	Y56-F221 HydrophobicContact CD1-CB 3.96Å; Y56-F221 HydrophobicContact CE1-CB 4.37Å; S57-F221 WeakPolarHBondContact O-CA 3.07Å; M58-F221 HydrophobicContact CB-CD1 4.26Å; M58-F221 HydrophobicContact CB-CE1 4.39Å; M58-F221 HydrophobicContact CE-CD1 4.37Å; M58-F221 HydrophobicContact CE-CE1 3.49Å; M58-F221 VanDerWaalsContact CE-CE1 3.49Å; M58-F221 HydrophobicContact CE-CZ 4.11Å; M58-F221 HydrophobicContact CG-CD1 4.12Å; M58-F221 HydrophobicContact CG-CE1 3.9Å; M58-F221 HydrophobicContact CG-CZ 4.4Å; M58-F221 HydrophobicContact SD-CE1 4.32Å; K169-F221 WeakPolarHBondContact CA-O 3.36Å; K169-F221 WeakPolarHBondContact CG-O 3.38Å; I170-F221 HydrophobicContact CB-CB 4.27Å; I170-F221 HydrophobicContact CB-CD2 4.33Å; I170-F221 HydrophobicContact CG2-CD2 4.28Å; I170-F221 PolarHBondContact N-O 2.93Å; I170-F221 PolarHBondContact O-N 2.88Å; F172-F221 AromaticContact CD2-CE2 3.64Å; F172-F221 HydrophobicContact CD2-CE2 3.64Å; F172-F221 HydrophobicContact CD2-CZ 4.25Å; F172-F221 AromaticContact CE2-CE2 3.7Å; F172-F221 HydrophobicContact CE2-CE2 3.7Å; F172-F221 HydrophobicContact CE2-CZ 4.16Å; F172-F221 HydrophobicContact CG-CE2 4.28Å; F172-F221 HydrophobicContact CZ-CE2 4.37Å; I190-F221 HydrophobicContact CD1-CB 3.81Å; I190-F221 HydrophobicContact CD1-CD1 3.52Å; I190-F221 HydrophobicContact CD1-CE1 4.16Å; I190-F221 HydrophobicContact CD1-CG 3.72Å; I190-F221 HydrophobicContact CG1-CD1 3.8Å; I190-F221 HydrophobicContact CG1-CE1 3.9Å; I190-F221 HydrophobicContact CG1-CG 4.23Å; I190-F221 HydrophobicContact CG1-CZ 4.44Å; I190-F221 HydrophobicContact CG2-CD2 4.02Å; I190-F221 HydrophobicContact CG2-CE1 4.5Å; I190-F221 HydrophobicContact CG2-CE2 4.03Å; I190-F221 HydrophobicContact CG2-CG 4.27Å; I190-F221 HydrophobicContact CG2-CZ 4.26Å; I206-F221 HydrophobicContact CB-CE1 4.28Å; I206-F221 HydrophobicContact CG2-CD1 4.15Å; I206-F221 HydrophobicContact CG2-CE1 3.73Å; V208-F221 HydrophobicContact CG2-CE2 4.36Å; V208-F221 HydrophobicContact CG2-CZ 3.72Å; V219-F221 HydrophobicContact CB-CE2 4.49Å; V219-F221 HydrophobicContact CG1-CD2 4.22Å; V219-F221 HydrophobicContact CG1-CE1 4.5Å; V219-F221 HydrophobicContact CG1-CE2 3.58Å; V219-F221 HydrophobicContact CG1-CZ 3.76Å
222	Q	91.6	Very high	78.3	Confident	45 Å²	45	46.7 Å²	46.7	21%	0.21	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	124	176	-176.3	66	62.8	0	0	108.7	Y56 S57 N167 M224	Y56-Q222 WeakPolarHBondContact CA-O 3.39Å; S57-Q222 PolarHBondContact N-O 2.86Å; S57-Q222 PolarHBondContact O-N 3.49Å; S57-Q222 PolarHBondContact OG-O 2.6Å; N167-Q222 PolarHBondContact ND2-OE1 2.79Å; Q222-M224 PolarHBondContact O-N 3.2Å
223	A	85.3	Confident	76.4	Confident	24 Å²	24	53.6 Å²	53.6	20%	0.198	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	126.4	172.4	0	0	0	0	0	109.1	E55 Y56 G225	E55-A223 CarbonylContact O-C 3.48Å; E55-A223 WeakPolarHBondContact O-CA 3.32Å; Y56-A223 HydrophobicContact CE1-CB 4.22Å; A223-G225 PolarHBondContact O-N 3.25Å
224	M	73.6	Confident	74.6	Confident	52 Å²	52	55.6 Å²	55.6	26%	0.256	30%	0.299	S	S	.	.			trans	-78.3	113.3	174.7	-67.1	177.7	63.7	0	0	107.1	H52 E55 Q222	H52-M224 HydrophobicContact CB-SD 4.36Å; H52-M224 VanDerWaalsContact CE1-CE 3.45Å; H52-M224 WeakPolarHBondContact CE1-CE 3.19Å; E55-M224 PolarHBondContact O-N 3.03Å; Q222-M224 PolarHBondContact O-N 3.2Å
225	G	60.8	Low	72.8	Confident	42 Å²	42	58.2 Å²	58.2	43%	0.433	31%	0.312	S	S	.	.			trans	-62.6	155.8	172.7	0	0	0	0	0	111	A223 S227	A223-G225 PolarHBondContact O-N 3.25Å; G225-S227 PolarHBondContact O-N 2.96Å
226	E	52	Low	71	Confident	184 Å²	184	58.8 Å²	58.8	86%	0.86	31%	0.31	S	S	*	.	S	Bend	trans	-56.3	-16.6	170.9	-64.9	179.7	173.3	0	0	113	S229	E226-S229 PolarHBondContact O-N 3.17Å; E226-S229 PolarHBondContact O-OG 3.38Å
227	S	50.8	Low	69.3	Low	29 Å²	29	58.3 Å²	58.3	20%	0.203	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-62	-173.2	52.1	0	0	0	0	111.2	G225 S229 A240	G225-S227 PolarHBondContact O-N 2.96Å; S227-S229 PolarHBondContact O-N 3.35Å; S227-A240 WeakPolarHBondContact CB-O 3.42Å; S227-A240 WeakPolarHBondContact O-CB 3.45Å
228	C	53.1	Low	67.5	Low	14 Å²	14	63.7 Å²	63.7	10%	0.095	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	63.8	174.5	-57.7	0	0	0	0	110.4	C247 C256	C228-C247 VanDerWaalsContact CA-SG 3.56Å; C228-C247 HydrophobicContact CB-CB 4.26Å; C228-C247 WeakPolarHBondContact CB-SG 3.42Å; C228-C247 WeakPolarHBondContact SG-CB 3.28Å; C228-C247 CovalentContact SG-SG 2.05Å; C228-C247 PolarHBondContact SG-SG 2.61Å; C228-C256 HydrophobicContact CB-CB 4.35Å; C228-C256 WeakPolarHBondContact CB-SG 3.49Å
229	S	50.3	Low	65.7	Low	49 Å²	49	68.7 Å²	68.7	34%	0.343	36%	0.357	S	S	.	.			trans	-41.7	143.3	-179.8	-84.9	0	0	0	0	112.8	E226 S227 N231	E226-S229 PolarHBondContact O-N 3.17Å; E226-S229 PolarHBondContact O-OG 3.38Å; S227-S229 PolarHBondContact O-N 3.35Å; S229-N231 PolarHBondContact O-N 3.25Å
230	Q	50.9	Low	63.8	Low	152 Å²	152	69.4 Å²	69.4	71%	0.71	36%	0.363	S	S	*	.	S	Bend	trans	-54	-10.3	174.8	-63.3	-170.1	-3.4	0	0	114.2	Y232	Q230-Y232 PolarHBondContact O-N 3.42Å
231	N	48.1	Very low	61.8	Low	106 Å²	106	73.9 Å²	73.9	57%	0.567	38%	0.382	S	S	*	.			trans	-83.8	112.7	179.8	-72.6	-39.5	0	0	0	112.1	S229 K233	S229-N231 PolarHBondContact O-N 3.25Å; N231-K233 VanDerWaalsContact C-N 3.32Å; N231-K233 PolarHBondContact O-N 2.88Å
232	Y	49.1	Very low	59.8	Low	72 Å²	72	77.1 Å²	77.1	28%	0.282	40%	0.402	S	S	.	.			trans	-59.1	-26.9	-177.7	170.8	-122.4	0	0	0	116.4	Q230 S234 E251 K254	Q230-Y232 PolarHBondContact O-N 3.42Å; Y232-S234 PolarHBondContact O-N 2.81Å; Y232-E251 WeakPolarHBondContact OH-CA 3.25Å; Y232-E251 WeakPolarHBondContact OH-CB 3.26Å; Y232-E251 PolarHBondContact OH-O 3.15Å; Y232-K254 WeakPolarHBondContact CB-O 3.43Å; Y232-K254 HydrophobicContact CD1-CB 3.86Å; Y232-K254 HydrophobicContact CD1-CD 4.45Å; Y232-K254 HydrophobicContact CD1-CG 3.97Å; Y232-K254 HydrophobicContact CD2-CB 3.97Å; Y232-K254 HydrophobicContact CE1-CB 4.18Å; Y232-K254 HydrophobicContact CE1-CD 4.48Å; Y232-K254 HydrophobicContact CE1-CG 3.86Å; Y232-K254 VanDerWaalsContact CE2-CA 3.48Å; Y232-K254 HydrophobicContact CE2-CB 4.29Å; Y232-K254 VanDerWaalsContact CG-C 3.5Å; Y232-K254 HydrophobicContact CG-CB 3.74Å; Y232-K254 HydrophobicContact CG-CG 4.34Å
233	K	58.4	Low	57.9	Low	153 Å²	153	81.1 Å²	81.1	67%	0.665	44%	0.435	S	S	*	.			trans	-46.2	114.4	-170.7	-73.3	-172.4	177.8	-177	0	109.4	N231 E235 I236 C237	N231-K233 VanDerWaalsContact C-N 3.32Å; N231-K233 PolarHBondContact O-N 2.88Å; K233-E235 PolarHBondContact O-N 3.15Å; K233-I236 HydrophobicContact CB-CB 4.32Å; K233-I236 HydrophobicContact CB-CD1 3.9Å; K233-I236 HydrophobicContact CB-CG1 3.93Å; K233-I236 HydrophobicContact CD-CD1 4.02Å; K233-I236 HydrophobicContact CG-CD1 4.42Å; K233-I236 WeakPolarHBondContact O-CA 3.38Å; K233-I236 WeakPolarHBondContact O-CB 3.11Å; K233-I236 PolarHBondContact O-N 2.93Å; K233-C237 PolarHBondContact O-N 2.86Å
234	S	60.3	Low	56.2	Low	54 Å²	54	85.5 Å²	85.5	38%	0.378	46%	0.459	S	S	.	.	H	α-helix	trans	-53.4	-37.1	-166.9	53.6	0	0	0	0	112.1	Y232 C237 Q238	Y232-S234 PolarHBondContact O-N 2.81Å; S234-C237 PolarHBondContact O-N 3.47Å; S234-Q238 WeakPolarHBondContact O-CB 3.39Å; S234-Q238 WeakPolarHBondContact O-CG 3.36Å; S234-Q238 PolarHBondContact O-N 3.07Å
235	E	59.5	Low	55.5	Low	144 Å²	144	83.6 Å²	83.6	67%	0.673	45%	0.451	S	S	*	.	H	α-helix	trans	-60.6	-46.5	174.2	-166.3	174.2	-161.8	0	0	112.7	K233 Q238 N239	K233-E235 PolarHBondContact O-N 3.15Å; E235-Q238 PolarHBondContact O-N 3.43Å; E235-N239 VanDerWaalsContact O-CB 3.24Å; E235-N239 WeakPolarHBondContact O-CB 3.13Å; E235-N239 PolarHBondContact O-N 2.84Å; E235-N239 PolarHBondContact O-ND2 2.93Å; E235-N239 VanDerWaalsContact O-ND2 3.1Å
236	I	58.5	Low	55.8	Low	71 Å²	71	88.3 Å²	88.3	36%	0.364	46%	0.459	S	S	.	.	H	α-helix	trans	-64.2	-45.2	175.9	-57.3	-178.3	0	0	0	110.1	K233 Q238 N239 A240	K233-I236 HydrophobicContact CB-CB 4.32Å; K233-I236 HydrophobicContact CB-CD1 3.9Å; K233-I236 HydrophobicContact CB-CG1 3.93Å; K233-I236 HydrophobicContact CD-CD1 4.02Å; K233-I236 HydrophobicContact CG-CD1 4.42Å; K233-I236 WeakPolarHBondContact O-CA 3.38Å; K233-I236 WeakPolarHBondContact O-CB 3.11Å; K233-I236 PolarHBondContact O-N 2.93Å; I236-Q238 VanDerWaalsContact C-N 3.33Å; I236-Q238 PolarHBondContact O-N 3.32Å; I236-N239 PolarHBondContact O-N 2.8Å; I236-A240 VanDerWaalsContact O-CB 3.24Å; I236-A240 WeakPolarHBondContact O-CB 3.5Å; I236-A240 PolarHBondContact O-N 3.18Å
237	C	62.4	Low	56.5	Low	2 Å²	2	80 Å²	80	1%	0.014	42%	0.421	C	S	.	.	H	α-helix	trans	-65.1	-32.1	179.3	158.4	0	0	0	0	113.2	K233 S234 A240 C247 C249 C256	K233-C237 PolarHBondContact O-N 2.86Å; S234-C237 PolarHBondContact O-N 3.47Å; C237-A240 WeakPolarHBondContact O-CB 3.44Å; C237-C247 WeakPolarHBondContact O-CB 3.5Å; C237-C249 HydrophobicContact CB-CB 4.12Å; C237-C249 WeakPolarHBondContact CB-SG 3.11Å; C237-C249 WeakPolarHBondContact SG-CA 3.45Å; C237-C249 WeakPolarHBondContact SG-CB 3.35Å; C237-C249 PolarHBondContact SG-N 3.49Å; C237-C249 VanDerWaalsContact SG-N 3.44Å; C237-C249 CovalentContact SG-SG 2.02Å; C237-C249 PolarHBondContact SG-SG 2.83Å; C237-C256 HydrophobicContact CB-CB 3.95Å; C237-C256 PolarHBondContact SG-SG 2.8Å
238	Q	61.5	Low	57.5	Low	112 Å²	112	81.2 Å²	81.2	52%	0.523	42%	0.423	S	S	.	.	H	α-helix	trans	-78.8	-33.1	172.7	-72	-158.7	20.7	0	0	112.8	S234 E235 I236 A240 K241	S234-Q238 WeakPolarHBondContact O-CB 3.39Å; S234-Q238 WeakPolarHBondContact O-CG 3.36Å; S234-Q238 PolarHBondContact O-N 3.07Å; E235-Q238 PolarHBondContact O-N 3.43Å; I236-Q238 VanDerWaalsContact C-N 3.33Å; I236-Q238 PolarHBondContact O-N 3.32Å; Q238-A240 VanDerWaalsContact C-N 3.32Å; Q238-K241 WeakPolarHBondContact O-CD 3.46Å; Q238-K241 WeakPolarHBondContact O-CE 3.48Å; Q238-K241 VanDerWaalsContact O-CG 3.23Å; Q238-K241 WeakPolarHBondContact O-CG 3.23Å
239	N	62	Low	58.2	Low	123 Å²	123	81.5 Å²	81.5	66%	0.658	43%	0.425	S	S	*	.	H	α-helix	trans	-78.4	-18	178.6	-67.5	-18.7	0	0	0	113	E235 I236 K241	E235-N239 VanDerWaalsContact O-CB 3.24Å; E235-N239 WeakPolarHBondContact O-CB 3.13Å; E235-N239 PolarHBondContact O-N 2.84Å; E235-N239 PolarHBondContact O-ND2 2.93Å; E235-N239 VanDerWaalsContact O-ND2 3.1Å; I236-N239 PolarHBondContact O-N 2.8Å; N239-K241 PolarHBondContact O-N 2.6Å; N239-K241 VanDerWaalsContact O-N 3.15Å
240	A	58.2	Low	58.9	Low	15 Å²	15	79.1 Å²	79.1	12%	0.124	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-6.7	173.1	0	0	0	0	0	115.5	S227 I236 C237 Q238 T242	S227-A240 WeakPolarHBondContact CB-O 3.42Å; S227-A240 WeakPolarHBondContact O-CB 3.45Å; I236-A240 VanDerWaalsContact O-CB 3.24Å; I236-A240 WeakPolarHBondContact O-CB 3.5Å; I236-A240 PolarHBondContact O-N 3.18Å; C237-A240 WeakPolarHBondContact O-CB 3.44Å; Q238-A240 VanDerWaalsContact C-N 3.32Å; A240-T242 PolarHBondContact O-N 3.32Å
241	K	55.1	Low	59.7	Low	109 Å²	109	78.1 Å²	78.1	47%	0.474	40%	0.404	S	S	.	.			trans	-65	130.7	-178.6	-68.1	168.3	-169.8	165.9	0	110.4	Q238 N239 T245	Q238-K241 WeakPolarHBondContact O-CD 3.46Å; Q238-K241 WeakPolarHBondContact O-CE 3.48Å; Q238-K241 VanDerWaalsContact O-CG 3.23Å; Q238-K241 WeakPolarHBondContact O-CG 3.23Å; N239-K241 PolarHBondContact O-N 2.6Å; N239-K241 VanDerWaalsContact O-N 3.15Å; K241-T245 WeakPolarHBondContact CA-O 3.34Å
242	T	54.7	Low	60.6	Low	67 Å²	67	79.2 Å²	79.2	41%	0.411	40%	0.404	S	S	.	.			trans	-105.5	177	167.6	71	0	0	0	0	109.6	A240 T244 T245	A240-T242 PolarHBondContact O-N 3.32Å; T242-T244 PolarHBondContact O-N 3.49Å; T242-T244 PolarHBondContact OG1-N 3.19Å; T242-T244 PolarHBondContact OG1-OG1 2.76Å; T242-T245 PolarHBondContact N-O 2.75Å; T242-T245 VanDerWaalsContact OG1-CB 3.24Å; T242-T245 WeakPolarHBondContact OG1-CB 3.49Å; T242-T245 PolarHBondContact OG1-N 3.21Å
243	S	50.4	Low	61.4	Low	129 Å²	129	80 Å²	80	90%	0.902	41%	0.408	S	S	*	.	S	Bend	trans	-61.3	-25.1	174.8	50.7	0	0	0	0	113.2
244	T	50.7	Low	61.6	Low	116 Å²	116	79.7 Å²	79.7	71%	0.712	41%	0.407	S	S	*	.	S	Bend	trans	-106.9	-24.3	-178.9	55.4	0	0	0	0	113.6	T242	T242-T244 PolarHBondContact O-N 3.49Å; T242-T244 PolarHBondContact OG1-N 3.19Å; T242-T244 PolarHBondContact OG1-OG1 2.76Å
245	T	59.4	Low	61.8	Low	12 Å²	12	80.5 Å²	80.5	7%	0.074	40%	0.404	C	S	.	.			trans	-111.6	115.9	-172.9	-65	0	0	0	0	111	K241 T242 E258 N260	K241-T245 WeakPolarHBondContact CA-O 3.34Å; T242-T245 PolarHBondContact N-O 2.75Å; T242-T245 VanDerWaalsContact OG1-CB 3.24Å; T242-T245 WeakPolarHBondContact OG1-CB 3.49Å; T242-T245 PolarHBondContact OG1-N 3.21Å; T245-E258 HydrophobicContact CG2-CG 3.45Å; T245-E258 VanDerWaalsContact CG2-CG 3.45Å; T245-E258 WeakPolarHBondContact CG2-OE1 3.32Å; T245-E258 PolarHBondContact OG1-OE1 3.46Å; T245-N260 WeakPolarHBondContact CA-OD1 3.44Å
246	K	66.9	Low	62	Low	141 Å²	141	74.1 Å²	74.1	61%	0.613	38%	0.375	S	S	*	.			trans	-91	127.2	167.1	-67.4	179.6	-179.6	179.1	0	108.7	L259	K246-L259 HydrophobicContact CB-CB 4.01Å; K246-L259 WeakPolarHBondContact O-CA 3.25Å; K246-L259 WeakPolarHBondContact O-CB 3.1Å; K246-L259 PolarHBondContact O-N 2.95Å
247	C	66.1	Low	62.4	Low	9 Å²	9	71.1 Å²	71.1	6%	0.061	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	143.2	171.3	-58.1	0	0	0	0	110.5	C228 C237 C256 I257	C228-C247 VanDerWaalsContact CA-SG 3.56Å; C228-C247 HydrophobicContact CB-CB 4.26Å; C228-C247 WeakPolarHBondContact CB-SG 3.42Å; C228-C247 WeakPolarHBondContact SG-CB 3.28Å; C228-C247 CovalentContact SG-SG 2.05Å; C228-C247 PolarHBondContact SG-SG 2.61Å; C237-C247 WeakPolarHBondContact O-CB 3.5Å; C247-C256 VanDerWaalsContact CB-SG 3.56Å; C247-I257 CarbonylContact C-O 3.52Å; C247-I257 WeakPolarHBondContact CA-O 3.49Å
248	F	71.5	Confident	62.5	Low	55 Å²	55	72.1 Å²	72.1	24%	0.241	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	129.2	173.4	169.5	-99	0	0	0	110.5	C250 I257 L259 V269 C272	F248-C250 HydrophobicContact CE1-CB 4.17Å; F248-I257 HydrophobicContact CD1-CB 4.46Å; F248-I257 HydrophobicContact CD1-CD1 4.29Å; F248-I257 PolarHBondContact N-O 2.84Å; F248-I257 PolarHBondContact O-N 3.25Å; F248-L259 HydrophobicContact CB-CD1 3.39Å; F248-L259 HydrophobicContact CB-CD2 4.36Å; F248-L259 HydrophobicContact CB-CG 3.72Å; F248-L259 HydrophobicContact CG-CD1 4.24Å; F248-V269 HydrophobicContact CD2-CG2 4.43Å; F248-V269 HydrophobicContact CE1-CG2 4.47Å; F248-V269 HydrophobicContact CE2-CG2 4.21Å; F248-V269 HydrophobicContact CZ-CG1 4.46Å; F248-V269 HydrophobicContact CZ-CG2 4.24Å; F248-C272 HydrophobicContact CE1-CB 3.83Å; F248-C272 HydrophobicContact CZ-CB 4.32Å
249	C	67.7	Low	62.4	Low	20 Å²	20	67.6 Å²	67.6	14%	0.135	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	113.4	-179.8	-43.2	0	0	0	0	109	C237 E251	C237-C249 HydrophobicContact CB-CB 4.12Å; C237-C249 WeakPolarHBondContact CB-SG 3.11Å; C237-C249 WeakPolarHBondContact SG-CA 3.45Å; C237-C249 WeakPolarHBondContact SG-CB 3.35Å; C237-C249 PolarHBondContact SG-N 3.49Å; C237-C249 VanDerWaalsContact SG-N 3.44Å; C237-C249 CovalentContact SG-SG 2.02Å; C237-C249 PolarHBondContact SG-SG 2.83Å; C249-E251 PolarHBondContact O-N 3.09Å
250	C	65.2	Low	62.2	Low	0 Å²	0	65.8 Å²	65.8	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	101.3	171.1	-173.7	0	0	0	0	109.8	F248 K253 K254 K255 I257 C272	F248-C250 HydrophobicContact CE1-CB 4.17Å; C250-K253 HydrophobicContact CB-CB 4.33Å; C250-K253 PolarHBondContact O-N 2.85Å; C250-K254 WeakPolarHBondContact O-CA 3.25Å; C250-K254 PolarHBondContact O-N 2.88Å; C250-K255 PolarHBondContact N-O 2.69Å; C250-K255 PolarHBondContact O-N 2.81Å; C250-K255 VanDerWaalsContact O-N 3.16Å; C250-I257 HydrophobicContact CB-CD1 3.88Å; C250-I257 HydrophobicContact CB-CG1 4.46Å; C250-C272 WeakPolarHBondContact CA-SG 3.19Å; C250-C272 HydrophobicContact CB-CB 3.97Å; C250-C272 WeakPolarHBondContact CB-SG 3.46Å; C250-C272 VanDerWaalsContact SG-CA 3.54Å; C250-C272 WeakPolarHBondContact SG-CB 3.45Å; C250-C272 CovalentContact SG-SG 2.04Å; C250-C272 PolarHBondContact SG-SG 2.82Å
251	E	67.5	Low	62	Low	130 Å²	130	67.5 Å²	67.5	61%	0.607	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-45.9	-177.7	-66.8	-169.6	164.6	0	0	112.8	Y232 C249 K253 K254	Y232-E251 WeakPolarHBondContact OH-CA 3.25Å; Y232-E251 WeakPolarHBondContact OH-CB 3.26Å; Y232-E251 PolarHBondContact OH-O 3.15Å; C249-E251 PolarHBondContact O-N 3.09Å; E251-K253 PolarHBondContact O-N 2.84Å; E251-K254 PolarHBondContact O-N 2.8Å
252	K	67.8	Low	61.9	Low	130 Å²	130	70.5 Å²	70.5	57%	0.565	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-40.5	-179.6	-73.7	-169.1	177.5	-175	0	112.8	R273	K252-R273 PolarHBondContact NZ-O 2.98Å
253	K	65	Low	61.8	Low	88 Å²	88	73.8 Å²	73.8	38%	0.383	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-0.6	178.9	-65	-174.3	175.6	176.1	0	113.5	I42 C250 E251 K255 D271	I42-K253 PolarHBondContact O-NZ 2.9Å; C250-K253 HydrophobicContact CB-CB 4.33Å; C250-K253 PolarHBondContact O-N 2.85Å; E251-K253 PolarHBondContact O-N 2.84Å; K253-K255 VanDerWaalsContact C-N 3.34Å; K253-K255 WeakPolarHBondContact O-CG 3.33Å; K253-K255 PolarHBondContact O-N 2.84Å; K253-D271 WeakPolarHBondContact CE-O 3.49Å; K253-D271 PolarHBondContact NZ-O 2.87Å
254	K	63	Low	61.9	Low	147 Å²	147	68 Å²	68	64%	0.639	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	47.3	-173.5	-63.1	-175.7	-179.2	175.8	0	113.7	Y232 C250 E251	Y232-K254 WeakPolarHBondContact CB-O 3.43Å; Y232-K254 HydrophobicContact CD1-CB 3.86Å; Y232-K254 HydrophobicContact CD1-CD 4.45Å; Y232-K254 HydrophobicContact CD1-CG 3.97Å; Y232-K254 HydrophobicContact CD2-CB 3.97Å; Y232-K254 HydrophobicContact CE1-CB 4.18Å; Y232-K254 HydrophobicContact CE1-CD 4.48Å; Y232-K254 HydrophobicContact CE1-CG 3.86Å; Y232-K254 VanDerWaalsContact CE2-CA 3.48Å; Y232-K254 HydrophobicContact CE2-CB 4.29Å; Y232-K254 VanDerWaalsContact CG-C 3.5Å; Y232-K254 HydrophobicContact CG-CB 3.74Å; Y232-K254 HydrophobicContact CG-CG 4.34Å; C250-K254 WeakPolarHBondContact O-CA 3.25Å; C250-K254 PolarHBondContact O-N 2.88Å; E251-K254 PolarHBondContact O-N 2.8Å
255	K	64.9	Low	62.3	Low	70 Å²	70	66.7 Å²	66.7	30%	0.304	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	152.9	-176	-72.8	-176.7	-172.8	-177.1	0	113.9	N40 C250 K253	N40-K255 PolarHBondContact ND2-NZ 3.12Å; N40-K255 PolarHBondContact OD1-NZ 3.16Å; C250-K255 PolarHBondContact N-O 2.69Å; C250-K255 PolarHBondContact O-N 2.81Å; C250-K255 VanDerWaalsContact O-N 3.16Å; K253-K255 VanDerWaalsContact C-N 3.34Å; K253-K255 WeakPolarHBondContact O-CG 3.33Å; K253-K255 PolarHBondContact O-N 2.84Å
256	C	64	Low	62.1	Low	10 Å²	10	67.7 Å²	67.7	7%	0.068	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	126.4	171	-173.3	0	0	0	0	109.4	C228 C237 C247	C228-C256 HydrophobicContact CB-CB 4.35Å; C228-C256 WeakPolarHBondContact CB-SG 3.49Å; C237-C256 HydrophobicContact CB-CB 3.95Å; C237-C256 PolarHBondContact SG-SG 2.8Å; C247-C256 VanDerWaalsContact CB-SG 3.56Å
257	I	65.5	Low	61.7	Low	9 Å²	9	65.2 Å²	65.2	5%	0.046	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	129.8	-176.4	-56.8	178.2	0	0	0	109	C247 F248 C250 K268	C247-I257 CarbonylContact C-O 3.52Å; C247-I257 WeakPolarHBondContact CA-O 3.49Å; F248-I257 HydrophobicContact CD1-CB 4.46Å; F248-I257 HydrophobicContact CD1-CD1 4.29Å; F248-I257 PolarHBondContact N-O 2.84Å; F248-I257 PolarHBondContact O-N 3.25Å; C250-I257 HydrophobicContact CB-CD1 3.88Å; C250-I257 HydrophobicContact CB-CG1 4.46Å; I257-K268 HydrophobicContact CG2-CD 4.03Å; I257-K268 HydrophobicContact CG2-CG 4.47Å
258	E	64.9	Low	61.4	Low	23 Å²	23	65.7 Å²	65.7	11%	0.107	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	128.4	172.9	-155.5	177.4	-170.5	0	0	111.9	T245 N260 K268	T245-E258 HydrophobicContact CG2-CG 3.45Å; T245-E258 VanDerWaalsContact CG2-CG 3.45Å; T245-E258 WeakPolarHBondContact CG2-OE1 3.32Å; T245-E258 PolarHBondContact OG1-OE1 3.46Å; E258-N260 WeakPolarHBondContact CG-OD1 3.43Å; E258-N260 VanDerWaalsContact OE1-CG 3.31Å; E258-N260 PolarHBondContact OE1-ND2 2.91Å; E258-N260 PolarHBondContact OE1-OD1 3.13Å; E258-K268 PolarHBondContact O-NZ 2.94Å
259	L	59.9	Low	61	Low	16 Å²	16	63.8 Å²	63.8	8%	0.084	32%	0.316	C	S	.	.			trans	-111.8	62.8	178.2	-66.7	177.6	0	0	0	110.6	K246 F248 K268	K246-L259 HydrophobicContact CB-CB 4.01Å; K246-L259 WeakPolarHBondContact O-CA 3.25Å; K246-L259 WeakPolarHBondContact O-CB 3.1Å; K246-L259 PolarHBondContact O-N 2.95Å; F248-L259 HydrophobicContact CB-CD1 3.39Å; F248-L259 HydrophobicContact CB-CD2 4.36Å; F248-L259 HydrophobicContact CB-CG 3.72Å; F248-L259 HydrophobicContact CG-CD1 4.24Å; L259-K268 HydrophobicContact CD2-CB 4.19Å; L259-K268 HydrophobicContact CD2-CD 3.98Å
260	N	58	Low	60.8	Low	86 Å²	86	66.6 Å²	66.6	46%	0.46	33%	0.33	S	S	.	.			trans	-80.7	-15.6	175.7	-69.1	-9.5	0	0	0	113.9	T245 E258	T245-N260 WeakPolarHBondContact CA-OD1 3.44Å; E258-N260 WeakPolarHBondContact CG-OD1 3.43Å; E258-N260 VanDerWaalsContact OE1-CG 3.31Å; E258-N260 PolarHBondContact OE1-ND2 2.91Å; E258-N260 PolarHBondContact OE1-OD1 3.13Å
261	N	53.5	Low	60.6	Low	50 Å²	50	68.8 Å²	68.8	27%	0.267	34%	0.342	S	S	.	.			trans	-126.5	121.6	-173	-171.4	-20.4	0	0	0	111.6	R59 D263 T264 H265	R59-N261 PolarHBondContact NH1-ND2 3.29Å; N261-D263 VanDerWaalsContact C-N 3.31Å; N261-D263 PolarHBondContact O-N 2.83Å; N261-D263 PolarHBondContact OD1-N 3Å; N261-D263 PolarHBondContact OD1-OD2 2.83Å; N261-T264 PolarHBondContact O-N 3.46Å; N261-T264 PolarHBondContact O-OG1 2.84Å; N261-H265 PolarHBondContact O-N 3.27Å
262	Q	52.7	Low	60.3	Low	173 Å²	173	63.1 Å²	63.1	81%	0.808	32%	0.316	S	S	*	.	S	Bend	trans	-59.1	-37.1	178	-72.7	-176.5	-14.8	0	0	112.6	T264 H265	Q262-T264 VanDerWaalsContact C-N 3.3Å; Q262-T264 PolarHBondContact O-N 3.17Å; Q262-H265 WeakPolarHBondContact O-CB 3.22Å; Q262-H265 PolarHBondContact O-N 3.08Å; Q262-H265 VanDerWaalsContact O-N 3.11Å
263	D	52.5	Low	60	Low	136 Å²	136	64.9 Å²	64.9	73%	0.727	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-31.8	-176.2	-57	-31.7	0	0	0	112.3	N261	N261-D263 VanDerWaalsContact C-N 3.31Å; N261-D263 PolarHBondContact O-N 2.83Å; N261-D263 PolarHBondContact OD1-N 3Å; N261-D263 PolarHBondContact OD1-OD2 2.83Å
264	T	53.1	Low	59.6	Low	7 Å²	7	64.5 Å²	64.5	4%	0.043	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-5.1	176.8	62.8	0	0	0	0	113	N261 Q262 G266 L267 K268	N261-T264 PolarHBondContact O-N 3.46Å; N261-T264 PolarHBondContact O-OG1 2.84Å; Q262-T264 VanDerWaalsContact C-N 3.3Å; Q262-T264 PolarHBondContact O-N 3.17Å; T264-G266 PolarHBondContact O-N 3.08Å; T264-L267 PolarHBondContact O-N 2.85Å; T264-K268 VanDerWaalsContact O-CB 3.32Å; T264-K268 WeakPolarHBondContact O-CB 3.43Å; T264-K268 VanDerWaalsContact O-CG 3.25Å; T264-K268 WeakPolarHBondContact O-CG 3Å; T264-K268 PolarHBondContact O-N 2.97Å
265	H	58.8	Low	58.7	Low	88 Å²	88	64.7 Å²	64.7	41%	0.407	33%	0.327	S	S	.	.	H	α-helix	trans	-61	-47.8	-175.7	-178.6	-77.6	0	0	0	111.1	N261 Q262 V269	N261-H265 PolarHBondContact O-N 3.27Å; Q262-H265 WeakPolarHBondContact O-CB 3.22Å; Q262-H265 PolarHBondContact O-N 3.08Å; Q262-H265 VanDerWaalsContact O-N 3.11Å; H265-V269 WeakPolarHBondContact O-CB 3.41Å; H265-V269 VanDerWaalsContact O-CG2 3.23Å; H265-V269 WeakPolarHBondContact O-CG2 3.36Å; H265-V269 PolarHBondContact O-N 3.39Å; H265-V269 VanDerWaalsContact O-N 3.07Å
266	G	55.9	Low	57.4	Low	34 Å²	34	68.7 Å²	68.7	35%	0.351	35%	0.352	S	S	.	.	H	α-helix	trans	-58.3	-55.1	177.3	0	0	0	0	0	111.6	T264 K268 V269 D270	T264-G266 PolarHBondContact O-N 3.08Å; G266-K268 PolarHBondContact O-N 3.48Å; G266-V269 PolarHBondContact O-N 2.87Å; G266-V269 VanDerWaalsContact O-N 3.1Å; G266-D270 WeakPolarHBondContact O-CB 3.18Å; G266-D270 VanDerWaalsContact O-CG 3.32Å; G266-D270 PolarHBondContact O-N 3.28Å
267	L	57.4	Low	56.1	Low	89 Å²	89	75.2 Å²	75.2	47%	0.466	39%	0.385	S	S	.	.	H	α-helix	trans	-55.4	-46.4	179.5	-65.4	169.9	0	0	0	112.7	T264 V269 D270 D271	T264-L267 PolarHBondContact O-N 2.85Å; L267-V269 VanDerWaalsContact C-N 3.33Å; L267-V269 PolarHBondContact O-N 2.83Å; L267-D270 PolarHBondContact O-N 2.88Å; L267-D271 WeakPolarHBondContact O-CB 3.41Å; L267-D271 PolarHBondContact O-N 3.2Å
268	K	60.5	Low	54.5	Low	18 Å²	18	80.5 Å²	80.5	8%	0.078	41%	0.413	C	S	.	.	H	α-helix	trans	-65	-35	179.2	-74.4	174.1	173.9	-179	0	113	I257 E258 L259 T264 G266	I257-K268 HydrophobicContact CG2-CD 4.03Å; I257-K268 HydrophobicContact CG2-CG 4.47Å; E258-K268 PolarHBondContact O-NZ 2.94Å; L259-K268 HydrophobicContact CD2-CB 4.19Å; L259-K268 HydrophobicContact CD2-CD 3.98Å; T264-K268 VanDerWaalsContact O-CB 3.32Å; T264-K268 WeakPolarHBondContact O-CB 3.43Å; T264-K268 VanDerWaalsContact O-CG 3.25Å; T264-K268 WeakPolarHBondContact O-CG 3Å; T264-K268 PolarHBondContact O-N 2.97Å; G266-K268 PolarHBondContact O-N 3.48Å
269	V	62.5	Low	52.8	Low	16 Å²	16	86.1 Å²	86.1	10%	0.097	45%	0.449	C	S	.	.	H	α-helix	trans	-76.3	-42	178	170.9	0	0	0	0	110.7	F248 H265 G266 L267 C272 R273	F248-V269 HydrophobicContact CD2-CG2 4.43Å; F248-V269 HydrophobicContact CE1-CG2 4.47Å; F248-V269 HydrophobicContact CE2-CG2 4.21Å; F248-V269 HydrophobicContact CZ-CG1 4.46Å; F248-V269 HydrophobicContact CZ-CG2 4.24Å; H265-V269 WeakPolarHBondContact O-CB 3.41Å; H265-V269 VanDerWaalsContact O-CG2 3.23Å; H265-V269 WeakPolarHBondContact O-CG2 3.36Å; H265-V269 PolarHBondContact O-N 3.39Å; H265-V269 VanDerWaalsContact O-N 3.07Å; G266-V269 PolarHBondContact O-N 2.87Å; G266-V269 VanDerWaalsContact O-N 3.1Å; L267-V269 VanDerWaalsContact C-N 3.33Å; L267-V269 PolarHBondContact O-N 2.83Å; V269-C272 WeakPolarHBondContact O-CB 3.31Å; V269-C272 PolarHBondContact O-N 3.31Å; V269-R273 WeakPolarHBondContact O-CG 3.48Å; V269-R273 PolarHBondContact O-N 3.11Å
270	D	64.2	Low	51.2	Low	78 Å²	78	88.6 Å²	88.6	42%	0.417	48%	0.479	S	S	.	.	H	α-helix	trans	-67.4	-42.2	-179	-68.4	-28.3	0	0	0	111.5	G266 L267 C272 R273 V274	G266-D270 WeakPolarHBondContact O-CB 3.18Å; G266-D270 VanDerWaalsContact O-CG 3.32Å; G266-D270 PolarHBondContact O-N 3.28Å; L267-D270 PolarHBondContact O-N 2.88Å; D270-C272 PolarHBondContact O-N 3.03Å; D270-R273 WeakPolarHBondContact O-CA 3.02Å; D270-R273 VanDerWaalsContact O-CB 3.3Å; D270-R273 WeakPolarHBondContact O-CB 3.2Å; D270-R273 PolarHBondContact O-N 2.99Å; D270-R273 IonicContact OD1-NH1 2.6Å; D270-V274 WeakPolarHBondContact O-CG2 3.38Å; D270-V274 PolarHBondContact O-N 3.29Å
271	D	61.1	Low	49.8	Very low	46 Å²	46	90.2 Å²	90.2	25%	0.246	49%	0.492	C	S	.	.	H	α-helix	trans	-71.1	-13.9	175.5	-76.9	-28.8	0	0	0	114.4	I43 K253 L267 R273	I43-D271 HydrophobicContact CD1-CB 3.82Å; I43-D271 WeakPolarHBondContact CD1-OD2 3.46Å; I43-D271 HydrophobicContact CG1-CB 3.84Å; I43-D271 WeakPolarHBondContact CG1-OD2 3.15Å; I43-D271 WeakPolarHBondContact CG2-OD2 3.45Å; K253-D271 WeakPolarHBondContact CE-O 3.49Å; K253-D271 PolarHBondContact NZ-O 2.87Å; L267-D271 WeakPolarHBondContact O-CB 3.41Å; L267-D271 PolarHBondContact O-N 3.2Å; D271-R273 VanDerWaalsContact C-N 3.34Å
272	C	61.5	Low	48.5	Very low	11 Å²	11	93 Å²	93	7%	0.074	52%	0.522	C	S	.	.	H	α-helix	trans	-76	-27.1	165.1	-177.3	0	0	0	0	111.9	F248 C250 V269 D270	F248-C272 HydrophobicContact CE1-CB 3.83Å; F248-C272 HydrophobicContact CZ-CB 4.32Å; C250-C272 WeakPolarHBondContact CA-SG 3.19Å; C250-C272 HydrophobicContact CB-CB 3.97Å; C250-C272 WeakPolarHBondContact CB-SG 3.46Å; C250-C272 VanDerWaalsContact SG-CA 3.54Å; C250-C272 WeakPolarHBondContact SG-CB 3.45Å; C250-C272 CovalentContact SG-SG 2.04Å; C250-C272 PolarHBondContact SG-SG 2.82Å; V269-C272 WeakPolarHBondContact O-CB 3.31Å; V269-C272 PolarHBondContact O-N 3.31Å; D270-C272 PolarHBondContact O-N 3.03Å
273	R	61.9	Low	47.3	Very low	167 Å²	167	88.3 Å²	88.3	63%	0.63	51%	0.513	S	S	*	.	H	α-helix	trans	-85	-35.8	-179.1	-65.7	169.2	173.2	174.7	-5.5	112.4	K252 V269 D270 D271 E275	K252-R273 PolarHBondContact NZ-O 2.98Å; V269-R273 WeakPolarHBondContact O-CG 3.48Å; V269-R273 PolarHBondContact O-N 3.11Å; D270-R273 WeakPolarHBondContact O-CA 3.02Å; D270-R273 VanDerWaalsContact O-CB 3.3Å; D270-R273 WeakPolarHBondContact O-CB 3.2Å; D270-R273 PolarHBondContact O-N 2.99Å; D270-R273 IonicContact OD1-NH1 2.6Å; D271-R273 VanDerWaalsContact C-N 3.34Å; R273-E275 PolarHBondContact O-N 3.31Å
274	V	56.3	Low	46.2	Very low	80 Å²	80	90.7 Å²	90.7	49%	0.485	52%	0.519	S	S	.	.	S	Bend	trans	-56.6	123.4	-179.2	175	0	0	0	0	110.4	D270	D270-V274 WeakPolarHBondContact O-CG2 3.38Å; D270-V274 PolarHBondContact O-N 3.29Å
275	E	42.5	Very low	45.1	Very low	152 Å²	152	98 Å²	98	71%	0.71	56%	0.558	S	S	*	*			trans	-68.2	144.8	169.3	-66.4	-178.8	164.6	0	0	109	R273 I277	R273-E275 PolarHBondContact O-N 3.31Å; E275-I277 PolarHBondContact O-N 3.2Å
276	N	37.9	Very low	43.7	Very low	154 Å²	154	102.4 Å²	102.4	82%	0.824	58%	0.576	S	S	*	*			trans	-42	117.2	171.7	-81.2	-19.9	0	0	0	109.3	N278	N276-N278 VanDerWaalsContact C-N 3.31Å; N276-N278 PolarHBondContact O-N 2.72Å
277	I	36.4	Very low	42.4	Very low	147 Å²	147	110.3 Å²	110.3	75%	0.754	60%	0.601	S	S	*	*	S	Bend	trans	-64.3	102.8	169	-65.6	174.9	0	0	0	106.1	E275	E275-I277 PolarHBondContact O-N 3.2Å
278	N	32.9	Very low	41.1	Very low	120 Å²	120	115.5 Å²	115.5	64%	0.642	62%	0.623	S	S	*	*			trans	62.6	86.2	158.8	-60.3	-19.8	0	0	0	117.7	N276	N276-N278 VanDerWaalsContact C-N 3.31Å; N276-N278 PolarHBondContact O-N 2.72Å
279	T	28.2	Very low	40.2	Very low	141 Å²	141	128.3 Å²	128.3	87%	0.865	68%	0.678	S	S	*	*	S	Bend		-106.1	99.1	121.3	52.1	0	0	0	0	108.4
280	G	26.5	Very low	39	Very low	68 Å²	68	133.9 Å²	133.9	70%	0.701	71%	0.707	S	S	*	*			trans	93.1	91.1	158.4	0	0	0	0	0	116.8
281	T	28.8	Very low	37.7	Very low	120 Å²	120	136.8 Å²	136.8	74%	0.736	72%	0.723	S	S	*	*			trans	-120.1	78.6	138.2	26.3	0	0	0	0	108.2	A283	T281-A283 PolarHBondContact O-N 3.3Å
282	A	27.1	Very low	36.4	Very low	109 Å²	109	141.9 Å²	141.9	90%	0.901	75%	0.749	S	S	*	*			trans	-74.2	89.1	147	0	0	0	0	0	106.4
283	A	28	Very low	34.9	Very low	74 Å²	74	149.6 Å²	149.6	61%	0.612	79%	0.789	S	S	*	*			trans	-144.2	96.6	166.6	0	0	0	0	0	108.2	T281	T281-A283 PolarHBondContact O-N 3.3Å
284	E	27.7	Very low	33.3	Very low	186 Å²	186	148.5 Å²	148.5	87%	0.869	80%	0.799	S	S	*	*			trans	49.9	97.3	137.4	-61.9	179.5	157.8	0	0	117.9
285	N	31.3	Very low	31.7	Very low	160 Å²	160	153.1 Å²	153.1	86%	0.856	82%	0.82	S	S	*	*			trans	-113.3	100.6	145.1	-95.8	-31	0	0	0	110.1
286	K	30.1	Very low	30.9	Very low	181 Å²	181	153.1 Å²	153.1	79%	0.787	83%	0.827	S	S	*	*			trans	33	123.4	132.4	-71.8	175.4	177.7	172.4	0	119.9
287	K	27.9	Very low	30.4	Very low	199 Å²	199	153.1 Å²	153.1	87%	0.865	83%	0.828	S	S	*	*				40.5	109.7	127	-68.7	-175.2	175.2	-174.9	0	118.2
288	E	29.7	Very low	29.9	Very low	199 Å²	199	153.6 Å²	153.6	93%	0.93	83%	0.834	S	S	*	*			trans	-136	105.5	137.7	-89.7	-175.5	159.4	0	0	108.9
289	K	40.9	Very low	29.6	Very low	286 Å²	286	156.6 Å²	156.6	100%	1.243	85%	0.851	S	S	*	*			trans	-156.9	0	148	-136.2	-179	-173.6	-178.8	0	109.3

Retrieved 289 of 289 residues in 247.3 ms (Link to these results)

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