A0AA82N7Z6_SCHMA Loading...

Egg protein CP391S-like protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N7Z6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 345 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.2	Very low	57.3	Low	213 Å²	213	129.7 Å²	129.7	100%	1.049	63%	0.63	S	S	*	*				0	110.6	0	-84.9	173.9	167.5	0	0	108.9	Y3	M1-Y3 HydrophobicContact CB-CD2 4.34Å; M1-Y3 PolarHBondContact O-N 3.46Å; M1-Y3 HydrophobicContact SD-CE2 4.19Å
2	R	46.3	Very low	58.5	Low	243 Å²	243	128 Å²	128	92%	0.917	63%	0.625	S	S	*	*			trans	-79.2	98.1	166.1	-72.8	-178.4	178.2	178.1	-0.5	106.5	N4	R2-N4 PolarHBondContact O-N 2.95Å; R2-N4 VanDerWaalsContact O-N 3.09Å
3	Y	53.6	Low	59.4	Low	144 Å²	144	122.6 Å²	122.6	57%	0.565	60%	0.604	S	S	*	*			trans	-73.8	98.3	174	-111.1	-89.8	0	0	0	107.9	M1 F5 Y315	M1-Y3 HydrophobicContact CB-CD2 4.34Å; M1-Y3 PolarHBondContact O-N 3.46Å; M1-Y3 HydrophobicContact SD-CE2 4.19Å; Y3-F5 PolarHBondContact O-N 2.79Å; Y3-F5 VanDerWaalsContact O-N 3.12Å; Y3-Y315 VanDerWaalsContact OH-CD1 3.29Å; Y3-Y315 WeakPolarHBondContact OH-CD1 3.13Å; Y3-Y315 WeakPolarHBondContact OH-CE1 3.44Å
4	N	52.8	Low	60.2	Low	149 Å²	149	123.9 Å²	123.9	80%	0.797	60%	0.6	S	S	*	*			trans	-73.7	97.8	167.2	-73.1	-19	0	0	0	107	R2 S6	R2-N4 PolarHBondContact O-N 2.95Å; R2-N4 VanDerWaalsContact O-N 3.09Å; N4-S6 PolarHBondContact O-N 2.73Å
5	F	50.8	Low	60.7	Low	116 Å²	116	121.5 Å²	121.5	51%	0.509	60%	0.596	S	S	.	*			trans	-55.9	127.1	167.1	-81.9	-87.5	0	0	0	108.8	Y3	Y3-F5 PolarHBondContact O-N 2.79Å; Y3-F5 VanDerWaalsContact O-N 3.12Å
6	S	60.6	Low	61.3	Low	57 Å²	57	119.3 Å²	119.3	40%	0.399	59%	0.586	S	S	.	*			trans	-54.6	135.8	173.7	171.6	0	0	0	0	109.8	N4 S8 L9	N4-S6 PolarHBondContact O-N 2.73Å; S6-S8 PolarHBondContact O-N 2.79Å; S6-S8 PolarHBondContact OG-N 3.35Å; S6-S8 PolarHBondContact OG-OG 3.22Å; S6-L9 PolarHBondContact O-N 2.93Å
7	P	65.2	Low	61.1	Low	97 Å²	97	118.9 Å²	118.9	63%	0.63	58%	0.581	S	S	*	*	H	α-helix	trans	-50.5	-30.9	177.3	-27.1	33.6	0	0	0	113.9	L9 W10 I11	P7-L9 VanDerWaalsContact C-N 3.33Å; P7-L9 PolarHBondContact O-N 3.24Å; P7-W10 PolarHBondContact O-N 3Å; P7-I11 WeakPolarHBondContact O-CG1 3.42Å; P7-I11 PolarHBondContact O-N 3.38Å; P7-I11 VanDerWaalsContact O-N 3.09Å
8	S	66	Low	60.9	Low	75 Å²	75	116.8 Å²	116.8	52%	0.524	58%	0.576	S	S	.	*	H	α-helix	trans	-63.1	-34.6	178.1	61.3	0	0	0	0	113.9	S6 I11 L12	S6-S8 PolarHBondContact O-N 2.79Å; S6-S8 PolarHBondContact OG-N 3.35Å; S6-S8 PolarHBondContact OG-OG 3.22Å; S8-I11 PolarHBondContact O-N 3.18Å; S8-L12 PolarHBondContact O-N 3.22Å; S8-L12 VanDerWaalsContact O-N 3.14Å
9	L	59.1	Low	60.5	Low	94 Å²	94	119.3 Å²	119.3	49%	0.492	58%	0.578	S	S	.	*	H	α-helix	trans	-70	-38	176.8	-94	136.8	0	0	0	111.3	S6 P7 L12 V13	S6-L9 PolarHBondContact O-N 2.93Å; P7-L9 VanDerWaalsContact C-N 3.33Å; P7-L9 PolarHBondContact O-N 3.24Å; L9-L12 PolarHBondContact O-N 2.88Å; L9-V13 VanDerWaalsContact O-CG2 3.24Å; L9-V13 WeakPolarHBondContact O-CG2 3.37Å; L9-V13 PolarHBondContact O-N 2.95Å; L9-V13 VanDerWaalsContact O-N 3.08Å
10	W	64	Low	60.1	Low	132 Å²	132	116.9 Å²	116.9	50%	0.5	57%	0.568	S	S	.	*	H	α-helix	trans	-64	-44.8	174.1	-74.4	99.5	0	0	0	111.3	P7 L12 V13 Y14	P7-W10 PolarHBondContact O-N 3Å; W10-L12 VanDerWaalsContact C-N 3.33Å; W10-L12 PolarHBondContact O-N 3.5Å; W10-V13 PolarHBondContact O-N 3.22Å; W10-Y14 HydrophobicContact CB-CD2 4.22Å; W10-Y14 HydrophobicContact CB-CE2 4.22Å; W10-Y14 HydrophobicContact CD2-CE2 4.5Å; W10-Y14 HydrophobicContact CE3-CD2 4.48Å; W10-Y14 AromaticContact CE3-CE2 3.72Å; W10-Y14 HydrophobicContact CE3-CE2 3.72Å; W10-Y14 WeakPolarHBondContact O-CB 3.42Å; W10-Y14 WeakPolarHBondContact O-CD2 3.38Å; W10-Y14 PolarHBondContact O-N 2.72Å
11	I	70.8	Confident	59.8	Low	107 Å²	107	118.3 Å²	118.3	55%	0.549	57%	0.568	S	S	.	*	H	α-helix	trans	-58.1	-46.2	177.7	-65.4	164.7	0	0	0	110.7	P7 S8 V13 Y14 V15	P7-I11 WeakPolarHBondContact O-CG1 3.42Å; P7-I11 PolarHBondContact O-N 3.38Å; P7-I11 VanDerWaalsContact O-N 3.09Å; S8-I11 PolarHBondContact O-N 3.18Å; I11-V13 PolarHBondContact O-N 3.18Å; I11-Y14 PolarHBondContact O-N 3.05Å; I11-V15 HydrophobicContact CG2-CG2 4.2Å; I11-V15 WeakPolarHBondContact O-CB 3.35Å; I11-V15 WeakPolarHBondContact O-CG2 3.41Å; I11-V15 PolarHBondContact O-N 3.43Å
12	L	71.4	Confident	60.2	Low	109 Å²	109	114.9 Å²	114.9	57%	0.571	55%	0.547	S	S	*	.	H	α-helix	trans	-60.6	-45.5	178.3	-166	93.8	0	0	0	111.8	S8 L9 W10 V15 I16	S8-L12 PolarHBondContact O-N 3.22Å; S8-L12 VanDerWaalsContact O-N 3.14Å; L9-L12 PolarHBondContact O-N 2.88Å; W10-L12 VanDerWaalsContact C-N 3.33Å; W10-L12 PolarHBondContact O-N 3.5Å; L12-V15 PolarHBondContact O-N 3.49Å; L12-I16 HydrophobicContact CD2-CD1 4.14Å; L12-I16 HydrophobicContact CG-CD1 4.12Å; L12-I16 VanDerWaalsContact O-CG1 3.26Å; L12-I16 WeakPolarHBondContact O-CG1 3.31Å; L12-I16 PolarHBondContact O-N 3.03Å
13	V	70.7	Confident	60.5	Low	58 Å²	58	112.3 Å²	112.3	35%	0.352	54%	0.537	S	S	.	.	H	α-helix	trans	-62.9	-47.2	178.4	172	0	0	0	0	110.6	L9 W10 I11 V15 I16 F17	L9-V13 VanDerWaalsContact O-CG2 3.24Å; L9-V13 WeakPolarHBondContact O-CG2 3.37Å; L9-V13 PolarHBondContact O-N 2.95Å; L9-V13 VanDerWaalsContact O-N 3.08Å; W10-V13 PolarHBondContact O-N 3.22Å; I11-V13 PolarHBondContact O-N 3.18Å; V13-V15 PolarHBondContact O-N 3.4Å; V13-I16 PolarHBondContact O-N 3.37Å; V13-F17 HydrophobicContact CG1-CD2 3.52Å; V13-F17 HydrophobicContact CG1-CE2 3.43Å; V13-F17 VanDerWaalsContact CG1-CE2 3.43Å; V13-F17 WeakPolarHBondContact O-CD2 3.23Å; V13-F17 PolarHBondContact O-N 3.42Å
14	Y	70.2	Confident	60.2	Low	141 Å²	141	113.3 Å²	113.3	55%	0.553	55%	0.545	S	S	*	.	H	α-helix	trans	-61.3	-42.3	175.6	-81	-67.9	0	0	0	112.2	W10 I11 I16 F17 V18	W10-Y14 HydrophobicContact CB-CD2 4.22Å; W10-Y14 HydrophobicContact CB-CE2 4.22Å; W10-Y14 HydrophobicContact CD2-CE2 4.5Å; W10-Y14 HydrophobicContact CE3-CD2 4.48Å; W10-Y14 AromaticContact CE3-CE2 3.72Å; W10-Y14 HydrophobicContact CE3-CE2 3.72Å; W10-Y14 WeakPolarHBondContact O-CB 3.42Å; W10-Y14 WeakPolarHBondContact O-CD2 3.38Å; W10-Y14 PolarHBondContact O-N 2.72Å; I11-Y14 PolarHBondContact O-N 3.05Å; Y14-I16 PolarHBondContact O-N 2.92Å; Y14-F17 PolarHBondContact O-N 3.11Å; Y14-V18 VanDerWaalsContact O-CB 3.29Å; Y14-V18 WeakPolarHBondContact O-CB 3.47Å; Y14-V18 WeakPolarHBondContact O-CG2 3.37Å; Y14-V18 PolarHBondContact O-N 3.02Å
15	V	68.6	Low	59.8	Low	87 Å²	87	110.5 Å²	110.5	53%	0.527	53%	0.53	S	S	.	.	H	α-helix	trans	-62.7	-43.4	176.8	170	0	0	0	0	110.4	I11 L12 V13 W19	I11-V15 HydrophobicContact CG2-CG2 4.2Å; I11-V15 WeakPolarHBondContact O-CB 3.35Å; I11-V15 WeakPolarHBondContact O-CG2 3.41Å; I11-V15 PolarHBondContact O-N 3.43Å; L12-V15 PolarHBondContact O-N 3.49Å; V13-V15 PolarHBondContact O-N 3.4Å; V15-W19 WeakPolarHBondContact O-CB 3.43Å; V15-W19 PolarHBondContact O-N 3.16Å
16	I	69.7	Low	60	Low	87 Å²	87	107.7 Å²	107.7	45%	0.446	52%	0.524	S	S	.	.	H	α-helix	trans	-62.2	-46.1	175.8	-68.2	164.3	0	0	0	110.6	L12 V13 Y14 L20	L12-I16 HydrophobicContact CD2-CD1 4.14Å; L12-I16 HydrophobicContact CG-CD1 4.12Å; L12-I16 VanDerWaalsContact O-CG1 3.26Å; L12-I16 WeakPolarHBondContact O-CG1 3.31Å; L12-I16 PolarHBondContact O-N 3.03Å; V13-I16 PolarHBondContact O-N 3.37Å; Y14-I16 PolarHBondContact O-N 2.92Å; I16-L20 HydrophobicContact CG2-CD1 3.68Å; I16-L20 HydrophobicContact CG2-CG 4.38Å; I16-L20 VanDerWaalsContact O-CB 3.27Å; I16-L20 WeakPolarHBondContact O-CB 3.08Å; I16-L20 WeakPolarHBondContact O-CD1 3.46Å; I16-L20 WeakPolarHBondContact O-CG 3.06Å; I16-L20 PolarHBondContact O-N 3.45Å
17	F	57.5	Low	60	Low	113 Å²	113	106.7 Å²	106.7	50%	0.496	51%	0.514	S	S	.	.	H	α-helix	trans	-64.9	-45.7	178.2	-83.6	-69.6	0	0	0	112.7	V13 Y14 Y21	V13-F17 HydrophobicContact CG1-CD2 3.52Å; V13-F17 HydrophobicContact CG1-CE2 3.43Å; V13-F17 VanDerWaalsContact CG1-CE2 3.43Å; V13-F17 WeakPolarHBondContact O-CD2 3.23Å; V13-F17 PolarHBondContact O-N 3.42Å; Y14-F17 PolarHBondContact O-N 3.11Å; F17-Y21 WeakPolarHBondContact O-CB 3.32Å; F17-Y21 PolarHBondContact O-N 2.72Å
18	V	57.5	Low	60.2	Low	80 Å²	80	105.8 Å²	105.8	49%	0.485	50%	0.504	S	S	.	.	H	α-helix	trans	-66.7	-40	178.7	171.6	0	0	0	0	110.7	Y14 Y21 K22	Y14-V18 VanDerWaalsContact O-CB 3.29Å; Y14-V18 WeakPolarHBondContact O-CB 3.47Å; Y14-V18 WeakPolarHBondContact O-CG2 3.37Å; Y14-V18 PolarHBondContact O-N 3.02Å; V18-Y21 PolarHBondContact O-N 3.33Å; V18-K22 WeakPolarHBondContact O-CB 3.4Å; V18-K22 PolarHBondContact O-N 3.13Å
19	W	53.5	Low	60.5	Low	165 Å²	165	102.4 Å²	102.4	63%	0.625	48%	0.48	S	S	*	.	H	α-helix	trans	-69.2	-44	179.1	-165.9	69.9	0	0	0	111.7	V15 R23	V15-W19 WeakPolarHBondContact O-CB 3.43Å; V15-W19 PolarHBondContact O-N 3.16Å; W19-R23 VanDerWaalsContact O-CB 3.25Å; W19-R23 WeakPolarHBondContact O-CB 3.49Å; W19-R23 PolarHBondContact O-N 3.24Å
20	L	52.5	Low	61.5	Low	70 Å²	70	99 Å²	99	37%	0.366	46%	0.464	S	S	.	.	H	α-helix	trans	-62.7	-45.2	171.6	-70.8	169.4	0	0	0	110.7	I16 R23 F24	I16-L20 HydrophobicContact CG2-CD1 3.68Å; I16-L20 HydrophobicContact CG2-CG 4.38Å; I16-L20 VanDerWaalsContact O-CB 3.27Å; I16-L20 WeakPolarHBondContact O-CB 3.08Å; I16-L20 WeakPolarHBondContact O-CD1 3.46Å; I16-L20 WeakPolarHBondContact O-CG 3.06Å; I16-L20 PolarHBondContact O-N 3.45Å; L20-R23 PolarHBondContact O-N 2.04Å; L20-F24 HydrophobicContact CB-CD2 4.28Å; L20-F24 HydrophobicContact CB-CE2 4.4Å; L20-F24 HydrophobicContact CD2-CE2 4.13Å; L20-F24 WeakPolarHBondContact O-CB 3.39Å; L20-F24 WeakPolarHBondContact O-CD2 3.37Å; L20-F24 PolarHBondContact O-N 3.21Å
21	Y	53.2	Low	62.2	Low	147 Å²	147	99.3 Å²	99.3	58%	0.576	47%	0.471	S	S	*	.	H	α-helix	trans	-61	-48.6	179.3	-177.3	-94.3	0	0	0	112.2	F17 V18 R23 F24 N25	F17-Y21 WeakPolarHBondContact O-CB 3.32Å; F17-Y21 PolarHBondContact O-N 2.72Å; V18-Y21 PolarHBondContact O-N 3.33Å; Y21-R23 VanDerWaalsContact C-N 3.31Å; Y21-R23 PolarHBondContact O-N 2.73Å; Y21-F24 PolarHBondContact O-N 2.95Å; Y21-N25 VanDerWaalsContact CE2-ND2 3.27Å; Y21-N25 WeakPolarHBondContact CE2-ND2 2.97Å; Y21-N25 PolarHBondContact O-N 3.3Å
22	K	51.2	Low	62.3	Low	141 Å²	141	98.1 Å²	98.1	61%	0.613	46%	0.46	S	S	*	.	H	α-helix	trans	-58.7	-42.9	174.2	-93.9	-172.1	170.6	-176	0	111.7	V18 C26	V18-K22 WeakPolarHBondContact O-CB 3.4Å; V18-K22 PolarHBondContact O-N 3.13Å; K22-C26 PolarHBondContact O-N 2.91Å
23	R	51.8	Low	62.3	Low	189 Å²	189	97.8 Å²	97.8	71%	0.713	46%	0.464	S	S	*	.	H	α-helix	trans	-69.4	-32	-179.6	-167.9	173.5	-177.8	172.9	0.4	112.8	W19 L20 Y21	W19-R23 VanDerWaalsContact O-CB 3.25Å; W19-R23 WeakPolarHBondContact O-CB 3.49Å; W19-R23 PolarHBondContact O-N 3.24Å; L20-R23 PolarHBondContact O-N 2.04Å; Y21-R23 VanDerWaalsContact C-N 3.31Å; Y21-R23 PolarHBondContact O-N 2.73Å
24	F	47.5	Very low	62.3	Low	165 Å²	165	99.8 Å²	99.8	72%	0.724	47%	0.473	S	S	*	.	H	α-helix	trans	-82.1	-32.2	178.7	-82.2	-66	0	0	0	113.5	L20 Y21	L20-F24 HydrophobicContact CB-CD2 4.28Å; L20-F24 HydrophobicContact CB-CE2 4.4Å; L20-F24 HydrophobicContact CD2-CE2 4.13Å; L20-F24 WeakPolarHBondContact O-CB 3.39Å; L20-F24 WeakPolarHBondContact O-CD2 3.37Å; L20-F24 PolarHBondContact O-N 3.21Å; Y21-F24 PolarHBondContact O-N 2.95Å
25	N	43.8	Very low	62.5	Low	91 Å²	91	93.4 Å²	93.4	49%	0.487	45%	0.448	S	S	.	.	H	α-helix	trans	-111.6	-23	-168.8	-80.7	-11.7	0	0	0	117.1	Y21 N27	Y21-N25 VanDerWaalsContact CE2-ND2 3.27Å; Y21-N25 WeakPolarHBondContact CE2-ND2 2.97Å; Y21-N25 PolarHBondContact O-N 3.3Å; N25-N27 PolarHBondContact O-N 3.19Å
26	C	54.4	Low	62.7	Low	56 Å²	56	93.9 Å²	93.9	38%	0.378	44%	0.441	S	S	.	.			trans	-102.5	81.2	-173.5	-62.9	0	0	0	0	111.6	K22	K22-C26 PolarHBondContact O-N 2.91Å
27	N	61.5	Low	63.1	Low	36 Å²	36	96.1 Å²	96.1	19%	0.193	45%	0.454	C	S	.	.			trans	-85	109.3	151.3	-163.7	60.7	0	0	0	105.5	N25 Y29 C30 Y54 K55 I193	N25-N27 PolarHBondContact O-N 3.19Å; N27-Y29 WeakPolarHBondContact ND2-CB 2.94Å; N27-Y29 PolarHBondContact O-N 3.43Å; N27-C30 WeakPolarHBondContact O-CB 3.2Å; N27-C30 PolarHBondContact O-N 2.94Å; N27-Y54 VanDerWaalsContact CG-OH 3.28Å; N27-Y54 PolarHBondContact ND2-OH 2.91Å; N27-Y54 VanDerWaalsContact ND2-OH 3.1Å; N27-Y54 PolarHBondContact OD1-OH 3.39Å; N27-Y54 VanDerWaalsContact OD1-OH 3.08Å; N27-K55 WeakPolarHBondContact OD1-CE 3.02Å; N27-K55 PolarHBondContact OD1-NZ 2.7Å; N27-I193 HydrophobicContact CB-CG2 4.16Å; N27-I193 WeakPolarHBondContact ND2-CG2 3.44Å
28	D	70	Confident	64.1	Low	78 Å²	78	93.1 Å²	93.1	42%	0.417	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-46.4	-30.4	-173.7	-66.7	-2.1	0	0	0	114.3	C30 E31 R32 L35	D28-C30 PolarHBondContact O-N 2.89Å; D28-C30 VanDerWaalsContact O-N 3.15Å; D28-E31 PolarHBondContact O-N 3.43Å; D28-E31 VanDerWaalsContact O-N 3.14Å; D28-R32 WeakPolarHBondContact O-CB 3.39Å; D28-R32 PolarHBondContact O-N 2.8Å; D28-R32 IonicContact OD2-CZ 2.72Å; D28-R32 IonicContact OD2-NH2 3.82Å; D28-R32 PolarHBondContact OD2-NH2 2.02Å; D28-L35 HydrophobicContact CB-CD1 4.24Å
29	Y	72.1	Confident	65.6	Low	4 Å²	4	93.3 Å²	93.3	2%	0.016	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-50.7	-31.6	172.3	-163.9	-100.7	0	0	0	115	N27 E31 L35 Y36 Y54 I193 K200 K201 H202	N27-Y29 WeakPolarHBondContact ND2-CB 2.94Å; N27-Y29 PolarHBondContact O-N 3.43Å; Y29-E31 VanDerWaalsContact C-N 3.35Å; Y29-L35 HydrophobicContact CD2-CB 3.79Å; Y29-L35 HydrophobicContact CE2-CB 4.14Å; Y29-Y36 WeakPolarHBondContact OH-CD2 3.33Å; Y29-Y54 AromaticContact CD2-CD1 3.62Å; Y29-Y54 HydrophobicContact CD2-CD1 3.62Å; Y29-Y54 HydrophobicContact CD2-CD2 4.49Å; Y29-Y54 AromaticContact CD2-CE1 3.62Å; Y29-Y54 HydrophobicContact CD2-CE1 3.62Å; Y29-Y54 HydrophobicContact CD2-CG 4.06Å; Y29-Y54 HydrophobicContact CE2-CD1 4.14Å; Y29-Y54 HydrophobicContact CE2-CE1 4.5Å; Y29-Y54 HydrophobicContact CG-CD1 4.4Å; Y29-Y54 AromaticContact CG-CE1 3.97Å; Y29-Y54 HydrophobicContact CG-CE1 3.97Å; Y29-I193 HydrophobicContact CD1-CB 4.28Å; Y29-I193 HydrophobicContact CD1-CD1 3.36Å; Y29-I193 HydrophobicContact CD1-CG1 4.41Å; Y29-I193 HydrophobicContact CD1-CG2 4.16Å; Y29-I193 HydrophobicContact CD2-CD1 4.03Å; Y29-I193 HydrophobicContact CE1-CD1 3.76Å; Y29-I193 HydrophobicContact CE2-CD1 4.39Å; Y29-I193 HydrophobicContact CG-CD1 3.49Å; Y29-I193 VanDerWaalsContact CG-CD1 3.49Å; Y29-K200 HydrophobicContact CD1-CB 4.19Å; Y29-K200 HydrophobicContact CD1-CD 4.29Å; Y29-K200 HydrophobicContact CE1-CB 3.84Å; Y29-K200 HydrophobicContact CE1-CD 4.28Å; Y29-K201 PolarHBondContact OH-O 2.84Å; Y29-H202 HydrophobicContact CE1-CB 4.33Å; Y29-H202 HydrophobicContact CE2-CB 3.8Å; Y29-H202 AromaticContact CE2-CG 3.76Å; Y29-H202 AromaticContact CE2-ND1 3.38Å; Y29-H202 WeakPolarHBondContact CE2-ND1 3.46Å; Y29-H202 AromaticContact CZ-ND1 3.77Å; Y29-H202 VanDerWaalsContact OH-CA 3.29Å; Y29-H202 WeakPolarHBondContact OH-CA 3.29Å; Y29-H202 WeakPolarHBondContact OH-CB 3.14Å; Y29-H202 PolarHBondContact OH-ND1 3.45Å
30	C	80.2	Confident	67	Low	24 Å²	24	86.2 Å²	86.2	16%	0.162	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-70.3	-35.7	-178	-63.8	0	0	0	0	111.7	N27 D28 C195 K200	N27-C30 WeakPolarHBondContact O-CB 3.2Å; N27-C30 PolarHBondContact O-N 2.94Å; D28-C30 PolarHBondContact O-N 2.89Å; D28-C30 VanDerWaalsContact O-N 3.15Å; C30-C195 WeakPolarHBondContact CA-SG 3.46Å; C30-C195 HydrophobicContact CB-CB 3.67Å; C30-C195 WeakPolarHBondContact CB-SG 3.4Å; C30-C195 WeakPolarHBondContact SG-CA 3.4Å; C30-C195 WeakPolarHBondContact SG-CB 3.1Å; C30-C195 CovalentContact SG-SG 2.03Å; C30-C195 PolarHBondContact SG-SG 3.27Å; C30-K200 PolarHBondContact O-NZ 2.86Å
31	E	77.2	Confident	68.8	Low	138 Å²	138	85.6 Å²	85.6	65%	0.645	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-18.8	-176.5	-63.9	174.9	-164.4	0	0	113	D28 Y29 P33	D28-E31 PolarHBondContact O-N 3.43Å; D28-E31 VanDerWaalsContact O-N 3.14Å; Y29-E31 VanDerWaalsContact C-N 3.35Å; E31-P33 WeakPolarHBondContact O-CD 3.46Å
32	R	74.6	Confident	70.3	Confident	81 Å²	81	80.5 Å²	80.5	31%	0.306	39%	0.391	S	S	.	.			trans	-115.3	92.4	-175.6	-72.5	-163	-71.2	168.8	-10	112.8	D28 D34 L35	D28-R32 WeakPolarHBondContact O-CB 3.39Å; D28-R32 PolarHBondContact O-N 2.8Å; D28-R32 IonicContact OD2-CZ 2.72Å; D28-R32 IonicContact OD2-NH2 3.82Å; D28-R32 PolarHBondContact OD2-NH2 2.02Å; R32-D34 WeakPolarHBondContact CA-OD1 3.29Å; R32-D34 WeakPolarHBondContact CB-OD1 3.49Å; R32-D34 PolarHBondContact O-N 3.24Å; R32-L35 HydrophobicContact CB-CD1 3.83Å; R32-L35 HydrophobicContact CB-CG 3.85Å; R32-L35 WeakPolarHBondContact O-CB 3.27Å; R32-L35 PolarHBondContact O-N 3.38Å
33	P	69.9	Low	72.1	Confident	102 Å²	102	77.7 Å²	77.7	66%	0.662	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-60.6	-27.6	177.1	-21.2	32.2	0	0	0	113.7	E31 L35 Y36	E31-P33 WeakPolarHBondContact O-CD 3.46Å; P33-L35 PolarHBondContact O-N 3.5Å; P33-Y36 VanDerWaalsContact O-CB 3.25Å; P33-Y36 WeakPolarHBondContact O-CB 3.07Å; P33-Y36 PolarHBondContact O-N 2.82Å
34	D	70.5	Confident	74.1	Confident	101 Å²	101	72.1 Å²	72.1	54%	0.54	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-58.5	-26.5	176.3	54.2	-62.3	0	0	0	112.9	R32 Y36	R32-D34 WeakPolarHBondContact CA-OD1 3.29Å; R32-D34 WeakPolarHBondContact CB-OD1 3.49Å; R32-D34 PolarHBondContact O-N 3.24Å; D34-Y36 PolarHBondContact O-N 3.37Å
35	L	74.9	Confident	76.3	Confident	6 Å²	6	67.8 Å²	67.8	3%	0.031	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-72.7	-11.6	176.9	-64.7	-179.1	0	0	0	114.2	D28 Y29 R32 P33 Y38 Y54 H202	D28-L35 HydrophobicContact CB-CD1 4.24Å; Y29-L35 HydrophobicContact CD2-CB 3.79Å; Y29-L35 HydrophobicContact CE2-CB 4.14Å; R32-L35 HydrophobicContact CB-CD1 3.83Å; R32-L35 HydrophobicContact CB-CG 3.85Å; R32-L35 WeakPolarHBondContact O-CB 3.27Å; R32-L35 PolarHBondContact O-N 3.38Å; P33-L35 PolarHBondContact O-N 3.5Å; L35-Y38 HydrophobicContact CD2-CD2 4.41Å; L35-Y38 HydrophobicContact CD2-CG 4.22Å; L35-Y54 HydrophobicContact CB-CD2 4.28Å; L35-Y54 HydrophobicContact CD1-CD2 3.7Å; L35-Y54 HydrophobicContact CD1-CE2 3.63Å; L35-Y54 HydrophobicContact CD2-CD2 4.22Å; L35-Y54 HydrophobicContact CG-CD2 4.31Å; L35-H202 PolarHBondContact O-CE1 3.43Å
36	Y	73.8	Confident	78.7	Confident	97 Å²	97	70.2 Å²	70.2	38%	0.38	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-63.7	-45.3	-176.9	-173.6	-89.5	0	0	0	112.2	Y29 P33 D34 K201 H202	Y29-Y36 WeakPolarHBondContact OH-CD2 3.33Å; P33-Y36 VanDerWaalsContact O-CB 3.25Å; P33-Y36 WeakPolarHBondContact O-CB 3.07Å; P33-Y36 PolarHBondContact O-N 2.82Å; D34-Y36 PolarHBondContact O-N 3.37Å; Y36-K201 VanDerWaalsContact CE2-O 3.29Å; Y36-K201 WeakPolarHBondContact CE2-O 3.06Å; Y36-H202 PolarHBondContact O-CE1 3.2Å; Y36-H202 PolarHBondContact O-ND1 2.99Å
37	N	77	Confident	80.7	Confident	134 Å²	134	70.9 Å²	70.9	72%	0.717	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-111.9	19.8	178.2	-66.4	-34.5	0	0	0	112	E39	N37-E39 PolarHBondContact O-N 3.36Å
38	Y	79.9	Confident	82.3	Confident	51 Å²	51	72.4 Å²	72.4	20%	0.2	37%	0.367	C	S	.	.			trans	-64.2	110.7	-177.6	177.3	-93.1	0	0	0	110.1	L35 I40 I52 H53	L35-Y38 HydrophobicContact CD2-CD2 4.41Å; L35-Y38 HydrophobicContact CD2-CG 4.22Å; Y38-I40 HydrophobicContact CE1-CD1 4.26Å; Y38-I40 HydrophobicContact CE1-CG1 4.43Å; Y38-I40 HydrophobicContact CE2-CD1 3.91Å; Y38-I40 HydrophobicContact CE2-CG1 4.19Å; Y38-I40 VanDerWaalsContact CZ-CD1 3.47Å; Y38-I40 WeakPolarHBondContact OH-CD1 3.33Å; Y38-I52 HydrophobicContact CE1-CG2 4.2Å; Y38-H53 WeakPolarHBondContact O-CA 3.38Å
39	E	87.3	Confident	83.6	Confident	83 Å²	83	69.7 Å²	69.7	39%	0.388	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	128.1	173.8	175.7	173.6	-152.9	0	0	108.3	N37 V41 R49 I52 H53	N37-E39 PolarHBondContact O-N 3.36Å; E39-V41 HydrophobicContact CG-CG2 4.17Å; E39-R49 IonicContact OE1-CZ 2.72Å; E39-R49 IonicContact OE1-NE 3.75Å; E39-R49 IonicContact OE1-NH2 2.84Å; E39-R49 PolarHBondContact OE1-NH2 3.34Å; E39-R49 IonicContact OE2-NH2 2.71Å; E39-I52 CarbonylContact C-O 3.56Å; E39-I52 WeakPolarHBondContact CA-O 3.2Å; E39-H53 VanDerWaalsContact CG-CE1 3.46Å; E39-H53 WeakPolarHBondContact CG-CE1 3.06Å; E39-H53 IonicContact OE1-CE1 3.36Å; E39-H53 IonicContact OE1-NE2 2.68Å
40	I	84.7	Confident	84.7	Confident	17 Å²	17	70.4 Å²	70.4	9%	0.087	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	112.5	167.2	-59.9	173.4	0	0	0	107.5	Y38 I42 S51 I52 I256 L259	Y38-I40 HydrophobicContact CE1-CD1 4.26Å; Y38-I40 HydrophobicContact CE1-CG1 4.43Å; Y38-I40 HydrophobicContact CE2-CD1 3.91Å; Y38-I40 HydrophobicContact CE2-CG1 4.19Å; Y38-I40 VanDerWaalsContact CZ-CD1 3.47Å; Y38-I40 WeakPolarHBondContact OH-CD1 3.33Å; I40-I42 HydrophobicContact CG2-CG1 4.26Å; I40-I42 PolarHBondContact O-N 3.4Å; I40-S51 CarbonylContact O-C 3.56Å; I40-S51 WeakPolarHBondContact O-CA 3.26Å; I40-I52 HydrophobicContact CB-CB 4.41Å; I40-I52 PolarHBondContact N-O 3.45Å; I40-I52 PolarHBondContact O-N 3.26Å; I40-I256 HydrophobicContact CD1-CD1 4Å; I40-L259 HydrophobicContact CB-CD2 4.34Å; I40-L259 HydrophobicContact CD1-CD1 3.94Å; I40-L259 HydrophobicContact CD1-CD2 3.83Å; I40-L259 HydrophobicContact CD1-CG 4.2Å; I40-L259 HydrophobicContact CG1-CD2 3.92Å; I40-L259 HydrophobicContact CG2-CD2 3.53Å; I40-L259 HydrophobicContact CG2-CG 4.07Å
41	V	88.8	Confident	85.3	Confident	57 Å²	57	69.3 Å²	69.3	35%	0.345	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	115.4	169.5	-175.8	0	0	0	0	108.1	E39 E44 R49	E39-V41 HydrophobicContact CG-CG2 4.17Å; V41-E44 HydrophobicContact CG1-CB 3.86Å; V41-R49 HydrophobicContact CG1-CG 4.43Å
42	I	86.3	Confident	85.9	Confident	40 Å²	40	62.7 Å²	62.7	21%	0.205	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-41.8	-179.1	-67.8	171.4	0	0	0	110.4	I40 Y50 I52 L243	I40-I42 HydrophobicContact CG2-CG1 4.26Å; I40-I42 PolarHBondContact O-N 3.4Å; I42-Y50 HydrophobicContact CB-CD1 4.04Å; I42-Y50 HydrophobicContact CD1-CD1 3.68Å; I42-Y50 HydrophobicContact CD1-CE1 3.59Å; I42-Y50 HydrophobicContact CG1-CD1 4.35Å; I42-Y50 HydrophobicContact CG2-CD1 4.45Å; I42-Y50 PolarHBondContact N-O 3.46Å; I42-I52 HydrophobicContact CD1-CD1 4.01Å; I42-I52 HydrophobicContact CD1-CG1 3.43Å; I42-I52 VanDerWaalsContact CD1-CG1 3.43Å; I42-I52 HydrophobicContact CG1-CG1 4.28Å; I42-L243 HydrophobicContact CD1-CD2 3.34Å
43	I	88.2	Confident	86.7	Confident	82 Å²	82	59.4 Å²	59.4	42%	0.421	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	138.2	178.5	-178.1	166.7	0	0	0	108.9	Y48 R49 Y50	I43-Y48 HydrophobicContact CG2-CD1 3.93Å; I43-Y48 HydrophobicContact CG2-CE1 3.63Å; I43-R49 CarbonylContact O-C 3.56Å; I43-R49 WeakPolarHBondContact O-CA 3.44Å; I43-Y50 PolarHBondContact N-O 3.09Å; I43-Y50 PolarHBondContact O-N 3.11Å
44	E	93.4	Very high	87.4	Confident	72 Å²	72	55.4 Å²	55.4	34%	0.336	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	128.2	173	-176.8	165.7	-177	0	0	109	V41 Y48 R49 K209 W210	V41-E44 HydrophobicContact CG1-CB 3.86Å; E44-Y48 WeakPolarHBondContact CA-O 3.04Å; E44-R49 HydrophobicContact CB-CG 4.32Å; E44-R49 HydrophobicContact CG-CB 4.29Å; E44-R49 HydrophobicContact CG-CG 4.24Å; E44-R49 IonicContact OE1-NH1 2.75Å; E44-R49 PolarHBondContact OE1-NH1 3.14Å; E44-R49 VanDerWaalsContact OE1-NH1 3.11Å; E44-R49 IonicContact OE2-CZ 3.9Å; E44-R49 IonicContact OE2-NE 3.1Å; E44-R49 IonicContact OE2-NH1 3.91Å; E44-R49 PolarHBondContact OE2-NH1 3.47Å; E44-K209 WeakPolarHBondContact OE1-CE 3.34Å; E44-K209 IonicContact OE1-NZ 2.81Å; E44-K209 PolarHBondContact OE1-NZ 3.01Å; E44-W210 HydrophobicContact CG-CZ2 4.07Å; E44-W210 PolarHBondContact OE1-NE1 3.09Å
45	N	93.9	Very high	88.2	Confident	74 Å²	74	53.5 Å²	53.5	40%	0.396	26%	0.262	S	S	.	.			trans	-137.4	-170.2	168.3	66.6	39.1	0	0	0	108.6	T47 Y48 W210	N45-T47 VanDerWaalsContact C-N 3.25Å; N45-T47 PolarHBondContact O-N 2.99Å; N45-T47 PolarHBondContact OD1-N 3.28Å; N45-T47 PolarHBondContact OD1-OG1 3.41Å; N45-Y48 PolarHBondContact N-O 3.27Å; N45-Y48 WeakPolarHBondContact OD1-CA 3.11Å; N45-Y48 WeakPolarHBondContact OD1-CB 3Å; N45-Y48 PolarHBondContact OD1-N 3.09Å; N45-Y48 PolarHBondContact OD1-O 3.28Å; N45-W210 WeakPolarHBondContact O-CH2 3.5Å; N45-W210 WeakPolarHBondContact O-CZ2 3.28Å
46	D	94	Very high	89.1	Confident	142 Å²	142	53.3 Å²	53.3	76%	0.759	26%	0.261	S	S	*	.	S	Bend	trans	-69.2	-18.3	-174.7	-63.6	-29.4	0	0	0	115.1	R62	D46-R62 WeakPolarHBondContact O-CD 3.25Å
47	T	95.9	Very high	90	Very high	69 Å²	69	49 Å²	49	42%	0.423	25%	0.245	S	C	.	.	S	Bend	trans	-123	-13.4	-174.1	63	0	0	0	0	113.9	N45 Q61 R62	N45-T47 VanDerWaalsContact C-N 3.25Å; N45-T47 PolarHBondContact O-N 2.99Å; N45-T47 PolarHBondContact OD1-N 3.28Å; N45-T47 PolarHBondContact OD1-OG1 3.41Å; T47-Q61 CarbonylContact O-C 3.58Å; T47-Q61 WeakPolarHBondContact O-CA 3.38Å; T47-R62 PolarHBondContact O-N 3.12Å
48	Y	96.1	Very high	90.9	Very high	69 Å²	69	42.6 Å²	42.6	27%	0.271	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	133.9	-173.5	-171.7	-86.6	0	0	0	111.3	I43 E44 N45 R59 I60 Q61	I43-Y48 HydrophobicContact CG2-CD1 3.93Å; I43-Y48 HydrophobicContact CG2-CE1 3.63Å; E44-Y48 WeakPolarHBondContact CA-O 3.04Å; N45-Y48 PolarHBondContact N-O 3.27Å; N45-Y48 WeakPolarHBondContact OD1-CA 3.11Å; N45-Y48 WeakPolarHBondContact OD1-CB 3Å; N45-Y48 PolarHBondContact OD1-N 3.09Å; N45-Y48 PolarHBondContact OD1-O 3.28Å; Y48-R59 HydrophobicContact CE2-CG 3.9Å; Y48-R59 WeakPolarHBondContact OH-CD 3.29Å; Y48-I60 WeakPolarHBondContact CA-O 3.45Å; Y48-Q61 HydrophobicContact CD2-CG 3.75Å; Y48-Q61 HydrophobicContact CE2-CG 3.9Å
49	R	96.9	Very high	91.8	Very high	20 Å²	20	44.6 Å²	44.6	8%	0.075	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	134.7	169.1	178.2	175.1	172.9	140.5	-8.5	110	E39 V41 I43 E44 R59 I60 W210	E39-R49 IonicContact OE1-CZ 2.72Å; E39-R49 IonicContact OE1-NE 3.75Å; E39-R49 IonicContact OE1-NH2 2.84Å; E39-R49 PolarHBondContact OE1-NH2 3.34Å; E39-R49 IonicContact OE2-NH2 2.71Å; V41-R49 HydrophobicContact CG1-CG 4.43Å; I43-R49 CarbonylContact O-C 3.56Å; I43-R49 WeakPolarHBondContact O-CA 3.44Å; E44-R49 HydrophobicContact CB-CG 4.32Å; E44-R49 HydrophobicContact CG-CB 4.29Å; E44-R49 HydrophobicContact CG-CG 4.24Å; E44-R49 IonicContact OE1-NH1 2.75Å; E44-R49 PolarHBondContact OE1-NH1 3.14Å; E44-R49 VanDerWaalsContact OE1-NH1 3.11Å; E44-R49 IonicContact OE2-CZ 3.9Å; E44-R49 IonicContact OE2-NE 3.1Å; E44-R49 IonicContact OE2-NH1 3.91Å; E44-R49 PolarHBondContact OE2-NH1 3.47Å; R49-R59 CarbonylContact O-C 3.46Å; R49-R59 WeakPolarHBondContact O-CA 3.03Å; R49-I60 HydrophobicContact CB-CB 4.24Å; R49-I60 HydrophobicContact CB-CD1 4.48Å; R49-I60 HydrophobicContact CB-CG1 4.5Å; R49-I60 PolarHBondContact N-O 3.48Å; R49-I60 PolarHBondContact O-N 3.41Å; R49-W210 HydrophobicContact CB-CH2 4Å; R49-W210 HydrophobicContact CB-CZ2 3.61Å
50	Y	94.8	Very high	92.3	Very high	20 Å²	20	40.7 Å²	40.7	8%	0.078	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	127.7	171.1	-174	-110.7	0	0	0	109.9	I42 I43 I52 S57 M58 R59 I242	I42-Y50 HydrophobicContact CB-CD1 4.04Å; I42-Y50 HydrophobicContact CD1-CD1 3.68Å; I42-Y50 HydrophobicContact CD1-CE1 3.59Å; I42-Y50 HydrophobicContact CG1-CD1 4.35Å; I42-Y50 HydrophobicContact CG2-CD1 4.45Å; I42-Y50 PolarHBondContact N-O 3.46Å; I43-Y50 PolarHBondContact N-O 3.09Å; I43-Y50 PolarHBondContact O-N 3.11Å; Y50-I52 HydrophobicContact CE1-CD1 3.75Å; Y50-I52 HydrophobicContact CE1-CG1 4.46Å; Y50-I52 WeakPolarHBondContact OH-CD1 3.24Å; Y50-S57 WeakPolarHBondContact OH-CB 3.15Å; Y50-S57 PolarHBondContact OH-OG 3.44Å; Y50-M58 WeakPolarHBondContact CA-O 3.45Å; Y50-R59 HydrophobicContact CD2-CB 3.88Å; Y50-R59 HydrophobicContact CD2-CG 4.26Å; Y50-R59 HydrophobicContact CE2-CB 4.37Å; Y50-I242 HydrophobicContact CE1-CG2 3.7Å; Y50-I242 WeakPolarHBondContact OH-CG2 3.42Å
51	S	92.9	Very high	92.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	148.4	-176.7	55.7	0	0	0	0	111.2	I40 H53 S57 M58	I40-S51 CarbonylContact O-C 3.56Å; I40-S51 WeakPolarHBondContact O-CA 3.26Å; S51-H53 PolarHBondContact OG-NE2 3.42Å; S51-S57 CarbonylContact O-C 3.54Å; S51-S57 WeakPolarHBondContact O-CA 3.34Å; S51-M58 PolarHBondContact N-O 3Å; S51-M58 PolarHBondContact O-N 3.19Å; S51-M58 VanDerWaalsContact OG-CE 3.27Å; S51-M58 WeakPolarHBondContact OG-CE 3.27Å; S51-M58 PolarHBondContact OG-O 3.36Å
52	I	90	Very high	93.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	131.7	176.8	-57.7	-61.8	0	0	0	108.4	Y38 E39 I40 I42 Y50 I222 L243	Y38-I52 HydrophobicContact CE1-CG2 4.2Å; E39-I52 CarbonylContact C-O 3.56Å; E39-I52 WeakPolarHBondContact CA-O 3.2Å; I40-I52 HydrophobicContact CB-CB 4.41Å; I40-I52 PolarHBondContact N-O 3.45Å; I40-I52 PolarHBondContact O-N 3.26Å; I42-I52 HydrophobicContact CD1-CD1 4.01Å; I42-I52 HydrophobicContact CD1-CG1 3.43Å; I42-I52 VanDerWaalsContact CD1-CG1 3.43Å; I42-I52 HydrophobicContact CG1-CG1 4.28Å; Y50-I52 HydrophobicContact CE1-CD1 3.75Å; Y50-I52 HydrophobicContact CE1-CG1 4.46Å; Y50-I52 WeakPolarHBondContact OH-CD1 3.24Å; I52-I222 HydrophobicContact CD1-CD1 3.74Å; I52-I222 HydrophobicContact CG2-CD1 3.66Å; I52-L243 HydrophobicContact CD1-CD1 4.42Å; I52-L243 HydrophobicContact CD1-CD2 4.46Å; I52-L243 HydrophobicContact CG1-CD2 4.44Å
53	H	90.7	Very high	93.7	Very high	12 Å²	12	46.9 Å²	46.9	6%	0.056	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	177.2	178.6	-61.8	-95	0	0	0	109.3	Y38 E39 S51 K55 Y56 I204	Y38-H53 WeakPolarHBondContact O-CA 3.38Å; E39-H53 VanDerWaalsContact CG-CE1 3.46Å; E39-H53 WeakPolarHBondContact CG-CE1 3.06Å; E39-H53 IonicContact OE1-CE1 3.36Å; E39-H53 IonicContact OE1-NE2 2.68Å; S51-H53 PolarHBondContact OG-NE2 3.42Å; H53-K55 PolarHBondContact O-N 3.48Å; H53-K55 VanDerWaalsContact O-N 3.11Å; H53-Y56 CarbonylContact C-O 3.57Å; H53-Y56 WeakPolarHBondContact CA-O 3.39Å; H53-Y56 WeakPolarHBondContact CB-O 3.28Å; H53-Y56 PolarHBondContact N-O 3.3Å; H53-Y56 PolarHBondContact O-N 3.39Å; H53-Y56 VanDerWaalsContact O-O 3.07Å; H53-I204 HydrophobicContact CB-CD1 3.53Å; H53-I204 HydrophobicContact CB-CG1 3.79Å; H53-I204 HydrophobicContact CB-CG2 4.21Å
54	Y	86.1	Confident	94.2	Very high	18 Å²	18	46.1 Å²	46.1	7%	0.071	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	118.1	175.2	177.7	-113.4	0	0	0	111.2	N27 Y29 L35 Y56 I193	N27-Y54 VanDerWaalsContact CG-OH 3.28Å; N27-Y54 PolarHBondContact ND2-OH 2.91Å; N27-Y54 VanDerWaalsContact ND2-OH 3.1Å; N27-Y54 PolarHBondContact OD1-OH 3.39Å; N27-Y54 VanDerWaalsContact OD1-OH 3.08Å; Y29-Y54 AromaticContact CD2-CD1 3.62Å; Y29-Y54 HydrophobicContact CD2-CD1 3.62Å; Y29-Y54 HydrophobicContact CD2-CD2 4.49Å; Y29-Y54 AromaticContact CD2-CE1 3.62Å; Y29-Y54 HydrophobicContact CD2-CE1 3.62Å; Y29-Y54 HydrophobicContact CD2-CG 4.06Å; Y29-Y54 HydrophobicContact CE2-CD1 4.14Å; Y29-Y54 HydrophobicContact CE2-CE1 4.5Å; Y29-Y54 HydrophobicContact CG-CD1 4.4Å; Y29-Y54 AromaticContact CG-CE1 3.97Å; Y29-Y54 HydrophobicContact CG-CE1 3.97Å; L35-Y54 HydrophobicContact CB-CD2 4.28Å; L35-Y54 HydrophobicContact CD1-CD2 3.7Å; L35-Y54 HydrophobicContact CD1-CE2 3.63Å; L35-Y54 HydrophobicContact CD2-CD2 4.22Å; L35-Y54 HydrophobicContact CG-CD2 4.31Å; Y54-Y56 PolarHBondContact O-N 3.45Å; Y54-Y56 VanDerWaalsContact O-N 3.07Å; Y54-I193 HydrophobicContact CD1-CD1 4.47Å; Y54-I193 HydrophobicContact CE1-CD1 3.86Å
55	K	86.7	Confident	94.2	Very high	60 Å²	60	47.7 Å²	47.7	26%	0.261	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	-1.5	-176.6	-64.1	-172.8	175	-175.7	0	116.8	N27 H53 Y92 A221 I222	N27-K55 WeakPolarHBondContact OD1-CE 3.02Å; N27-K55 PolarHBondContact OD1-NZ 2.7Å; H53-K55 PolarHBondContact O-N 3.48Å; H53-K55 VanDerWaalsContact O-N 3.11Å; K55-Y92 PolarHBondContact NZ-O 3.39Å; K55-A221 CarbonylContact O-C 3.46Å; K55-A221 WeakPolarHBondContact O-CA 3.36Å; K55-I222 PolarHBondContact O-N 3.28Å
56	Y	93	Very high	94.1	Very high	3 Å²	3	46.6 Å²	46.6	1%	0.012	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	144.5	-173.2	-77.8	-89.3	0	0	0	111.5	H53 Y54 Y92 I189 I204 F219 E220 A221 I222	H53-Y56 CarbonylContact C-O 3.57Å; H53-Y56 WeakPolarHBondContact CA-O 3.39Å; H53-Y56 WeakPolarHBondContact CB-O 3.28Å; H53-Y56 PolarHBondContact N-O 3.3Å; H53-Y56 PolarHBondContact O-N 3.39Å; H53-Y56 VanDerWaalsContact O-O 3.07Å; Y54-Y56 PolarHBondContact O-N 3.45Å; Y54-Y56 VanDerWaalsContact O-N 3.07Å; Y56-Y92 HydrophobicContact CD2-CE1 4.36Å; Y56-Y92 HydrophobicContact CD2-CE2 4.15Å; Y56-Y92 HydrophobicContact CE2-CD1 4.12Å; Y56-Y92 AromaticContact CE2-CD2 3.53Å; Y56-Y92 HydrophobicContact CE2-CD2 3.53Å; Y56-Y92 HydrophobicContact CE2-CE1 4.11Å; Y56-Y92 AromaticContact CE2-CE2 3.52Å; Y56-Y92 HydrophobicContact CE2-CE2 3.52Å; Y56-Y92 AromaticContact CE2-CG 3.86Å; Y56-Y92 HydrophobicContact CE2-CG 3.86Å; Y56-Y92 AromaticContact CE2-CZ 3.84Å; Y56-Y92 AromaticContact CZ-CD2 3.98Å; Y56-Y92 PolarHBondContact OH-N 3.4Å; Y56-I189 HydrophobicContact CD1-CD1 3.99Å; Y56-I189 HydrophobicContact CD2-CD1 4.3Å; Y56-I189 HydrophobicContact CE1-CD1 4.19Å; Y56-I189 HydrophobicContact CE2-CD1 4.49Å; Y56-I189 HydrophobicContact CG-CD1 4.05Å; Y56-I204 HydrophobicContact CD2-CD1 4.11Å; Y56-I204 HydrophobicContact CG-CD1 4.09Å; Y56-F219 HydrophobicContact CD1-CB 4.19Å; Y56-E220 CarbonylContact C-O 3.55Å; Y56-E220 WeakPolarHBondContact CA-O 3.06Å; Y56-A221 HydrophobicContact CD1-CB 4.4Å; Y56-A221 HydrophobicContact CE1-CB 4.02Å; Y56-I222 WeakPolarHBondContact O-CD1 3.32Å
57	S	93.2	Very high	94	Very high	5 Å²	5	42.9 Å²	42.9	4%	0.035	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	148.8	161.4	64.3	0	0	0	0	109	Y50 S51 F219 E220	Y50-S57 WeakPolarHBondContact OH-CB 3.15Å; Y50-S57 PolarHBondContact OH-OG 3.44Å; S51-S57 CarbonylContact O-C 3.54Å; S51-S57 WeakPolarHBondContact O-CA 3.34Å; S57-F219 VanDerWaalsContact O-CA 3.27Å; S57-F219 WeakPolarHBondContact O-CA 3.37Å; S57-E220 PolarHBondContact N-O 3.49Å; S57-E220 PolarHBondContact O-N 3.44Å; S57-E220 PolarHBondContact OG-O 3.37Å
58	M	96.9	Very high	93.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	119.3	172.5	176.7	178.5	63.2	0	0	108.6	Y50 S51 I60 V206 V217 V218 F219	Y50-M58 WeakPolarHBondContact CA-O 3.45Å; S51-M58 PolarHBondContact N-O 3Å; S51-M58 PolarHBondContact O-N 3.19Å; S51-M58 VanDerWaalsContact OG-CE 3.27Å; S51-M58 WeakPolarHBondContact OG-CE 3.27Å; S51-M58 PolarHBondContact OG-O 3.36Å; M58-I60 HydrophobicContact CE-CD1 4.14Å; M58-I60 HydrophobicContact CG-CD1 4.49Å; M58-I60 HydrophobicContact CG-CG1 4.11Å; M58-I60 HydrophobicContact SD-CD1 4.14Å; M58-I60 HydrophobicContact SD-CG1 4.38Å; M58-V206 HydrophobicContact SD-CG2 4.18Å; M58-V217 HydrophobicContact CG-CG1 3.83Å; M58-V217 HydrophobicContact SD-CG1 4.09Å; M58-V218 WeakPolarHBondContact CA-O 3.25Å; M58-F219 HydrophobicContact CB-CD1 3.97Å; M58-F219 HydrophobicContact CB-CE1 3.87Å; M58-F219 HydrophobicContact CG-CD1 4.16Å; M58-F219 HydrophobicContact CG-CE1 3.7Å; M58-F219 HydrophobicContact CG-CZ 4.2Å; M58-F219 HydrophobicContact SD-CE1 3.59Å; M58-F219 VanDerWaalsContact SD-CE1 3.59Å; M58-F219 HydrophobicContact SD-CZ 3.84Å
59	R	97.1	Very high	93.6	Very high	94 Å²	94	39.3 Å²	39.3	36%	0.355	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.9	173	-173.6	179.1	65.5	161.4	5.9	109.5	Y48 R49 Y50 Q61 V217 V218	Y48-R59 HydrophobicContact CE2-CG 3.9Å; Y48-R59 WeakPolarHBondContact OH-CD 3.29Å; R49-R59 CarbonylContact O-C 3.46Å; R49-R59 WeakPolarHBondContact O-CA 3.03Å; Y50-R59 HydrophobicContact CD2-CB 3.88Å; Y50-R59 HydrophobicContact CD2-CG 4.26Å; Y50-R59 HydrophobicContact CE2-CB 4.37Å; R59-Q61 HydrophobicContact CG-CG 4.4Å; R59-V217 CarbonylContact O-C 3.55Å; R59-V217 WeakPolarHBondContact O-CA 3.49Å; R59-V218 PolarHBondContact N-O 3.22Å; R59-V218 PolarHBondContact O-N 3.24Å
60	I	98.3	Very high	93.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	133.3	176.9	-48.1	-179	0	0	0	108.7	Y48 R49 M58 V206 W210 L216 V217	Y48-I60 WeakPolarHBondContact CA-O 3.45Å; R49-I60 HydrophobicContact CB-CB 4.24Å; R49-I60 HydrophobicContact CB-CD1 4.48Å; R49-I60 HydrophobicContact CB-CG1 4.5Å; R49-I60 PolarHBondContact N-O 3.48Å; R49-I60 PolarHBondContact O-N 3.41Å; M58-I60 HydrophobicContact CE-CD1 4.14Å; M58-I60 HydrophobicContact CG-CD1 4.49Å; M58-I60 HydrophobicContact CG-CG1 4.11Å; M58-I60 HydrophobicContact SD-CD1 4.14Å; M58-I60 HydrophobicContact SD-CG1 4.38Å; I60-V206 HydrophobicContact CD1-CG1 4.09Å; I60-W210 HydrophobicContact CB-CD2 4.38Å; I60-W210 HydrophobicContact CB-CE3 4.12Å; I60-W210 HydrophobicContact CD1-CB 3.93Å; I60-W210 HydrophobicContact CD1-CD2 4.2Å; I60-W210 HydrophobicContact CD1-CG 3.79Å; I60-W210 HydrophobicContact CG2-CB 4.04Å; I60-W210 HydrophobicContact CG2-CD2 3.84Å; I60-W210 HydrophobicContact CG2-CE3 3.36Å; I60-W210 HydrophobicContact CG2-CG 4.14Å; I60-W210 HydrophobicContact CG2-CZ3 4.04Å; I60-L216 CarbonylContact C-O 3.52Å; I60-L216 WeakPolarHBondContact CA-O 3.18Å; I60-V217 HydrophobicContact CG1-CG1 4.28Å; I60-V217 HydrophobicContact CG1-CG2 4.16Å; I60-V217 HydrophobicContact CG2-CG2 4.15Å
61	Q	97.9	Very high	92.8	Very high	39 Å²	39	45.7 Å²	45.7	18%	0.182	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	132.4	177.2	-64	179.6	-110.3	0	0	109.7	T47 Y48 R59 Q64 S215 L216	T47-Q61 CarbonylContact O-C 3.58Å; T47-Q61 WeakPolarHBondContact O-CA 3.38Å; Y48-Q61 HydrophobicContact CD2-CG 3.75Å; Y48-Q61 HydrophobicContact CE2-CG 3.9Å; R59-Q61 HydrophobicContact CG-CG 4.4Å; Q61-Q64 HydrophobicContact CB-CG 3.61Å; Q61-S215 CarbonylContact O-C 3.54Å; Q61-S215 WeakPolarHBondContact O-CA 3.06Å; Q61-L216 PolarHBondContact N-O 2.89Å; Q61-L216 PolarHBondContact O-N 3.42Å
62	R	97.1	Very high	92.7	Very high	81 Å²	81	50.5 Å²	50.5	31%	0.306	26%	0.258	S	S	.	.	S	Bend	trans	-89.3	166.4	171.8	-66.2	-171.8	74.1	-161.6	-4.3	111.7	D46 T47 Q64 W210 G214	D46-R62 WeakPolarHBondContact O-CD 3.25Å; T47-R62 PolarHBondContact O-N 3.12Å; R62-Q64 PolarHBondContact O-N 2.03Å; R62-Q64 PolarHBondContact O-NE2 3Å; R62-W210 HydrophobicContact CG-CE3 4.01Å; R62-W210 HydrophobicContact CG-CZ3 3.79Å; R62-G214 CarbonylContact C-O 3.52Å
63	N	95.5	Very high	92.8	Very high	125 Å²	125	51 Å²	51	67%	0.668	26%	0.26	S	S	*	.	S	Bend	trans	54.7	38.1	175.4	-52.4	-25.5	0	0	0	112.4	G214	N63-G214 PolarHBondContact N-O 2.9Å
64	Q	97	Very high	92.5	Very high	66 Å²	66	57 Å²	57	31%	0.308	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-92.7	145.2	175.9	-58.9	-55.7	-69.1	0	0	109.6	Q61 R62 Y172 G214 L216	Q61-Q64 HydrophobicContact CB-CG 3.61Å; R62-Q64 PolarHBondContact O-N 2.03Å; R62-Q64 PolarHBondContact O-NE2 3Å; Q64-Y172 WeakPolarHBondContact O-CE2 3.3Å; Q64-Y172 PolarHBondContact O-OH 2.97Å; Q64-Y172 VanDerWaalsContact O-OH 3.13Å; Q64-G214 PolarHBondContact N-O 2.79Å; Q64-L216 HydrophobicContact CB-CB 3.97Å; Q64-L216 HydrophobicContact CG-CB 3.87Å; Q64-L216 HydrophobicContact CG-CD2 4.48Å
65	S	94.6	Very high	92.7	Very high	105 Å²	105	59 Å²	59	73%	0.734	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-72.6	159.7	169.1	-56.4	0	0	0	0	110.8	P67	S65-P67 WeakPolarHBondContact O-CD 3.32Å
66	Q	92	Very high	93	Very high	51 Å²	51	60 Å²	60	24%	0.238	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-59.1	125.5	175.9	-167.5	177	12.2	0	0	110.5	V68 S70 Y172 D174	Q66-V68 VanDerWaalsContact C-N 3.26Å; Q66-V68 WeakPolarHBondContact CG-O 3.45Å; Q66-V68 PolarHBondContact NE2-O 3.02Å; Q66-V68 VanDerWaalsContact NE2-O 3.1Å; Q66-V68 PolarHBondContact O-N 3.05Å; Q66-S70 PolarHBondContact NE2-OG 2.82Å; Q66-S70 VanDerWaalsContact NE2-OG 3.1Å; Q66-S70 PolarHBondContact OE1-OG 3.36Å; Q66-Y172 VanDerWaalsContact CA-CZ 3.48Å; Q66-Y172 HydrophobicContact CB-CD1 4.27Å; Q66-Y172 HydrophobicContact CB-CE1 3.64Å; Q66-Y172 HydrophobicContact CG-CD1 3.85Å; Q66-Y172 HydrophobicContact CG-CE1 3.66Å; Q66-Y172 PolarHBondContact N-OH 3.35Å; Q66-D174 PolarHBondContact NE2-OD1 3.3Å
67	P	91.8	Very high	92.9	Very high	64 Å²	64	60.5 Å²	60.5	42%	0.416	32%	0.315	S	S	.	.	S	Bend	trans	-67	-26	-178.5	-22	32	0	0	0	114.2	S65 L162 Y172 L216	S65-P67 WeakPolarHBondContact O-CD 3.32Å; P67-L162 HydrophobicContact CB-CD1 3.77Å; P67-L162 HydrophobicContact CG-CD1 4.1Å; P67-Y172 HydrophobicContact CG-CD2 4.37Å; P67-Y172 HydrophobicContact CG-CG 4.4Å; P67-L216 HydrophobicContact CG-CD1 3.81Å; P67-L216 HydrophobicContact CG-CD2 4.45Å
68	V	92.2	Very high	92.6	Very high	11 Å²	11	68.7 Å²	68.7	7%	0.067	35%	0.346	C	S	.	.	S	Bend	trans	-136.5	121.9	179.4	-179.9	0	0	0	0	108.1	Q66 H72 F73 I134 L139 L162	Q66-V68 VanDerWaalsContact C-N 3.26Å; Q66-V68 WeakPolarHBondContact CG-O 3.45Å; Q66-V68 PolarHBondContact NE2-O 3.02Å; Q66-V68 VanDerWaalsContact NE2-O 3.1Å; Q66-V68 PolarHBondContact O-N 3.05Å; V68-H72 HydrophobicContact CG1-CB 4.21Å; V68-F73 HydrophobicContact CB-CE2 4.16Å; V68-F73 HydrophobicContact CG1-CE2 3.94Å; V68-I134 HydrophobicContact CG1-CD1 3.94Å; V68-L139 HydrophobicContact CG2-CD1 4.35Å; V68-L139 HydrophobicContact CG2-CD2 3.72Å; V68-L162 HydrophobicContact CG2-CD1 3.94Å; V68-L162 HydrophobicContact CG2-CD2 4.07Å
69	P	90.6	Very high	92	Very high	52 Å²	52	73.7 Å²	73.7	34%	0.338	37%	0.373	S	S	.	.			trans	-55	141.2	-178.9	-25.1	33.1	0	0	0	113.5	E71 H72	P69-E71 VanDerWaalsContact C-N 3.26Å; P69-E71 HydrophobicContact CB-CG 4.26Å; P69-E71 WeakPolarHBondContact CB-OE1 3.36Å; P69-E71 VanDerWaalsContact CB-OE2 3.23Å; P69-E71 WeakPolarHBondContact CB-OE2 3.22Å; P69-E71 PolarHBondContact O-N 3.49Å; P69-H72 WeakPolarHBondContact O-CB 3.29Å; P69-H72 PolarHBondContact O-N 2.94Å; P69-H72 VanDerWaalsContact O-N 3.1Å
70	S	87.6	Confident	91.7	Very high	41 Å²	41	74.7 Å²	74.7	29%	0.287	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-60.7	-32.3	-174.2	-80.1	0	0	0	0	113.6	Q66 H72 F73 K143	Q66-S70 PolarHBondContact NE2-OG 2.82Å; Q66-S70 VanDerWaalsContact NE2-OG 3.1Å; Q66-S70 PolarHBondContact OE1-OG 3.36Å; S70-H72 PolarHBondContact O-N 3.28Å; S70-F73 WeakPolarHBondContact O-CB 3.38Å; S70-F73 PolarHBondContact O-N 3.47Å; S70-F73 VanDerWaalsContact O-N 3.15Å; S70-K143 VanDerWaalsContact CB-NZ 3.32Å; S70-K143 PolarHBondContact OG-NZ 2.93Å
71	E	88	Confident	91.4	Very high	133 Å²	133	78.6 Å²	78.6	62%	0.621	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-64.8	-19.1	177.8	63.6	-87.1	-159.6	0	0	113.5	P69 F73 I74	P69-E71 VanDerWaalsContact C-N 3.26Å; P69-E71 HydrophobicContact CB-CG 4.26Å; P69-E71 WeakPolarHBondContact CB-OE1 3.36Å; P69-E71 VanDerWaalsContact CB-OE2 3.23Å; P69-E71 WeakPolarHBondContact CB-OE2 3.22Å; P69-E71 PolarHBondContact O-N 3.49Å; E71-F73 VanDerWaalsContact C-N 3.27Å; E71-F73 PolarHBondContact O-N 2.77Å; E71-I74 VanDerWaalsContact O-CG2 3.22Å; E71-I74 WeakPolarHBondContact O-CG2 3.47Å
72	H	91.2	Very high	91.1	Very high	101 Å²	101	79.9 Å²	79.9	47%	0.468	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-77.9	-13.6	176.1	-62.7	-179.1	0	0	0	112.8	V68 P69 S70 I74 I134	V68-H72 HydrophobicContact CG1-CB 4.21Å; P69-H72 WeakPolarHBondContact O-CB 3.29Å; P69-H72 PolarHBondContact O-N 2.94Å; P69-H72 VanDerWaalsContact O-N 3.1Å; S70-H72 PolarHBondContact O-N 3.28Å; H72-I74 VanDerWaalsContact C-N 3.26Å; H72-I74 PolarHBondContact O-N 3.3Å; H72-I74 VanDerWaalsContact O-N 3.08Å; H72-I134 HydrophobicContact CB-CD1 3.43Å; H72-I134 VanDerWaalsContact CB-CD1 3.43Å
73	F	92.4	Very high	90.8	Very high	9 Å²	9	76 Å²	76	4%	0.039	39%	0.389	C	S	.	.			trans	-85	63.1	176.2	-72	-93.2	0	0	0	111.4	V68 S70 E71 Y132 I134 K143 T160 L162	V68-F73 HydrophobicContact CB-CE2 4.16Å; V68-F73 HydrophobicContact CG1-CE2 3.94Å; S70-F73 WeakPolarHBondContact O-CB 3.38Å; S70-F73 PolarHBondContact O-N 3.47Å; S70-F73 VanDerWaalsContact O-N 3.15Å; E71-F73 VanDerWaalsContact C-N 3.27Å; E71-F73 PolarHBondContact O-N 2.77Å; F73-Y132 VanDerWaalsContact O-CD1 3.3Å; F73-Y132 WeakPolarHBondContact O-CD1 3.49Å; F73-I134 HydrophobicContact CD1-CB 4.08Å; F73-I134 HydrophobicContact CD1-CG2 3.82Å; F73-I134 HydrophobicContact CE1-CB 4.19Å; F73-I134 HydrophobicContact CE1-CG2 3.4Å; F73-I134 VanDerWaalsContact CE1-CG2 3.4Å; F73-I134 HydrophobicContact CE2-CG2 4.28Å; F73-I134 HydrophobicContact CG-CB 4.46Å; F73-I134 HydrophobicContact CG-CG2 4.43Å; F73-I134 HydrophobicContact CZ-CG2 3.66Å; F73-K143 HydrophobicContact CB-CD 4.37Å; F73-K143 HydrophobicContact CD1-CB 3.48Å; F73-K143 VanDerWaalsContact CD1-CB 3.48Å; F73-K143 HydrophobicContact CD2-CB 4.42Å; F73-K143 HydrophobicContact CD2-CD 4.15Å; F73-K143 HydrophobicContact CE1-CB 3.59Å; F73-K143 HydrophobicContact CG-CB 3.91Å; F73-K143 HydrophobicContact CG-CD 4.12Å; F73-K143 HydrophobicContact CZ-CB 4.14Å; F73-T160 HydrophobicContact CE1-CG2 4.15Å; F73-T160 HydrophobicContact CE2-CG2 4.25Å; F73-T160 HydrophobicContact CZ-CG2 3.52Å; F73-L162 HydrophobicContact CZ-CD2 4.08Å
74	I	84.3	Confident	90.7	Very high	140 Å²	140	73.7 Å²	73.7	72%	0.718	38%	0.376	S	S	*	.			trans	-78.8	-26.7	-173.2	59.8	174.2	0	0	0	114.2	E71 H72 K76	E71-I74 VanDerWaalsContact O-CG2 3.22Å; E71-I74 WeakPolarHBondContact O-CG2 3.47Å; H72-I74 VanDerWaalsContact C-N 3.26Å; H72-I74 PolarHBondContact O-N 3.3Å; H72-I74 VanDerWaalsContact O-N 3.08Å; I74-K76 PolarHBondContact O-N 2.82Å
75	S	90	Very high	90.3	Very high	59 Å²	59	71.6 Å²	71.6	41%	0.413	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	97.5	-172.2	-59.5	0	0	0	0	111.2	Y132 V133	S75-Y132 CarbonylContact O-C 3.55Å; S75-Y132 VanDerWaalsContact O-CA 3.31Å; S75-Y132 WeakPolarHBondContact O-CA 3.38Å; S75-V133 PolarHBondContact O-N 3.1Å
76	K	92	Very high	90.1	Very high	81 Å²	81	69.7 Å²	69.7	35%	0.352	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	130.1	168.1	-165.7	174.1	-170.1	167.8	0	109.7	I74 E130 T131 Y132	I74-K76 PolarHBondContact O-N 2.82Å; K76-E130 IonicContact NZ-OE1 2.66Å; K76-E130 PolarHBondContact NZ-OE1 3.11Å; K76-T131 WeakPolarHBondContact CA-O 3.4Å; K76-Y132 HydrophobicContact CB-CD1 3.99Å; K76-Y132 HydrophobicContact CB-CE1 3.8Å; K76-Y132 HydrophobicContact CD-CE1 4.24Å; K76-Y132 HydrophobicContact CG-CD1 4.4Å; K76-Y132 HydrophobicContact CG-CE1 4.01Å
77	I	90.8	Very high	90.1	Very high	14 Å²	14	68.6 Å²	68.6	7%	0.072	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	153.8	177.4	62.6	161.9	0	0	0	110.4	Y81 T131 V133	I77-Y81 HydrophobicContact CB-CD2 4.22Å; I77-Y81 HydrophobicContact CB-CG 4.08Å; I77-Y81 VanDerWaalsContact CD1-CB 3.44Å; I77-Y81 HydrophobicContact CD1-CD1 4.17Å; I77-Y81 HydrophobicContact CD1-CG 3.97Å; I77-Y81 HydrophobicContact CG2-CD1 3.91Å; I77-Y81 HydrophobicContact CG2-CD2 3.68Å; I77-Y81 HydrophobicContact CG2-CE1 4.17Å; I77-Y81 HydrophobicContact CG2-CE2 3.96Å; I77-Y81 HydrophobicContact CG2-CG 3.66Å; I77-T131 HydrophobicContact CD1-CG2 3.65Å; I77-T131 HydrophobicContact CG1-CG2 3.68Å; I77-T131 PolarHBondContact N-O 2.76Å; I77-V133 HydrophobicContact CD1-CG2 3.61Å; I77-V133 HydrophobicContact CG1-CG2 3.98Å; I77-V133 HydrophobicContact CG2-CB 4.49Å; I77-V133 HydrophobicContact CG2-CG2 3.94Å
78	Y	87	Confident	90.1	Very high	176 Å²	176	70 Å²	70	69%	0.69	37%	0.371	S	S	*	.			trans	-116.7	139.8	177.3	-58.7	-80.3	0	0	0	109.5	K80	Y78-K80 PolarHBondContact O-N 2.9Å
79	D	84.9	Confident	90.2	Very high	106 Å²	106	69.9 Å²	69.9	57%	0.567	37%	0.369	S	S	*	.	S	Bend	trans	50.1	-107.7	175.5	-172.4	25.8	0	0	0	113.2	Y102 H103	D79-Y102 VanDerWaalsContact OD1-CE2 3.32Å; D79-Y102 WeakPolarHBondContact OD1-CE2 3.37Å; D79-H103 IonicContact OD1-CE1 4Å; D79-H103 IonicContact OD1-NE2 2.69Å
80	K	90.2	Very high	90.3	Very high	114 Å²	114	69.6 Å²	69.6	50%	0.496	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	124.7	-173.5	-170.3	176	-176.9	170.9	0	111.2	Y78 Q100 S101 Y102	Y78-K80 PolarHBondContact O-N 2.9Å; K80-Q100 HydrophobicContact CG-CG 3.98Å; K80-S101 WeakPolarHBondContact CA-O 3.47Å; K80-Y102 HydrophobicContact CB-CD2 3.78Å; K80-Y102 HydrophobicContact CB-CE2 4.3Å; K80-Y102 HydrophobicContact CD-CD2 4.34Å; K80-Y102 HydrophobicContact CG-CD2 3.98Å
81	Y	91.9	Very high	90.7	Very high	82 Å²	82	67.6 Å²	67.6	32%	0.322	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	123.6	-178.5	-172.2	-100.7	0	0	0	112.5	I77 I83 Q100 S101 V133 R135	I77-Y81 HydrophobicContact CB-CD2 4.22Å; I77-Y81 HydrophobicContact CB-CG 4.08Å; I77-Y81 VanDerWaalsContact CD1-CB 3.44Å; I77-Y81 HydrophobicContact CD1-CD1 4.17Å; I77-Y81 HydrophobicContact CD1-CG 3.97Å; I77-Y81 HydrophobicContact CG2-CD1 3.91Å; I77-Y81 HydrophobicContact CG2-CD2 3.68Å; I77-Y81 HydrophobicContact CG2-CE1 4.17Å; I77-Y81 HydrophobicContact CG2-CE2 3.96Å; I77-Y81 HydrophobicContact CG2-CG 3.66Å; Y81-I83 HydrophobicContact CD1-CD1 4.33Å; Y81-I83 HydrophobicContact CD1-CG1 3.57Å; Y81-I83 HydrophobicContact CE1-CG1 3.84Å; Y81-Q100 WeakPolarHBondContact O-CA 3.41Å; Y81-S101 PolarHBondContact N-O 3.43Å; Y81-S101 PolarHBondContact O-N 2.82Å; Y81-V133 HydrophobicContact CD1-CG2 4.38Å; Y81-V133 HydrophobicContact CE1-CG1 4.49Å; Y81-R135 PolarHBondContact OH-NH2 3.24Å
82	D	92.5	Very high	90.9	Very high	66 Å²	66	62 Å²	62	35%	0.353	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	123.2	176.5	-83.9	-15.1	0	0	0	111.4	R98 Q100	D82-R98 IonicContact OD2-CZ 3.77Å; D82-R98 IonicContact OD2-NE 3.11Å; D82-R98 IonicContact OD2-NH1 3.74Å; D82-R98 PolarHBondContact OD2-NH1 3.14Å; D82-Q100 WeakPolarHBondContact OD1-CG 3.19Å; D82-Q100 PolarHBondContact OD1-NE2 2.81Å
83	I	91.4	Very high	90.7	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	117.8	178.2	-48.2	174.7	0	0	0	108.2	Y81 P85 I99 V133 L140 V142	Y81-I83 HydrophobicContact CD1-CD1 4.33Å; Y81-I83 HydrophobicContact CD1-CG1 3.57Å; Y81-I83 HydrophobicContact CE1-CG1 3.84Å; I83-P85 WeakPolarHBondContact O-CD 3.32Å; I83-I99 CarbonylContact C-O 3.57Å; I83-I99 WeakPolarHBondContact CA-O 3.46Å; I83-I99 HydrophobicContact CB-CB 4.38Å; I83-I99 WeakPolarHBondContact CB-O 3.1Å; I83-I99 PolarHBondContact N-O 3.05Å; I83-I99 PolarHBondContact O-N 3.41Å; I83-V133 HydrophobicContact CD1-CG1 4.01Å; I83-V133 HydrophobicContact CD1-CG2 4.36Å; I83-L140 HydrophobicContact CB-CD1 4.49Å; I83-L140 HydrophobicContact CD1-CD1 4.23Å; I83-L140 HydrophobicContact CG2-CD1 3.26Å; I83-L140 HydrophobicContact CG2-CD2 3.69Å; I83-L140 HydrophobicContact CG2-CG 4.1Å; I83-V142 HydrophobicContact CD1-CG2 3.96Å
84	L	91.6	Very high	90.7	Very high	77 Å²	77	61.8 Å²	61.8	40%	0.403	35%	0.349	S	S	.	.			trans	-96	111.9	168.3	-66.1	170.5	0	0	0	107.9	G86 R97 R98	L84-G86 PolarHBondContact O-N 3.23Å; L84-R97 WeakPolarHBondContact CD2-O 3.38Å; L84-R98 HydrophobicContact CD2-CB 4.2Å; L84-R98 HydrophobicContact CD2-CG 4.36Å
85	P	90.5	Very high	91.2	Very high	22 Å²	22	60.4 Å²	60.4	14%	0.143	34%	0.339	C	S	.	.			trans	-57.6	136.5	174.9	-22.9	34.3	0	0	0	110.7	I83 F87 F89 I99 L140	I83-P85 WeakPolarHBondContact O-CD 3.32Å; P85-F87 HydrophobicContact CB-CD2 4.39Å; P85-F87 HydrophobicContact CB-CE2 4.3Å; P85-F87 HydrophobicContact CB-CZ 4.48Å; P85-F87 PolarHBondContact O-N 3.08Å; P85-F89 HydrophobicContact CB-CD1 4.48Å; P85-F89 HydrophobicContact CB-CE1 4.04Å; P85-F89 HydrophobicContact CG-CE1 3.79Å; P85-I99 HydrophobicContact CG-CD1 4.17Å; P85-L140 HydrophobicContact CG-CD2 4.43Å
86	G	88.9	Confident	91.5	Very high	64 Å²	64	58 Å²	58	66%	0.66	32%	0.322	S	S	*	.	S	Bend	trans	-76.1	2.9	175.5	0	0	0	0	0	114	L84	L84-G86 PolarHBondContact O-N 3.23Å
87	F	92.9	Very high	91.6	Very high	29 Å²	29	60.3 Å²	60.3	13%	0.127	33%	0.328	C	S	.	.	S	Bend	trans	-140.9	154.5	-174.6	48.6	-97	0	0	0	109.8	P85 F89 K137 L140 I163 P165	P85-F87 HydrophobicContact CB-CD2 4.39Å; P85-F87 HydrophobicContact CB-CE2 4.3Å; P85-F87 HydrophobicContact CB-CZ 4.48Å; P85-F87 PolarHBondContact O-N 3.08Å; F87-F89 HydrophobicContact CD2-CB 4.46Å; F87-F89 AromaticContact CD2-CD1 3.78Å; F87-F89 HydrophobicContact CD2-CD1 3.78Å; F87-F89 HydrophobicContact CD2-CG 4.49Å; F87-F89 AromaticContact CE2-CD1 3.61Å; F87-F89 HydrophobicContact CE2-CD1 3.61Å; F87-F89 HydrophobicContact CE2-CE1 4.03Å; F87-F89 HydrophobicContact CE2-CG 4.33Å; F87-K137 WeakPolarHBondContact CD1-O 3.27Å; F87-L140 HydrophobicContact CE1-CB 4.33Å; F87-L140 HydrophobicContact CZ-CB 3.96Å; F87-I163 HydrophobicContact CE2-CG2 4.38Å; F87-I163 WeakPolarHBondContact CZ-O 3.41Å; F87-P165 HydrophobicContact CB-CB 4.14Å; F87-P165 HydrophobicContact CB-CG 4.12Å; F87-P165 HydrophobicContact CD1-CG 4.02Å; F87-P165 VanDerWaalsContact CD2-CA 3.47Å; F87-P165 HydrophobicContact CD2-CB 4.06Å; F87-P165 HydrophobicContact CD2-CG 4.07Å; F87-P165 HydrophobicContact CE1-CG 4.44Å; F87-P165 HydrophobicContact CE2-CG 4.47Å; F87-P165 HydrophobicContact CG-CB 4.09Å; F87-P165 HydrophobicContact CG-CG 3.81Å
88	S	90.7	Very high	91.8	Very high	93 Å²	93	62.9 Å²	62.9	65%	0.65	34%	0.337	S	S	*	.			trans	-90.2	132.1	175.2	-173.4	0	0	0	0	110.1
89	F	94.5	Very high	92.2	Very high	8 Å²	8	54.6 Å²	54.6	4%	0.035	31%	0.305	C	S	.	.			trans	-148.7	169.4	173.7	74.5	-81.2	0	0	0	110.5	P85 F87 V96 I99 I163 P165	P85-F89 HydrophobicContact CB-CD1 4.48Å; P85-F89 HydrophobicContact CB-CE1 4.04Å; P85-F89 HydrophobicContact CG-CE1 3.79Å; F87-F89 HydrophobicContact CD2-CB 4.46Å; F87-F89 AromaticContact CD2-CD1 3.78Å; F87-F89 HydrophobicContact CD2-CD1 3.78Å; F87-F89 HydrophobicContact CD2-CG 4.49Å; F87-F89 AromaticContact CE2-CD1 3.61Å; F87-F89 HydrophobicContact CE2-CD1 3.61Å; F87-F89 HydrophobicContact CE2-CE1 4.03Å; F87-F89 HydrophobicContact CE2-CG 4.33Å; F89-V96 HydrophobicContact CD1-CB 4.22Å; F89-V96 HydrophobicContact CD2-CB 4.45Å; F89-V96 HydrophobicContact CD2-CG2 4.05Å; F89-V96 HydrophobicContact CE1-CB 3.73Å; F89-V96 HydrophobicContact CE1-CG1 3.8Å; F89-V96 HydrophobicContact CE1-CG2 4.22Å; F89-V96 HydrophobicContact CE2-CB 3.98Å; F89-V96 HydrophobicContact CE2-CG1 4.38Å; F89-V96 HydrophobicContact CE2-CG2 3.51Å; F89-V96 HydrophobicContact CZ-CB 3.59Å; F89-V96 HydrophobicContact CZ-CG1 3.59Å; F89-V96 HydrophobicContact CZ-CG2 3.6Å; F89-V96 PolarHBondContact O-N 2.99Å; F89-I99 HydrophobicContact CE1-CD1 4.24Å; F89-I99 HydrophobicContact CZ-CD1 3.75Å; F89-I163 HydrophobicContact CD2-CG2 4.29Å; F89-I163 HydrophobicContact CE1-CG2 4.04Å; F89-I163 HydrophobicContact CE2-CG2 3.78Å; F89-I163 HydrophobicContact CZ-CG2 3.64Å; F89-P165 WeakPolarHBondContact CB-O 3.32Å
90	S	93.4	Very high	92.6	Very high	46 Å²	46	50.2 Å²	50.2	32%	0.322	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	144.6	178.5	-55.3	0	0	0	0	111.4	S94 H95	S90-S94 CarbonylContact C-O 3.56Å; S90-S94 VanDerWaalsContact CA-O 3.28Å; S90-S94 WeakPolarHBondContact CA-O 3.44Å; S90-H95 PolarHBondContact OG-ND1 2.71Å
91	Y	95.2	Very high	92.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	121.9	175.3	-176.3	-93.9	0	0	0	108.7	G93 S94 V108 I116 N118 I119 V169 R190	Y91-G93 PolarHBondContact O-N 2.82Å; Y91-G93 VanDerWaalsContact O-N 3.07Å; Y91-S94 PolarHBondContact N-O 3.29Å; Y91-S94 PolarHBondContact O-N 3.22Å; Y91-V108 HydrophobicContact CD1-CB 4.29Å; Y91-V108 HydrophobicContact CD1-CG1 4.08Å; Y91-V108 HydrophobicContact CD1-CG2 4.48Å; Y91-V108 HydrophobicContact CE1-CG2 4.42Å; Y91-V108 HydrophobicContact CG-CG1 4.09Å; Y91-I116 HydrophobicContact CD1-CD1 4.23Å; Y91-I116 HydrophobicContact CD1-CG1 4.43Å; Y91-N118 PolarHBondContact OH-O 3.06Å; Y91-I119 HydrophobicContact CE2-CD1 4.37Å; Y91-I119 HydrophobicContact CE2-CG1 4.08Å; Y91-V169 HydrophobicContact CE2-CG2 4.47Å; Y91-R190 WeakPolarHBondContact CE1-O 3.33Å; Y91-R190 VanDerWaalsContact OH-C 3.28Å; Y91-R190 PolarHBondContact OH-N 2.82Å; Y91-R190 VanDerWaalsContact OH-N 3.16Å; Y91-R190 PolarHBondContact OH-O 2.78Å
92	Y	92.1	Very high	92.6	Very high	15 Å²	15	45.4 Å²	45.4	6%	0.059	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	23	-173.1	-84.7	-99	0	0	0	115.5	K55 Y56 I189 H202	K55-Y92 PolarHBondContact NZ-O 3.39Å; Y56-Y92 HydrophobicContact CD2-CE1 4.36Å; Y56-Y92 HydrophobicContact CD2-CE2 4.15Å; Y56-Y92 HydrophobicContact CE2-CD1 4.12Å; Y56-Y92 AromaticContact CE2-CD2 3.53Å; Y56-Y92 HydrophobicContact CE2-CD2 3.53Å; Y56-Y92 HydrophobicContact CE2-CE1 4.11Å; Y56-Y92 AromaticContact CE2-CE2 3.52Å; Y56-Y92 HydrophobicContact CE2-CE2 3.52Å; Y56-Y92 AromaticContact CE2-CG 3.86Å; Y56-Y92 HydrophobicContact CE2-CG 3.86Å; Y56-Y92 AromaticContact CE2-CZ 3.84Å; Y56-Y92 AromaticContact CZ-CD2 3.98Å; Y56-Y92 PolarHBondContact OH-N 3.4Å; Y92-I189 HydrophobicContact CE2-CD1 4.23Å; Y92-H202 HydrophobicContact CE1-CB 4.04Å; Y92-H202 AromaticContact CE1-CD2 3.71Å; Y92-H202 AromaticContact CZ-CD2 4Å; Y92-H202 PolarHBondContact OH-CD2 2.82Å
93	G	88.8	Confident	92.4	Very high	61 Å²	61	46.1 Å²	46.1	63%	0.629	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.7	-1.7	-177.5	0	0	0	0	0	114.7	Y91	Y91-G93 PolarHBondContact O-N 2.82Å; Y91-G93 VanDerWaalsContact O-N 3.07Å
94	S	91.7	Very high	92.2	Very high	45 Å²	45	48 Å²	48	32%	0.315	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	136.7	177.6	-63.8	0	0	0	0	111.4	S90 Y91 V96	S90-S94 CarbonylContact C-O 3.56Å; S90-S94 VanDerWaalsContact CA-O 3.28Å; S90-S94 WeakPolarHBondContact CA-O 3.44Å; Y91-S94 PolarHBondContact N-O 3.29Å; Y91-S94 PolarHBondContact O-N 3.22Å; S94-V96 PolarHBondContact O-N 2.96Å
95	H	94.5	Very high	92.3	Very high	111 Å²	111	44.8 Å²	44.8	51%	0.514	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	124.9	177	-69.3	-61.1	0	0	0	111.5	S90 D110 V111	S90-H95 PolarHBondContact OG-ND1 2.71Å; H95-D110 WeakPolarHBondContact O-CA 3.16Å; H95-D110 WeakPolarHBondContact O-CB 3.47Å; H95-V111 HydrophobicContact CB-CG2 3.94Å; H95-V111 PolarHBondContact O-N 3.29Å
96	V	95.7	Very high	92.5	Very high	9 Å²	9	43.9 Å²	43.9	6%	0.055	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	135.1	-177.4	-178.4	0	0	0	0	110.6	F89 S94 I99 V108 I116	F89-V96 HydrophobicContact CD1-CB 4.22Å; F89-V96 HydrophobicContact CD2-CB 4.45Å; F89-V96 HydrophobicContact CD2-CG2 4.05Å; F89-V96 HydrophobicContact CE1-CB 3.73Å; F89-V96 HydrophobicContact CE1-CG1 3.8Å; F89-V96 HydrophobicContact CE1-CG2 4.22Å; F89-V96 HydrophobicContact CE2-CB 3.98Å; F89-V96 HydrophobicContact CE2-CG1 4.38Å; F89-V96 HydrophobicContact CE2-CG2 3.51Å; F89-V96 HydrophobicContact CZ-CB 3.59Å; F89-V96 HydrophobicContact CZ-CG1 3.59Å; F89-V96 HydrophobicContact CZ-CG2 3.6Å; F89-V96 PolarHBondContact O-N 2.99Å; S94-V96 PolarHBondContact O-N 2.96Å; V96-I99 HydrophobicContact CG1-CD1 4.4Å; V96-I99 HydrophobicContact CG1-CG1 4Å; V96-V108 HydrophobicContact CB-CG1 4.4Å; V96-V108 HydrophobicContact CG1-CG1 3.82Å; V96-V108 HydrophobicContact CG2-CG1 3.65Å; V96-I116 HydrophobicContact CG2-CD1 4.2Å
97	R	94.4	Very high	92.9	Very high	129 Å²	129	42.1 Å²	42.1	49%	0.487	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	-37.6	173.9	176.2	59.2	175.5	172	-0.1	112.6	L84 Y109 D110 V111 Y113	L84-R97 WeakPolarHBondContact CD2-O 3.38Å; R97-Y109 PolarHBondContact N-O 2.92Å; R97-D110 WeakPolarHBondContact CB-O 3.37Å; R97-V111 HydrophobicContact CB-CG2 4.35Å; R97-Y113 HydrophobicContact CG-CE1 4.45Å
98	R	94.6	Very high	93	Very high	68 Å²	68	40.8 Å²	40.8	26%	0.257	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	139.8	-173.9	-178.2	-174.3	-63.2	-165.5	8.1	109.4	D82 L84 Y109	D82-R98 IonicContact OD2-CZ 3.77Å; D82-R98 IonicContact OD2-NE 3.11Å; D82-R98 IonicContact OD2-NH1 3.74Å; D82-R98 PolarHBondContact OD2-NH1 3.14Å; L84-R98 HydrophobicContact CD2-CB 4.2Å; L84-R98 HydrophobicContact CD2-CG 4.36Å; R98-Y109 PolarHBondContact N-O 3.47Å; R98-Y109 PolarHBondContact O-N 3.38Å
99	I	95.2	Very high	93.3	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	137.4	165.6	-67.5	167.9	0	0	0	107	I83 P85 F89 V96 E106 L107 V108 L140 I163	I83-I99 CarbonylContact C-O 3.57Å; I83-I99 WeakPolarHBondContact CA-O 3.46Å; I83-I99 HydrophobicContact CB-CB 4.38Å; I83-I99 WeakPolarHBondContact CB-O 3.1Å; I83-I99 PolarHBondContact N-O 3.05Å; I83-I99 PolarHBondContact O-N 3.41Å; P85-I99 HydrophobicContact CG-CD1 4.17Å; F89-I99 HydrophobicContact CE1-CD1 4.24Å; F89-I99 HydrophobicContact CZ-CD1 3.75Å; V96-I99 HydrophobicContact CG1-CD1 4.4Å; V96-I99 HydrophobicContact CG1-CG1 4Å; I99-E106 HydrophobicContact CG2-CB 3.67Å; I99-E106 HydrophobicContact CG2-CG 4.2Å; I99-L107 CarbonylContact C-O 3.51Å; I99-L107 WeakPolarHBondContact CA-O 3.36Å; I99-V108 HydrophobicContact CG1-CG1 4.43Å; I99-L140 HydrophobicContact CD1-CD2 3.57Å; I99-I163 HydrophobicContact CD1-CD1 3.37Å
100	Q	94.7	Very high	93.2	Very high	14 Å²	14	39.7 Å²	39.7	7%	0.065	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	115.3	178.3	179.4	172.6	90.3	0	0	108.7	K80 Y81 D82 E106 L107 Y109	K80-Q100 HydrophobicContact CG-CG 3.98Å; Y81-Q100 WeakPolarHBondContact O-CA 3.41Å; D82-Q100 WeakPolarHBondContact OD1-CG 3.19Å; D82-Q100 PolarHBondContact OD1-NE2 2.81Å; Q100-E106 CarbonylContact O-C 3.57Å; Q100-E106 WeakPolarHBondContact O-CA 3.37Å; Q100-L107 HydrophobicContact CB-CB 4.33Å; Q100-L107 PolarHBondContact N-O 3.45Å; Q100-L107 PolarHBondContact O-N 3.43Å; Q100-Y109 HydrophobicContact CB-CE2 3.96Å
101	S	92.8	Very high	93.1	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.007	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	123.9	171.9	-176	0	0	0	0	108.5	K80 Y81 R144	K80-S101 WeakPolarHBondContact CA-O 3.47Å; Y81-S101 PolarHBondContact N-O 3.43Å; Y81-S101 PolarHBondContact O-N 2.82Å; S101-R144 PolarHBondContact OG-NH2 3.34Å
102	Y	89.4	Confident	92.9	Very high	95 Å²	95	44.9 Å²	44.9	37%	0.373	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	117.4	179.6	-176.7	-116.5	0	0	0	110.2	D79 K80 D104 A105	D79-Y102 VanDerWaalsContact OD1-CE2 3.32Å; D79-Y102 WeakPolarHBondContact OD1-CE2 3.37Å; K80-Y102 HydrophobicContact CB-CD2 3.78Å; K80-Y102 HydrophobicContact CB-CE2 4.3Å; K80-Y102 HydrophobicContact CD-CD2 4.34Å; K80-Y102 HydrophobicContact CG-CD2 3.98Å; Y102-D104 PolarHBondContact O-N 2.69Å; Y102-D104 VanDerWaalsContact O-N 3.08Å; Y102-A105 PolarHBondContact N-O 2.97Å; Y102-A105 PolarHBondContact O-N 3.41Å; Y102-A105 VanDerWaalsContact O-O 3.06Å
103	H	87.5	Confident	92.9	Very high	81 Å²	81	50.1 Å²	50.1	38%	0.375	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.5	-115.3	-173.7	-59	-60	0	0	0	111.7	D79 A105 R144	D79-H103 IonicContact OD1-CE1 4Å; D79-H103 IonicContact OD1-NE2 2.69Å; H103-A105 VanDerWaalsContact C-N 3.34Å; H103-A105 PolarHBondContact O-N 2.79Å; H103-R144 PolarHBondContact O-NE 2.9Å; H103-R144 PolarHBondContact O-NH2 3.01Å
104	D	88	Confident	93.1	Very high	39 Å²	39	49 Å²	49	21%	0.209	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	6.6	-173.2	-65.2	-34.5	0	0	0	115.4	Y102 Y122 Y126 Y146	Y102-D104 PolarHBondContact O-N 2.69Å; Y102-D104 VanDerWaalsContact O-N 3.08Å; D104-Y122 HydrophobicContact CB-CD2 3.88Å; D104-Y122 HydrophobicContact CB-CG 3.8Å; D104-Y126 WeakPolarHBondContact OD1-CE1 3.46Å; D104-Y146 WeakPolarHBondContact OD1-CE1 3.45Å; D104-Y146 PolarHBondContact OD1-OH 2.81Å
105	A	93.4	Very high	93.3	Very high	9 Å²	9	49.1 Å²	49.1	7%	0.074	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	152.8	-172.2	0	0	0	0	0	113.6	Y102 H103 L107 I119 Y120 R144	Y102-A105 PolarHBondContact N-O 2.97Å; Y102-A105 PolarHBondContact O-N 3.41Å; Y102-A105 VanDerWaalsContact O-O 3.06Å; H103-A105 VanDerWaalsContact C-N 3.34Å; H103-A105 PolarHBondContact O-N 2.79Å; A105-L107 HydrophobicContact CB-CD1 4.35Å; A105-I119 WeakPolarHBondContact CA-O 3.25Å; A105-Y120 HydrophobicContact CB-CD1 3.67Å; A105-Y120 HydrophobicContact CB-CE1 3.51Å; A105-R144 PolarHBondContact O-NH2 3.28Å
106	E	95.2	Very high	93.3	Very high	3 Å²	3	44.3 Å²	44.3	1%	0.014	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	113.4	158.9	-58.8	81.8	-172.2	0	0	109.6	I99 Q100 N118 I119 V142 R144	I99-E106 HydrophobicContact CG2-CB 3.67Å; I99-E106 HydrophobicContact CG2-CG 4.2Å; Q100-E106 CarbonylContact O-C 3.57Å; Q100-E106 WeakPolarHBondContact O-CA 3.37Å; E106-N118 CarbonylContact O-C 3.51Å; E106-N118 VanDerWaalsContact O-CA 3.28Å; E106-N118 WeakPolarHBondContact O-CA 3.33Å; E106-I119 HydrophobicContact CB-CB 4.19Å; E106-I119 PolarHBondContact N-O 3.4Å; E106-I119 PolarHBondContact O-N 3.26Å; E106-I119 WeakPolarHBondContact OE2-CB 3Å; E106-I119 WeakPolarHBondContact OE2-CG2 3.32Å; E106-I119 VanDerWaalsContact OE2-O 3.09Å; E106-V142 HydrophobicContact CG-CG2 4.08Å; E106-V142 WeakPolarHBondContact OE1-CB 3.45Å; E106-V142 WeakPolarHBondContact OE1-CG1 3.36Å; E106-R144 IonicContact OE1-CZ 3.93Å; E106-R144 IonicContact OE1-NH1 2.78Å; E106-R144 PolarHBondContact OE1-NH1 2.82Å; E106-R144 IonicContact OE1-NH2 3.21Å; E106-R144 IonicContact OE2-NH1 3.54Å
107	L	96	Very high	93.3	Very high	28 Å²	28	43.9 Å²	43.9	15%	0.147	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	125	175.8	-65.7	77.7	0	0	0	109	I99 Q100 A105 Y109	I99-L107 CarbonylContact C-O 3.51Å; I99-L107 WeakPolarHBondContact CA-O 3.36Å; Q100-L107 HydrophobicContact CB-CB 4.33Å; Q100-L107 PolarHBondContact N-O 3.45Å; Q100-L107 PolarHBondContact O-N 3.43Å; A105-L107 HydrophobicContact CB-CD1 4.35Å; L107-Y109 HydrophobicContact CB-CD2 4.47Å; L107-Y109 HydrophobicContact CB-CE2 3.61Å; L107-Y109 WeakPolarHBondContact CD2-OH 3.18Å; L107-Y109 WeakPolarHBondContact O-CD2 3.46Å
108	V	95.7	Very high	93.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127.9	-174.4	-169.5	0	0	0	0	109.8	Y91 V96 I99 H115 I116 G117 I119	Y91-V108 HydrophobicContact CD1-CB 4.29Å; Y91-V108 HydrophobicContact CD1-CG1 4.08Å; Y91-V108 HydrophobicContact CD1-CG2 4.48Å; Y91-V108 HydrophobicContact CE1-CG2 4.42Å; Y91-V108 HydrophobicContact CG-CG1 4.09Å; V96-V108 HydrophobicContact CB-CG1 4.4Å; V96-V108 HydrophobicContact CG1-CG1 3.82Å; V96-V108 HydrophobicContact CG2-CG1 3.65Å; I99-V108 HydrophobicContact CG1-CG1 4.43Å; V108-H115 PolarHBondContact O-CD2 2.86Å; V108-I116 HydrophobicContact CB-CG1 4.19Å; V108-I116 HydrophobicContact CG1-CD1 3.93Å; V108-I116 HydrophobicContact CG1-CG1 3.95Å; V108-I116 VanDerWaalsContact O-CG1 3.26Å; V108-I116 WeakPolarHBondContact O-CG1 3.45Å; V108-I116 PolarHBondContact O-N 2.99Å; V108-G117 PolarHBondContact N-O 2.8Å; V108-G117 PolarHBondContact O-N 3.15Å; V108-I119 HydrophobicContact CG2-CD1 4.18Å; V108-I119 HydrophobicContact CG2-CG1 4.17Å
109	Y	96	Very high	93.7	Very high	45 Å²	45	35 Å²	35	18%	0.176	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	139.8	-178.7	-61.7	-95.7	0	0	0	111.9	R97 R98 Q100 L107 S114 H115	R97-Y109 PolarHBondContact N-O 2.92Å; R98-Y109 PolarHBondContact N-O 3.47Å; R98-Y109 PolarHBondContact O-N 3.38Å; Q100-Y109 HydrophobicContact CB-CE2 3.96Å; L107-Y109 HydrophobicContact CB-CD2 4.47Å; L107-Y109 HydrophobicContact CB-CE2 3.61Å; L107-Y109 WeakPolarHBondContact CD2-OH 3.18Å; L107-Y109 WeakPolarHBondContact O-CD2 3.46Å; Y109-S114 VanDerWaalsContact CA-O 3.26Å; Y109-S114 WeakPolarHBondContact CA-O 3.16Å; Y109-H115 HydrophobicContact CD1-CB 4.04Å; Y109-H115 HydrophobicContact CE1-CB 3.74Å
110	D	94	Very high	93.8	Very high	34 Å²	34	36.6 Å²	36.6	18%	0.182	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	179.1	175.6	71.7	13.8	0	0	0	113.4	H95 R97 G112 Y113 S114 I116	H95-D110 WeakPolarHBondContact O-CA 3.16Å; H95-D110 WeakPolarHBondContact O-CB 3.47Å; R97-D110 WeakPolarHBondContact CB-O 3.37Å; D110-G112 PolarHBondContact O-N 3.22Å; D110-G112 VanDerWaalsContact OD1-C 3.28Å; D110-G112 VanDerWaalsContact OD1-CA 3.26Å; D110-G112 WeakPolarHBondContact OD1-CA 3.38Å; D110-G112 PolarHBondContact OD1-N 3.29Å; D110-Y113 WeakPolarHBondContact O-CA 3.41Å; D110-Y113 PolarHBondContact O-N 3.19Å; D110-Y113 PolarHBondContact OD1-N 3.33Å; D110-Y113 VanDerWaalsContact OD1-N 3.12Å; D110-S114 PolarHBondContact N-O 3.14Å; D110-S114 WeakPolarHBondContact OD1-CB 3.47Å; D110-S114 PolarHBondContact OD1-N 3.27Å; D110-S114 WeakPolarHBondContact OD2-CB 3.44Å; D110-I116 HydrophobicContact CB-CD1 4.23Å; D110-I116 HydrophobicContact CB-CG2 3.77Å
111	V	91	Very high	93.9	Very high	92 Å²	92	36 Å²	36	56%	0.558	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-28	176.4	-176.6	0	0	0	0	113.2	H95 R97 Y113	H95-V111 HydrophobicContact CB-CG2 3.94Å; H95-V111 PolarHBondContact O-N 3.29Å; R97-V111 HydrophobicContact CB-CG2 4.35Å; V111-Y113 PolarHBondContact O-N 3.3Å
112	G	91.1	Very high	94.1	Very high	62 Å²	62	37.5 Å²	37.5	64%	0.639	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	7.9	174.3	0	0	0	0	0	114	D110 S114	D110-G112 PolarHBondContact O-N 3.22Å; D110-G112 VanDerWaalsContact OD1-C 3.28Å; D110-G112 VanDerWaalsContact OD1-CA 3.26Å; D110-G112 WeakPolarHBondContact OD1-CA 3.38Å; D110-G112 PolarHBondContact OD1-N 3.29Å; G112-S114 PolarHBondContact O-N 2.99Å
113	Y	90.8	Very high	94.4	Very high	125 Å²	125	33 Å²	33	49%	0.49	18%	0.178	S	C	.	.			trans	58.3	21.8	-171.5	-59.5	-81.3	0	0	0	113.8	R97 D110 V111	R97-Y113 HydrophobicContact CG-CE1 4.45Å; D110-Y113 WeakPolarHBondContact O-CA 3.41Å; D110-Y113 PolarHBondContact O-N 3.19Å; D110-Y113 PolarHBondContact OD1-N 3.33Å; D110-Y113 VanDerWaalsContact OD1-N 3.12Å; V111-Y113 PolarHBondContact O-N 3.3Å
114	S	93.6	Very high	94.7	Very high	37 Å²	37	30.3 Å²	30.3	26%	0.259	17%	0.167	S	C	.	.			trans	-76.9	132.9	171	-146.2	0	0	0	0	109.5	Y109 D110 G112 I116 R199	Y109-S114 VanDerWaalsContact CA-O 3.26Å; Y109-S114 WeakPolarHBondContact CA-O 3.16Å; D110-S114 PolarHBondContact N-O 3.14Å; D110-S114 WeakPolarHBondContact OD1-CB 3.47Å; D110-S114 PolarHBondContact OD1-N 3.27Å; D110-S114 WeakPolarHBondContact OD2-CB 3.44Å; G112-S114 PolarHBondContact O-N 2.99Å; S114-I116 PolarHBondContact O-N 2.86Å; S114-R199 PolarHBondContact OG-NH2 3.3Å
115	H	95	Very high	94.9	Very high	48 Å²	48	34.1 Å²	34.1	22%	0.222	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	115.6	170	-179.2	-137.2	0	0	0	109.4	V108 Y109 G117 N118 L192	V108-H115 PolarHBondContact O-CD2 2.86Å; Y109-H115 HydrophobicContact CD1-CB 4.04Å; Y109-H115 HydrophobicContact CE1-CB 3.74Å; H115-G117 PolarHBondContact CD2-O 3.39Å; H115-G117 PolarHBondContact NE2-O 2.85Å; H115-N118 PolarHBondContact CE1-OD1 3.17Å; H115-N118 VanDerWaalsContact CE1-OD1 3.25Å; H115-N118 PolarHBondContact NE2-OD1 2.95Å; H115-L192 VanDerWaalsContact ND1-CD1 3.29Å; H115-L192 WeakPolarHBondContact ND1-CD1 3.35Å
116	I	95.5	Very high	94.9	Very high	10 Å²	10	36.6 Å²	36.6	5%	0.051	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	-7.9	-174.6	57.3	166	0	0	0	113.3	Y91 V96 V108 D110 S114 L192	Y91-I116 HydrophobicContact CD1-CD1 4.23Å; Y91-I116 HydrophobicContact CD1-CG1 4.43Å; V96-I116 HydrophobicContact CG2-CD1 4.2Å; V108-I116 HydrophobicContact CB-CG1 4.19Å; V108-I116 HydrophobicContact CG1-CD1 3.93Å; V108-I116 HydrophobicContact CG1-CG1 3.95Å; V108-I116 VanDerWaalsContact O-CG1 3.26Å; V108-I116 WeakPolarHBondContact O-CG1 3.45Å; V108-I116 PolarHBondContact O-N 2.99Å; D110-I116 HydrophobicContact CB-CD1 4.23Å; D110-I116 HydrophobicContact CB-CG2 3.77Å; S114-I116 PolarHBondContact O-N 2.86Å; I116-L192 PolarHBondContact O-N 2.88Å
117	G	96.7	Very high	94.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.8	-172.7	179.1	0	0	0	0	0	114.2	V108 H115 R190	V108-G117 PolarHBondContact N-O 2.8Å; V108-G117 PolarHBondContact O-N 3.15Å; H115-G117 PolarHBondContact CD2-O 3.39Å; H115-G117 PolarHBondContact NE2-O 2.85Å; G117-R190 CarbonylContact C-O 3.58Å; G117-R190 WeakPolarHBondContact CA-O 3.43Å
118	N	97.5	Very high	94.7	Very high	9 Å²	9	44.2 Å²	44.2	5%	0.048	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	145.7	-175.1	-49.8	-80.5	0	0	0	110.1	Y91 E106 H115 Y120 R190	Y91-N118 PolarHBondContact OH-O 3.06Å; E106-N118 CarbonylContact O-C 3.51Å; E106-N118 VanDerWaalsContact O-CA 3.28Å; E106-N118 WeakPolarHBondContact O-CA 3.33Å; H115-N118 PolarHBondContact CE1-OD1 3.17Å; H115-N118 VanDerWaalsContact CE1-OD1 3.25Å; H115-N118 PolarHBondContact NE2-OD1 2.95Å; N118-Y120 HydrophobicContact CB-CD2 4.02Å; N118-Y120 HydrophobicContact CB-CE1 4.27Å; N118-Y120 HydrophobicContact CB-CE2 3.31Å; N118-Y120 VanDerWaalsContact CB-CZ 3.42Å; N118-Y120 WeakPolarHBondContact CB-OH 3Å; N118-Y120 VanDerWaalsContact CG-OH 3.24Å; N118-Y120 PolarHBondContact ND2-OH 2.91Å; N118-R190 HydrophobicContact CB-CB 4.42Å; N118-R190 PolarHBondContact N-O 3.05Å; N118-R190 PolarHBondContact O-N 2.89Å
119	I	97.9	Very high	94.7	Very high	2 Å²	2	46 Å²	46	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	132	167.7	-60.3	169.1	0	0	0	105.9	Y91 A105 E106 V108 I163 V169 F171 I189	Y91-I119 HydrophobicContact CE2-CD1 4.37Å; Y91-I119 HydrophobicContact CE2-CG1 4.08Å; A105-I119 WeakPolarHBondContact CA-O 3.25Å; E106-I119 HydrophobicContact CB-CB 4.19Å; E106-I119 PolarHBondContact N-O 3.4Å; E106-I119 PolarHBondContact O-N 3.26Å; E106-I119 WeakPolarHBondContact OE2-CB 3Å; E106-I119 WeakPolarHBondContact OE2-CG2 3.32Å; E106-I119 VanDerWaalsContact OE2-O 3.09Å; V108-I119 HydrophobicContact CG2-CD1 4.18Å; V108-I119 HydrophobicContact CG2-CG1 4.17Å; I119-I163 HydrophobicContact CD1-CD1 3.53Å; I119-I163 HydrophobicContact CD1-CG1 4.13Å; I119-V169 HydrophobicContact CD1-CG1 4.02Å; I119-V169 HydrophobicContact CD1-CG2 4.09Å; I119-V169 HydrophobicContact CG1-CG1 4.41Å; I119-V169 HydrophobicContact CG2-CG1 4.07Å; I119-F171 HydrophobicContact CG2-CE1 3.37Å; I119-F171 HydrophobicContact CG2-CZ 3.6Å; I119-I189 HydrophobicContact CG1-CG2 4.43Å
120	Y	97.7	Very high	94.6	Very high	35 Å²	35	46.4 Å²	46.4	14%	0.137	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	127.9	-177.6	-65.1	-78.8	0	0	0	108.8	A105 N118 Y122 F171 S187 K188 R190	A105-Y120 HydrophobicContact CB-CD1 3.67Å; A105-Y120 HydrophobicContact CB-CE1 3.51Å; N118-Y120 HydrophobicContact CB-CD2 4.02Å; N118-Y120 HydrophobicContact CB-CE1 4.27Å; N118-Y120 HydrophobicContact CB-CE2 3.31Å; N118-Y120 VanDerWaalsContact CB-CZ 3.42Å; N118-Y120 WeakPolarHBondContact CB-OH 3Å; N118-Y120 VanDerWaalsContact CG-OH 3.24Å; N118-Y120 PolarHBondContact ND2-OH 2.91Å; Y120-Y122 HydrophobicContact CD1-CE1 4.32Å; Y120-Y122 HydrophobicContact CG-CE1 4.48Å; Y120-F171 WeakPolarHBondContact O-CZ 3.35Å; Y120-S187 CarbonylContact O-C 3.52Å; Y120-S187 VanDerWaalsContact O-CA 3.25Å; Y120-S187 WeakPolarHBondContact O-CA 3.16Å; Y120-K188 HydrophobicContact CD2-CD 4.26Å; Y120-K188 HydrophobicContact CD2-CG 3.68Å; Y120-K188 HydrophobicContact CG-CG 4.07Å; Y120-K188 PolarHBondContact N-O 2.97Å; Y120-K188 PolarHBondContact O-N 3.07Å; Y120-R190 HydrophobicContact CE2-CB 4.03Å; Y120-R190 PolarHBondContact OH-NH1 3.28Å
121	N	97.4	Very high	94.7	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.011	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	84.4	176.7	-166.9	21.5	0	0	0	108.5	Y146 M159 T160 S161 F171 Y173 S187	N121-Y146 PolarHBondContact O-OH 3.46Å; N121-M159 WeakPolarHBondContact OD1-CE 3.49Å; N121-T160 PolarHBondContact ND2-O 3.39Å; N121-S161 VanDerWaalsContact CB-OG 3.26Å; N121-S161 WeakPolarHBondContact CB-OG 3.04Å; N121-S161 PolarHBondContact ND2-OG 2.8Å; N121-F171 HydrophobicContact CB-CD1 4.01Å; N121-F171 HydrophobicContact CB-CE1 4.02Å; N121-F171 HydrophobicContact CB-CG 4.46Å; N121-F171 HydrophobicContact CB-CZ 4.45Å; N121-Y173 WeakPolarHBondContact OD1-CE1 3.29Å; N121-S187 PolarHBondContact OD1-OG 2.98Å
122	Y	96.4	Very high	94.9	Very high	32 Å²	32	43.4 Å²	43.4	13%	0.125	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	161.9	-161.3	73.4	-73.1	0	0	0	114	D104 Y120 V124 Y146 R186	D104-Y122 HydrophobicContact CB-CD2 3.88Å; D104-Y122 HydrophobicContact CB-CG 3.8Å; Y120-Y122 HydrophobicContact CD1-CE1 4.32Å; Y120-Y122 HydrophobicContact CG-CE1 4.48Å; Y122-V124 HydrophobicContact CD2-CG1 4.29Å; Y122-V124 HydrophobicContact CE2-CG1 3.7Å; Y122-Y146 VanDerWaalsContact CA-OH 3.31Å; Y122-Y146 WeakPolarHBondContact CA-OH 3.35Å; Y122-Y146 WeakPolarHBondContact CB-OH 3.47Å; Y122-R186 HydrophobicContact CD1-CB 4.09Å; Y122-R186 WeakPolarHBondContact CD1-O 3.35Å; Y122-R186 HydrophobicContact CE1-CB 3.55Å; Y122-R186 PolarHBondContact N-O 2.89Å; Y122-R186 PolarHBondContact O-N 2.97Å; Y122-R186 WeakPolarHBondContact OH-CD 3.19Å
123	V	96.2	Very high	95	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	135.1	169.9	-174.8	0	0	0	0	108.1	Y126 Y146 A157 M159 I180 K184 V185	V123-Y126 VanDerWaalsContact O-CD1 3.24Å; V123-Y126 WeakPolarHBondContact O-CD1 3.46Å; V123-Y146 HydrophobicContact CB-CD1 4.08Å; V123-Y146 HydrophobicContact CB-CD2 4.32Å; V123-Y146 HydrophobicContact CB-CG 3.89Å; V123-Y146 HydrophobicContact CG2-CD1 4.48Å; V123-Y146 HydrophobicContact CG2-CD2 3.84Å; V123-Y146 HydrophobicContact CG2-CG 3.83Å; V123-A157 HydrophobicContact CG2-CB 3.81Å; V123-M159 HydrophobicContact CG2-SD 3.79Å; V123-I180 HydrophobicContact CG1-CG2 4.33Å; V123-K184 CarbonylContact C-O 3.56Å; V123-K184 WeakPolarHBondContact CA-O 3.49Å; V123-K184 HydrophobicContact CG1-CB 4.47Å; V123-V185 HydrophobicContact CG2-CG1 4.18Å
124	V	93.8	Very high	95.1	Very high	24 Å²	24	35.9 Å²	35.9	15%	0.145	18%	0.18	C	C	.	.	S	Bend	trans	-80.8	151.6	174.2	-48.7	0	0	0	0	110.6	Y122 Y126 K184	Y122-V124 HydrophobicContact CD2-CG1 4.29Å; Y122-V124 HydrophobicContact CE2-CG1 3.7Å; V124-Y126 PolarHBondContact O-N 3.34Å; V124-K184 HydrophobicContact CG2-CB 3.69Å; V124-K184 HydrophobicContact CG2-CG 3.7Å; V124-K184 PolarHBondContact N-O 3.32Å
125	N	91.6	Very high	94.9	Very high	119 Å²	119	39.6 Å²	39.6	64%	0.636	19%	0.189	S	C	*	.	S	Bend	trans	57	45.8	175.5	-55.7	-13.2	0	0	0	113.5	T148	N125-T148 PolarHBondContact O-OG1 2.79Å
126	Y	93.2	Very high	94.4	Very high	62 Å²	62	38.8 Å²	38.8	24%	0.243	19%	0.193	C	C	.	.			trans	-82.2	154.2	170	62.6	-88.5	0	0	0	111	D104 V123 V124 L129 Y146	D104-Y126 WeakPolarHBondContact OD1-CE1 3.46Å; V123-Y126 VanDerWaalsContact O-CD1 3.24Å; V123-Y126 WeakPolarHBondContact O-CD1 3.46Å; V124-Y126 PolarHBondContact O-N 3.34Å; Y126-L129 HydrophobicContact CD2-CB 3.89Å; Y126-L129 HydrophobicContact CE2-CB 3.51Å; Y126-L129 HydrophobicContact CE2-CD2 4.35Å; Y126-Y146 AromaticContact CD1-CD1 3.68Å; Y126-Y146 HydrophobicContact CD1-CD1 3.68Å; Y126-Y146 AromaticContact CD1-CE1 3.82Å; Y126-Y146 HydrophobicContact CD1-CE1 3.82Å; Y126-Y146 HydrophobicContact CD2-CD1 4.32Å; Y126-Y146 HydrophobicContact CE1-CD1 4.24Å; Y126-Y146 AromaticContact CE1-CE1 3.94Å; Y126-Y146 HydrophobicContact CE1-CE1 3.94Å; Y126-Y146 AromaticContact CG-CD1 3.71Å; Y126-Y146 HydrophobicContact CG-CD1 3.71Å; Y126-Y146 HydrophobicContact CG-CE1 4.25Å
127	N	94.1	Very high	93.9	Very high	109 Å²	109	47.3 Å²	47.3	58%	0.583	23%	0.229	S	C	*	.	S	Bend	trans	-90.9	-39	177.1	-66.5	25.1	0	0	0	111	S147	N127-S147 PolarHBondContact N-O 3.41Å
128	N	94.5	Very high	93.6	Very high	82 Å²	82	54.8 Å²	54.8	44%	0.439	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	149	-179.7	-174.6	35	0	0	0	110.9	S147	N128-S147 PolarHBondContact N-O 2.84Å; N128-S147 PolarHBondContact O-N 2.9Å
129	L	94.6	Very high	93.4	Very high	37 Å²	37	56.4 Å²	56.4	19%	0.194	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	120.3	179.2	169	60.7	0	0	0	109.9	Y126 R144 N145 Y146	Y126-L129 HydrophobicContact CD2-CB 3.89Å; Y126-L129 HydrophobicContact CE2-CB 3.51Å; Y126-L129 HydrophobicContact CE2-CD2 4.35Å; L129-R144 HydrophobicContact CD1-CB 3.8Å; L129-R144 HydrophobicContact CD1-CG 3.9Å; L129-N145 WeakPolarHBondContact CA-O 3.2Å; L129-Y146 HydrophobicContact CD1-CD1 4Å; L129-Y146 HydrophobicContact CD1-CE1 3.75Å; L129-Y146 HydrophobicContact CD1-CE2 4.37Å; L129-Y146 HydrophobicContact CD1-CG 4.43Å; L129-Y146 HydrophobicContact CD2-CE1 4.39Å
130	E	94.8	Very high	93.2	Very high	54 Å²	54	56.4 Å²	56.4	25%	0.252	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	129.9	167.2	-51.7	-169.1	126	0	0	109.9	K76 Y132 R144 N145	K76-E130 IonicContact NZ-OE1 2.66Å; K76-E130 PolarHBondContact NZ-OE1 3.11Å; E130-Y132 HydrophobicContact CB-CE2 3.74Å; E130-Y132 PolarHBondContact OE2-OH 3.08Å; E130-R144 CarbonylContact O-C 3.57Å; E130-R144 VanDerWaalsContact O-CA 3.29Å; E130-R144 WeakPolarHBondContact O-CA 3.22Å; E130-N145 HydrophobicContact CB-CB 4.23Å; E130-N145 PolarHBondContact N-O 3.41Å; E130-N145 PolarHBondContact O-N 2.87Å
131	T	95.5	Very high	93	Very high	13 Å²	13	54.8 Å²	54.8	8%	0.08	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	131.4	179.8	-54.4	0	0	0	0	110.6	K76 I77 V142 K143 R144	K76-T131 WeakPolarHBondContact CA-O 3.4Å; I77-T131 HydrophobicContact CD1-CG2 3.65Å; I77-T131 HydrophobicContact CG1-CG2 3.68Å; I77-T131 PolarHBondContact N-O 2.76Å; T131-V142 HydrophobicContact CG2-CG1 3.57Å; T131-K143 CarbonylContact C-O 3.54Å; T131-K143 WeakPolarHBondContact CA-O 3.03Å; T131-R144 HydrophobicContact CG2-CG 4.05Å
132	Y	94.9	Very high	92.9	Very high	50 Å²	50	54.9 Å²	54.9	20%	0.196	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	141.1	178.5	-59.9	-96.9	0	0	0	110.1	F73 S75 K76 E130 V142 K143	F73-Y132 VanDerWaalsContact O-CD1 3.3Å; F73-Y132 WeakPolarHBondContact O-CD1 3.49Å; S75-Y132 CarbonylContact O-C 3.55Å; S75-Y132 VanDerWaalsContact O-CA 3.31Å; S75-Y132 WeakPolarHBondContact O-CA 3.38Å; K76-Y132 HydrophobicContact CB-CD1 3.99Å; K76-Y132 HydrophobicContact CB-CE1 3.8Å; K76-Y132 HydrophobicContact CD-CE1 4.24Å; K76-Y132 HydrophobicContact CG-CD1 4.4Å; K76-Y132 HydrophobicContact CG-CE1 4.01Å; E130-Y132 HydrophobicContact CB-CE2 3.74Å; E130-Y132 PolarHBondContact OE2-OH 3.08Å; Y132-V142 CarbonylContact O-C 3.6Å; Y132-V142 WeakPolarHBondContact O-CA 3.4Å; Y132-K143 PolarHBondContact N-O 3.41Å; Y132-K143 PolarHBondContact O-N 2.85Å
133	V	93.6	Very high	92.9	Very high	4 Å²	4	54.6 Å²	54.6	2%	0.024	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	142.3	-177.6	-178.5	0	0	0	0	110	S75 I77 Y81 I83 L140 G141 V142	S75-V133 PolarHBondContact O-N 3.1Å; I77-V133 HydrophobicContact CD1-CG2 3.61Å; I77-V133 HydrophobicContact CG1-CG2 3.98Å; I77-V133 HydrophobicContact CG2-CB 4.49Å; I77-V133 HydrophobicContact CG2-CG2 3.94Å; Y81-V133 HydrophobicContact CD1-CG2 4.38Å; Y81-V133 HydrophobicContact CE1-CG1 4.49Å; I83-V133 HydrophobicContact CD1-CG1 4.01Å; I83-V133 HydrophobicContact CD1-CG2 4.36Å; V133-L140 HydrophobicContact CG1-CD1 4.31Å; V133-G141 WeakPolarHBondContact CA-O 3.47Å; V133-V142 HydrophobicContact CG2-CG2 4.41Å
134	I	92.7	Very high	92.9	Very high	25 Å²	25	54.7 Å²	54.7	13%	0.128	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	132.6	167.2	-174.5	177.4	0	0	0	109.2	V68 H72 F73 L139 L140 G141	V68-I134 HydrophobicContact CG1-CD1 3.94Å; H72-I134 HydrophobicContact CB-CD1 3.43Å; H72-I134 VanDerWaalsContact CB-CD1 3.43Å; F73-I134 HydrophobicContact CD1-CB 4.08Å; F73-I134 HydrophobicContact CD1-CG2 3.82Å; F73-I134 HydrophobicContact CE1-CB 4.19Å; F73-I134 HydrophobicContact CE1-CG2 3.4Å; F73-I134 VanDerWaalsContact CE1-CG2 3.4Å; F73-I134 HydrophobicContact CE2-CG2 4.28Å; F73-I134 HydrophobicContact CG-CB 4.46Å; F73-I134 HydrophobicContact CG-CG2 4.43Å; F73-I134 HydrophobicContact CZ-CG2 3.66Å; I134-L139 HydrophobicContact CD1-CD1 4.17Å; I134-L139 HydrophobicContact CG1-CD1 4.38Å; I134-L139 HydrophobicContact CG2-CD1 3.73Å; I134-L140 WeakPolarHBondContact O-CD1 3.29Å; I134-G141 PolarHBondContact N-O 2.91Å; I134-G141 PolarHBondContact O-N 3.38Å
135	R	88.8	Confident	93	Very high	115 Å²	115	54.9 Å²	54.9	43%	0.434	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	101.8	177	-166.2	-174.7	-53.2	-177.4	5.9	109.5	Y81	Y81-R135 PolarHBondContact OH-NH2 3.24Å
136	G	85.6	Confident	93.3	Very high	30 Å²	30	49.2 Å²	49.2	31%	0.309	24%	0.237	S	C	.	.			trans	-105.8	174.2	173.8	0	0	0	0	0	112.2	E138 L139	G136-E138 VanDerWaalsContact C-N 3.29Å; G136-L139 CarbonylContact C-O 3.58Å; G136-L139 WeakPolarHBondContact CA-O 3.36Å; G136-L139 PolarHBondContact N-O 2.84Å
137	K	85.5	Confident	93.4	Very high	189 Å²	189	46.9 Å²	46.9	82%	0.822	23%	0.23	S	C	*	.	S	Bend	trans	-69.4	-29.6	170.9	-67.2	-174.5	-176.1	-179.6	0	112.4	F87	F87-K137 WeakPolarHBondContact CD1-O 3.27Å
138	E	89.5	Confident	93.4	Very high	158 Å²	158	41.8 Å²	41.8	74%	0.738	20%	0.203	S	C	*	.	S	Bend	trans	-112.4	-2.4	-172.6	-61.2	-174.3	166.9	0	0	113.6	G136 P165	G136-E138 VanDerWaalsContact C-N 3.29Å; E138-P165 WeakPolarHBondContact O-CD 3.38Å
139	L	93	Very high	93.3	Very high	42 Å²	42	41.4 Å²	41.4	22%	0.22	20%	0.201	C	C	.	.			trans	-159.6	153.5	176.4	67.1	92.4	0	0	0	111.5	V68 I134 G136 I163	V68-L139 HydrophobicContact CG2-CD1 4.35Å; V68-L139 HydrophobicContact CG2-CD2 3.72Å; I134-L139 HydrophobicContact CD1-CD1 4.17Å; I134-L139 HydrophobicContact CG1-CD1 4.38Å; I134-L139 HydrophobicContact CG2-CD1 3.73Å; G136-L139 CarbonylContact C-O 3.58Å; G136-L139 WeakPolarHBondContact CA-O 3.36Å; G136-L139 PolarHBondContact N-O 2.84Å; L139-I163 CarbonylContact C-O 3.54Å; L139-I163 WeakPolarHBondContact CA-O 3.27Å
140	L	93.9	Very high	93.1	Very high	3 Å²	3	40 Å²	40	2%	0.016	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	135.4	164.3	167.5	63.3	0	0	0	107.3	I83 P85 F87 I99 V133 I134 L162 I163	I83-L140 HydrophobicContact CB-CD1 4.49Å; I83-L140 HydrophobicContact CD1-CD1 4.23Å; I83-L140 HydrophobicContact CG2-CD1 3.26Å; I83-L140 HydrophobicContact CG2-CD2 3.69Å; I83-L140 HydrophobicContact CG2-CG 4.1Å; P85-L140 HydrophobicContact CG-CD2 4.43Å; F87-L140 HydrophobicContact CE1-CB 4.33Å; F87-L140 HydrophobicContact CZ-CB 3.96Å; I99-L140 HydrophobicContact CD1-CD2 3.57Å; V133-L140 HydrophobicContact CG1-CD1 4.31Å; I134-L140 WeakPolarHBondContact O-CD1 3.29Å; L140-L162 CarbonylContact O-C 3.45Å; L140-L162 WeakPolarHBondContact O-CA 3.42Å; L140-I163 HydrophobicContact CB-CB 4.33Å; L140-I163 HydrophobicContact CD2-CD1 4.21Å; L140-I163 PolarHBondContact N-O 2.03Å; L140-I163 PolarHBondContact O-N 2.74Å
141	G	94.5	Very high	92.8	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	146.1	178.2	0	0	0	0	0	113.1	V133 I134 S161	V133-G141 WeakPolarHBondContact CA-O 3.47Å; I134-G141 PolarHBondContact N-O 2.91Å; I134-G141 PolarHBondContact O-N 3.38Å; G141-S161 CarbonylContact C-O 3.59Å; G141-S161 VanDerWaalsContact CA-O 3.23Å; G141-S161 WeakPolarHBondContact CA-O 3.42Å
142	V	95.3	Very high	92.5	Very high	4 Å²	4	49.4 Å²	49.4	2%	0.024	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	119	171.4	-176.4	0	0	0	0	107.7	I83 E106 T131 Y132 V133 R144 T160 S161	I83-V142 HydrophobicContact CD1-CG2 3.96Å; E106-V142 HydrophobicContact CG-CG2 4.08Å; E106-V142 WeakPolarHBondContact OE1-CB 3.45Å; E106-V142 WeakPolarHBondContact OE1-CG1 3.36Å; T131-V142 HydrophobicContact CG2-CG1 3.57Å; Y132-V142 CarbonylContact O-C 3.6Å; Y132-V142 WeakPolarHBondContact O-CA 3.4Å; V133-V142 HydrophobicContact CG2-CG2 4.41Å; V142-R144 HydrophobicContact CG1-CG 4.41Å; V142-T160 CarbonylContact O-C 3.57Å; V142-T160 WeakPolarHBondContact O-CA 3.34Å; V142-S161 PolarHBondContact N-O 3.33Å; V142-S161 PolarHBondContact O-N 3.32Å
143	K	95.5	Very high	92.4	Very high	26 Å²	26	51.4 Å²	51.4	11%	0.113	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	133.1	176.1	176.6	177.4	-179.2	-175.7	0	108.9	S70 F73 T131 Y132 T158 T160	S70-K143 VanDerWaalsContact CB-NZ 3.32Å; S70-K143 PolarHBondContact OG-NZ 2.93Å; F73-K143 HydrophobicContact CB-CD 4.37Å; F73-K143 HydrophobicContact CD1-CB 3.48Å; F73-K143 VanDerWaalsContact CD1-CB 3.48Å; F73-K143 HydrophobicContact CD2-CB 4.42Å; F73-K143 HydrophobicContact CD2-CD 4.15Å; F73-K143 HydrophobicContact CE1-CB 3.59Å; F73-K143 HydrophobicContact CG-CB 3.91Å; F73-K143 HydrophobicContact CG-CD 4.12Å; F73-K143 HydrophobicContact CZ-CB 4.14Å; T131-K143 CarbonylContact C-O 3.54Å; T131-K143 WeakPolarHBondContact CA-O 3.03Å; Y132-K143 PolarHBondContact N-O 3.41Å; Y132-K143 PolarHBondContact O-N 2.85Å; K143-T158 HydrophobicContact CD-CG2 4.32Å; K143-T158 HydrophobicContact CG-CG2 4.15Å; K143-T160 HydrophobicContact CB-CG2 4.38Å
144	R	95.8	Very high	92.4	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.008	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.2	179.8	-70.2	-170.9	173.8	87	-0.5	111.3	S101 H103 A105 E106 L129 E130 T131 V142 Y146 T158 M159	S101-R144 PolarHBondContact OG-NH2 3.34Å; H103-R144 PolarHBondContact O-NE 2.9Å; H103-R144 PolarHBondContact O-NH2 3.01Å; A105-R144 PolarHBondContact O-NH2 3.28Å; E106-R144 IonicContact OE1-CZ 3.93Å; E106-R144 IonicContact OE1-NH1 2.78Å; E106-R144 PolarHBondContact OE1-NH1 2.82Å; E106-R144 IonicContact OE1-NH2 3.21Å; E106-R144 IonicContact OE2-NH1 3.54Å; L129-R144 HydrophobicContact CD1-CB 3.8Å; L129-R144 HydrophobicContact CD1-CG 3.9Å; E130-R144 CarbonylContact O-C 3.57Å; E130-R144 VanDerWaalsContact O-CA 3.29Å; E130-R144 WeakPolarHBondContact O-CA 3.22Å; T131-R144 HydrophobicContact CG2-CG 4.05Å; V142-R144 HydrophobicContact CG1-CG 4.41Å; R144-Y146 HydrophobicContact CB-CD2 4.07Å; R144-Y146 HydrophobicContact CB-CE2 3.5Å; R144-Y146 VanDerWaalsContact CB-CE2 3.5Å; R144-Y146 WeakPolarHBondContact CD-OH 3.35Å; R144-Y146 HydrophobicContact CG-CE2 4.34Å; R144-T158 VanDerWaalsContact O-CA 3.31Å; R144-T158 WeakPolarHBondContact O-CA 3.36Å; R144-M159 PolarHBondContact N-O 3.36Å; R144-M159 PolarHBondContact O-N 2.87Å
145	N	96.3	Very high	92.6	Very high	27 Å²	27	57 Å²	57	14%	0.144	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	115.7	167.6	-60.8	-28.6	0	0	0	108.4	L129 E130 T156 A157 T158	L129-N145 WeakPolarHBondContact CA-O 3.2Å; E130-N145 HydrophobicContact CB-CB 4.23Å; E130-N145 PolarHBondContact N-O 3.41Å; E130-N145 PolarHBondContact O-N 2.87Å; N145-T156 HydrophobicContact CB-CG2 3.99Å; N145-A157 CarbonylContact C-O 3.52Å; N145-A157 WeakPolarHBondContact CA-O 3.18Å; N145-T158 VanDerWaalsContact OD1-CG2 3.22Å; N145-T158 WeakPolarHBondContact OD1-CG2 3.11Å; N145-T158 PolarHBondContact OD1-OG1 3.06Å
146	Y	96.7	Very high	93	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	108.4	177.4	-69.7	-83.5	0	0	0	109.3	D104 N121 Y122 V123 Y126 L129 R144 T156 A157 M159	D104-Y146 WeakPolarHBondContact OD1-CE1 3.45Å; D104-Y146 PolarHBondContact OD1-OH 2.81Å; N121-Y146 PolarHBondContact O-OH 3.46Å; Y122-Y146 VanDerWaalsContact CA-OH 3.31Å; Y122-Y146 WeakPolarHBondContact CA-OH 3.35Å; Y122-Y146 WeakPolarHBondContact CB-OH 3.47Å; V123-Y146 HydrophobicContact CB-CD1 4.08Å; V123-Y146 HydrophobicContact CB-CD2 4.32Å; V123-Y146 HydrophobicContact CB-CG 3.89Å; V123-Y146 HydrophobicContact CG2-CD1 4.48Å; V123-Y146 HydrophobicContact CG2-CD2 3.84Å; V123-Y146 HydrophobicContact CG2-CG 3.83Å; Y126-Y146 AromaticContact CD1-CD1 3.68Å; Y126-Y146 HydrophobicContact CD1-CD1 3.68Å; Y126-Y146 AromaticContact CD1-CE1 3.82Å; Y126-Y146 HydrophobicContact CD1-CE1 3.82Å; Y126-Y146 HydrophobicContact CD2-CD1 4.32Å; Y126-Y146 HydrophobicContact CE1-CD1 4.24Å; Y126-Y146 AromaticContact CE1-CE1 3.94Å; Y126-Y146 HydrophobicContact CE1-CE1 3.94Å; Y126-Y146 AromaticContact CG-CD1 3.71Å; Y126-Y146 HydrophobicContact CG-CD1 3.71Å; Y126-Y146 HydrophobicContact CG-CE1 4.25Å; L129-Y146 HydrophobicContact CD1-CD1 4Å; L129-Y146 HydrophobicContact CD1-CE1 3.75Å; L129-Y146 HydrophobicContact CD1-CE2 4.37Å; L129-Y146 HydrophobicContact CD1-CG 4.43Å; L129-Y146 HydrophobicContact CD2-CE1 4.39Å; R144-Y146 HydrophobicContact CB-CD2 4.07Å; R144-Y146 HydrophobicContact CB-CE2 3.5Å; R144-Y146 VanDerWaalsContact CB-CE2 3.5Å; R144-Y146 WeakPolarHBondContact CD-OH 3.35Å; R144-Y146 HydrophobicContact CG-CE2 4.34Å; Y146-T156 CarbonylContact O-C 3.52Å; Y146-T156 VanDerWaalsContact O-CA 3.3Å; Y146-T156 WeakPolarHBondContact O-CA 3.27Å; Y146-A157 PolarHBondContact N-O 2.84Å; Y146-A157 PolarHBondContact O-N 2.86Å; Y146-M159 HydrophobicContact CD2-SD 4.25Å; Y146-M159 HydrophobicContact CE2-SD 4.16Å
147	S	96.5	Very high	93.6	Very high	13 Å²	13	52.6 Å²	52.6	9%	0.091	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	121.7	170.3	-54	0	0	0	0	108.8	N127 N128	N127-S147 PolarHBondContact N-O 3.41Å; N128-S147 PolarHBondContact N-O 2.84Å; N128-S147 PolarHBondContact O-N 2.9Å
148	T	94.1	Very high	94.1	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.012	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	144.6	179.2	-175.2	0	0	0	0	110.1	N125 V150 E154 V155 I180	N125-T148 PolarHBondContact O-OG1 2.79Å; T148-V150 HydrophobicContact CG2-CG2 4.18Å; T148-E154 WeakPolarHBondContact O-CA 3.23Å; T148-V155 HydrophobicContact CG2-CG2 3.59Å; T148-V155 PolarHBondContact N-O 3.49Å; T148-V155 PolarHBondContact O-N 2.72Å; T148-I180 HydrophobicContact CG2-CD1 3.63Å; T148-I180 HydrophobicContact CG2-CG1 3.89Å
149	N	92.5	Very high	94.5	Very high	74 Å²	74	36.9 Å²	36.9	40%	0.396	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	122	174.4	-169.4	-75.5	0	0	0	109.9	G152 T153	N149-G152 PolarHBondContact ND2-O 3.29Å; N149-G152 VanDerWaalsContact OD1-CA 3.28Å; N149-G152 WeakPolarHBondContact OD1-CA 3.49Å; N149-G152 PolarHBondContact OD1-N 3.24Å; N149-T153 WeakPolarHBondContact CA-O 3.26Å
150	V	90.1	Very high	94.7	Very high	8 Å²	8	35 Å²	35	5%	0.048	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	114.9	174.7	-176.9	0	0	0	0	108.4	T148 G152 T153 V155 E179 I180	T148-V150 HydrophobicContact CG2-CG2 4.18Å; V150-G152 PolarHBondContact O-N 3.28Å; V150-G152 VanDerWaalsContact O-N 3.13Å; V150-T153 PolarHBondContact N-O 3.26Å; V150-T153 PolarHBondContact O-N 2.94Å; V150-V155 HydrophobicContact CB-CG2 4.41Å; V150-V155 HydrophobicContact CG2-CG2 3.77Å; V150-E179 HydrophobicContact CB-CB 4.32Å; V150-E179 HydrophobicContact CG1-CB 3.85Å; V150-E179 WeakPolarHBondContact CG1-O 3.41Å; V150-I180 HydrophobicContact CG2-CG1 4.29Å
151	Y	89.1	Confident	94.8	Very high	204 Å²	204	35.1 Å²	35.1	80%	0.8	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	36	-179.2	-53	-63	0	0	0	114.6	T153	Y151-T153 VanDerWaalsContact C-N 3.34Å
152	G	89.4	Confident	94.9	Very high	61 Å²	61	35.3 Å²	35.3	63%	0.629	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	90	-10.9	-179.6	0	0	0	0	0	114.5	N149 V150	N149-G152 PolarHBondContact ND2-O 3.29Å; N149-G152 VanDerWaalsContact OD1-CA 3.28Å; N149-G152 WeakPolarHBondContact OD1-CA 3.49Å; N149-G152 PolarHBondContact OD1-N 3.24Å; V150-G152 PolarHBondContact O-N 3.28Å; V150-G152 VanDerWaalsContact O-N 3.13Å
153	T	92.2	Very high	95	Very high	92 Å²	92	35.5 Å²	35.5	56%	0.564	19%	0.193	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	130.1	175.1	-54.8	0	0	0	0	110.4	N149 V150 Y151 V155	N149-T153 WeakPolarHBondContact CA-O 3.26Å; V150-T153 PolarHBondContact N-O 3.26Å; V150-T153 PolarHBondContact O-N 2.94Å; Y151-T153 VanDerWaalsContact C-N 3.34Å; T153-V155 HydrophobicContact CG2-CG1 4.24Å
154	E	94.2	Very high	95	Very high	126 Å²	126	37.5 Å²	37.5	59%	0.589	20%	0.203	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	122.9	170.5	-173.4	174.4	71.9	0	0	109.7	T148	T148-E154 WeakPolarHBondContact O-CA 3.23Å
155	V	96.3	Very high	94.9	Very high	19 Å²	19	39.9 Å²	39.9	12%	0.115	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	147.1	175.4	-59.1	0	0	0	0	109.5	T148 V150 T153 P177 I180	T148-V155 HydrophobicContact CG2-CG2 3.59Å; T148-V155 PolarHBondContact N-O 3.49Å; T148-V155 PolarHBondContact O-N 2.72Å; V150-V155 HydrophobicContact CB-CG2 4.41Å; V150-V155 HydrophobicContact CG2-CG2 3.77Å; T153-V155 HydrophobicContact CG2-CG1 4.24Å; V155-P177 HydrophobicContact CB-CB 4.1Å; V155-P177 HydrophobicContact CB-CG 3.95Å; V155-P177 HydrophobicContact CG2-CB 4.21Å; V155-P177 HydrophobicContact CG2-CG 4.2Å; V155-I180 HydrophobicContact CG2-CD1 4.11Å; V155-I180 HydrophobicContact CG2-CG1 3.9Å
156	T	97.2	Very high	94.6	Very high	53 Å²	53	43.2 Å²	43.2	33%	0.325	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	118.6	-177.5	-59.7	0	0	0	0	110.6	N145 Y146 N175	N145-T156 HydrophobicContact CB-CG2 3.99Å; Y146-T156 CarbonylContact O-C 3.52Å; Y146-T156 VanDerWaalsContact O-CA 3.3Å; Y146-T156 WeakPolarHBondContact O-CA 3.27Å; T156-N175 PolarHBondContact O-ND2 3.34Å
157	A	97.6	Very high	94.5	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	131.2	167.8	0	0	0	0	0	110.3	V123 N145 Y146 N175 I176 I180	V123-A157 HydrophobicContact CG2-CB 3.81Å; N145-A157 CarbonylContact C-O 3.52Å; N145-A157 WeakPolarHBondContact CA-O 3.18Å; Y146-A157 PolarHBondContact N-O 2.84Å; Y146-A157 PolarHBondContact O-N 2.86Å; A157-N175 CarbonylContact C-O 3.43Å; A157-N175 VanDerWaalsContact CA-O 3.23Å; A157-N175 WeakPolarHBondContact CA-O 3.37Å; A157-I176 HydrophobicContact CB-CD1 4.29Å; A157-I180 HydrophobicContact CB-CD1 3.74Å
158	T	97.1	Very high	94.4	Very high	17 Å²	17	45 Å²	45	10%	0.104	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	122.2	177.8	-61	0	0	0	0	109.8	K143 R144 N145 D174 N175	K143-T158 HydrophobicContact CD-CG2 4.32Å; K143-T158 HydrophobicContact CG-CG2 4.15Å; R144-T158 VanDerWaalsContact O-CA 3.31Å; R144-T158 WeakPolarHBondContact O-CA 3.36Å; N145-T158 VanDerWaalsContact OD1-CG2 3.22Å; N145-T158 WeakPolarHBondContact OD1-CG2 3.11Å; N145-T158 PolarHBondContact OD1-OG1 3.06Å; T158-D174 HydrophobicContact CG2-CB 3.58Å; T158-D174 PolarHBondContact O-N 3.07Å; T158-N175 PolarHBondContact N-O 3.43Å; T158-N175 PolarHBondContact O-N 3.3Å
159	M	97.2	Very high	94.6	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	133.8	-174.8	-53.8	178.5	89.6	0	0	109.7	N121 V123 R144 Y146 Y173 I176 S187 I211	N121-M159 WeakPolarHBondContact OD1-CE 3.49Å; V123-M159 HydrophobicContact CG2-SD 3.79Å; R144-M159 PolarHBondContact N-O 3.36Å; R144-M159 PolarHBondContact O-N 2.87Å; Y146-M159 HydrophobicContact CD2-SD 4.25Å; Y146-M159 HydrophobicContact CE2-SD 4.16Å; M159-Y173 HydrophobicContact CE-CD1 3.6Å; M159-Y173 HydrophobicContact CE-CE1 3.54Å; M159-Y173 HydrophobicContact CG-CD1 4.36Å; M159-I176 HydrophobicContact CE-CD1 4.18Å; M159-I176 HydrophobicContact CG-CD1 3.83Å; M159-I176 HydrophobicContact SD-CD1 4.3Å; M159-S187 WeakPolarHBondContact CE-OG 3.32Å; M159-I211 HydrophobicContact CE-CG2 3.9Å
160	T	96.8	Very high	94.9	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.012	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	127.6	-177.5	-58.7	0	0	0	0	110.8	F73 N121 V142 K143 L162 F171 Y172 D174	F73-T160 HydrophobicContact CE1-CG2 4.15Å; F73-T160 HydrophobicContact CE2-CG2 4.25Å; F73-T160 HydrophobicContact CZ-CG2 3.52Å; N121-T160 PolarHBondContact ND2-O 3.39Å; V142-T160 CarbonylContact O-C 3.57Å; V142-T160 WeakPolarHBondContact O-CA 3.34Å; K143-T160 HydrophobicContact CB-CG2 4.38Å; T160-L162 HydrophobicContact CG2-CD2 3.89Å; T160-L162 HydrophobicContact CG2-CG 4.07Å; T160-F171 CarbonylContact O-C 3.51Å; T160-F171 WeakPolarHBondContact O-CA 3.3Å; T160-Y172 PolarHBondContact N-O 3.37Å; T160-Y172 PolarHBondContact O-N 2.99Å; T160-D174 WeakPolarHBondContact CB-OD2 3.45Å; T160-D174 PolarHBondContact OG1-OD2 2.86Å
161	S	96.9	Very high	95.3	Very high	5 Å²	5	41.2 Å²	41.2	4%	0.035	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	130.1	170.7	-60.9	0	0	0	0	109.7	N121 G141 V142 S170	N121-S161 VanDerWaalsContact CB-OG 3.26Å; N121-S161 WeakPolarHBondContact CB-OG 3.04Å; N121-S161 PolarHBondContact ND2-OG 2.8Å; G141-S161 CarbonylContact C-O 3.59Å; G141-S161 VanDerWaalsContact CA-O 3.23Å; G141-S161 WeakPolarHBondContact CA-O 3.42Å; V142-S161 PolarHBondContact N-O 3.33Å; V142-S161 PolarHBondContact O-N 3.32Å; S161-S170 CarbonylContact C-O 3.5Å; S161-S170 WeakPolarHBondContact CA-O 3.48Å
162	L	96.3	Very high	95.7	Very high	5 Å²	5	32.5 Å²	32.5	3%	0.026	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	144.1	178.6	-59.5	174.7	0	0	0	110.6	P67 V68 F73 L140 T160 V169 S170	P67-L162 HydrophobicContact CB-CD1 3.77Å; P67-L162 HydrophobicContact CG-CD1 4.1Å; V68-L162 HydrophobicContact CG2-CD1 3.94Å; V68-L162 HydrophobicContact CG2-CD2 4.07Å; F73-L162 HydrophobicContact CZ-CD2 4.08Å; L140-L162 CarbonylContact O-C 3.45Å; L140-L162 WeakPolarHBondContact O-CA 3.42Å; T160-L162 HydrophobicContact CG2-CD2 3.89Å; T160-L162 HydrophobicContact CG2-CG 4.07Å; L162-V169 CarbonylContact O-C 3.58Å; L162-V169 WeakPolarHBondContact O-CA 3.25Å; L162-S170 PolarHBondContact N-O 2.69Å; L162-S170 PolarHBondContact O-N 3.11Å
163	I	96.9	Very high	96.1	Very high	8 Å²	8	29.6 Å²	29.6	4%	0.041	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	128.4	177.7	-56.5	173.1	0	0	0	108.1	F87 F89 I99 I119 L139 L140 K168 V169	F87-I163 HydrophobicContact CE2-CG2 4.38Å; F87-I163 WeakPolarHBondContact CZ-O 3.41Å; F89-I163 HydrophobicContact CD2-CG2 4.29Å; F89-I163 HydrophobicContact CE1-CG2 4.04Å; F89-I163 HydrophobicContact CE2-CG2 3.78Å; F89-I163 HydrophobicContact CZ-CG2 3.64Å; I99-I163 HydrophobicContact CD1-CD1 3.37Å; I119-I163 HydrophobicContact CD1-CD1 3.53Å; I119-I163 HydrophobicContact CD1-CG1 4.13Å; L139-I163 CarbonylContact C-O 3.54Å; L139-I163 WeakPolarHBondContact CA-O 3.27Å; L140-I163 HydrophobicContact CB-CB 4.33Å; L140-I163 HydrophobicContact CD2-CD1 4.21Å; L140-I163 PolarHBondContact N-O 2.03Å; L140-I163 PolarHBondContact O-N 2.74Å; I163-K168 WeakPolarHBondContact CA-O 3.28Å; I163-V169 HydrophobicContact CG1-CG2 4.46Å
164	Q	95.3	Very high	96.3	Very high	68 Å²	68	26.8 Å²	26.8	32%	0.318	14%	0.141	S	C	.	.			trans	-109.6	160.5	-177.4	-67.7	176.7	-3.5	0	0	111.9	N166 G167 K168	Q164-N166 VanDerWaalsContact CB-OD1 3.3Å; Q164-N166 WeakPolarHBondContact CB-OD1 3.35Å; Q164-N166 PolarHBondContact O-N 3.41Å; Q164-N166 VanDerWaalsContact O-N 3.16Å; Q164-G167 WeakPolarHBondContact O-CA 3.35Å; Q164-G167 PolarHBondContact O-N 3.49Å; Q164-K168 HydrophobicContact CB-CB 4.38Å; Q164-K168 PolarHBondContact N-O 2.68Å
165	P	93.8	Very high	96.4	Very high	53 Å²	53	24.1 Å²	24.1	34%	0.344	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-30.3	178.8	-29.2	32.8	0	0	0	115.5	F87 F89 E138 G167	F87-P165 HydrophobicContact CB-CB 4.14Å; F87-P165 HydrophobicContact CB-CG 4.12Å; F87-P165 HydrophobicContact CD1-CG 4.02Å; F87-P165 VanDerWaalsContact CD2-CA 3.47Å; F87-P165 HydrophobicContact CD2-CB 4.06Å; F87-P165 HydrophobicContact CD2-CG 4.07Å; F87-P165 HydrophobicContact CE1-CG 4.44Å; F87-P165 HydrophobicContact CE2-CG 4.47Å; F87-P165 HydrophobicContact CG-CB 4.09Å; F87-P165 HydrophobicContact CG-CG 3.81Å; F89-P165 WeakPolarHBondContact CB-O 3.32Å; E138-P165 WeakPolarHBondContact O-CD 3.38Å; P165-G167 PolarHBondContact O-N 2.85Å
166	N	91	Very high	96.5	Very high	96 Å²	96	23.9 Å²	23.9	51%	0.513	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-0.9	175.4	57.8	17	0	0	0	113.5	Q164 K168	Q164-N166 VanDerWaalsContact CB-OD1 3.3Å; Q164-N166 WeakPolarHBondContact CB-OD1 3.35Å; Q164-N166 PolarHBondContact O-N 3.41Å; Q164-N166 VanDerWaalsContact O-N 3.16Å; N166-K168 VanDerWaalsContact C-N 3.35Å; N166-K168 WeakPolarHBondContact ND2-CD 3.44Å; N166-K168 WeakPolarHBondContact ND2-CE 3.21Å; N166-K168 VanDerWaalsContact OD1-CB 3.25Å; N166-K168 WeakPolarHBondContact OD1-CB 3.31Å; N166-K168 WeakPolarHBondContact OD1-CG 3.21Å; N166-K168 PolarHBondContact OD1-N 2.68Å
167	G	93.3	Very high	96.4	Very high	3 Å²	3	22.1 Å²	22.1	3%	0.031	12%	0.118	C	C	.	.			trans	82.7	6.5	-177.3	0	0	0	0	0	114.7	Q164 P165 V169	Q164-G167 WeakPolarHBondContact O-CA 3.35Å; Q164-G167 PolarHBondContact O-N 3.49Å; P165-G167 PolarHBondContact O-N 2.85Å; G167-V169 PolarHBondContact O-N 3.48Å
168	K	95.6	Very high	96.3	Very high	47 Å²	47	28.7 Å²	28.7	20%	0.204	16%	0.159	C	C	.	.			trans	-64.3	133.4	171.8	-68.3	-179.2	-161.8	-144.3	0	109.8	I163 Q164 N166 V218 F219 E220	I163-K168 WeakPolarHBondContact CA-O 3.28Å; Q164-K168 HydrophobicContact CB-CB 4.38Å; Q164-K168 PolarHBondContact N-O 2.68Å; N166-K168 VanDerWaalsContact C-N 3.35Å; N166-K168 WeakPolarHBondContact ND2-CD 3.44Å; N166-K168 WeakPolarHBondContact ND2-CE 3.21Å; N166-K168 VanDerWaalsContact OD1-CB 3.25Å; N166-K168 WeakPolarHBondContact OD1-CB 3.31Å; N166-K168 WeakPolarHBondContact OD1-CG 3.21Å; N166-K168 PolarHBondContact OD1-N 2.68Å; K168-V218 HydrophobicContact CD-CG1 4.35Å; K168-F219 VanDerWaalsContact CA-O 3.31Å; K168-F219 WeakPolarHBondContact CA-O 3.26Å; K168-E220 WeakPolarHBondContact CE-OE1 3.33Å; K168-E220 WeakPolarHBondContact CE-OE2 3.26Å; K168-E220 HydrophobicContact CG-CB 4.21Å; K168-E220 HydrophobicContact CG-CG 4.19Å; K168-E220 IonicContact NZ-OE1 3.99Å; K168-E220 PolarHBondContact NZ-OE1 3.4Å; K168-E220 IonicContact NZ-OE2 3.51Å; K168-E220 PolarHBondContact NZ-OE2 3.4Å
169	V	97.8	Very high	96.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	126.3	172.5	-179.2	0	0	0	0	107.2	Y91 I119 L162 I163 G167 F171 I189 F219	Y91-V169 HydrophobicContact CE2-CG2 4.47Å; I119-V169 HydrophobicContact CD1-CG1 4.02Å; I119-V169 HydrophobicContact CD1-CG2 4.09Å; I119-V169 HydrophobicContact CG1-CG1 4.41Å; I119-V169 HydrophobicContact CG2-CG1 4.07Å; L162-V169 CarbonylContact O-C 3.58Å; L162-V169 WeakPolarHBondContact O-CA 3.25Å; I163-V169 HydrophobicContact CG1-CG2 4.46Å; G167-V169 PolarHBondContact O-N 3.48Å; V169-F171 HydrophobicContact CG1-CE1 3.99Å; V169-F171 HydrophobicContact CG1-CZ 4.37Å; V169-I189 HydrophobicContact CG1-CG2 4.09Å; V169-F219 HydrophobicContact CB-CB 4.33Å; V169-F219 HydrophobicContact CB-CD2 4.41Å; V169-F219 HydrophobicContact CG1-CD2 4.5Å; V169-F219 PolarHBondContact N-O 3.01Å; V169-F219 PolarHBondContact O-N 3.24Å
170	S	98	Very high	96	Very high	6 Å²	6	33 Å²	33	4%	0.042	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	141.2	179.2	-49.8	0	0	0	0	111.3	S161 L162 V217	S161-S170 CarbonylContact C-O 3.5Å; S161-S170 WeakPolarHBondContact CA-O 3.48Å; L162-S170 PolarHBondContact N-O 2.69Å; L162-S170 PolarHBondContact O-N 3.11Å; S170-V217 CarbonylContact C-O 3.52Å; S170-V217 WeakPolarHBondContact CA-O 3.28Å; S170-V217 WeakPolarHBondContact CB-O 3.26Å
171	F	98.5	Very high	95.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	125.7	167.5	-55.2	-37.4	0	0	0	109	I119 Y120 N121 T160 V169 Y173 I189 V206 L216 V217 F219	I119-F171 HydrophobicContact CG2-CE1 3.37Å; I119-F171 HydrophobicContact CG2-CZ 3.6Å; Y120-F171 WeakPolarHBondContact O-CZ 3.35Å; N121-F171 HydrophobicContact CB-CD1 4.01Å; N121-F171 HydrophobicContact CB-CE1 4.02Å; N121-F171 HydrophobicContact CB-CG 4.46Å; N121-F171 HydrophobicContact CB-CZ 4.45Å; T160-F171 CarbonylContact O-C 3.51Å; T160-F171 WeakPolarHBondContact O-CA 3.3Å; V169-F171 HydrophobicContact CG1-CE1 3.99Å; V169-F171 HydrophobicContact CG1-CZ 4.37Å; F171-Y173 HydrophobicContact CB-CE1 4.07Å; F171-I189 HydrophobicContact CE2-CG2 4.43Å; F171-I189 HydrophobicContact CZ-CG2 3.94Å; F171-V206 HydrophobicContact CD2-CG2 4.06Å; F171-V206 HydrophobicContact CE2-CG2 4.39Å; F171-L216 CarbonylContact O-C 3.54Å; F171-L216 WeakPolarHBondContact O-CA 3.47Å; F171-V217 HydrophobicContact CB-CB 4.19Å; F171-V217 PolarHBondContact N-O 3.29Å; F171-V217 PolarHBondContact O-N 2.97Å; F171-F219 AromaticContact CD2-CE2 3.66Å; F171-F219 HydrophobicContact CD2-CE2 3.66Å; F171-F219 HydrophobicContact CD2-CZ 4.44Å; F171-F219 HydrophobicContact CE2-CD2 4.34Å; F171-F219 AromaticContact CE2-CE2 3.41Å; F171-F219 HydrophobicContact CE2-CE2 3.41Å; F171-F219 VanDerWaalsContact CE2-CE2 3.41Å; F171-F219 HydrophobicContact CE2-CZ 4.11Å; F171-F219 HydrophobicContact CZ-CE2 4.12Å
172	Y	98.3	Very high	95.7	Very high	21 Å²	21	41.7 Å²	41.7	8%	0.082	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	134.7	170.3	-178.1	-104.3	0	0	0	108.7	Q64 Q66 P67 T160 D174 L216	Q64-Y172 WeakPolarHBondContact O-CE2 3.3Å; Q64-Y172 PolarHBondContact O-OH 2.97Å; Q64-Y172 VanDerWaalsContact O-OH 3.13Å; Q66-Y172 VanDerWaalsContact CA-CZ 3.48Å; Q66-Y172 HydrophobicContact CB-CD1 4.27Å; Q66-Y172 HydrophobicContact CB-CE1 3.64Å; Q66-Y172 HydrophobicContact CG-CD1 3.85Å; Q66-Y172 HydrophobicContact CG-CE1 3.66Å; Q66-Y172 PolarHBondContact N-OH 3.35Å; P67-Y172 HydrophobicContact CG-CD2 4.37Å; P67-Y172 HydrophobicContact CG-CG 4.4Å; T160-Y172 PolarHBondContact N-O 3.37Å; T160-Y172 PolarHBondContact O-N 2.99Å; Y172-D174 HydrophobicContact CD1-CB 4.35Å; Y172-D174 HydrophobicContact CE1-CB 4.1Å; Y172-L216 HydrophobicContact CD2-CB 4.29Å; Y172-L216 HydrophobicContact CD2-CD1 4.31Å
173	Y	98.1	Very high	95.6	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	94	178.7	-49.1	-59.1	0	0	0	108.9	N121 M159 F171 I176 S187 I211 S213 G214 S215 V217	N121-Y173 WeakPolarHBondContact OD1-CE1 3.29Å; M159-Y173 HydrophobicContact CE-CD1 3.6Å; M159-Y173 HydrophobicContact CE-CE1 3.54Å; M159-Y173 HydrophobicContact CG-CD1 4.36Å; F171-Y173 HydrophobicContact CB-CE1 4.07Å; Y173-I176 HydrophobicContact CD1-CD1 4.39Å; Y173-I176 HydrophobicContact CG-CG1 4.32Å; Y173-S187 WeakPolarHBondContact CE1-OG 3Å; Y173-S187 VanDerWaalsContact OH-CB 3.28Å; Y173-S187 WeakPolarHBondContact OH-CB 3.49Å; Y173-S187 PolarHBondContact OH-OG 2.88Å; Y173-I211 HydrophobicContact CD1-CG2 3.85Å; Y173-I211 HydrophobicContact CD2-CG2 4.19Å; Y173-I211 HydrophobicContact CE1-CG2 3.67Å; Y173-I211 HydrophobicContact CE2-CB 4.18Å; Y173-I211 HydrophobicContact CE2-CG1 4.19Å; Y173-I211 HydrophobicContact CE2-CG2 4.02Å; Y173-I211 HydrophobicContact CG-CG2 4.11Å; Y173-S213 CarbonylContact O-C 3.56Å; Y173-S213 WeakPolarHBondContact O-CA 3.41Å; Y173-G214 PolarHBondContact O-N 2.82Å; Y173-S215 WeakPolarHBondContact CD2-O 3.42Å; Y173-S215 PolarHBondContact N-O 3.47Å; Y173-S215 VanDerWaalsContact N-O 3.15Å; Y173-V217 HydrophobicContact CE2-CG2 3.87Å
174	D	96.3	Very high	95.5	Very high	32 Å²	32	48.1 Å²	48.1	17%	0.171	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	-46.4	-177.8	-56.6	-107.6	0	0	0	111.4	Q66 T158 T160 Y172	Q66-D174 PolarHBondContact NE2-OD1 3.3Å; T158-D174 HydrophobicContact CG2-CB 3.58Å; T158-D174 PolarHBondContact O-N 3.07Å; T160-D174 WeakPolarHBondContact CB-OD2 3.45Å; T160-D174 PolarHBondContact OG1-OD2 2.86Å; Y172-D174 HydrophobicContact CD1-CB 4.35Å; Y172-D174 HydrophobicContact CE1-CB 4.1Å
175	N	96.5	Very high	95.6	Very high	70 Å²	70	45.1 Å²	45.1	37%	0.374	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	121.2	177.4	-175	45.3	0	0	0	110.3	T156 A157 T158	T156-N175 PolarHBondContact O-ND2 3.34Å; A157-N175 CarbonylContact C-O 3.43Å; A157-N175 VanDerWaalsContact CA-O 3.23Å; A157-N175 WeakPolarHBondContact CA-O 3.37Å; T158-N175 PolarHBondContact N-O 3.43Å; T158-N175 PolarHBondContact O-N 3.3Å
176	I	97.2	Very high	95.8	Very high	15 Å²	15	48.2 Å²	48.2	8%	0.077	23%	0.234	C	C	.	.			trans	-126.2	98.1	171.4	-52.8	-66.3	0	0	0	106.7	A157 M159 Y173 T178 V185 I211 S213	A157-I176 HydrophobicContact CB-CD1 4.29Å; M159-I176 HydrophobicContact CE-CD1 4.18Å; M159-I176 HydrophobicContact CG-CD1 3.83Å; M159-I176 HydrophobicContact SD-CD1 4.3Å; Y173-I176 HydrophobicContact CD1-CD1 4.39Å; Y173-I176 HydrophobicContact CG-CG1 4.32Å; I176-T178 PolarHBondContact O-N 2.84Å; I176-V185 HydrophobicContact CG2-CG1 4.08Å; I176-I211 HydrophobicContact CD1-CG2 4.37Å; I176-I211 HydrophobicContact CG1-CG2 4.47Å; I176-S213 PolarHBondContact N-OG 3.02Å; I176-S213 PolarHBondContact O-OG 3.35Å
177	P	96.5	Very high	96.1	Very high	16 Å²	16	43.8 Å²	43.8	10%	0.104	21%	0.21	C	C	.	.			trans	-53.7	136.2	175.3	-24.6	32.3	0	0	0	111.4	V155 E179 I180	V155-P177 HydrophobicContact CB-CB 4.1Å; V155-P177 HydrophobicContact CB-CG 3.95Å; V155-P177 HydrophobicContact CG2-CB 4.21Å; V155-P177 HydrophobicContact CG2-CG 4.2Å; P177-E179 WeakPolarHBondContact CB-OE2 3.37Å; P177-E179 PolarHBondContact O-N 3.17Å; P177-I180 HydrophobicContact CB-CD1 4.34Å; P177-I180 HydrophobicContact CB-CG1 4.26Å; P177-I180 HydrophobicContact CG-CD1 4.12Å; P177-I180 PolarHBondContact O-N 2.86Å; P177-I180 VanDerWaalsContact O-N 3.13Å
178	T	94.6	Very high	96.3	Very high	138 Å²	138	45.2 Å²	45.2	85%	0.847	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-18.6	-178	44.6	0	0	0	0	113.4	I176 I180	I176-T178 PolarHBondContact O-N 2.84Å; T178-I180 VanDerWaalsContact C-N 3.26Å
179	E	94	Very high	96.5	Very high	99 Å²	99	43 Å²	43	46%	0.463	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-23.3	176	-57.3	83.2	172.8	0	0	111.7	V150 P177 E181	V150-E179 HydrophobicContact CB-CB 4.32Å; V150-E179 HydrophobicContact CG1-CB 3.85Å; V150-E179 WeakPolarHBondContact CG1-O 3.41Å; P177-E179 WeakPolarHBondContact CB-OE2 3.37Å; P177-E179 PolarHBondContact O-N 3.17Å; E179-E181 PolarHBondContact O-N 2.9Å
180	I	94.1	Very high	96.4	Very high	10 Å²	10	45.3 Å²	45.3	5%	0.051	22%	0.215	C	C	.	.	S	Bend	trans	-75.8	116.5	176.1	-59.2	178.2	0	0	0	109	V123 T148 V150 V155 A157 P177 T178 K184 V185	V123-I180 HydrophobicContact CG1-CG2 4.33Å; T148-I180 HydrophobicContact CG2-CD1 3.63Å; T148-I180 HydrophobicContact CG2-CG1 3.89Å; V150-I180 HydrophobicContact CG2-CG1 4.29Å; V155-I180 HydrophobicContact CG2-CD1 4.11Å; V155-I180 HydrophobicContact CG2-CG1 3.9Å; A157-I180 HydrophobicContact CB-CD1 3.74Å; P177-I180 HydrophobicContact CB-CD1 4.34Å; P177-I180 HydrophobicContact CB-CG1 4.26Å; P177-I180 HydrophobicContact CG-CD1 4.12Å; P177-I180 PolarHBondContact O-N 2.86Å; P177-I180 VanDerWaalsContact O-N 3.13Å; T178-I180 VanDerWaalsContact C-N 3.26Å; I180-K184 HydrophobicContact CG2-CB 3.94Å; I180-K184 HydrophobicContact CG2-CD 4.46Å; I180-V185 HydrophobicContact CG2-CG1 3.85Å
181	E	93.8	Very high	96.3	Very high	81 Å²	81	45 Å²	45	38%	0.379	21%	0.213	S	C	.	.			trans	-57.9	138.1	177.9	-63.9	170.8	-99.3	0	0	112.2	E179 Y183 K184	E179-E181 PolarHBondContact O-N 2.9Å; E181-Y183 VanDerWaalsContact C-N 3.25Å; E181-Y183 HydrophobicContact CB-CD1 3.77Å; E181-Y183 HydrophobicContact CB-CE1 3.58Å; E181-Y183 HydrophobicContact CG-CE1 4.25Å; E181-Y183 PolarHBondContact O-N 2.91Å; E181-Y183 VanDerWaalsContact O-N 3.09Å; E181-Y183 VanDerWaalsContact OE2-CE1 3.28Å; E181-Y183 WeakPolarHBondContact OE2-CE1 3.32Å; E181-K184 HydrophobicContact CB-CD 4.42Å; E181-K184 HydrophobicContact CB-CG 4.35Å; E181-K184 VanDerWaalsContact O-CB 3.3Å; E181-K184 WeakPolarHBondContact O-CB 3.36Å; E181-K184 PolarHBondContact O-N 3.39Å; E181-K184 IonicContact OE1-NZ 3.96Å; E181-K184 PolarHBondContact OE1-NZ 2.87Å
182	E	94.4	Very high	96.1	Very high	108 Å²	108	46.9 Å²	46.9	51%	0.505	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-54.3	-36.2	-172	-180	175.3	161.6	0	0	113.6	K184 V185 A208 K209	E182-K184 PolarHBondContact O-N 2.74Å; E182-V185 VanDerWaalsContact O-CG2 3.23Å; E182-V185 WeakPolarHBondContact O-CG2 3.33Å; E182-V185 PolarHBondContact O-N 2.77Å; E182-A208 HydrophobicContact CG-CB 3.27Å; E182-A208 WeakPolarHBondContact OE1-CB 3.47Å; E182-K209 WeakPolarHBondContact OE1-CA 3.29Å; E182-K209 PolarHBondContact OE1-N 3.25Å
183	Y	94.1	Very high	95.7	Very high	121 Å²	121	46.4 Å²	46.4	48%	0.475	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-70.5	-16.3	-179.6	78.9	-89.2	0	0	0	113.9	E181 R186	E181-Y183 VanDerWaalsContact C-N 3.25Å; E181-Y183 HydrophobicContact CB-CD1 3.77Å; E181-Y183 HydrophobicContact CB-CE1 3.58Å; E181-Y183 HydrophobicContact CG-CE1 4.25Å; E181-Y183 PolarHBondContact O-N 2.91Å; E181-Y183 VanDerWaalsContact O-N 3.09Å; E181-Y183 VanDerWaalsContact OE2-CE1 3.28Å; E181-Y183 WeakPolarHBondContact OE2-CE1 3.32Å; Y183-R186 PolarHBondContact O-NE 3.26Å; Y183-R186 VanDerWaalsContact O-NE 3.15Å
184	K	95.2	Very high	95.2	Very high	26 Å²	26	51.6 Å²	51.6	11%	0.113	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-80.9	-27.6	-179.6	-66.2	-174.1	179.9	167	0	112.5	V123 V124 I180 E181 E182	V123-K184 CarbonylContact C-O 3.56Å; V123-K184 WeakPolarHBondContact CA-O 3.49Å; V123-K184 HydrophobicContact CG1-CB 4.47Å; V124-K184 HydrophobicContact CG2-CB 3.69Å; V124-K184 HydrophobicContact CG2-CG 3.7Å; V124-K184 PolarHBondContact N-O 3.32Å; I180-K184 HydrophobicContact CG2-CB 3.94Å; I180-K184 HydrophobicContact CG2-CD 4.46Å; E181-K184 HydrophobicContact CB-CD 4.42Å; E181-K184 HydrophobicContact CB-CG 4.35Å; E181-K184 VanDerWaalsContact O-CB 3.3Å; E181-K184 WeakPolarHBondContact O-CB 3.36Å; E181-K184 PolarHBondContact O-N 3.39Å; E181-K184 IonicContact OE1-NZ 3.96Å; E181-K184 PolarHBondContact OE1-NZ 2.87Å; E182-K184 PolarHBondContact O-N 2.74Å
185	V	96.8	Very high	94.7	Very high	5 Å²	5	51.1 Å²	51.1	3%	0.03	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	125.3	176.9	-67.6	0	0	0	0	110	V123 I176 I180 E182 I211	V123-V185 HydrophobicContact CG2-CG1 4.18Å; I176-V185 HydrophobicContact CG2-CG1 4.08Å; I180-V185 HydrophobicContact CG2-CG1 3.85Å; E182-V185 VanDerWaalsContact O-CG2 3.23Å; E182-V185 WeakPolarHBondContact O-CG2 3.33Å; E182-V185 PolarHBondContact O-N 2.77Å; V185-I211 HydrophobicContact CB-CB 4.42Å; V185-I211 HydrophobicContact CB-CG2 3.82Å; V185-I211 HydrophobicContact CG2-CB 3.95Å; V185-I211 HydrophobicContact CG2-CD1 4.37Å; V185-I211 HydrophobicContact CG2-CG2 3.87Å
186	R	97.7	Very high	94	Very high	118 Å²	118	57.5 Å²	57.5	45%	0.445	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	125	-174.9	-66.4	-176.4	-178.8	-172.3	-1.6	111.2	Y122 Y183	Y122-R186 HydrophobicContact CD1-CB 4.09Å; Y122-R186 WeakPolarHBondContact CD1-O 3.35Å; Y122-R186 HydrophobicContact CE1-CB 3.55Å; Y122-R186 PolarHBondContact N-O 2.89Å; Y122-R186 PolarHBondContact O-N 2.97Å; Y122-R186 WeakPolarHBondContact OH-CD 3.19Å; Y183-R186 PolarHBondContact O-NE 3.26Å; Y183-R186 VanDerWaalsContact O-NE 3.15Å
187	S	98.2	Very high	93.4	Very high	3 Å²	3	60.9 Å²	60.9	2%	0.021	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	128.9	176.4	-50.8	0	0	0	0	109.7	Y120 N121 M159 Y173 V206	Y120-S187 CarbonylContact O-C 3.52Å; Y120-S187 VanDerWaalsContact O-CA 3.25Å; Y120-S187 WeakPolarHBondContact O-CA 3.16Å; N121-S187 PolarHBondContact OD1-OG 2.98Å; M159-S187 WeakPolarHBondContact CE-OG 3.32Å; Y173-S187 WeakPolarHBondContact CE1-OG 3Å; Y173-S187 VanDerWaalsContact OH-CB 3.28Å; Y173-S187 WeakPolarHBondContact OH-CB 3.49Å; Y173-S187 PolarHBondContact OH-OG 2.88Å; S187-V206 WeakPolarHBondContact O-CG2 3.23Å; S187-V206 PolarHBondContact O-N 3Å
188	K	97.6	Very high	92.9	Very high	33 Å²	33	61.8 Å²	61.8	14%	0.143	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	156.4	-179.4	64.1	-179.1	179	-175.5	0	112.5	Y120 E203 I204	Y120-K188 HydrophobicContact CD2-CD 4.26Å; Y120-K188 HydrophobicContact CD2-CG 3.68Å; Y120-K188 HydrophobicContact CG-CG 4.07Å; Y120-K188 PolarHBondContact N-O 2.97Å; Y120-K188 PolarHBondContact O-N 3.07Å; K188-E203 WeakPolarHBondContact CD-OE2 3.24Å; K188-E203 WeakPolarHBondContact CE-OE2 3.47Å; K188-E203 IonicContact NZ-OE1 3.69Å; K188-E203 IonicContact NZ-OE2 2.68Å; K188-E203 PolarHBondContact NZ-OE2 3.34Å; K188-I204 CarbonylContact C-O 3.55Å; K188-I204 WeakPolarHBondContact CA-O 3.48Å; K188-I204 WeakPolarHBondContact CB-O 3.32Å
189	I	97.8	Very high	92.6	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	139.9	165.9	60.9	167.5	0	0	0	109.6	Y56 Y92 I119 V169 F171 E203 I204 F219	Y56-I189 HydrophobicContact CD1-CD1 3.99Å; Y56-I189 HydrophobicContact CD2-CD1 4.3Å; Y56-I189 HydrophobicContact CE1-CD1 4.19Å; Y56-I189 HydrophobicContact CE2-CD1 4.49Å; Y56-I189 HydrophobicContact CG-CD1 4.05Å; Y92-I189 HydrophobicContact CE2-CD1 4.23Å; I119-I189 HydrophobicContact CG1-CG2 4.43Å; V169-I189 HydrophobicContact CG1-CG2 4.09Å; F171-I189 HydrophobicContact CE2-CG2 4.43Å; F171-I189 HydrophobicContact CZ-CG2 3.94Å; I189-E203 WeakPolarHBondContact O-CA 3.49Å; I189-I204 HydrophobicContact CD1-CD1 4.01Å; I189-I204 HydrophobicContact CG1-CB 3.9Å; I189-I204 HydrophobicContact CG1-CD1 4.21Å; I189-I204 HydrophobicContact CG1-CG1 4.42Å; I189-I204 PolarHBondContact N-O 2.87Å; I189-I204 PolarHBondContact O-N 3.49Å; I189-F219 HydrophobicContact CD1-CB 3.85Å; I189-F219 HydrophobicContact CD1-CD1 3.61Å; I189-F219 HydrophobicContact CD1-CD2 4.37Å; I189-F219 HydrophobicContact CD1-CE1 4.26Å; I189-F219 HydrophobicContact CD1-CG 3.67Å; I189-F219 HydrophobicContact CG1-CD1 3.94Å; I189-F219 HydrophobicContact CG1-CE1 4.08Å; I189-F219 HydrophobicContact CG1-CG 4.18Å; I189-F219 HydrophobicContact CG1-CZ 4.44Å; I189-F219 HydrophobicContact CG2-CD2 3.91Å; I189-F219 HydrophobicContact CG2-CE2 4.06Å; I189-F219 HydrophobicContact CG2-CG 4.29Å
190	R	96.8	Very high	92.4	Very high	50 Å²	50	61 Å²	61	19%	0.189	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	128.1	178.9	-179.3	-172.1	-70.4	162.4	-3.9	110.8	Y91 G117 N118 Y120 K201 H202 E203	Y91-R190 WeakPolarHBondContact CE1-O 3.33Å; Y91-R190 VanDerWaalsContact OH-C 3.28Å; Y91-R190 PolarHBondContact OH-N 2.82Å; Y91-R190 VanDerWaalsContact OH-N 3.16Å; Y91-R190 PolarHBondContact OH-O 2.78Å; G117-R190 CarbonylContact C-O 3.58Å; G117-R190 WeakPolarHBondContact CA-O 3.43Å; N118-R190 HydrophobicContact CB-CB 4.42Å; N118-R190 PolarHBondContact N-O 3.05Å; N118-R190 PolarHBondContact O-N 2.89Å; Y120-R190 HydrophobicContact CE2-CB 4.03Å; Y120-R190 PolarHBondContact OH-NH1 3.28Å; R190-K201 HydrophobicContact CG-CB 4.39Å; R190-H202 CarbonylContact C-O 3.55Å; R190-H202 VanDerWaalsContact CA-O 3.23Å; R190-H202 WeakPolarHBondContact CA-O 3.4Å; R190-H202 WeakPolarHBondContact CG-O 3.36Å; R190-E203 HydrophobicContact CB-CG 4.08Å; R190-E203 HydrophobicContact CG-CG 3.83Å; R190-E203 IonicContact CZ-OE1 3.66Å; R190-E203 IonicContact NE-OE1 2.68Å; R190-E203 PolarHBondContact NE-OE1 2.86Å; R190-E203 IonicContact NH2-OE1 3.94Å; R190-E203 PolarHBondContact NH2-OE1 2.93Å; R190-E203 IonicContact NH2-OE2 3.58Å
191	G	95.3	Very high	92.3	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	142.5	166.9	0	0	0	0	0	111.8	K201 H202	G191-K201 WeakPolarHBondContact O-CA 2.95Å; G191-H202 PolarHBondContact N-O 2.81Å; G191-H202 PolarHBondContact O-N 2.95Å
192	L	94.1	Very high	92.3	Very high	39 Å²	39	61.3 Å²	61.3	20%	0.204	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	119.7	168.8	-62.6	177.6	0	0	0	109	H115 I116 K201	H115-L192 VanDerWaalsContact ND1-CD1 3.29Å; H115-L192 WeakPolarHBondContact ND1-CD1 3.35Å; I116-L192 PolarHBondContact O-N 2.88Å; L192-K201 HydrophobicContact CD2-CB 4.24Å
193	I	89.9	Confident	92.4	Very high	11 Å²	11	58.2 Å²	58.2	6%	0.056	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	121.4	-172.5	-66.7	164.7	0	0	0	107.8	N27 Y29 Y54 C195 R199 K200 H202	N27-I193 HydrophobicContact CB-CG2 4.16Å; N27-I193 WeakPolarHBondContact ND2-CG2 3.44Å; Y29-I193 HydrophobicContact CD1-CB 4.28Å; Y29-I193 HydrophobicContact CD1-CD1 3.36Å; Y29-I193 HydrophobicContact CD1-CG1 4.41Å; Y29-I193 HydrophobicContact CD1-CG2 4.16Å; Y29-I193 HydrophobicContact CD2-CD1 4.03Å; Y29-I193 HydrophobicContact CE1-CD1 3.76Å; Y29-I193 HydrophobicContact CE2-CD1 4.39Å; Y29-I193 HydrophobicContact CG-CD1 3.49Å; Y29-I193 VanDerWaalsContact CG-CD1 3.49Å; Y54-I193 HydrophobicContact CD1-CD1 4.47Å; Y54-I193 HydrophobicContact CE1-CD1 3.86Å; I193-C195 PolarHBondContact O-N 2.87Å; I193-R199 CarbonylContact O-C 3.59Å; I193-R199 WeakPolarHBondContact O-CA 3.41Å; I193-K200 PolarHBondContact N-O 3.35Å; I193-K200 PolarHBondContact O-N 2.93Å; I193-H202 HydrophobicContact CD1-CB 4.03Å
194	N	87.4	Confident	92.5	Very high	109 Å²	109	52.5 Å²	52.5	58%	0.583	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	120.9	173.4	-59.2	-51.7	0	0	0	108.9	R199	N194-R199 WeakPolarHBondContact OD1-CG 3.32Å; N194-R199 PolarHBondContact OD1-NE 2.94Å
195	C	86.5	Confident	92.6	Very high	22 Å²	22	54.3 Å²	54.3	15%	0.149	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	165.3	171.7	-59.1	0	0	0	0	109.8	C30 I193 G197 G198 K200	C30-C195 WeakPolarHBondContact CA-SG 3.46Å; C30-C195 HydrophobicContact CB-CB 3.67Å; C30-C195 WeakPolarHBondContact CB-SG 3.4Å; C30-C195 WeakPolarHBondContact SG-CA 3.4Å; C30-C195 WeakPolarHBondContact SG-CB 3.1Å; C30-C195 CovalentContact SG-SG 2.03Å; C30-C195 PolarHBondContact SG-SG 3.27Å; I193-C195 PolarHBondContact O-N 2.87Å; C195-G197 VanDerWaalsContact C-N 3.25Å; C195-G197 PolarHBondContact O-N 3.16Å; C195-G198 WeakPolarHBondContact CA-O 3.2Å; C195-G198 WeakPolarHBondContact CB-O 3.34Å; C195-G198 PolarHBondContact N-O 3.33Å; C195-G198 PolarHBondContact O-N 3.42Å; C195-K200 HydrophobicContact CB-CG 4.42Å
196	E	82.5	Confident	92.6	Very high	203 Å²	203	54.4 Å²	54.4	95%	0.949	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-39	177.5	-172.3	172.8	-168.6	0	0	112.2	G198	E196-G198 VanDerWaalsContact C-N 3.26Å; E196-G198 PolarHBondContact O-N 2.94Å
197	G	83.6	Confident	92.6	Very high	86 Å²	86	50.3 Å²	50.3	89%	0.887	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	11.1	175.2	0	0	0	0	0	115.7	C195	C195-G197 VanDerWaalsContact C-N 3.25Å; C195-G197 PolarHBondContact O-N 3.16Å
198	G	86.9	Confident	92.5	Very high	36 Å²	36	51.5 Å²	51.5	37%	0.371	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	113.3	-172.9	-179.6	0	0	0	0	0	114.2	C195 E196 K200	C195-G198 WeakPolarHBondContact CA-O 3.2Å; C195-G198 WeakPolarHBondContact CB-O 3.34Å; C195-G198 PolarHBondContact N-O 3.33Å; C195-G198 PolarHBondContact O-N 3.42Å; E196-G198 VanDerWaalsContact C-N 3.26Å; E196-G198 PolarHBondContact O-N 2.94Å; G198-K200 PolarHBondContact O-N 2.97Å
199	R	87.9	Confident	92.4	Very high	136 Å²	136	54.8 Å²	54.8	51%	0.513	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	117.6	-178.4	-75.9	-176.4	172.3	-178.9	-3.3	111	S114 I193 N194	S114-R199 PolarHBondContact OG-NH2 3.3Å; I193-R199 CarbonylContact O-C 3.59Å; I193-R199 WeakPolarHBondContact O-CA 3.41Å; N194-R199 WeakPolarHBondContact OD1-CG 3.32Å; N194-R199 PolarHBondContact OD1-NE 2.94Å
200	K	90.6	Very high	92.4	Very high	84 Å²	84	55.3 Å²	55.3	37%	0.365	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	152.7	167.9	-62.6	-171.3	179	178.4	0	110.2	Y29 C30 I193 C195 G198	Y29-K200 HydrophobicContact CD1-CB 4.19Å; Y29-K200 HydrophobicContact CD1-CD 4.29Å; Y29-K200 HydrophobicContact CE1-CB 3.84Å; Y29-K200 HydrophobicContact CE1-CD 4.28Å; C30-K200 PolarHBondContact O-NZ 2.86Å; I193-K200 PolarHBondContact N-O 3.35Å; I193-K200 PolarHBondContact O-N 2.93Å; C195-K200 HydrophobicContact CB-CG 4.42Å; G198-K200 PolarHBondContact O-N 2.97Å
201	K	92.1	Very high	92.4	Very high	96 Å²	96	53.2 Å²	53.2	42%	0.417	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	140.6	172.2	62.7	-176	-178.4	175.6	0	109.8	Y29 Y36 R190 G191 L192 E203	Y29-K201 PolarHBondContact OH-O 2.84Å; Y36-K201 VanDerWaalsContact CE2-O 3.29Å; Y36-K201 WeakPolarHBondContact CE2-O 3.06Å; R190-K201 HydrophobicContact CG-CB 4.39Å; G191-K201 WeakPolarHBondContact O-CA 2.95Å; L192-K201 HydrophobicContact CD2-CB 4.24Å; K201-E203 IonicContact NZ-OE1 2.68Å
202	H	93.1	Very high	92.5	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.009	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	137	164.2	-175.2	62.2	0	0	0	108.2	Y29 L35 Y36 Y92 R190 G191 I193 I204	Y29-H202 HydrophobicContact CE1-CB 4.33Å; Y29-H202 HydrophobicContact CE2-CB 3.8Å; Y29-H202 AromaticContact CE2-CG 3.76Å; Y29-H202 AromaticContact CE2-ND1 3.38Å; Y29-H202 WeakPolarHBondContact CE2-ND1 3.46Å; Y29-H202 AromaticContact CZ-ND1 3.77Å; Y29-H202 VanDerWaalsContact OH-CA 3.29Å; Y29-H202 WeakPolarHBondContact OH-CA 3.29Å; Y29-H202 WeakPolarHBondContact OH-CB 3.14Å; Y29-H202 PolarHBondContact OH-ND1 3.45Å; L35-H202 PolarHBondContact O-CE1 3.43Å; Y36-H202 PolarHBondContact O-CE1 3.2Å; Y36-H202 PolarHBondContact O-ND1 2.99Å; Y92-H202 HydrophobicContact CE1-CB 4.04Å; Y92-H202 AromaticContact CE1-CD2 3.71Å; Y92-H202 AromaticContact CZ-CD2 4Å; Y92-H202 PolarHBondContact OH-CD2 2.82Å; R190-H202 CarbonylContact C-O 3.55Å; R190-H202 VanDerWaalsContact CA-O 3.23Å; R190-H202 WeakPolarHBondContact CA-O 3.4Å; R190-H202 WeakPolarHBondContact CG-O 3.36Å; G191-H202 PolarHBondContact N-O 2.81Å; G191-H202 PolarHBondContact O-N 2.95Å; I193-H202 HydrophobicContact CD1-CB 4.03Å; H202-I204 WeakPolarHBondContact NE2-CG1 3.12Å
203	E	95.4	Very high	92.7	Very high	42 Å²	42	58.3 Å²	58.3	20%	0.196	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	131.7	-177.2	-67	-175.7	-166.6	0	0	109.9	K188 I189 R190 K201	K188-E203 WeakPolarHBondContact CD-OE2 3.24Å; K188-E203 WeakPolarHBondContact CE-OE2 3.47Å; K188-E203 IonicContact NZ-OE1 3.69Å; K188-E203 IonicContact NZ-OE2 2.68Å; K188-E203 PolarHBondContact NZ-OE2 3.34Å; I189-E203 WeakPolarHBondContact O-CA 3.49Å; R190-E203 HydrophobicContact CB-CG 4.08Å; R190-E203 HydrophobicContact CG-CG 3.83Å; R190-E203 IonicContact CZ-OE1 3.66Å; R190-E203 IonicContact NE-OE1 2.68Å; R190-E203 PolarHBondContact NE-OE1 2.86Å; R190-E203 IonicContact NH2-OE1 3.94Å; R190-E203 PolarHBondContact NH2-OE1 2.93Å; R190-E203 IonicContact NH2-OE2 3.58Å; K201-E203 IonicContact NZ-OE1 2.68Å
204	I	96.6	Very high	93	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	109.5	172.5	-55.8	167.7	0	0	0	106.6	H53 Y56 K188 I189 H202 F219	H53-I204 HydrophobicContact CB-CD1 3.53Å; H53-I204 HydrophobicContact CB-CG1 3.79Å; H53-I204 HydrophobicContact CB-CG2 4.21Å; Y56-I204 HydrophobicContact CD2-CD1 4.11Å; Y56-I204 HydrophobicContact CG-CD1 4.09Å; K188-I204 CarbonylContact C-O 3.55Å; K188-I204 WeakPolarHBondContact CA-O 3.48Å; K188-I204 WeakPolarHBondContact CB-O 3.32Å; I189-I204 HydrophobicContact CD1-CD1 4.01Å; I189-I204 HydrophobicContact CG1-CB 3.9Å; I189-I204 HydrophobicContact CG1-CD1 4.21Å; I189-I204 HydrophobicContact CG1-CG1 4.42Å; I189-I204 PolarHBondContact N-O 2.87Å; I189-I204 PolarHBondContact O-N 3.49Å; H202-I204 WeakPolarHBondContact NE2-CG1 3.12Å; I204-F219 HydrophobicContact CB-CE1 4.2Å; I204-F219 HydrophobicContact CG2-CD1 4.22Å; I204-F219 HydrophobicContact CG2-CE1 3.6Å
205	S	97.1	Very high	93.5	Very high	64 Å²	64	53.2 Å²	53.2	45%	0.448	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	136.1	-176.8	-58.1	0	0	0	0	111
206	V	98	Very high	94.1	Very high	7 Å²	7	53.1 Å²	53.1	4%	0.042	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-70.4	126.1	168.8	-175.8	0	0	0	0	107.5	M58 I60 F171 S187 A208 W210 I211 V217 F219	M58-V206 HydrophobicContact SD-CG2 4.18Å; I60-V206 HydrophobicContact CD1-CG1 4.09Å; F171-V206 HydrophobicContact CD2-CG2 4.06Å; F171-V206 HydrophobicContact CE2-CG2 4.39Å; S187-V206 WeakPolarHBondContact O-CG2 3.23Å; S187-V206 PolarHBondContact O-N 3Å; V206-A208 PolarHBondContact O-N 3.12Å; V206-W210 HydrophobicContact CG1-CB 4.24Å; V206-I211 HydrophobicContact CB-CD1 4.31Å; V206-I211 HydrophobicContact CB-CG1 4.27Å; V206-I211 HydrophobicContact CG1-CD1 4.4Å; V206-I211 HydrophobicContact CG1-CG1 3.83Å; V206-V217 HydrophobicContact CG1-CG2 3.81Å; V206-V217 HydrophobicContact CG2-CB 4.39Å; V206-V217 HydrophobicContact CG2-CG1 3.83Å; V206-V217 HydrophobicContact CG2-CG2 4.03Å; V206-F219 HydrophobicContact CG2-CE2 4.34Å; V206-F219 HydrophobicContact CG2-CZ 3.79Å
207	P	97	Very high	94.9	Very high	33 Å²	33	43.5 Å²	43.5	21%	0.214	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-62.8	129.9	176.5	-12.3	23.2	0	0	0	109.1	K209 W210	P207-K209 PolarHBondContact O-N 2.91Å; P207-K209 VanDerWaalsContact O-N 3.12Å; P207-W210 WeakPolarHBondContact O-CB 3.29Å; P207-W210 PolarHBondContact O-N 2.91Å
208	A	96.3	Very high	95.6	Very high	28 Å²	28	39.9 Å²	39.9	23%	0.231	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-62	-29.3	-164.9	0	0	0	0	0	113.6	E182 V206 W210 I211	E182-A208 HydrophobicContact CG-CB 3.27Å; E182-A208 WeakPolarHBondContact OE1-CB 3.47Å; V206-A208 PolarHBondContact O-N 3.12Å; A208-W210 PolarHBondContact O-N 2.88Å; A208-I211 WeakPolarHBondContact O-CB 3.34Å; A208-I211 PolarHBondContact O-N 2.87Å
209	K	95.3	Very high	96.1	Very high	102 Å²	102	38.1 Å²	38.1	44%	0.443	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-55	-22.1	171.8	72.9	176.8	-172.6	172.4	0	114.8	E44 E182 P207 K212	E44-K209 WeakPolarHBondContact OE1-CE 3.34Å; E44-K209 IonicContact OE1-NZ 2.81Å; E44-K209 PolarHBondContact OE1-NZ 3.01Å; E182-K209 WeakPolarHBondContact OE1-CA 3.29Å; E182-K209 PolarHBondContact OE1-N 3.25Å; P207-K209 PolarHBondContact O-N 2.91Å; P207-K209 VanDerWaalsContact O-N 3.12Å; K209-K212 VanDerWaalsContact O-CE 3.24Å; K209-K212 WeakPolarHBondContact O-CE 3.42Å
210	W	97.3	Very high	96.4	Very high	11 Å²	11	35 Å²	35	4%	0.042	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-93.4	-8.8	177.7	-71.5	100.5	0	0	0	113.8	E44 N45 R49 I60 R62 V206 P207 A208 K212 S215	E44-W210 HydrophobicContact CG-CZ2 4.07Å; E44-W210 PolarHBondContact OE1-NE1 3.09Å; N45-W210 WeakPolarHBondContact O-CH2 3.5Å; N45-W210 WeakPolarHBondContact O-CZ2 3.28Å; R49-W210 HydrophobicContact CB-CH2 4Å; R49-W210 HydrophobicContact CB-CZ2 3.61Å; I60-W210 HydrophobicContact CB-CD2 4.38Å; I60-W210 HydrophobicContact CB-CE3 4.12Å; I60-W210 HydrophobicContact CD1-CB 3.93Å; I60-W210 HydrophobicContact CD1-CD2 4.2Å; I60-W210 HydrophobicContact CD1-CG 3.79Å; I60-W210 HydrophobicContact CG2-CB 4.04Å; I60-W210 HydrophobicContact CG2-CD2 3.84Å; I60-W210 HydrophobicContact CG2-CE3 3.36Å; I60-W210 HydrophobicContact CG2-CG 4.14Å; I60-W210 HydrophobicContact CG2-CZ3 4.04Å; R62-W210 HydrophobicContact CG-CE3 4.01Å; R62-W210 HydrophobicContact CG-CZ3 3.79Å; V206-W210 HydrophobicContact CG1-CB 4.24Å; P207-W210 WeakPolarHBondContact O-CB 3.29Å; P207-W210 PolarHBondContact O-N 2.91Å; A208-W210 PolarHBondContact O-N 2.88Å; W210-K212 VanDerWaalsContact C-N 3.3Å; W210-K212 PolarHBondContact O-N 3.02Å; W210-S215 WeakPolarHBondContact O-CB 3.4Å; W210-S215 PolarHBondContact O-OG 2.8Å
211	I	97.8	Very high	96.5	Very high	5 Å²	5	33.3 Å²	33.3	3%	0.026	18%	0.184	C	C	.	.			trans	-85	76.9	178	-52.8	176.9	0	0	0	108.6	M159 Y173 I176 V185 V206 A208	M159-I211 HydrophobicContact CE-CG2 3.9Å; Y173-I211 HydrophobicContact CD1-CG2 3.85Å; Y173-I211 HydrophobicContact CD2-CG2 4.19Å; Y173-I211 HydrophobicContact CE1-CG2 3.67Å; Y173-I211 HydrophobicContact CE2-CB 4.18Å; Y173-I211 HydrophobicContact CE2-CG1 4.19Å; Y173-I211 HydrophobicContact CE2-CG2 4.02Å; Y173-I211 HydrophobicContact CG-CG2 4.11Å; I176-I211 HydrophobicContact CD1-CG2 4.37Å; I176-I211 HydrophobicContact CG1-CG2 4.47Å; V185-I211 HydrophobicContact CB-CB 4.42Å; V185-I211 HydrophobicContact CB-CG2 3.82Å; V185-I211 HydrophobicContact CG2-CB 3.95Å; V185-I211 HydrophobicContact CG2-CD1 4.37Å; V185-I211 HydrophobicContact CG2-CG2 3.87Å; V206-I211 HydrophobicContact CB-CD1 4.31Å; V206-I211 HydrophobicContact CB-CG1 4.27Å; V206-I211 HydrophobicContact CG1-CD1 4.4Å; V206-I211 HydrophobicContact CG1-CG1 3.83Å; A208-I211 WeakPolarHBondContact O-CB 3.34Å; A208-I211 PolarHBondContact O-N 2.87Å
212	K	97.1	Very high	96.1	Very high	98 Å²	98	30.4 Å²	30.4	43%	0.426	17%	0.173	S	C	.	.			trans	-132.8	153.6	-179.1	-63.9	-175.1	176.9	-179.3	0	110.6	K209 W210 G214 S215	K209-K212 VanDerWaalsContact O-CE 3.24Å; K209-K212 WeakPolarHBondContact O-CE 3.42Å; W210-K212 VanDerWaalsContact C-N 3.3Å; W210-K212 PolarHBondContact O-N 3.02Å; K212-G214 PolarHBondContact O-N 2.83Å; K212-S215 VanDerWaalsContact O-CB 3.32Å; K212-S215 WeakPolarHBondContact O-CB 3.25Å; K212-S215 PolarHBondContact O-N 2.76Å; K212-S215 PolarHBondContact O-OG 2.84Å
213	S	97.6	Very high	95.2	Very high	49 Å²	49	41.6 Å²	41.6	34%	0.343	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45.4	134.1	175.5	-54.4	0	0	0	0	112	Y173 I176 S215	Y173-S213 CarbonylContact O-C 3.56Å; Y173-S213 WeakPolarHBondContact O-CA 3.41Å; I176-S213 PolarHBondContact N-OG 3.02Å; I176-S213 PolarHBondContact O-OG 3.35Å; S213-S215 VanDerWaalsContact C-N 3.28Å; S213-S215 PolarHBondContact O-N 2.8Å
214	G	97.3	Very high	94	Very high	12 Å²	12	44 Å²	44	12%	0.124	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	11.5	-179.6	0	0	0	0	0	114.8	R62 N63 Q64 Y173 K212	R62-G214 CarbonylContact C-O 3.52Å; N63-G214 PolarHBondContact N-O 2.9Å; Q64-G214 PolarHBondContact N-O 2.79Å; Y173-G214 PolarHBondContact O-N 2.82Å; K212-G214 PolarHBondContact O-N 2.83Å
215	S	98.1	Very high	92.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.236	C	C	.	.			trans	-92.6	136.1	172.6	-37.2	0	0	0	0	111	Q61 Y173 W210 K212 S213	Q61-S215 CarbonylContact O-C 3.54Å; Q61-S215 WeakPolarHBondContact O-CA 3.06Å; Y173-S215 WeakPolarHBondContact CD2-O 3.42Å; Y173-S215 PolarHBondContact N-O 3.47Å; Y173-S215 VanDerWaalsContact N-O 3.15Å; W210-S215 WeakPolarHBondContact O-CB 3.4Å; W210-S215 PolarHBondContact O-OG 2.8Å; K212-S215 VanDerWaalsContact O-CB 3.32Å; K212-S215 WeakPolarHBondContact O-CB 3.25Å; K212-S215 PolarHBondContact O-N 2.76Å; K212-S215 PolarHBondContact O-OG 2.84Å; S213-S215 VanDerWaalsContact C-N 3.28Å; S213-S215 PolarHBondContact O-N 2.8Å
216	L	98.5	Very high	91.7	Very high	21 Å²	21	42.8 Å²	42.8	11%	0.11	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	122.2	176.8	178	64.6	0	0	0	109.2	I60 Q61 Q64 P67 F171 Y172 V218	I60-L216 CarbonylContact C-O 3.52Å; I60-L216 WeakPolarHBondContact CA-O 3.18Å; Q61-L216 PolarHBondContact N-O 2.89Å; Q61-L216 PolarHBondContact O-N 3.42Å; Q64-L216 HydrophobicContact CB-CB 3.97Å; Q64-L216 HydrophobicContact CG-CB 3.87Å; Q64-L216 HydrophobicContact CG-CD2 4.48Å; P67-L216 HydrophobicContact CG-CD1 3.81Å; P67-L216 HydrophobicContact CG-CD2 4.45Å; F171-L216 CarbonylContact O-C 3.54Å; F171-L216 WeakPolarHBondContact O-CA 3.47Å; Y172-L216 HydrophobicContact CD2-CB 4.29Å; Y172-L216 HydrophobicContact CD2-CD1 4.31Å; L216-V218 HydrophobicContact CD1-CG2 4.42Å; L216-V218 HydrophobicContact CD2-CG2 4.26Å; L216-V218 HydrophobicContact CG-CG2 4.03Å
217	V	98.6	Very high	90.3	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	134.8	171.6	-176.2	0	0	0	0	108.4	M58 R59 I60 S170 F171 Y173 V206 F219	M58-V217 HydrophobicContact CG-CG1 3.83Å; M58-V217 HydrophobicContact SD-CG1 4.09Å; R59-V217 CarbonylContact O-C 3.55Å; R59-V217 WeakPolarHBondContact O-CA 3.49Å; I60-V217 HydrophobicContact CG1-CG1 4.28Å; I60-V217 HydrophobicContact CG1-CG2 4.16Å; I60-V217 HydrophobicContact CG2-CG2 4.15Å; S170-V217 CarbonylContact C-O 3.52Å; S170-V217 WeakPolarHBondContact CA-O 3.28Å; S170-V217 WeakPolarHBondContact CB-O 3.26Å; F171-V217 HydrophobicContact CB-CB 4.19Å; F171-V217 PolarHBondContact N-O 3.29Å; F171-V217 PolarHBondContact O-N 2.97Å; Y173-V217 HydrophobicContact CE2-CG2 3.87Å; V206-V217 HydrophobicContact CG1-CG2 3.81Å; V206-V217 HydrophobicContact CG2-CB 4.39Å; V206-V217 HydrophobicContact CG2-CG1 3.83Å; V206-V217 HydrophobicContact CG2-CG2 4.03Å; V217-F219 HydrophobicContact CG1-CD2 4.25Å; V217-F219 HydrophobicContact CG1-CE1 4.48Å; V217-F219 HydrophobicContact CG1-CE2 3.6Å; V217-F219 HydrophobicContact CG1-CZ 3.75Å
218	V	98.2	Very high	89	Confident	10 Å²	10	47.5 Å²	47.5	6%	0.061	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	120.9	176.1	-175.9	0	0	0	0	109.1	M58 R59 K168 L216	M58-V218 WeakPolarHBondContact CA-O 3.25Å; R59-V218 PolarHBondContact N-O 3.22Å; R59-V218 PolarHBondContact O-N 3.24Å; K168-V218 HydrophobicContact CD-CG1 4.35Å; L216-V218 HydrophobicContact CD1-CG2 4.42Å; L216-V218 HydrophobicContact CD2-CG2 4.26Å; L216-V218 HydrophobicContact CG-CG2 4.03Å
219	F	98	Very high	88.1	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	126	167.9	-58.5	-83.4	0	0	0	109.7	Y56 S57 M58 K168 V169 F171 I189 I204 V206 V217	Y56-F219 HydrophobicContact CD1-CB 4.19Å; S57-F219 VanDerWaalsContact O-CA 3.27Å; S57-F219 WeakPolarHBondContact O-CA 3.37Å; M58-F219 HydrophobicContact CB-CD1 3.97Å; M58-F219 HydrophobicContact CB-CE1 3.87Å; M58-F219 HydrophobicContact CG-CD1 4.16Å; M58-F219 HydrophobicContact CG-CE1 3.7Å; M58-F219 HydrophobicContact CG-CZ 4.2Å; M58-F219 HydrophobicContact SD-CE1 3.59Å; M58-F219 VanDerWaalsContact SD-CE1 3.59Å; M58-F219 HydrophobicContact SD-CZ 3.84Å; K168-F219 VanDerWaalsContact CA-O 3.31Å; K168-F219 WeakPolarHBondContact CA-O 3.26Å; V169-F219 HydrophobicContact CB-CB 4.33Å; V169-F219 HydrophobicContact CB-CD2 4.41Å; V169-F219 HydrophobicContact CG1-CD2 4.5Å; V169-F219 PolarHBondContact N-O 3.01Å; V169-F219 PolarHBondContact O-N 3.24Å; F171-F219 AromaticContact CD2-CE2 3.66Å; F171-F219 HydrophobicContact CD2-CE2 3.66Å; F171-F219 HydrophobicContact CD2-CZ 4.44Å; F171-F219 HydrophobicContact CE2-CD2 4.34Å; F171-F219 AromaticContact CE2-CE2 3.41Å; F171-F219 HydrophobicContact CE2-CE2 3.41Å; F171-F219 VanDerWaalsContact CE2-CE2 3.41Å; F171-F219 HydrophobicContact CE2-CZ 4.11Å; F171-F219 HydrophobicContact CZ-CE2 4.12Å; I189-F219 HydrophobicContact CD1-CB 3.85Å; I189-F219 HydrophobicContact CD1-CD1 3.61Å; I189-F219 HydrophobicContact CD1-CD2 4.37Å; I189-F219 HydrophobicContact CD1-CE1 4.26Å; I189-F219 HydrophobicContact CD1-CG 3.67Å; I189-F219 HydrophobicContact CG1-CD1 3.94Å; I189-F219 HydrophobicContact CG1-CE1 4.08Å; I189-F219 HydrophobicContact CG1-CG 4.18Å; I189-F219 HydrophobicContact CG1-CZ 4.44Å; I189-F219 HydrophobicContact CG2-CD2 3.91Å; I189-F219 HydrophobicContact CG2-CE2 4.06Å; I189-F219 HydrophobicContact CG2-CG 4.29Å; I204-F219 HydrophobicContact CB-CE1 4.2Å; I204-F219 HydrophobicContact CG2-CD1 4.22Å; I204-F219 HydrophobicContact CG2-CE1 3.6Å; V206-F219 HydrophobicContact CG2-CE2 4.34Å; V206-F219 HydrophobicContact CG2-CZ 3.79Å; V217-F219 HydrophobicContact CG1-CD2 4.25Å; V217-F219 HydrophobicContact CG1-CE1 4.48Å; V217-F219 HydrophobicContact CG1-CE2 3.6Å; V217-F219 HydrophobicContact CG1-CZ 3.75Å
220	E	95	Very high	87.4	Confident	70 Å²	70	49.3 Å²	49.3	33%	0.327	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	128.4	178.3	179.4	160.3	-161	0	0	110	Y56 S57 K168 I222	Y56-E220 CarbonylContact C-O 3.55Å; Y56-E220 WeakPolarHBondContact CA-O 3.06Å; S57-E220 PolarHBondContact N-O 3.49Å; S57-E220 PolarHBondContact O-N 3.44Å; S57-E220 PolarHBondContact OG-O 3.37Å; K168-E220 WeakPolarHBondContact CE-OE1 3.33Å; K168-E220 WeakPolarHBondContact CE-OE2 3.26Å; K168-E220 HydrophobicContact CG-CB 4.21Å; K168-E220 HydrophobicContact CG-CG 4.19Å; K168-E220 IonicContact NZ-OE1 3.99Å; K168-E220 PolarHBondContact NZ-OE1 3.4Å; K168-E220 IonicContact NZ-OE2 3.51Å; K168-E220 PolarHBondContact NZ-OE2 3.4Å; E220-I222 PolarHBondContact O-N 3.01Å
221	A	91.6	Very high	86.7	Confident	48 Å²	48	51.4 Å²	51.4	40%	0.397	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	123.8	178.1	0	0	0	0	0	109.8	K55 Y56	K55-A221 CarbonylContact O-C 3.46Å; K55-A221 WeakPolarHBondContact O-CA 3.36Å; Y56-A221 HydrophobicContact CD1-CB 4.4Å; Y56-A221 HydrophobicContact CE1-CB 4.02Å
222	I	84.8	Confident	86.2	Confident	36 Å²	36	53.4 Å²	53.4	19%	0.185	27%	0.272	C	S	.	.			trans	-86.7	120.8	175	-55.9	165.8	0	0	0	107.5	I52 K55 Y56 E220 E224 I225	I52-I222 HydrophobicContact CD1-CD1 3.74Å; I52-I222 HydrophobicContact CG2-CD1 3.66Å; K55-I222 PolarHBondContact O-N 3.28Å; Y56-I222 WeakPolarHBondContact O-CD1 3.32Å; E220-I222 PolarHBondContact O-N 3.01Å; I222-E224 WeakPolarHBondContact CG2-O 3.34Å; I222-I225 HydrophobicContact CB-CG2 4.29Å; I222-I225 HydrophobicContact CD1-CG2 4.22Å; I222-I225 HydrophobicContact CG2-CG2 3.48Å; I222-I225 VanDerWaalsContact CG2-CG2 3.48Å
223	R	72.6	Confident	85.6	Confident	237 Å²	237	55.5 Å²	55.5	89%	0.894	28%	0.283	S	S	*	.	S	Bend	trans	-77.4	-40.4	174.3	-65	-176.7	-179.5	-173.2	0.4	111.4
224	E	70.6	Confident	85	Confident	93 Å²	93	55.8 Å²	55.8	44%	0.435	28%	0.283	S	S	.	.			trans	-134.2	123.8	-169.8	-69	-166.6	-154.8	0	0	110.1	I222 Q228 Y229 I240	I222-E224 WeakPolarHBondContact CG2-O 3.34Å; E224-Q228 PolarHBondContact OE2-NE2 3.26Å; E224-Y229 PolarHBondContact OE2-OH 2.73Å; E224-I240 HydrophobicContact CB-CD1 4.13Å; E224-I240 HydrophobicContact CB-CG1 4.1Å; E224-I240 WeakPolarHBondContact O-CD1 3.39Å
225	I	71.1	Confident	84.4	Confident	39 Å²	39	55.2 Å²	55.2	20%	0.2	28%	0.277	C	S	.	.			trans	-119.6	150.7	170.8	56.6	171	0	0	0	109.2	I222 S227 Q228	I222-I225 HydrophobicContact CB-CG2 4.29Å; I222-I225 HydrophobicContact CD1-CG2 4.22Å; I222-I225 HydrophobicContact CG2-CG2 3.48Å; I222-I225 VanDerWaalsContact CG2-CG2 3.48Å; I225-S227 PolarHBondContact O-N 3Å; I225-Q228 WeakPolarHBondContact O-CB 3.35Å; I225-Q228 WeakPolarHBondContact O-CG 3.4Å; I225-Q228 PolarHBondContact O-N 3.41Å
226	C	74	Confident	83.7	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-48.7	-41.1	179.8	-58.6	0	0	0	0	112.7	Q228 Y229 C245 C254 I256	C226-Q228 PolarHBondContact O-N 3.46Å; C226-Y229 VanDerWaalsContact O-CD2 3.25Å; C226-Y229 WeakPolarHBondContact O-CD2 3.42Å; C226-Y229 PolarHBondContact O-N 3.22Å; C226-C245 WeakPolarHBondContact CA-SG 3.41Å; C226-C245 HydrophobicContact CB-CB 3.68Å; C226-C245 WeakPolarHBondContact CB-SG 3.4Å; C226-C245 WeakPolarHBondContact SG-CA 3.38Å; C226-C245 WeakPolarHBondContact SG-CB 3.4Å; C226-C245 CovalentContact SG-SG 2.03Å; C226-C245 PolarHBondContact SG-SG 3.19Å; C226-C254 CarbonylContact C-O 3.56Å; C226-C254 WeakPolarHBondContact O-CB 3.37Å; C226-C254 PolarHBondContact O-SG 2.94Å; C226-I256 HydrophobicContact CB-CG1 4.24Å
227	S	69.8	Low	82.9	Confident	55 Å²	55	65.9 Å²	65.9	39%	0.385	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-65.2	-6.1	-177	-50.4	0	0	0	0	115.8	I225 C254	I225-S227 PolarHBondContact O-N 3Å; S227-C254 WeakPolarHBondContact CA-O 3.34Å; S227-C254 PolarHBondContact N-O 2.8Å; S227-C254 PolarHBondContact OG-O 3.33Å
228	Q	69.8	Low	81.8	Confident	84 Å²	84	66.6 Å²	66.6	39%	0.393	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-79.8	-22.7	172.7	81.5	-166.1	-7.4	0	0	112.7	E224 I225 C226 N230	E224-Q228 PolarHBondContact OE2-NE2 3.26Å; I225-Q228 WeakPolarHBondContact O-CB 3.35Å; I225-Q228 WeakPolarHBondContact O-CG 3.4Å; I225-Q228 PolarHBondContact O-N 3.41Å; C226-Q228 PolarHBondContact O-N 3.46Å; Q228-N230 PolarHBondContact O-N 2.71Å
229	Y	77.9	Confident	80.4	Confident	36 Å²	36	75 Å²	75	14%	0.141	38%	0.375	C	S	.	.			trans	-82.8	120.3	179.8	-54.3	-72.2	0	0	0	109.1	E224 C226 T234 A238 I240 C254	E224-Y229 PolarHBondContact OE2-OH 2.73Å; C226-Y229 VanDerWaalsContact O-CD2 3.25Å; C226-Y229 WeakPolarHBondContact O-CD2 3.42Å; C226-Y229 PolarHBondContact O-N 3.22Å; Y229-T234 WeakPolarHBondContact CD1-O 3.35Å; Y229-A238 HydrophobicContact CD2-CB 3.69Å; Y229-A238 HydrophobicContact CE1-CB 4.26Å; Y229-A238 HydrophobicContact CE2-CB 3.18Å; Y229-A238 HydrophobicContact CG-CB 4.41Å; Y229-A238 VanDerWaalsContact CZ-CB 3.48Å; Y229-I240 HydrophobicContact CE2-CD1 3.82Å; Y229-I240 HydrophobicContact CE2-CG1 4.42Å; Y229-C254 VanDerWaalsContact O-CB 3.29Å; Y229-C254 WeakPolarHBondContact O-CB 3.36Å
230	N	79.4	Confident	78.9	Confident	131 Å²	131	76.2 Å²	76.2	70%	0.701	38%	0.381	S	S	*	.			trans	-100.4	3.9	-173	64.8	-20.4	0	0	0	113.6	Q228 W247	Q228-N230 PolarHBondContact O-N 2.71Å; N230-W247 WeakPolarHBondContact O-CH2 3.37Å
231	T	83.8	Confident	77.4	Confident	55 Å²	55	79.1 Å²	79.1	34%	0.337	41%	0.409	S	S	.	.	S	Bend	trans	-133.1	153.8	176.9	72	0	0	0	0	110.1	E233 T234 C235	T231-E233 VanDerWaalsContact C-N 3.31Å; T231-E233 PolarHBondContact O-N 2.8Å; T231-T234 PolarHBondContact N-OG1 3.16Å; T231-T234 PolarHBondContact O-N 2.75Å; T231-T234 PolarHBondContact O-OG1 2.68Å; T231-T234 WeakPolarHBondContact OG1-CB 3.41Å; T231-T234 WeakPolarHBondContact OG1-CG2 3.41Å; T231-T234 PolarHBondContact OG1-N 2.87Å; T231-T234 VanDerWaalsContact OG1-N 3.11Å; T231-T234 PolarHBondContact OG1-OG1 3.3Å; T231-C235 VanDerWaalsContact O-CB 3.23Å; T231-C235 WeakPolarHBondContact O-CB 3.49Å; T231-C235 PolarHBondContact O-N 3.04Å
232	N	85.8	Confident	76.1	Confident	48 Å²	48	81.9 Å²	81.9	26%	0.257	42%	0.416	S	S	.	.	H	α-helix	trans	-56.6	-46.9	175.9	-169.9	1.6	0	0	0	111.4	T234 C235 Q236 W247 E249	N232-T234 PolarHBondContact O-N 2.85Å; N232-C235 WeakPolarHBondContact O-CB 3.39Å; N232-C235 PolarHBondContact O-N 2.72Å; N232-Q236 WeakPolarHBondContact O-CG 3.41Å; N232-Q236 PolarHBondContact O-N 2.91Å; N232-Q236 VanDerWaalsContact OD1-CD 3.28Å; N232-Q236 WeakPolarHBondContact OD1-CG 3.3Å; N232-Q236 PolarHBondContact OD1-NE2 3.24Å; N232-W247 VanDerWaalsContact CA-CD2 3.47Å; N232-W247 HydrophobicContact CB-CB 4.26Å; N232-W247 HydrophobicContact CB-CD2 3.8Å; N232-W247 HydrophobicContact CB-CE3 4.49Å; N232-W247 HydrophobicContact CB-CG 3.66Å; N232-W247 VanDerWaalsContact CG-CD1 3.43Å; N232-W247 WeakPolarHBondContact OD1-CB 3.32Å; N232-E249 PolarHBondContact ND2-OE1 2.87Å
233	E	85.1	Confident	75.5	Confident	141 Å²	141	80.6 Å²	80.6	66%	0.659	41%	0.41	S	S	*	.	H	α-helix	trans	-60.3	-49.6	179.8	-174.3	-179.9	-175.8	0	0	112.4	T231 C235 Q236 N237	T231-E233 VanDerWaalsContact C-N 3.31Å; T231-E233 PolarHBondContact O-N 2.8Å; E233-C235 VanDerWaalsContact C-N 3.27Å; E233-C235 PolarHBondContact O-N 2.94Å; E233-Q236 PolarHBondContact O-N 3.05Å; E233-N237 WeakPolarHBondContact O-CB 3.23Å; E233-N237 PolarHBondContact O-N 2.7Å; E233-N237 PolarHBondContact O-ND2 2.86Å; E233-N237 VanDerWaalsContact O-ND2 3.16Å
234	T	85.5	Confident	75.8	Confident	55 Å²	55	74.2 Å²	74.2	34%	0.337	40%	0.397	S	S	.	.	H	α-helix	trans	-67.3	-29.8	178.5	56.6	0	0	0	0	112.7	Y229 T231 N232 A238	Y229-T234 WeakPolarHBondContact CD1-O 3.35Å; T231-T234 PolarHBondContact N-OG1 3.16Å; T231-T234 PolarHBondContact O-N 2.75Å; T231-T234 PolarHBondContact O-OG1 2.68Å; T231-T234 WeakPolarHBondContact OG1-CB 3.41Å; T231-T234 WeakPolarHBondContact OG1-CG2 3.41Å; T231-T234 PolarHBondContact OG1-N 2.87Å; T231-T234 VanDerWaalsContact OG1-N 3.11Å; T231-T234 PolarHBondContact OG1-OG1 3.3Å; N232-T234 PolarHBondContact O-N 2.85Å; T234-A238 PolarHBondContact O-N 2.89Å
235	C	84.8	Confident	76.3	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-70.6	-43	175.2	-177.5	0	0	0	0	112.9	T231 N232 E233 A238 F246 W247 C254	T231-C235 VanDerWaalsContact O-CB 3.23Å; T231-C235 WeakPolarHBondContact O-CB 3.49Å; T231-C235 PolarHBondContact O-N 3.04Å; N232-C235 WeakPolarHBondContact O-CB 3.39Å; N232-C235 PolarHBondContact O-N 2.72Å; E233-C235 VanDerWaalsContact C-N 3.27Å; E233-C235 PolarHBondContact O-N 2.94Å; C235-A238 VanDerWaalsContact O-CB 3.27Å; C235-A238 WeakPolarHBondContact O-CB 3.21Å; C235-A238 PolarHBondContact O-N 3.33Å; C235-F246 PolarHBondContact SG-O 3.22Å; C235-W247 HydrophobicContact CB-CB 4.36Å; C235-W247 HydrophobicContact CB-CE3 3.79Å; C235-W247 PolarHBondContact SG-N 3.12Å; C235-W247 VanDerWaalsContact SG-N 3.43Å; C235-C254 VanDerWaalsContact CA-SG 3.51Å; C235-C254 HydrophobicContact CB-CB 3.52Å; C235-C254 WeakPolarHBondContact CB-SG 3.49Å; C235-C254 WeakPolarHBondContact SG-CA 3.49Å; C235-C254 WeakPolarHBondContact SG-CB 3.36Å; C235-C254 CovalentContact SG-SG 2.02Å; C235-C254 PolarHBondContact SG-SG 2.86Å
236	Q	82.6	Confident	77	Confident	131 Å²	131	71.1 Å²	71.1	61%	0.612	38%	0.382	S	S	*	.	H	α-helix	trans	-70.1	-36.1	179.3	-71.8	-177.3	3.7	0	0	112	N232 E233 A238	N232-Q236 WeakPolarHBondContact O-CG 3.41Å; N232-Q236 PolarHBondContact O-N 2.91Å; N232-Q236 VanDerWaalsContact OD1-CD 3.28Å; N232-Q236 WeakPolarHBondContact OD1-CG 3.3Å; N232-Q236 PolarHBondContact OD1-NE2 3.24Å; E233-Q236 PolarHBondContact O-N 3.05Å; Q236-A238 PolarHBondContact O-N 3.35Å
237	N	81	Confident	77.5	Confident	114 Å²	114	72.9 Å²	72.9	61%	0.61	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	6	178	-65.3	-32.9	0	0	0	113.4	E233 E239	E233-N237 WeakPolarHBondContact O-CB 3.23Å; E233-N237 PolarHBondContact O-N 2.7Å; E233-N237 PolarHBondContact O-ND2 2.86Å; E233-N237 VanDerWaalsContact O-ND2 3.16Å; N237-E239 PolarHBondContact O-N 3.47Å; N237-E239 VanDerWaalsContact O-N 3.09Å
238	A	76.5	Confident	78.2	Confident	16 Å²	16	70.4 Å²	70.4	13%	0.132	37%	0.372	C	S	.	.			trans	-71.8	101.8	-178.9	0	0	0	0	0	111.6	Y229 T234 C235 Q236 I240 C245	Y229-A238 HydrophobicContact CD2-CB 3.69Å; Y229-A238 HydrophobicContact CE1-CB 4.26Å; Y229-A238 HydrophobicContact CE2-CB 3.18Å; Y229-A238 HydrophobicContact CG-CB 4.41Å; Y229-A238 VanDerWaalsContact CZ-CB 3.48Å; T234-A238 PolarHBondContact O-N 2.89Å; C235-A238 VanDerWaalsContact O-CB 3.27Å; C235-A238 WeakPolarHBondContact O-CB 3.21Å; C235-A238 PolarHBondContact O-N 3.33Å; Q236-A238 PolarHBondContact O-N 3.35Å; A238-I240 VanDerWaalsContact C-N 3.33Å; A238-I240 PolarHBondContact O-N 2.87Å; A238-I240 VanDerWaalsContact O-N 3.11Å; A238-C245 HydrophobicContact CB-CB 4.18Å
239	E	68.4	Low	78.9	Confident	185 Å²	185	72.4 Å²	72.4	86%	0.864	38%	0.381	S	S	*	.			trans	-83.6	73.2	169.6	-71.2	-170.1	171.4	0	0	111.4	N237	N237-E239 PolarHBondContact O-N 3.47Å; N237-E239 VanDerWaalsContact O-N 3.09Å
240	I	67.6	Low	79.1	Confident	26 Å²	26	77.8 Å²	77.8	13%	0.133	41%	0.405	C	S	.	.	B	Isolated β-bridge	trans	-88.6	112.9	168.1	-61.8	171.6	0	0	0	108	E224 Y229 A238 I242 L243	E224-I240 HydrophobicContact CB-CD1 4.13Å; E224-I240 HydrophobicContact CB-CG1 4.1Å; E224-I240 WeakPolarHBondContact O-CD1 3.39Å; Y229-I240 HydrophobicContact CE2-CD1 3.82Å; Y229-I240 HydrophobicContact CE2-CG1 4.42Å; A238-I240 VanDerWaalsContact C-N 3.33Å; A238-I240 PolarHBondContact O-N 2.87Å; A238-I240 VanDerWaalsContact O-N 3.11Å; I240-I242 PolarHBondContact O-N 3.24Å; I240-L243 HydrophobicContact CB-CB 4.34Å; I240-L243 HydrophobicContact CG2-CB 3.95Å; I240-L243 HydrophobicContact CG2-CD1 4.37Å; I240-L243 HydrophobicContact CG2-CG 4.23Å; I240-L243 PolarHBondContact O-N 2.9Å; I240-L243 VanDerWaalsContact O-O 3.12Å
241	S	61.8	Low	79.1	Confident	131 Å²	131	76.2 Å²	76.2	92%	0.916	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-18.3	-171.4	-41	0	0	0	0	115.6
242	I	65.9	Low	79	Confident	106 Å²	106	80.8 Å²	80.8	54%	0.544	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-21.3	-176.1	-55.8	166.3	0	0	0	112.3	Y50 I240	Y50-I242 HydrophobicContact CE1-CG2 3.7Å; Y50-I242 WeakPolarHBondContact OH-CG2 3.42Å; I240-I242 PolarHBondContact O-N 3.24Å
243	L	71.9	Confident	78.7	Confident	10 Å²	10	85 Å²	85	5%	0.052	43%	0.426	C	S	.	.	B	Isolated β-bridge	trans	-129	124.6	-168.1	-59.3	175.2	0	0	0	110.6	I42 I52 I240 C245 I256	I42-L243 HydrophobicContact CD1-CD2 3.34Å; I52-L243 HydrophobicContact CD1-CD1 4.42Å; I52-L243 HydrophobicContact CD1-CD2 4.46Å; I52-L243 HydrophobicContact CG1-CD2 4.44Å; I240-L243 HydrophobicContact CB-CB 4.34Å; I240-L243 HydrophobicContact CG2-CB 3.95Å; I240-L243 HydrophobicContact CG2-CD1 4.37Å; I240-L243 HydrophobicContact CG2-CG 4.23Å; I240-L243 PolarHBondContact O-N 2.9Å; I240-L243 VanDerWaalsContact O-O 3.12Å; L243-C245 PolarHBondContact O-N 2.97Å; L243-I256 HydrophobicContact CD1-CD1 3.96Å; L243-I256 HydrophobicContact CD1-CG1 4.3Å; L243-I256 HydrophobicContact CD2-CD1 4.26Å; L243-I256 HydrophobicContact CD2-CG2 4.16Å
244	T	77.7	Confident	78.4	Confident	103 Å²	103	78.3 Å²	78.3	63%	0.632	40%	0.395	S	S	*	.			trans	-83.7	115.4	167.1	-52.4	0	0	0	0	109.1	S257	T244-S257 WeakPolarHBondContact CB-OG 3.41Å; T244-S257 WeakPolarHBondContact O-CB 3.23Å; T244-S257 PolarHBondContact O-N 3.46Å; T244-S257 PolarHBondContact O-OG 3.23Å
245	C	81.9	Confident	78.1	Confident	16 Å²	16	77 Å²	77	11%	0.108	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	147.7	176.2	-57.1	0	0	0	0	111.5	C226 A238 L243 I255	C226-C245 WeakPolarHBondContact CA-SG 3.41Å; C226-C245 HydrophobicContact CB-CB 3.68Å; C226-C245 WeakPolarHBondContact CB-SG 3.4Å; C226-C245 WeakPolarHBondContact SG-CA 3.38Å; C226-C245 WeakPolarHBondContact SG-CB 3.4Å; C226-C245 CovalentContact SG-SG 2.03Å; C226-C245 PolarHBondContact SG-SG 3.19Å; A238-C245 HydrophobicContact CB-CB 4.18Å; L243-C245 PolarHBondContact O-N 2.97Å; C245-I255 CarbonylContact C-O 3.51Å; C245-I255 WeakPolarHBondContact CA-O 3.46Å
246	F	85.5	Confident	77.7	Confident	50 Å²	50	77.2 Å²	77.2	22%	0.219	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	147.4	170	84.1	-86.6	0	0	0	110.9	C235 C248 I255 I256 T262 C265	C235-F246 PolarHBondContact SG-O 3.22Å; F246-C248 HydrophobicContact CE2-CB 4.31Å; F246-I255 HydrophobicContact CD1-CD1 4.26Å; F246-I255 HydrophobicContact CD1-CG1 3.74Å; F246-I255 WeakPolarHBondContact CD1-O 3.11Å; F246-I255 HydrophobicContact CD2-CD1 4.49Å; F246-I255 HydrophobicContact CD2-CG1 4.18Å; F246-I255 HydrophobicContact CE1-CB 4.3Å; F246-I255 HydrophobicContact CE1-CD1 3.37Å; F246-I255 HydrophobicContact CE1-CG1 3.35Å; F246-I255 HydrophobicContact CE2-CD1 3.62Å; F246-I255 HydrophobicContact CE2-CG1 3.8Å; F246-I255 HydrophobicContact CG-CG1 4.2Å; F246-I255 HydrophobicContact CZ-CD1 3.02Å; F246-I255 HydrophobicContact CZ-CG1 3.42Å; F246-I255 VanDerWaalsContact CZ-CG1 3.42Å; F246-I255 PolarHBondContact N-O 3.44Å; F246-I255 PolarHBondContact O-N 2.79Å; F246-I256 WeakPolarHBondContact CE1-O 3.26Å; F246-T262 HydrophobicContact CE1-CG2 3.65Å; F246-T262 HydrophobicContact CZ-CG2 3.54Å; F246-C265 HydrophobicContact CE2-CB 3.8Å; F246-C265 HydrophobicContact CZ-CB 3.91Å
247	W	85.2	Confident	77.1	Confident	37 Å²	37	72.7 Å²	72.7	14%	0.14	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	125.4	178.4	-174.7	-106.5	0	0	0	110.5	N230 N232 C235 E249 E252 C254	N230-W247 WeakPolarHBondContact O-CH2 3.37Å; N232-W247 VanDerWaalsContact CA-CD2 3.47Å; N232-W247 HydrophobicContact CB-CB 4.26Å; N232-W247 HydrophobicContact CB-CD2 3.8Å; N232-W247 HydrophobicContact CB-CE3 4.49Å; N232-W247 HydrophobicContact CB-CG 3.66Å; N232-W247 VanDerWaalsContact CG-CD1 3.43Å; N232-W247 WeakPolarHBondContact OD1-CB 3.32Å; C235-W247 HydrophobicContact CB-CB 4.36Å; C235-W247 HydrophobicContact CB-CE3 3.79Å; C235-W247 PolarHBondContact SG-N 3.12Å; C235-W247 VanDerWaalsContact SG-N 3.43Å; W247-E249 PolarHBondContact NE1-OE2 3.4Å; W247-E252 VanDerWaalsContact CH2-C 3.5Å; W247-E252 WeakPolarHBondContact CH2-O 3.39Å; W247-E252 HydrophobicContact CZ2-CB 4.25Å; W247-C254 HydrophobicContact CE3-CB 4.03Å; W247-C254 HydrophobicContact CZ3-CB 4.26Å
248	C	83.5	Confident	76.1	Confident	3 Å²	3	72.6 Å²	72.6	2%	0.02	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	105.3	169.8	179.7	0	0	0	0	110.1	F246 K250 K251 E252 K253 I255 C265	F246-C248 HydrophobicContact CE2-CB 4.31Å; C248-K250 VanDerWaalsContact C-N 3.32Å; C248-K250 PolarHBondContact O-N 2.83Å; C248-K251 HydrophobicContact CB-CB 4.36Å; C248-K251 PolarHBondContact O-N 3.15Å; C248-E252 WeakPolarHBondContact O-CA 3.48Å; C248-E252 PolarHBondContact O-N 2.87Å; C248-K253 PolarHBondContact N-O 3.34Å; C248-K253 PolarHBondContact O-N 2.81Å; C248-I255 HydrophobicContact CB-CD1 3.78Å; C248-I255 HydrophobicContact CB-CG1 3.99Å; C248-C265 HydrophobicContact CB-CB 3.75Å; C248-C265 WeakPolarHBondContact CB-SG 3.23Å; C248-C265 WeakPolarHBondContact SG-CB 3.46Å; C248-C265 CovalentContact SG-SG 2.04Å; C248-C265 PolarHBondContact SG-SG 3.42Å
249	E	84.8	Confident	75.1	Confident	126 Å²	126	73.3 Å²	73.3	59%	0.589	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-57.5	-43.5	178.8	-67.5	-65.6	175.8	0	0	112	N232 W247 K251 E252	N232-E249 PolarHBondContact ND2-OE1 2.87Å; W247-E249 PolarHBondContact NE1-OE2 3.4Å; E249-K251 PolarHBondContact O-N 3.41Å; E249-E252 PolarHBondContact O-N 3.01Å
250	K	82.4	Confident	74.2	Confident	149 Å²	149	71.6 Å²	71.6	65%	0.648	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-60.8	-30.4	-178.9	-169.4	178.9	-178.9	-178	0	113.6	C248 D264	C248-K250 VanDerWaalsContact C-N 3.32Å; C248-K250 PolarHBondContact O-N 2.83Å; K250-D264 HydrophobicContact CD-CB 4.41Å; K250-D264 WeakPolarHBondContact CD-O 3.48Å; K250-D264 IonicContact NZ-OD1 3.69Å; K250-D264 PolarHBondContact NZ-OD1 2.85Å
251	K	78.8	Confident	73.3	Confident	98 Å²	98	76.2 Å²	76.2	43%	0.426	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-104.9	-4.4	-179	-68.3	-175.2	178.1	176.9	0	112.9	C248 E249 K253	C248-K251 HydrophobicContact CB-CB 4.36Å; C248-K251 PolarHBondContact O-N 3.15Å; E249-K251 PolarHBondContact O-N 3.41Å; K251-K253 HydrophobicContact CB-CB 4.25Å; K251-K253 VanDerWaalsContact O-CG 3.31Å; K251-K253 WeakPolarHBondContact O-CG 3.47Å; K251-K253 PolarHBondContact O-N 2.84Å
252	E	81.5	Confident	72.8	Confident	152 Å²	152	70 Å²	70	71%	0.71	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.1	42.3	-169.7	-60.7	-178.1	161.5	0	0	112.4	W247 C248 E249	W247-E252 VanDerWaalsContact CH2-C 3.5Å; W247-E252 WeakPolarHBondContact CH2-O 3.39Å; W247-E252 HydrophobicContact CZ2-CB 4.25Å; C248-E252 WeakPolarHBondContact O-CA 3.48Å; C248-E252 PolarHBondContact O-N 2.87Å; E249-E252 PolarHBondContact O-N 3.01Å
253	K	80.6	Confident	72.2	Confident	135 Å²	135	72.4 Å²	72.4	59%	0.587	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.6	140.6	-173.3	-79.2	173.9	-173.4	-178.5	0	111.5	C248 K251 I255	C248-K253 PolarHBondContact N-O 3.34Å; C248-K253 PolarHBondContact O-N 2.81Å; K251-K253 HydrophobicContact CB-CB 4.25Å; K251-K253 VanDerWaalsContact O-CG 3.31Å; K251-K253 WeakPolarHBondContact O-CG 3.47Å; K251-K253 PolarHBondContact O-N 2.84Å; K253-I255 HydrophobicContact CB-CG2 4.48Å
254	C	79.6	Confident	71.7	Confident	1 Å²	1	76.2 Å²	76.2	1%	0.007	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	122.7	169.1	-170.1	0	0	0	0	110.7	C226 S227 Y229 C235 W247	C226-C254 CarbonylContact C-O 3.56Å; C226-C254 WeakPolarHBondContact O-CB 3.37Å; C226-C254 PolarHBondContact O-SG 2.94Å; S227-C254 WeakPolarHBondContact CA-O 3.34Å; S227-C254 PolarHBondContact N-O 2.8Å; S227-C254 PolarHBondContact OG-O 3.33Å; Y229-C254 VanDerWaalsContact O-CB 3.29Å; Y229-C254 WeakPolarHBondContact O-CB 3.36Å; C235-C254 VanDerWaalsContact CA-SG 3.51Å; C235-C254 HydrophobicContact CB-CB 3.52Å; C235-C254 WeakPolarHBondContact CB-SG 3.49Å; C235-C254 WeakPolarHBondContact SG-CA 3.49Å; C235-C254 WeakPolarHBondContact SG-CB 3.36Å; C235-C254 CovalentContact SG-SG 2.02Å; C235-C254 PolarHBondContact SG-SG 2.86Å; W247-C254 HydrophobicContact CE3-CB 4.03Å; W247-C254 HydrophobicContact CZ3-CB 4.26Å
255	I	78.9	Confident	71.2	Confident	27 Å²	27	72.1 Å²	72.1	14%	0.138	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	162.2	-174.6	51.5	165.1	0	0	0	111.5	C245 F246 C248 K253 T262 C265	C245-I255 CarbonylContact C-O 3.51Å; C245-I255 WeakPolarHBondContact CA-O 3.46Å; F246-I255 HydrophobicContact CD1-CD1 4.26Å; F246-I255 HydrophobicContact CD1-CG1 3.74Å; F246-I255 WeakPolarHBondContact CD1-O 3.11Å; F246-I255 HydrophobicContact CD2-CD1 4.49Å; F246-I255 HydrophobicContact CD2-CG1 4.18Å; F246-I255 HydrophobicContact CE1-CB 4.3Å; F246-I255 HydrophobicContact CE1-CD1 3.37Å; F246-I255 HydrophobicContact CE1-CG1 3.35Å; F246-I255 HydrophobicContact CE2-CD1 3.62Å; F246-I255 HydrophobicContact CE2-CG1 3.8Å; F246-I255 HydrophobicContact CG-CG1 4.2Å; F246-I255 HydrophobicContact CZ-CD1 3.02Å; F246-I255 HydrophobicContact CZ-CG1 3.42Å; F246-I255 VanDerWaalsContact CZ-CG1 3.42Å; F246-I255 PolarHBondContact N-O 3.44Å; F246-I255 PolarHBondContact O-N 2.79Å; C248-I255 HydrophobicContact CB-CD1 3.78Å; C248-I255 HydrophobicContact CB-CG1 3.99Å; K253-I255 HydrophobicContact CB-CG2 4.48Å; I255-T262 HydrophobicContact CD1-CG2 4.29Å; I255-C265 HydrophobicContact CD1-CB 4Å
256	I	76.5	Confident	70	Confident	6 Å²	6	78.6 Å²	78.6	3%	0.031	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	129	179.9	-58.8	165.7	0	0	0	108.7	I40 C226 L243 F246 N258 L259	I40-I256 HydrophobicContact CD1-CD1 4Å; C226-I256 HydrophobicContact CB-CG1 4.24Å; L243-I256 HydrophobicContact CD1-CD1 3.96Å; L243-I256 HydrophobicContact CD1-CG1 4.3Å; L243-I256 HydrophobicContact CD2-CD1 4.26Å; L243-I256 HydrophobicContact CD2-CG2 4.16Å; F246-I256 WeakPolarHBondContact CE1-O 3.26Å; I256-N258 VanDerWaalsContact C-N 3.27Å; I256-N258 PolarHBondContact O-N 3.13Å; I256-L259 HydrophobicContact CB-CD1 4.08Å; I256-L259 HydrophobicContact CB-CG 4.43Å; I256-L259 PolarHBondContact O-N 3.27Å
257	S	69.2	Low	68.2	Low	36 Å²	36	82.5 Å²	82.5	25%	0.252	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-35.1	-178.5	54.9	0	0	0	0	114.8	T244 L259	T244-S257 WeakPolarHBondContact CB-OG 3.41Å; T244-S257 WeakPolarHBondContact O-CB 3.23Å; T244-S257 PolarHBondContact O-N 3.46Å; T244-S257 PolarHBondContact O-OG 3.23Å; S257-L259 VanDerWaalsContact C-N 3.3Å; S257-L259 PolarHBondContact O-N 2.92Å
258	N	60.6	Low	65.7	Low	112 Å²	112	88.7 Å²	88.7	60%	0.599	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	6.7	-177.6	-85.5	-6.1	0	0	0	115.2	I256 Q260	I256-N258 VanDerWaalsContact C-N 3.27Å; I256-N258 PolarHBondContact O-N 3.13Å; N258-Q260 PolarHBondContact O-N 2.76Å
259	L	54	Low	63.2	Low	31 Å²	31	98.2 Å²	98.2	16%	0.162	47%	0.469	C	S	.	.			trans	-67.9	128.1	173.3	-86.6	157	0	0	0	111	I40 I256 S257 D261 T262	I40-L259 HydrophobicContact CB-CD2 4.34Å; I40-L259 HydrophobicContact CD1-CD1 3.94Å; I40-L259 HydrophobicContact CD1-CD2 3.83Å; I40-L259 HydrophobicContact CD1-CG 4.2Å; I40-L259 HydrophobicContact CG1-CD2 3.92Å; I40-L259 HydrophobicContact CG2-CD2 3.53Å; I40-L259 HydrophobicContact CG2-CG 4.07Å; I256-L259 HydrophobicContact CB-CD1 4.08Å; I256-L259 HydrophobicContact CB-CG 4.43Å; I256-L259 PolarHBondContact O-N 3.27Å; S257-L259 VanDerWaalsContact C-N 3.3Å; S257-L259 PolarHBondContact O-N 2.92Å; L259-D261 PolarHBondContact O-N 2.84Å; L259-T262 HydrophobicContact CB-CG2 3.93Å; L259-T262 WeakPolarHBondContact O-CB 3.44Å; L259-T262 WeakPolarHBondContact O-CG2 3.37Å; L259-T262 PolarHBondContact O-N 3.32Å; L259-T262 PolarHBondContact O-OG1 2.9Å
260	Q	49.8	Very low	60.7	Low	148 Å²	148	99 Å²	99	69%	0.692	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-63.6	-27.7	169	-152.5	84.8	2.4	0	0	111.1	N258 T262 H263	N258-Q260 PolarHBondContact O-N 2.76Å; Q260-T262 PolarHBondContact O-N 2.84Å; Q260-H263 PolarHBondContact O-CD2 3.09Å
261	D	48.4	Very low	58.1	Low	124 Å²	124	96.8 Å²	96.8	66%	0.663	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-71.7	16.2	177	-67.7	-25.9	0	0	0	114.3	L259 H263	L259-D261 PolarHBondContact O-N 2.84Å; D261-H263 PolarHBondContact O-N 3.15Å
262	T	51.4	Low	55.5	Low	1 Å²	1	99.4 Å²	99.4	1%	0.006	50%	0.5	C	S	.	.	G	3₁₀ helix	trans	-81.1	9.4	176	51.6	0	0	0	0	113.1	F246 I255 L259 Q260 D264 C265 R266	F246-T262 HydrophobicContact CE1-CG2 3.65Å; F246-T262 HydrophobicContact CZ-CG2 3.54Å; I255-T262 HydrophobicContact CD1-CG2 4.29Å; L259-T262 HydrophobicContact CB-CG2 3.93Å; L259-T262 WeakPolarHBondContact O-CB 3.44Å; L259-T262 WeakPolarHBondContact O-CG2 3.37Å; L259-T262 PolarHBondContact O-N 3.32Å; L259-T262 PolarHBondContact O-OG1 2.9Å; Q260-T262 PolarHBondContact O-N 2.84Å; T262-D264 PolarHBondContact O-N 3.26Å; T262-D264 VanDerWaalsContact O-N 3.13Å; T262-C265 CarbonylContact O-C 3.57Å; T262-C265 PolarHBondContact O-N 3.48Å; T262-R266 WeakPolarHBondContact O-CB 3.1Å; T262-R266 PolarHBondContact O-N 3.24Å; T262-R266 WeakPolarHBondContact OG1-CD 3.08Å; T262-R266 PolarHBondContact OG1-NE 2.93Å
263	H	54.5	Low	53	Low	156 Å²	156	98.1 Å²	98.1	72%	0.722	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-53	-35	176.3	-73.2	-65.3	0	0	0	113.5	Q260 D261	Q260-H263 PolarHBondContact O-CD2 3.09Å; D261-H263 PolarHBondContact O-N 3.15Å
264	D	61.9	Low	50.5	Low	90 Å²	90	97.9 Å²	97.9	48%	0.481	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-83.3	-15.5	177.9	-99.6	-28.7	0	0	0	114.8	K250 T262	K250-D264 HydrophobicContact CD-CB 4.41Å; K250-D264 WeakPolarHBondContact CD-O 3.48Å; K250-D264 IonicContact NZ-OD1 3.69Å; K250-D264 PolarHBondContact NZ-OD1 2.85Å; T262-D264 PolarHBondContact O-N 3.26Å; T262-D264 VanDerWaalsContact O-N 3.13Å
265	C	66.4	Low	48.2	Very low	16 Å²	16	106.2 Å²	106.2	11%	0.108	55%	0.552	C	S	.	*	T	Hydrogen-bonded Turn	trans	-119.9	-15.7	-170.8	-59.8	0	0	0	0	113.5	F246 C248 I255 T262 V267	F246-C265 HydrophobicContact CE2-CB 3.8Å; F246-C265 HydrophobicContact CZ-CB 3.91Å; C248-C265 HydrophobicContact CB-CB 3.75Å; C248-C265 WeakPolarHBondContact CB-SG 3.23Å; C248-C265 WeakPolarHBondContact SG-CB 3.46Å; C248-C265 CovalentContact SG-SG 2.04Å; C248-C265 PolarHBondContact SG-SG 3.42Å; I255-C265 HydrophobicContact CD1-CB 4Å; T262-C265 CarbonylContact O-C 3.57Å; T262-C265 PolarHBondContact O-N 3.48Å; C265-V267 VanDerWaalsContact C-N 3.34Å; C265-V267 PolarHBondContact O-N 2.88Å
266	R	56.1	Low	45.7	Very low	152 Å²	152	111.4 Å²	111.4	57%	0.574	58%	0.579	S	S	*	*			trans	-71.3	94.1	168.5	-84.6	177.1	-174.5	-178.1	4.9	107.1	T262 E268	T262-R266 WeakPolarHBondContact O-CB 3.1Å; T262-R266 PolarHBondContact O-N 3.24Å; T262-R266 WeakPolarHBondContact OG1-CD 3.08Å; T262-R266 PolarHBondContact OG1-NE 2.93Å; R266-E268 PolarHBondContact O-N 3.37Å
267	V	47.1	Very low	43.5	Very low	132 Å²	132	118.6 Å²	118.6	80%	0.8	62%	0.618	S	S	*	*			trans	-58.5	120.5	158.5	-173.6	0	0	0	0	105.5	C265 K269	C265-V267 VanDerWaalsContact C-N 3.34Å; C265-V267 PolarHBondContact O-N 2.88Å; V267-K269 PolarHBondContact O-N 2.81Å
268	E	34.1	Very low	41.5	Very low	168 Å²	168	124.2 Å²	124.2	79%	0.785	64%	0.643	S	S	*	*			trans	-46.5	114.5	165.9	-87.2	178.8	155	0	0	106.5	R266 N270	R266-E268 PolarHBondContact O-N 3.37Å; E268-N270 PolarHBondContact O-N 3.25Å
269	K	31.2	Very low	39.7	Very low	202 Å²	202	123.4 Å²	123.4	88%	0.878	65%	0.647	S	S	*	*			trans	-65.1	94.1	176.5	-158.5	-177.5	-170.8	-175.8	0	104.9	V267 S271	V267-K269 PolarHBondContact O-N 2.81Å; K269-S271 PolarHBondContact O-N 2.92Å
270	N	30.8	Very low	38.4	Very low	143 Å²	143	127.4 Å²	127.4	77%	0.765	67%	0.672	S	S	*	*			trans	-58.3	99.4	167.9	-96.2	-9.7	0	0	0	105.6	E268 N272	E268-N270 PolarHBondContact O-N 3.25Å; N270-N272 VanDerWaalsContact C-N 3.31Å; N270-N272 PolarHBondContact O-N 3.34Å
271	S	28.1	Very low	37	Very low	103 Å²	103	126 Å²	126	72%	0.72	67%	0.674	S	S	*	*			trans	-52.7	98.8	159.1	46.4	0	0	0	0	107.1	K269	K269-S271 PolarHBondContact O-N 2.92Å
272	N	25.5	Very low	35.7	Very low	152 Å²	152	128.3 Å²	128.3	81%	0.813	68%	0.683	S	S	*	*			trans	-170.3	135.6	151	-99.3	-20	0	0	0	112.8	N270	N270-N272 VanDerWaalsContact C-N 3.31Å; N270-N272 PolarHBondContact O-N 3.34Å
273	V	28	Very low	34.2	Very low	126 Å²	126	137 Å²	137	76%	0.764	72%	0.723	S	S	*	*			trans	83.5	90.4	162.8	-157.6	0	0	0	0	116.7
274	N	28.1	Very low	32.7	Very low	130 Å²	130	137.1 Å²	137.1	70%	0.695	72%	0.724	S	S	*	*				31.6	99.5	129.8	-70.1	-7.4	0	0	0	117.3
275	D	32.3	Very low	31	Very low	175 Å²	175	138.1 Å²	138.1	94%	0.936	74%	0.738	S	S	*	*				-136.9	78.7	128.4	-87.8	-36.7	0	0	0	108.1	N277	D275-N277 PolarHBondContact O-N 3.47Å
276	L	25.3	Very low	28.8	Very low	136 Å²	136	145.7 Å²	145.7	71%	0.712	77%	0.769	S	S	*	*			trans	-72	106.8	152.8	-96.2	144.7	0	0	0	106.6
277	N	31.2	Very low	27.3	Very low	158 Å²	158	144.2 Å²	144.2	85%	0.845	78%	0.777	S	S	*	*				-163.3	108.6	127.5	-102.1	-7.5	0	0	0	112	D275	D275-N277 PolarHBondContact O-N 3.47Å
278	I	25.7	Very low	26.1	Very low	153 Å²	153	144 Å²	144	79%	0.785	78%	0.776	S	S	*	*			trans	-56.5	135.5	158.8	-64.5	154.2	0	0	0	108.9
279	S	24.4	Very low	25.5	Very low	96 Å²	96	141.8 Å²	141.8	67%	0.671	78%	0.779	S	S	*	*			trans	-162.3	118.4	132.5	-155.4	0	0	0	0	111.4
280	T	25.3	Very low	25.1	Very low	114 Å²	114	135.4 Å²	135.4	70%	0.699	77%	0.771	S	S	*	*			trans	51.7	142.7	135.5	51.5	0	0	0	0	120.2
281	T	20.8	Very low	25	Very low	119 Å²	119	137 Å²	137	73%	0.73	78%	0.777	S	S	*	*			cis	-175.3	137.8	-5	-92.2	0	0	0	0	102.8
282	M	20.6	Very low	24.8	Very low	172 Å²	172	137.6 Å²	137.6	85%	0.847	78%	0.777	S	S	*	*			trans	-63.6	128.2	166	-64.6	-124.7	-65.7	0	0	109.9
283	E	20.3	Very low	24.7	Very low	184 Å²	184	139 Å²	139	86%	0.86	78%	0.778	S	S	*	*			trans	-177.4	122.5	131.4	-104.6	-175.6	166.3	0	0	113.8
284	H	23.3	Very low	24.7	Very low	158 Å²	158	139.9 Å²	139.9	73%	0.731	78%	0.784	S	S	*	*				55.6	111.6	129.2	-126.9	72.2	0	0	0	122.5
285	S	25.7	Very low	24.7	Very low	111 Å²	111	142.6 Å²	142.6	78%	0.776	79%	0.792	S	S	*	*			trans	-178.9	107.3	133	54.9	0	0	0	0	108.6
286	K	21.8	Very low	24.4	Very low	176 Å²	176	142.2 Å²	142.2	77%	0.765	79%	0.79	S	S	*	*				46.2	118.6	79.6	-109.1	-178	-170.8	174.4	0	115.3
287	T	22.7	Very low	24.4	Very low	121 Å²	121	146.9 Å²	146.9	74%	0.742	80%	0.798	S	S	*	*			trans	116.9	109	134.8	-49.1	0	0	0	0	117.6
288	T	22.7	Very low	24.1	Very low	126 Å²	126	145.6 Å²	145.6	77%	0.773	80%	0.797	S	S	*	*			trans	82	113.1	134	-58.6	0	0	0	0	122
289	S	22.2	Very low	24.2	Very low	123 Å²	123	143.8 Å²	143.8	86%	0.86	79%	0.793	S	S	*	*			trans	-38.9	129	151.1	-60.2	0	0	0	0	114.9
290	G	21.7	Very low	24.2	Very low	67 Å²	67	150.1 Å²	150.1	69%	0.691	80%	0.802	S	S	*	*			trans	-162.6	90.3	161.9	0	0	0	0	0	109.7
291	I	30.1	Very low	24.3	Very low	176 Å²	176	151 Å²	151	90%	0.903	81%	0.807	S	S	*	*			trans	-116.9	105.5	162.6	-61.8	178.5	0	0	0	106.5
292	T	23.5	Very low	24.7	Very low	117 Å²	117	150.8 Å²	150.8	72%	0.718	81%	0.806	S	S	*	*			trans	-79.7	148.3	175.2	-44	0	0	0	0	110.4
293	E	23.1	Very low	25.6	Very low	180 Å²	180	150.9 Å²	150.9	84%	0.841	81%	0.805	S	S	*	*			trans	-23.7	137.8	173.9	-61.5	171.9	135	0	0	119.1
294	V	28.6	Very low	26.3	Very low	146 Å²	146	150.7 Å²	150.7	89%	0.885	80%	0.804	S	S	*	*			trans	-127.7	132.9	149.2	177.3	0	0	0	0	108.8
295	Q	26.6	Very low	27.4	Very low	186 Å²	186	149 Å²	149	87%	0.869	80%	0.8	S	S	*	*			trans	-60.6	138.2	-162.5	-73.6	162.9	-29.3	0	0	116.3
296	N	26.5	Very low	28.3	Very low	167 Å²	167	152.4 Å²	152.4	89%	0.893	80%	0.801	S	S	*	*			trans	-71.4	120.5	163.5	-90.9	-27.9	0	0	0	111
297	R	25	Very low	29.4	Very low	234 Å²	234	151.1 Å²	151.1	88%	0.883	80%	0.797	S	S	*	*			trans	-89.5	105.7	171.5	-162.7	178.6	-146.1	156	5.4	109.9	T299	R297-T299 PolarHBondContact O-N 3.41Å
298	T	25.2	Very low	30.8	Very low	131 Å²	131	152.1 Å²	152.1	80%	0.804	79%	0.793	S	S	*	*			trans	-62.2	117.8	166.5	-53.6	0	0	0	0	109.8
299	T	28.8	Very low	32.3	Very low	115 Å²	115	153.6 Å²	153.6	71%	0.706	79%	0.789	S	S	*	*			trans	-128.6	117.8	163	-28.6	0	0	0	0	108.3	R297	R297-T299 PolarHBondContact O-N 3.41Å
300	R	22.9	Very low	34.1	Very low	229 Å²	229	151 Å²	151	86%	0.864	77%	0.771	S	S	*	*			trans	-57.5	129.4	173.2	-75.9	172.4	168.3	149.1	-4.6	109.6
301	T	29.3	Very low	35.7	Very low	133 Å²	133	152.1 Å²	152.1	82%	0.816	76%	0.758	S	S	*	*			trans	-138.5	101	157	1.1	0	0	0	0	108.4
302	T	28.1	Very low	37.5	Very low	115 Å²	115	150.9 Å²	150.9	71%	0.706	74%	0.742	S	S	*	*			trans	-82.7	126.7	177.3	-37.9	0	0	0	0	107.9	E304	T302-E304 PolarHBondContact O-N 2.92Å
303	E	40.7	Very low	39.6	Very low	174 Å²	174	152.3 Å²	152.3	81%	0.813	74%	0.735	S	S	*	*	S	Bend	trans	69.2	21.3	149	-118.9	158.6	-173.1	0	0	124.5
304	E	34.3	Very low	41.8	Very low	179 Å²	179	148.4 Å²	148.4	84%	0.836	72%	0.72	S	S	*	*			trans	-98.4	-2.5	162.6	-80.5	-170.8	154.1	0	0	115	T302 K306	T302-E304 PolarHBondContact O-N 2.92Å; E304-K306 PolarHBondContact O-N 2.8Å
305	N	45.8	Very low	44	Very low	122 Å²	122	147.3 Å²	147.3	65%	0.652	70%	0.7	S	S	*	*	H	α-helix	trans	-77.3	-4.5	-169.6	-92.6	-29.5	0	0	0	117.2
306	K	45.8	Very low	46.4	Very low	184 Å²	184	141.3 Å²	141.3	80%	0.8	68%	0.676	S	S	*	*	H	α-helix	trans	-77.9	-37.3	179	-85.3	-179.2	178.6	170.7	0	112.7	E304 S310	E304-K306 PolarHBondContact O-N 2.8Å; K306-S310 PolarHBondContact O-N 2.82Å
307	Q	44.3	Very low	48.6	Very low	148 Å²	148	134.9 Å²	134.9	69%	0.692	64%	0.643	S	S	*	*	H	α-helix	trans	-75.6	-37.3	-176.4	-161.3	164.4	-4.2	0	0	111.8	K309 S310 H311	Q307-K309 PolarHBondContact O-N 3.03Å; Q307-S310 PolarHBondContact O-N 3.17Å; Q307-H311 PolarHBondContact O-CD2 3.26Å; Q307-H311 VanDerWaalsContact O-CD2 3.26Å; Q307-H311 PolarHBondContact O-N 2.82Å
308	H	52.1	Low	51.1	Low	142 Å²	142	128.1 Å²	128.1	66%	0.657	62%	0.624	S	S	*	*	H	α-helix	trans	-69.4	-32.6	178.4	-147.8	-73.7	0	0	0	113.1	W312	H308-W312 WeakPolarHBondContact O-CB 3.28Å; H308-W312 PolarHBondContact O-N 2.78Å
309	K	54.4	Low	53.7	Low	158 Å²	158	124.6 Å²	124.6	69%	0.687	60%	0.603	S	S	*	*	H	α-helix	trans	-67.6	-40	174.5	-94.3	-175.8	176.2	179.9	0	112.8	Q307 W312 Y313	Q307-K309 PolarHBondContact O-N 3.03Å; K309-W312 PolarHBondContact O-N 2.68Å; K309-Y313 PolarHBondContact O-N 2.85Å
310	S	58.8	Low	56.2	Low	67 Å²	67	123.8 Å²	123.8	47%	0.469	59%	0.594	S	S	.	*	H	α-helix	trans	-60.2	-48.4	177	170.6	0	0	0	0	111.2	K306 Q307 Y313 L314	K306-S310 PolarHBondContact O-N 2.82Å; Q307-S310 PolarHBondContact O-N 3.17Å; S310-Y313 PolarHBondContact O-N 2.73Å; S310-L314 PolarHBondContact O-N 2.87Å; S310-L314 VanDerWaalsContact O-N 3.14Å
311	H	56.5	Low	58.8	Low	91 Å²	91	115.9 Å²	115.9	42%	0.421	57%	0.571	S	S	.	*	H	α-helix	trans	-67.1	-41.9	178.9	-75.5	-120.3	0	0	0	111.7	Q307 Y313 L314 Y315	Q307-H311 PolarHBondContact O-CD2 3.26Å; Q307-H311 VanDerWaalsContact O-CD2 3.26Å; Q307-H311 PolarHBondContact O-N 2.82Å; H311-Y313 VanDerWaalsContact C-N 3.31Å; H311-Y313 PolarHBondContact O-N 2.82Å; H311-L314 PolarHBondContact O-N 2.93Å; H311-Y315 HydrophobicContact CB-CD2 4.09Å; H311-Y315 HydrophobicContact CB-CE2 4.15Å; H311-Y315 AromaticContact ND1-CE2 3.68Å; H311-Y315 WeakPolarHBondContact O-CD2 3.35Å; H311-Y315 PolarHBondContact O-N 2.68Å
312	W	68.1	Low	61.3	Low	151 Å²	151	111.7 Å²	111.7	57%	0.572	55%	0.55	S	S	*	.	H	α-helix	trans	-59.5	-41.1	177.4	-175.3	75.7	0	0	0	112.6	H308 K309 V316 V317	H308-W312 WeakPolarHBondContact O-CB 3.28Å; H308-W312 PolarHBondContact O-N 2.78Å; K309-W312 PolarHBondContact O-N 2.68Å; W312-V316 HydrophobicContact CG-CG2 4.42Å; W312-V316 VanDerWaalsContact O-CB 3.28Å; W312-V316 WeakPolarHBondContact O-CB 3.24Å; W312-V316 PolarHBondContact O-N 2.69Å; W312-V317 HydrophobicContact CE3-CG2 4.48Å; W312-V317 HydrophobicContact CZ3-CG2 4.21Å
313	Y	67.4	Low	63.8	Low	147 Å²	147	108.6 Å²	108.6	58%	0.576	53%	0.533	S	S	*	.	I	π-helix	trans	-65	-42.6	176.6	-156	-93.6	0	0	0	111.9	K309 S310 H311 V317 I318	K309-Y313 PolarHBondContact O-N 2.85Å; S310-Y313 PolarHBondContact O-N 2.73Å; H311-Y313 VanDerWaalsContact C-N 3.31Å; H311-Y313 PolarHBondContact O-N 2.82Å; Y313-V317 HydrophobicContact CD2-CB 4.19Å; Y313-V317 HydrophobicContact CD2-CG1 4.45Å; Y313-V317 HydrophobicContact CD2-CG2 3.84Å; Y313-V317 HydrophobicContact CE1-CG1 4.44Å; Y313-V317 HydrophobicContact CE2-CB 4.3Å; Y313-V317 HydrophobicContact CE2-CG1 4.06Å; Y313-V317 HydrophobicContact CE2-CG2 4.16Å; Y313-V317 HydrophobicContact CG-CB 4.31Å; Y313-V317 HydrophobicContact CG-CG2 4.28Å; Y313-V317 WeakPolarHBondContact O-CB 3.47Å; Y313-V317 PolarHBondContact O-N 2.93Å; Y313-I318 PolarHBondContact O-N 2.92Å
314	L	69.6	Low	65.8	Low	98 Å²	98	105 Å²	105	51%	0.513	52%	0.518	S	S	.	.	I	π-helix	trans	-70	-37.8	-176.9	-131.3	140	0	0	0	112.8	S310 H311 I318	S310-L314 PolarHBondContact O-N 2.87Å; S310-L314 VanDerWaalsContact O-N 3.14Å; H311-L314 PolarHBondContact O-N 2.93Å; L314-I318 HydrophobicContact CD2-CD1 4.43Å; L314-I318 HydrophobicContact CG-CD1 4.02Å
315	Y	74.4	Confident	68.1	Low	122 Å²	122	102.8 Å²	102.8	48%	0.478	51%	0.506	S	S	.	.	I	π-helix	trans	-96.8	-21.9	-174.3	-66.2	-66.9	0	0	0	114.9	Y3 H311 P319	Y3-Y315 VanDerWaalsContact OH-CD1 3.29Å; Y3-Y315 WeakPolarHBondContact OH-CD1 3.13Å; Y3-Y315 WeakPolarHBondContact OH-CE1 3.44Å; H311-Y315 HydrophobicContact CB-CD2 4.09Å; H311-Y315 HydrophobicContact CB-CE2 4.15Å; H311-Y315 AromaticContact ND1-CE2 3.68Å; H311-Y315 WeakPolarHBondContact O-CD2 3.35Å; H311-Y315 PolarHBondContact O-N 2.68Å; Y315-P319 WeakPolarHBondContact O-CG 3.13Å
316	V	75.9	Confident	70.1	Confident	60 Å²	60	102.9 Å²	102.9	36%	0.364	51%	0.506	S	S	.	.	I	π-helix	trans	-109.1	-48.2	-177.8	-174.5	0	0	0	0	111.3	W312 L320	W312-V316 HydrophobicContact CG-CG2 4.42Å; W312-V316 VanDerWaalsContact O-CB 3.28Å; W312-V316 WeakPolarHBondContact O-CB 3.24Å; W312-V316 PolarHBondContact O-N 2.69Å; V316-L320 HydrophobicContact CG1-CD1 4.09Å; V316-L320 WeakPolarHBondContact O-CB 3.21Å; V316-L320 PolarHBondContact O-N 2.83Å
317	V	73.9	Confident	71.9	Confident	33 Å²	33	97.9 Å²	97.9	20%	0.2	49%	0.487	C	S	.	.	I	π-helix	trans	-75.6	-45	-172.5	-176.4	0	0	0	0	111.4	W312 Y313 L320 V321	W312-V317 HydrophobicContact CE3-CG2 4.48Å; W312-V317 HydrophobicContact CZ3-CG2 4.21Å; Y313-V317 HydrophobicContact CD2-CB 4.19Å; Y313-V317 HydrophobicContact CD2-CG1 4.45Å; Y313-V317 HydrophobicContact CD2-CG2 3.84Å; Y313-V317 HydrophobicContact CE1-CG1 4.44Å; Y313-V317 HydrophobicContact CE2-CB 4.3Å; Y313-V317 HydrophobicContact CE2-CG1 4.06Å; Y313-V317 HydrophobicContact CE2-CG2 4.16Å; Y313-V317 HydrophobicContact CG-CB 4.31Å; Y313-V317 HydrophobicContact CG-CG2 4.28Å; Y313-V317 WeakPolarHBondContact O-CB 3.47Å; Y313-V317 PolarHBondContact O-N 2.93Å; V317-L320 PolarHBondContact O-N 2.86Å; V317-V321 HydrophobicContact CG1-CG2 4.11Å; V317-V321 WeakPolarHBondContact O-CB 3.33Å; V317-V321 VanDerWaalsContact O-CG2 3.29Å; V317-V321 WeakPolarHBondContact O-CG2 3.31Å; V317-V321 PolarHBondContact O-N 3.26Å
318	I	77.7	Confident	73.8	Confident	92 Å²	92	94.1 Å²	94.1	47%	0.472	48%	0.477	S	S	.	.	H	α-helix	trans	-60.6	-47.3	-179.4	-60	176.4	0	0	0	111.9	Y313 L314 L320 V321 A322	Y313-I318 PolarHBondContact O-N 2.92Å; L314-I318 HydrophobicContact CD2-CD1 4.43Å; L314-I318 HydrophobicContact CG-CD1 4.02Å; I318-L320 PolarHBondContact O-N 3.1Å; I318-V321 PolarHBondContact O-N 3.21Å; I318-A322 VanDerWaalsContact O-CB 3.32Å; I318-A322 WeakPolarHBondContact O-CB 3.23Å; I318-A322 PolarHBondContact O-N 3.23Å
319	P	80.1	Confident	75.4	Confident	57 Å²	57	91.5 Å²	91.5	37%	0.37	47%	0.467	S	S	.	.	H	α-helix	trans	-66	-36	177.3	-25.2	38.2	0	0	0	113.4	Y315 A322 S323	Y315-P319 WeakPolarHBondContact O-CG 3.13Å; P319-A322 PolarHBondContact O-N 3.3Å; P319-S323 VanDerWaalsContact O-CB 3.3Å; P319-S323 WeakPolarHBondContact O-CB 3.31Å; P319-S323 PolarHBondContact O-N 3.13Å; P319-S323 PolarHBondContact O-OG 3.16Å
320	L	79.4	Confident	76.8	Confident	97 Å²	97	85.8 Å²	85.8	51%	0.508	45%	0.452	S	S	.	.	H	α-helix	trans	-61.7	-48.4	174.6	-106.9	153.6	0	0	0	111.2	V316 V317 I318 S323 L324	V316-L320 HydrophobicContact CG1-CD1 4.09Å; V316-L320 WeakPolarHBondContact O-CB 3.21Å; V316-L320 PolarHBondContact O-N 2.83Å; V317-L320 PolarHBondContact O-N 2.86Å; I318-L320 PolarHBondContact O-N 3.1Å; L320-S323 PolarHBondContact O-N 3.1Å; L320-S323 PolarHBondContact O-OG 3.08Å; L320-L324 WeakPolarHBondContact O-CG 3.01Å; L320-L324 PolarHBondContact O-N 3.1Å
321	V	78.9	Confident	77.9	Confident	63 Å²	63	85.9 Å²	85.9	38%	0.382	45%	0.452	S	S	.	.	H	α-helix	trans	-64	-44.2	177.9	173.3	0	0	0	0	110.7	V317 I318 S323 L324 F325	V317-V321 HydrophobicContact CG1-CG2 4.11Å; V317-V321 WeakPolarHBondContact O-CB 3.33Å; V317-V321 VanDerWaalsContact O-CG2 3.29Å; V317-V321 WeakPolarHBondContact O-CG2 3.31Å; V317-V321 PolarHBondContact O-N 3.26Å; I318-V321 PolarHBondContact O-N 3.21Å; V321-S323 VanDerWaalsContact C-N 3.33Å; V321-S323 PolarHBondContact O-N 2.81Å; V321-L324 WeakPolarHBondContact O-CB 3.44Å; V321-L324 PolarHBondContact O-N 2.87Å; V321-F325 HydrophobicContact CG1-CD2 3.66Å; V321-F325 HydrophobicContact CG1-CE2 3.42Å; V321-F325 VanDerWaalsContact CG1-CE2 3.42Å; V321-F325 WeakPolarHBondContact O-CD2 3.42Å; V321-F325 PolarHBondContact O-N 3.44Å
322	A	80.4	Confident	79.2	Confident	45 Å²	45	87 Å²	87	37%	0.372	46%	0.46	S	S	.	.	H	α-helix	trans	-61.3	-40.4	175.3	0	0	0	0	0	112.3	I318 P319 F325 L326	I318-A322 VanDerWaalsContact O-CB 3.32Å; I318-A322 WeakPolarHBondContact O-CB 3.23Å; I318-A322 PolarHBondContact O-N 3.23Å; P319-A322 PolarHBondContact O-N 3.3Å; A322-F325 PolarHBondContact O-N 2.9Å; A322-L326 WeakPolarHBondContact O-CG 3.44Å; A322-L326 PolarHBondContact O-N 3.35Å
323	S	81.8	Confident	79.9	Confident	50 Å²	50	84 Å²	84	35%	0.35	45%	0.454	S	S	.	.	H	α-helix	trans	-64.1	-40.5	176	76.1	0	0	0	0	111.9	P319 L320 V321 L326 I327	P319-S323 VanDerWaalsContact O-CB 3.3Å; P319-S323 WeakPolarHBondContact O-CB 3.31Å; P319-S323 PolarHBondContact O-N 3.13Å; P319-S323 PolarHBondContact O-OG 3.16Å; L320-S323 PolarHBondContact O-N 3.1Å; L320-S323 PolarHBondContact O-OG 3.08Å; V321-S323 VanDerWaalsContact C-N 3.33Å; V321-S323 PolarHBondContact O-N 2.81Å; S323-L326 PolarHBondContact O-N 3.05Å; S323-I327 WeakPolarHBondContact O-CB 3.22Å; S323-I327 WeakPolarHBondContact O-CD1 3.31Å; S323-I327 WeakPolarHBondContact O-CG1 3.44Å; S323-I327 PolarHBondContact O-N 2.77Å
324	L	82.4	Confident	80.6	Confident	98 Å²	98	85.4 Å²	85.4	51%	0.513	46%	0.459	S	S	.	.	H	α-helix	trans	-62.9	-42.4	173.9	-77	161.8	0	0	0	111.4	L320 V321 I327 C328	L320-L324 WeakPolarHBondContact O-CG 3.01Å; L320-L324 PolarHBondContact O-N 3.1Å; V321-L324 WeakPolarHBondContact O-CB 3.44Å; V321-L324 PolarHBondContact O-N 2.87Å; L324-I327 PolarHBondContact O-N 2.87Å; L324-C328 WeakPolarHBondContact O-CB 3.29Å; L324-C328 PolarHBondContact O-N 3.23Å; L324-C328 PolarHBondContact O-SG 2.84Å
325	F	82.9	Confident	81	Confident	134 Å²	134	89.9 Å²	89.9	59%	0.588	47%	0.469	S	S	*	.	H	α-helix	trans	-63.2	-43.5	175.3	-83.2	-69.3	0	0	0	112.4	V321 A322 C328 I329	V321-F325 HydrophobicContact CG1-CD2 3.66Å; V321-F325 HydrophobicContact CG1-CE2 3.42Å; V321-F325 VanDerWaalsContact CG1-CE2 3.42Å; V321-F325 WeakPolarHBondContact O-CD2 3.42Å; V321-F325 PolarHBondContact O-N 3.44Å; A322-F325 PolarHBondContact O-N 2.9Å; F325-C328 WeakPolarHBondContact O-CB 3.48Å; F325-C328 PolarHBondContact O-N 2.92Å; F325-I329 VanDerWaalsContact O-CG1 3.26Å; F325-I329 WeakPolarHBondContact O-CG1 3.3Å; F325-I329 PolarHBondContact O-N 2.72Å
326	L	87.4	Confident	81.2	Confident	124 Å²	124	91 Å²	91	65%	0.649	47%	0.472	S	S	*	.	H	α-helix	trans	-64.6	-39.3	176.8	-70.7	171.4	0	0	0	111.9	A322 S323 I329 G330	A322-L326 WeakPolarHBondContact O-CG 3.44Å; A322-L326 PolarHBondContact O-N 3.35Å; S323-L326 PolarHBondContact O-N 3.05Å; L326-I329 PolarHBondContact O-N 2.8Å; L326-G330 PolarHBondContact O-N 2.77Å
327	I	84.3	Confident	81.3	Confident	78 Å²	78	92.7 Å²	92.7	40%	0.4	48%	0.479	S	S	.	.	H	α-helix	trans	-63.5	-43.7	173.2	-68.5	164	0	0	0	110.5	S323 L324 G330 C331	S323-I327 WeakPolarHBondContact O-CB 3.22Å; S323-I327 WeakPolarHBondContact O-CD1 3.31Å; S323-I327 WeakPolarHBondContact O-CG1 3.44Å; S323-I327 PolarHBondContact O-N 2.77Å; L324-I327 PolarHBondContact O-N 2.87Å; I327-G330 PolarHBondContact O-N 2.88Å; I327-C331 WeakPolarHBondContact O-CB 3.22Å; I327-C331 PolarHBondContact O-N 2.89Å; I327-C331 PolarHBondContact O-SG 3.26Å
328	C	83.2	Confident	81.2	Confident	70 Å²	70	95.6 Å²	95.6	47%	0.473	49%	0.493	S	S	.	.	H	α-helix	trans	-61.8	-44.4	176.1	-75.2	0	0	0	0	112	L324 F325 C331 I332	L324-C328 WeakPolarHBondContact O-CB 3.29Å; L324-C328 PolarHBondContact O-N 3.23Å; L324-C328 PolarHBondContact O-SG 2.84Å; F325-C328 WeakPolarHBondContact O-CB 3.48Å; F325-C328 PolarHBondContact O-N 2.92Å; C328-C331 PolarHBondContact O-N 3.15Å; C328-I332 VanDerWaalsContact O-CG1 3.23Å; C328-I332 WeakPolarHBondContact O-CG1 3.48Å; C328-I332 PolarHBondContact O-N 2.88Å
329	I	86.9	Confident	81	Confident	87 Å²	87	101 Å²	101	45%	0.446	51%	0.507	S	S	.	.	H	α-helix	trans	-63.1	-45.7	176.2	-68.1	164.3	0	0	0	110.2	F325 L326 C331 I332 I333	F325-I329 VanDerWaalsContact O-CG1 3.26Å; F325-I329 WeakPolarHBondContact O-CG1 3.3Å; F325-I329 PolarHBondContact O-N 2.72Å; L326-I329 PolarHBondContact O-N 2.8Å; I329-C331 VanDerWaalsContact C-N 3.35Å; I329-C331 PolarHBondContact O-N 3.47Å; I329-I332 PolarHBondContact O-N 2.78Å; I329-I333 HydrophobicContact CG2-CD1 3.66Å; I329-I333 HydrophobicContact CG2-CG1 4.32Å; I329-I333 VanDerWaalsContact O-CG1 3.29Å; I329-I333 WeakPolarHBondContact O-CG1 3.3Å; I329-I333 PolarHBondContact O-N 3.08Å
330	G	83.2	Confident	80.5	Confident	37 Å²	37	105.5 Å²	105.5	38%	0.381	52%	0.517	S	S	.	.	H	α-helix	trans	-58.2	-44.5	175.2	0	0	0	0	0	112.4	L326 I327 I332 I333 W334	L326-G330 PolarHBondContact O-N 2.77Å; I327-G330 PolarHBondContact O-N 2.88Å; G330-I332 PolarHBondContact O-N 2.78Å; G330-I333 PolarHBondContact O-N 2.8Å; G330-W334 WeakPolarHBondContact O-CB 3.32Å; G330-W334 PolarHBondContact O-N 2.8Å
331	C	81.3	Confident	80	Confident	69 Å²	69	108.6 Å²	108.6	47%	0.466	53%	0.526	S	S	.	.	H	α-helix	trans	-63.4	-38.6	174.9	-76.5	0	0	0	0	112.8	I327 C328 I329 R335	I327-C331 WeakPolarHBondContact O-CB 3.22Å; I327-C331 PolarHBondContact O-N 2.89Å; I327-C331 PolarHBondContact O-SG 3.26Å; C328-C331 PolarHBondContact O-N 3.15Å; I329-C331 VanDerWaalsContact C-N 3.35Å; I329-C331 PolarHBondContact O-N 3.47Å; C331-R335 WeakPolarHBondContact O-CB 3.42Å; C331-R335 WeakPolarHBondContact O-CG 3.44Å; C331-R335 PolarHBondContact O-N 2.84Å
332	I	83.5	Confident	79	Confident	115 Å²	115	115.5 Å²	115.5	59%	0.59	55%	0.546	S	S	*	.	H	α-helix	trans	-67.3	-47	176.5	-70	164.5	0	0	0	110.3	C328 I329 G330 W334 R335 W336	C328-I332 VanDerWaalsContact O-CG1 3.23Å; C328-I332 WeakPolarHBondContact O-CG1 3.48Å; C328-I332 PolarHBondContact O-N 2.88Å; I329-I332 PolarHBondContact O-N 2.78Å; G330-I332 PolarHBondContact O-N 2.78Å; I332-W334 PolarHBondContact O-N 3.2Å; I332-R335 PolarHBondContact O-N 3.36Å; I332-W336 WeakPolarHBondContact O-CB 3.21Å; I332-W336 PolarHBondContact O-N 3.46Å
333	I	83.5	Confident	78	Confident	88 Å²	88	117.8 Å²	117.8	45%	0.451	56%	0.558	S	S	.	*	H	α-helix	trans	-62	-44.7	177.5	-65.8	167.7	0	0	0	110.3	I329 G330 W336 L337	I329-I333 HydrophobicContact CG2-CD1 3.66Å; I329-I333 HydrophobicContact CG2-CG1 4.32Å; I329-I333 VanDerWaalsContact O-CG1 3.29Å; I329-I333 WeakPolarHBondContact O-CG1 3.3Å; I329-I333 PolarHBondContact O-N 3.08Å; G330-I333 PolarHBondContact O-N 2.8Å; I333-W336 WeakPolarHBondContact O-CB 3.48Å; I333-W336 PolarHBondContact O-N 2.87Å; I333-L337 HydrophobicContact CG2-CD1 4.02Å; I333-L337 HydrophobicContact CG2-CG 4.44Å; I333-L337 WeakPolarHBondContact O-CG 3.28Å; I333-L337 PolarHBondContact O-N 2.78Å
334	W	82.5	Confident	76.6	Confident	177 Å²	177	122.2 Å²	122.2	67%	0.67	58%	0.578	S	S	*	*	H	α-helix	trans	-60.6	-46.7	176.6	-177	-80.6	0	0	0	112.1	G330 I332 W336 L337 L338	G330-W334 WeakPolarHBondContact O-CB 3.32Å; G330-W334 PolarHBondContact O-N 2.8Å; I332-W334 PolarHBondContact O-N 3.2Å; W334-W336 VanDerWaalsContact C-N 3.3Å; W334-W336 PolarHBondContact O-N 2.87Å; W334-L337 PolarHBondContact O-N 2.96Å; W334-L338 HydrophobicContact CG-CD1 4.5Å; W334-L338 WeakPolarHBondContact O-CB 3.48Å; W334-L338 PolarHBondContact O-N 2.98Å
335	R	77.1	Confident	74.9	Confident	192 Å²	192	128 Å²	128	73%	0.725	60%	0.603	S	S	*	*	H	α-helix	trans	-62.8	-36.7	174.9	-79.4	-175.9	174.8	-155.7	-0.2	112.2	C331 I332 R339	C331-R335 WeakPolarHBondContact O-CB 3.42Å; C331-R335 WeakPolarHBondContact O-CG 3.44Å; C331-R335 PolarHBondContact O-N 2.84Å; I332-R335 PolarHBondContact O-N 3.36Å; R335-R339 PolarHBondContact O-N 3.03Å
336	W	78.4	Confident	74.5	Confident	144 Å²	144	127.7 Å²	127.7	55%	0.545	60%	0.603	S	S	.	*	H	α-helix	trans	-67.3	-43.9	176.6	-171.5	77.2	0	0	0	111.7	I332 I333 W334 R339 R340	I332-W336 WeakPolarHBondContact O-CB 3.21Å; I332-W336 PolarHBondContact O-N 3.46Å; I333-W336 WeakPolarHBondContact O-CB 3.48Å; I333-W336 PolarHBondContact O-N 2.87Å; W334-W336 VanDerWaalsContact C-N 3.3Å; W334-W336 PolarHBondContact O-N 2.87Å; W336-R339 PolarHBondContact O-N 3.32Å; W336-R340 PolarHBondContact O-N 2.91Å
337	L	78.1	Confident	73.9	Confident	96 Å²	96	127.8 Å²	127.8	50%	0.503	60%	0.601	S	S	.	*	H	α-helix	trans	-63	-42.5	174.7	-72.6	170.4	0	0	0	112.3	I333 W334 R339 R340 K341	I333-L337 HydrophobicContact CG2-CD1 4.02Å; I333-L337 HydrophobicContact CG2-CG 4.44Å; I333-L337 WeakPolarHBondContact O-CG 3.28Å; I333-L337 PolarHBondContact O-N 2.78Å; W334-L337 PolarHBondContact O-N 2.96Å; L337-R339 VanDerWaalsContact C-N 3.34Å; L337-R339 PolarHBondContact O-N 2.86Å; L337-R340 PolarHBondContact O-N 3.3Å; L337-K341 PolarHBondContact O-N 3.13Å
338	L	72.4	Confident	73.3	Confident	95 Å²	95	130.6 Å²	130.6	50%	0.497	61%	0.612	S	S	.	*	H	α-helix	trans	-61.2	-39.6	174.2	-88.4	165.9	0	0	0	112.7	W334 R342	W334-L338 HydrophobicContact CG-CD1 4.5Å; W334-L338 WeakPolarHBondContact O-CB 3.48Å; W334-L338 PolarHBondContact O-N 2.98Å; L338-R342 PolarHBondContact O-N 2.97Å
339	R	73.2	Confident	72.7	Confident	205 Å²	205	134.2 Å²	134.2	77%	0.774	62%	0.62	S	S	*	*	H	α-helix	trans	-65.2	-40	173.7	-88.9	-171.3	-177.4	175	1	111.9	R335 W336 L337 K341 R342 S343	R335-R339 PolarHBondContact O-N 3.03Å; W336-R339 PolarHBondContact O-N 3.32Å; L337-R339 VanDerWaalsContact C-N 3.34Å; L337-R339 PolarHBondContact O-N 2.86Å; R339-K341 VanDerWaalsContact C-N 3.35Å; R339-R342 PolarHBondContact O-N 3.49Å; R339-S343 PolarHBondContact O-N 3.37Å
340	R	69.7	Low	71.8	Confident	152 Å²	152	137.1 Å²	137.1	57%	0.574	63%	0.631	S	S	*	*	H	α-helix	trans	-66.7	-37.4	-179.5	-147.7	175.6	-169.7	-176.1	2.1	111.9	W336 L337 R342 S343	W336-R340 PolarHBondContact O-N 2.91Å; L337-R340 PolarHBondContact O-N 3.3Å; R340-R342 VanDerWaalsContact C-N 3.29Å; R340-R342 PolarHBondContact O-N 2.66Å; R340-S343 PolarHBondContact O-N 2.95Å
341	K	68.3	Low	71.1	Confident	162 Å²	162	143.8 Å²	143.8	70%	0.704	65%	0.648	S	S	*	*	H	α-helix	trans	-63.3	-34	175.7	-151.3	178.5	-176.7	-173.9	0	112.4	L337 R339	L337-K341 PolarHBondContact O-N 3.13Å; R339-K341 VanDerWaalsContact C-N 3.35Å
342	R	59.2	Low	70.3	Confident	208 Å²	208	149.1 Å²	149.1	79%	0.785	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-11.2	175.8	-82.8	-171	-176.9	176.3	2	115.8	L338 R339 R340	L338-R342 PolarHBondContact O-N 2.97Å; R339-R342 PolarHBondContact O-N 3.49Å; R340-R342 VanDerWaalsContact C-N 3.29Å; R340-R342 PolarHBondContact O-N 2.66Å
343	S	59.2	Low	69.3	Low	92 Å²	92	151.8 Å²	151.8	64%	0.643	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	-11	177.5	-173.6	0	0	0	0	112.8	R339 R340	R339-S343 PolarHBondContact O-N 3.37Å; R340-S343 PolarHBondContact O-N 2.95Å
344	N	52.3	Low	68.1	Low	144 Å²	144	157.1 Å²	157.1	77%	0.77	68%	0.684	S	S	*	*			trans	-101.1	1.3	177.5	-76.2	3.5	0	0	0	112.5
345	E	47.3	Very low	66.8	Low	218 Å²	218	155.3 Å²	155.3	100%	1.019	69%	0.685	S	S	*	*			trans	-106	0	158.5	-78.6	176.1	161.8	0	0	107.3

Retrieved 345 of 345 residues in 276.6 ms (Link to these results)

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