A0A077ZH58_TRITR Loading...

Gal Lectin domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZH58, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 220 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39	Very low	35	Very low	236 Å²	236	152.5 Å²	152.5	100%	1.163	81%	0.806	S	S	*	*				0	89.8	0	-75.3	164.7	68.3	0	0	108.9
2	F	32.8	Very low	35.4	Very low	204 Å²	204	152.6 Å²	152.6	90%	0.895	80%	0.799	S	S	*	*			trans	-167	106	161.1	-103.1	-75.4	0	0	0	106	L4	F2-L4 PolarHBondContact O-N 3.46Å
3	P	41.6	Very low	36	Very low	113 Å²	113	148.8 Å²	148.8	73%	0.734	79%	0.789	S	S	*	*			trans	-83.4	114.6	172.5	31.1	-24.1	0	0	0	107.8	L5	P3-L5 VanDerWaalsContact C-N 3.33Å; P3-L5 PolarHBondContact O-N 2.72Å
4	L	37.6	Very low	37.1	Very low	174 Å²	174	139.3 Å²	139.3	91%	0.911	74%	0.744	S	S	*	*			trans	-67.7	93.7	164.3	-95	141.3	0	0	0	107.9	F2 L6	F2-L4 PolarHBondContact O-N 3.46Å; L4-L6 PolarHBondContact O-N 2.86Å
5	L	38.5	Very low	38.3	Very low	159 Å²	159	134.9 Å²	134.9	83%	0.832	71%	0.713	S	S	*	*			trans	-71.6	106.4	166	-88.6	161.4	0	0	0	108.3	P3 A7	P3-L5 VanDerWaalsContact C-N 3.33Å; P3-L5 PolarHBondContact O-N 2.72Å; L5-A7 VanDerWaalsContact C-N 3.33Å; L5-A7 PolarHBondContact O-N 3.04Å
6	L	31.4	Very low	39.4	Very low	144 Å²	144	127.1 Å²	127.1	75%	0.754	67%	0.673	S	S	*	*			trans	-58	93.9	162.8	-76.6	160.1	0	0	0	108.9	L4 F8	L4-L6 PolarHBondContact O-N 2.86Å; L6-F8 VanDerWaalsContact C-N 3.3Å; L6-F8 HydrophobicContact CB-CD2 4.21Å; L6-F8 HydrophobicContact CB-CE2 4.21Å; L6-F8 HydrophobicContact CD1-CE2 4.44Å; L6-F8 PolarHBondContact O-N 3.48Å
7	A	31.5	Very low	40.3	Very low	84 Å²	84	126.1 Å²	126.1	69%	0.694	66%	0.663	S	S	*	*			trans	-73.2	91.5	161.9	0	0	0	0	0	107.6	L5 T9	L5-A7 VanDerWaalsContact C-N 3.33Å; L5-A7 PolarHBondContact O-N 3.04Å; A7-T9 PolarHBondContact O-N 2.89Å
8	F	31.2	Very low	40.6	Very low	174 Å²	174	121.4 Å²	121.4	76%	0.763	64%	0.639	S	S	*	*			trans	-65.4	82.7	159.3	-83.2	-88.2	0	0	0	107.8	L6 L10	L6-F8 VanDerWaalsContact C-N 3.3Å; L6-F8 HydrophobicContact CB-CD2 4.21Å; L6-F8 HydrophobicContact CB-CE2 4.21Å; L6-F8 HydrophobicContact CD1-CE2 4.44Å; L6-F8 PolarHBondContact O-N 3.48Å; F8-L10 VanDerWaalsContact C-N 3.25Å; F8-L10 PolarHBondContact O-N 3.33Å
9	T	30.3	Very low	40.7	Very low	106 Å²	106	120.3 Å²	120.3	65%	0.65	63%	0.633	S	S	*	*			trans	-70.1	93.9	158.1	48.6	0	0	0	0	106.3	A7 I11	A7-T9 PolarHBondContact O-N 2.89Å; T9-I11 PolarHBondContact O-N 2.9Å
10	L	34.3	Very low	40.6	Very low	158 Å²	158	118.8 Å²	118.8	83%	0.827	63%	0.63	S	S	*	*			trans	-62.4	80.6	155.1	-82.7	160.9	0	0	0	106.7	F8 E12	F8-L10 VanDerWaalsContact C-N 3.25Å; F8-L10 PolarHBondContact O-N 3.33Å; L10-E12 VanDerWaalsContact C-N 3.35Å; L10-E12 PolarHBondContact O-N 3.46Å; L10-E12 VanDerWaalsContact O-N 3.16Å
11	I	36.9	Very low	40.3	Very low	126 Å²	126	116.8 Å²	116.8	65%	0.646	62%	0.62	S	S	*	*			trans	-71.1	99.2	162.5	-57.4	169.7	0	0	0	103.4	T9 P13	T9-I11 PolarHBondContact O-N 2.9Å; I11-P13 HydrophobicContact CG2-CB 4.03Å; I11-P13 HydrophobicContact CG2-CG 4.1Å; I11-P13 WeakPolarHBondContact O-CD 3.22Å; I11-P13 WeakPolarHBondContact O-CG 3.44Å
12	E	39.9	Very low	40	Very low	153 Å²	153	106.7 Å²	106.7	72%	0.715	57%	0.574	S	S	*	*			trans	-76.6	97.1	162.6	-74.7	-171.3	131.6	0	0	107	L10	L10-E12 VanDerWaalsContact C-N 3.35Å; L10-E12 PolarHBondContact O-N 3.46Å; L10-E12 VanDerWaalsContact O-N 3.16Å
13	P	43.4	Very low	39.9	Very low	103 Å²	103	105 Å²	105	67%	0.669	57%	0.569	S	S	*	*			trans	-95.4	110.9	-171.9	18.5	3.7	0	0	0	107.3	I11	I11-P13 HydrophobicContact CG2-CB 4.03Å; I11-P13 HydrophobicContact CG2-CG 4.1Å; I11-P13 WeakPolarHBondContact O-CD 3.22Å; I11-P13 WeakPolarHBondContact O-CG 3.44Å
14	G	51	Low	39.5	Very low	16 Å²	16	103.5 Å²	103.5	17%	0.165	55%	0.554	C	S	.	*			trans	130.9	3.8	162.6	0	0	0	0	0	116.2	F70 S112	G14-F70 VanDerWaalsContact C-CD2 3.49Å; G14-F70 WeakPolarHBondContact O-CD2 3.11Å; G14-S112 WeakPolarHBondContact O-CB 3.5Å
15	W	55.2	Low	39.2	Very low	74 Å²	74	96.4 Å²	96.4	28%	0.28	52%	0.515	S	S	.	.			trans	-84.3	118.1	169.5	-69.8	96	0	0	0	109.7	E68 F70 Q151	W15-E68 HydrophobicContact CE3-CB 4.16Å; W15-E68 HydrophobicContact CZ3-CB 4.31Å; W15-F70 HydrophobicContact CD2-CB 3.98Å; W15-F70 HydrophobicContact CE3-CB 3.91Å; W15-F70 HydrophobicContact CH2-CB 4.42Å; W15-F70 HydrophobicContact CZ2-CB 4.41Å; W15-F70 HydrophobicContact CZ3-CB 4.14Å; W15-Q151 HydrophobicContact CH2-CB 4.38Å; W15-Q151 HydrophobicContact CH2-CG 3.57Å; W15-Q151 VanDerWaalsContact CH2-NE2 3.25Å; W15-Q151 HydrophobicContact CZ2-CG 4.33Å; W15-Q151 HydrophobicContact CZ3-CG 4.19Å
16	C	55.6	Low	38.7	Very low	10 Å²	10	95.6 Å²	95.6	7%	0.068	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	112.6	173.1	-75.3	0	0	0	0	109.2	V69 S112 N113 C116	C16-V69 PolarHBondContact N-O 2.81Å; C16-V69 VanDerWaalsContact N-O 3.09Å; C16-V69 PolarHBondContact O-N 2.84Å; C16-S112 WeakPolarHBondContact CB-O 3.44Å; C16-S112 WeakPolarHBondContact SG-CB 3.31Å; C16-S112 PolarHBondContact SG-O 3.13Å; C16-S112 VanDerWaalsContact SG-O 3.34Å; C16-S112 PolarHBondContact SG-OG 3.3Å; C16-N113 VanDerWaalsContact SG-CA 3.51Å; C16-N113 PolarHBondContact SG-N 2.87Å; C16-N113 PolarHBondContact SG-OD1 3.16Å; C16-C116 HydrophobicContact CB-CB 3.55Å; C16-C116 PolarHBondContact O-SG 3.11Å
17	H	55.3	Low	38.5	Very low	110 Å²	110	95.4 Å²	95.4	51%	0.509	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	112.3	169.2	-56.1	-81.7	0	0	0	107.6	L19 E68	H17-L19 PolarHBondContact O-N 3.14Å; H17-E68 IonicContact CE1-OE1 2.94Å; H17-E68 PolarHBondContact CE1-OE1 3.16Å; H17-E68 IonicContact CE1-OE2 3.88Å; H17-E68 VanDerWaalsContact ND1-CD 3.25Å; H17-E68 WeakPolarHBondContact ND1-CG 3.46Å; H17-E68 IonicContact ND1-OE1 2.84Å; H17-E68 PolarHBondContact ND1-OE1 2.79Å
18	N	45.4	Very low	38.5	Very low	41 Å²	41	102.5 Å²	102.5	22%	0.219	52%	0.516	C	S	.	.			trans	-77.7	112	175	-127.9	-50.4	0	0	0	109.6	P20 C116 E117 T120	N18-P20 WeakPolarHBondContact O-CD 3.15Å; N18-P20 WeakPolarHBondContact OD1-CD 3.43Å; N18-C116 WeakPolarHBondContact CB-SG 3.32Å; N18-C116 PolarHBondContact ND2-O 2.74Å; N18-C116 VanDerWaalsContact ND2-O 3.09Å; N18-C116 PolarHBondContact ND2-SG 3.07Å; N18-E117 PolarHBondContact ND2-N 3.29Å; N18-T120 PolarHBondContact ND2-OG1 2.74Å; N18-T120 VanDerWaalsContact ND2-OG1 3.13Å
19	L	41.7	Very low	38.4	Very low	100 Å²	100	97.7 Å²	97.7	52%	0.524	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	31.2	-171.5	-103.3	149.5	0	0	0	117.3	H17 A22	H17-L19 PolarHBondContact O-N 3.14Å; L19-A22 HydrophobicContact CD2-CB 3.34Å; L19-A22 HydrophobicContact CG-CB 3.64Å
20	P	39.1	Very low	38.4	Very low	91 Å²	91	100.4 Å²	100.4	59%	0.591	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-16.4	157.7	18.6	-9.6	0	0	0	112.8	N18	N18-P20 WeakPolarHBondContact O-CD 3.15Å; N18-P20 WeakPolarHBondContact OD1-CD 3.43Å
21	N	35.2	Very low	38	Very low	77 Å²	77	96.1 Å²	96.1	41%	0.412	51%	0.508	S	S	.	.	S	Bend	trans	-111.7	-11.1	178.5	-64.9	-57.3	0	0	0	114	Q124	N21-Q124 PolarHBondContact ND2-NE2 2.94Å
22	A	31.5	Very low	37.6	Very low	24 Å²	24	94.5 Å²	94.5	20%	0.198	50%	0.501	C	S	.	.	G	3₁₀ helix	trans	-89.6	0.2	-179.1	0	0	0	0	0	115.1	L19 L24 Y25	L19-A22 HydrophobicContact CD2-CB 3.34Å; L19-A22 HydrophobicContact CG-CB 3.64Å; A22-L24 PolarHBondContact O-N 3.36Å; A22-L24 VanDerWaalsContact O-N 3.12Å; A22-Y25 PolarHBondContact O-N 2.75Å
23	Q	31.9	Very low	37.1	Very low	169 Å²	169	92.3 Å²	92.3	79%	0.79	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-59.7	-15.9	161.9	-73.7	-74.6	-37.9	0	0	112.4
24	L	32.9	Very low	36.7	Very low	81 Å²	81	90.5 Å²	90.5	42%	0.424	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-101.9	9.6	170.8	-85.8	164.5	0	0	0	113.7	A22 A35 F188	A22-L24 PolarHBondContact O-N 3.36Å; A22-L24 VanDerWaalsContact O-N 3.12Å; L24-A35 WeakPolarHBondContact O-CB 3.37Å; L24-F188 HydrophobicContact CD2-CE1 3.98Å; L24-F188 HydrophobicContact CD2-CZ 3.8Å
25	Y	31	Very low	36.1	Very low	24 Å²	24	91.1 Å²	91.1	9%	0.094	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.5	-16.3	-160.5	-126.3	-90.3	0	0	0	118.5	A22 L38 L39 R155	A22-Y25 PolarHBondContact O-N 2.75Å; Y25-L38 HydrophobicContact CD2-CB 4.46Å; Y25-L38 HydrophobicContact CD2-CD1 4Å; Y25-L38 HydrophobicContact CD2-CG 4.34Å; Y25-L38 HydrophobicContact CE2-CB 3.28Å; Y25-L38 HydrophobicContact CE2-CD1 3.51Å; Y25-L38 HydrophobicContact CE2-CG 3.55Å; Y25-L38 VanDerWaalsContact CE2-N 3.27Å; Y25-L38 VanDerWaalsContact OH-CA 3.29Å; Y25-L38 WeakPolarHBondContact OH-CA 3.13Å; Y25-L38 VanDerWaalsContact OH-CB 3.25Å; Y25-L38 WeakPolarHBondContact OH-CB 3.47Å; Y25-L38 PolarHBondContact OH-O 2.82Å; Y25-L39 HydrophobicContact CE1-CD2 4.42Å; Y25-L39 PolarHBondContact OH-N 2.86Å; Y25-L39 VanDerWaalsContact OH-N 3.08Å; Y25-R155 VanDerWaalsContact CE1-CZ 3.49Å; Y25-R155 VanDerWaalsContact CZ-CZ 3.49Å; Y25-R155 PolarHBondContact OH-NH1 3.25Å
26	N	27.4	Very low	35.3	Very low	143 Å²	143	95 Å²	95	77%	0.765	51%	0.51	S	S	*	.			trans	-159.4	76.6	171	-89	-40	0	0	0	110.6	R28	N26-R28 PolarHBondContact O-N 3.09Å; N26-R28 VanDerWaalsContact O-N 3.15Å
27	H	28.8	Very low	34.8	Very low	139 Å²	139	94.7 Å²	94.7	64%	0.644	51%	0.508	S	S	*	.			trans	-70.8	95.1	138.1	-122.8	-74.6	0	0	0	105.2	S29	H27-S29 PolarHBondContact O-N 3.35Å
28	R	29.6	Very low	34.5	Very low	233 Å²	233	91.6 Å²	91.6	88%	0.879	50%	0.495	S	S	*	.			trans	-59.1	99.6	156.6	-169.1	175.2	-170.1	175.5	2.7	104	N26 N30	N26-R28 PolarHBondContact O-N 3.09Å; N26-R28 VanDerWaalsContact O-N 3.15Å; R28-N30 PolarHBondContact O-N 3.32Å
29	S	31	Very low	34.8	Very low	73 Å²	73	94.7 Å²	94.7	51%	0.51	51%	0.511	S	S	.	.			trans	-62.6	85.9	-175.5	171.1	0	0	0	0	109.3	H27 G31 N32	H27-S29 PolarHBondContact O-N 3.35Å; S29-G31 PolarHBondContact O-N 3.28Å; S29-G31 PolarHBondContact OG-N 3.04Å; S29-G31 VanDerWaalsContact OG-N 3.16Å; S29-N32 PolarHBondContact OG-N 2.78Å; S29-N32 VanDerWaalsContact OG-N 3.08Å
30	N	29.6	Very low	35.5	Very low	163 Å²	163	93.4 Å²	93.4	87%	0.872	51%	0.511	S	S	*	.	S	Bend		-68.1	89.8	125.9	-93.4	-4.1	0	0	0	105.6	R28	R28-N30 PolarHBondContact O-N 3.32Å
31	G	26.4	Very low	37.2	Very low	68 Å²	68	90 Å²	90	70%	0.701	49%	0.488	S	S	*	.	S	Bend	trans	51.5	70.8	170.6	0	0	0	0	0	118.2	S29	S29-G31 PolarHBondContact O-N 3.28Å; S29-G31 PolarHBondContact OG-N 3.04Å; S29-G31 VanDerWaalsContact OG-N 3.16Å
32	N	26.9	Very low	39.5	Very low	93 Å²	93	96.1 Å²	96.1	50%	0.497	51%	0.505	S	S	.	.			trans	-167.2	126.2	143.2	-132.3	-19.1	0	0	0	111.8	S29 T34	S29-N32 PolarHBondContact OG-N 2.78Å; S29-N32 VanDerWaalsContact OG-N 3.08Å; N32-T34 PolarHBondContact O-N 2.91Å; N32-T34 VanDerWaalsContact O-N 3.11Å
33	P	29.3	Very low	42.2	Very low	106 Å²	106	98.2 Å²	98.2	69%	0.688	51%	0.512	S	S	*	.			trans	-89.7	67.7	-172.1	36.7	-32.7	0	0	0	111.3
34	T	35.5	Very low	45.1	Very low	65 Å²	65	94.5 Å²	94.5	40%	0.399	49%	0.491	S	S	.	.			trans	-146	64.4	-176.2	51.3	0	0	0	0	114.2	N32	N32-T34 PolarHBondContact O-N 2.91Å; N32-T34 VanDerWaalsContact O-N 3.11Å
35	A	37.8	Very low	47.9	Very low	29 Å²	29	96.7 Å²	96.7	24%	0.24	50%	0.499	C	S	.	.			trans	-178.3	90.3	143.3	0	0	0	0	0	114.6	L24 G37 F188	L24-A35 WeakPolarHBondContact O-CB 3.37Å; A35-G37 VanDerWaalsContact C-N 3.25Å; A35-G37 PolarHBondContact O-N 2.95Å; A35-F188 HydrophobicContact CB-CD1 4.43Å; A35-F188 HydrophobicContact CB-CE1 4Å
36	F	40.3	Very low	50.8	Low	156 Å²	156	99.2 Å²	99.2	68%	0.684	51%	0.51	S	S	*	.			trans	-93.3	39.7	167.4	-86.4	-96.1	0	0	0	111.8	L38 L39	F36-L38 PolarHBondContact O-N 3.18Å; F36-L39 HydrophobicContact CB-CD1 4.31Å; F36-L39 HydrophobicContact CD1-CD1 3.29Å; F36-L39 HydrophobicContact CE1-CD1 3.82Å; F36-L39 HydrophobicContact CG-CD1 4.06Å
37	G	44.3	Very low	53.9	Low	3 Å²	3	94.6 Å²	94.6	3%	0.031	49%	0.49	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-15.9	-147.2	0	0	0	0	0	119.8	A35 S186	A35-G37 VanDerWaalsContact C-N 3.25Å; A35-G37 PolarHBondContact O-N 2.95Å; G37-S186 WeakPolarHBondContact O-CB 3.19Å
38	L	49.5	Very low	56.8	Low	45 Å²	45	89.2 Å²	89.2	24%	0.236	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-143.9	17.6	168.9	-47.1	151.4	0	0	0	110.8	Y25 F36 S40 L41	Y25-L38 HydrophobicContact CD2-CB 4.46Å; Y25-L38 HydrophobicContact CD2-CD1 4Å; Y25-L38 HydrophobicContact CD2-CG 4.34Å; Y25-L38 HydrophobicContact CE2-CB 3.28Å; Y25-L38 HydrophobicContact CE2-CD1 3.51Å; Y25-L38 HydrophobicContact CE2-CG 3.55Å; Y25-L38 VanDerWaalsContact CE2-N 3.27Å; Y25-L38 VanDerWaalsContact OH-CA 3.29Å; Y25-L38 WeakPolarHBondContact OH-CA 3.13Å; Y25-L38 VanDerWaalsContact OH-CB 3.25Å; Y25-L38 WeakPolarHBondContact OH-CB 3.47Å; Y25-L38 PolarHBondContact OH-O 2.82Å; F36-L38 PolarHBondContact O-N 3.18Å; L38-S40 PolarHBondContact O-N 2.84Å; L38-S40 VanDerWaalsContact O-N 3.11Å; L38-L41 HydrophobicContact CB-CB 4.49Å; L38-L41 HydrophobicContact CB-CD1 4.08Å; L38-L41 HydrophobicContact CB-CG 4.37Å; L38-L41 HydrophobicContact CD2-CD1 3.72Å; L38-L41 HydrophobicContact CG-CD1 4.46Å; L38-L41 WeakPolarHBondContact O-CB 3.37Å; L38-L41 PolarHBondContact O-N 2.01Å
39	L	50.8	Low	59.6	Low	106 Å²	106	78.8 Å²	78.8	56%	0.555	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-17	-173.7	-78.8	161.6	0	0	0	111.7	Y25 F36 L41	Y25-L39 HydrophobicContact CE1-CD2 4.42Å; Y25-L39 PolarHBondContact OH-N 2.86Å; Y25-L39 VanDerWaalsContact OH-N 3.08Å; F36-L39 HydrophobicContact CB-CD1 4.31Å; F36-L39 HydrophobicContact CD1-CD1 3.29Å; F36-L39 HydrophobicContact CE1-CD1 3.82Å; F36-L39 HydrophobicContact CG-CD1 4.06Å; L39-L41 VanDerWaalsContact C-N 3.33Å
40	S	57.2	Low	62	Low	74 Å²	74	76.7 Å²	76.7	52%	0.517	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-18.3	171.7	61.3	0	0	0	0	113.8	L38 R42 H185	L38-S40 PolarHBondContact O-N 2.84Å; L38-S40 VanDerWaalsContact O-N 3.11Å; S40-R42 PolarHBondContact O-N 2.88Å; S40-H185 PolarHBondContact OG-O 2.98Å
41	L	73.9	Confident	64.3	Low	20 Å²	20	70.9 Å²	70.9	11%	0.105	39%	0.387	C	S	.	.	S	Bend	trans	-82.7	121.3	177.3	-67.5	-177.7	0	0	0	109.7	L38 L39 L43 R155 C156 R157 H185	L38-L41 HydrophobicContact CB-CB 4.49Å; L38-L41 HydrophobicContact CB-CD1 4.08Å; L38-L41 HydrophobicContact CB-CG 4.37Å; L38-L41 HydrophobicContact CD2-CD1 3.72Å; L38-L41 HydrophobicContact CG-CD1 4.46Å; L38-L41 WeakPolarHBondContact O-CB 3.37Å; L38-L41 PolarHBondContact O-N 2.01Å; L39-L41 VanDerWaalsContact C-N 3.33Å; L41-L43 PolarHBondContact O-N 3.15Å; L41-R155 HydrophobicContact CB-CB 4.32Å; L41-R155 HydrophobicContact CB-CG 4.4Å; L41-C156 WeakPolarHBondContact CD2-O 3.17Å; L41-R157 HydrophobicContact CD1-CB 3.85Å; L41-H185 WeakPolarHBondContact CD2-ND1 3.39Å
42	R	84	Confident	67.2	Low	205 Å²	205	70.7 Å²	70.7	77%	0.774	37%	0.368	S	S	*	.			trans	-53.1	113.6	176.3	-174.4	171.6	-179.1	159.1	2.2	110.9	S40	S40-R42 PolarHBondContact O-N 2.88Å
43	L	88.4	Confident	70.1	Confident	68 Å²	68	70.5 Å²	70.5	36%	0.356	36%	0.363	S	S	.	.			trans	-66.7	136.6	169.3	-170	62.9	0	0	0	109.2	L41 E45 D67 R155	L41-L43 PolarHBondContact O-N 3.15Å; L43-E45 HydrophobicContact CD2-CG 4.34Å; L43-E45 HydrophobicContact CG-CG 4.32Å; L43-D67 HydrophobicContact CD1-CB 4.43Å; L43-R155 HydrophobicContact CD1-CG 3.81Å
44	R	92.1	Very high	73	Confident	91 Å²	91	65.4 Å²	65.4	34%	0.343	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	111.9	177.2	-61.7	175.8	179.8	-123.9	-1	108	S153 Y154	R44-S153 WeakPolarHBondContact O-CA 3.5Å; R44-Y154 HydrophobicContact CB-CD1 3.96Å; R44-Y154 HydrophobicContact CB-CE1 3.64Å; R44-Y154 HydrophobicContact CB-CE2 4.42Å; R44-Y154 HydrophobicContact CB-CG 4.48Å; R44-Y154 WeakPolarHBondContact CB-O 3.36Å; R44-Y154 WeakPolarHBondContact CD-OH 3.21Å; R44-Y154 PolarHBondContact N-O 3.15Å; R44-Y154 WeakPolarHBondContact O-CD1 3.39Å; R44-Y154 PolarHBondContact O-N 3.09Å
45	E	92.2	Very high	75.7	Confident	126 Å²	126	64.7 Å²	64.7	59%	0.589	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100	133.7	174.5	-62	-179.8	120.4	0	0	109.1	L43 V152	L43-E45 HydrophobicContact CD2-CG 4.34Å; L43-E45 HydrophobicContact CG-CG 4.32Å; E45-V152 WeakPolarHBondContact CA-O 3.33Å
46	K	92.5	Very high	78.4	Confident	77 Å²	77	63.6 Å²	63.6	34%	0.335	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	145.9	176.6	-65	-168.3	179	-172.1	0	110	Y48 A55 Q151 V152 Y154	K46-Y48 HydrophobicContact CB-CD2 4.43Å; K46-Y48 HydrophobicContact CB-CE2 3.63Å; K46-Y48 HydrophobicContact CD-CE2 4.21Å; K46-Y48 WeakPolarHBondContact CD-OH 3.16Å; K46-A55 PolarHBondContact NZ-O 2.83Å; K46-A55 VanDerWaalsContact NZ-O 3.15Å; K46-Q151 WeakPolarHBondContact O-CA 3.49Å; K46-V152 HydrophobicContact CB-CG1 4.37Å; K46-V152 PolarHBondContact N-O 2.94Å; K46-V152 PolarHBondContact O-N 3.35Å; K46-Y154 HydrophobicContact CD-CE1 4.31Å
47	S	90.9	Very high	81	Confident	47 Å²	47	62.5 Å²	62.5	33%	0.329	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	143.3	173.2	-56.8	0	0	0	0	109.6	F150 Q151	S47-F150 CarbonylContact C-O 3.55Å; S47-F150 WeakPolarHBondContact CA-O 3.29Å; S47-Q151 WeakPolarHBondContact OG-CG 3.31Å
48	Y	89.9	Confident	83.3	Confident	26 Å²	26	62.5 Å²	62.5	10%	0.102	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	135.8	-179.4	-58.7	-87.4	0	0	0	108.7	K46 E52 A54 A55 H149 F150 V152	K46-Y48 HydrophobicContact CB-CD2 4.43Å; K46-Y48 HydrophobicContact CB-CE2 3.63Å; K46-Y48 HydrophobicContact CD-CE2 4.21Å; K46-Y48 WeakPolarHBondContact CD-OH 3.16Å; Y48-E52 WeakPolarHBondContact CA-OE2 3.12Å; Y48-A54 HydrophobicContact CD1-CB 4.15Å; Y48-A54 HydrophobicContact CD2-CB 3.52Å; Y48-A54 HydrophobicContact CE1-CB 4.27Å; Y48-A54 HydrophobicContact CE2-CB 3.63Å; Y48-A54 HydrophobicContact CG-CB 3.75Å; Y48-A55 PolarHBondContact OH-N 2.95Å; Y48-A55 VanDerWaalsContact OH-N 3.13Å; Y48-A55 PolarHBondContact OH-O 2.94Å; Y48-H149 CarbonylContact O-C 3.58Å; Y48-H149 VanDerWaalsContact O-CA 3.28Å; Y48-H149 WeakPolarHBondContact O-CA 3.06Å; Y48-H149 WeakPolarHBondContact O-CB 3.37Å; Y48-F150 AromaticContact CD2-CD1 3.83Å; Y48-F150 HydrophobicContact CD2-CD1 3.83Å; Y48-F150 HydrophobicContact CD2-CE1 4.41Å; Y48-F150 PolarHBondContact N-O 2.94Å; Y48-F150 PolarHBondContact O-N 2.93Å; Y48-V152 HydrophobicContact CE2-CG1 4.23Å
49	C	88.2	Confident	85.2	Confident	14 Å²	14	63.4 Å²	63.4	10%	0.095	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	161.5	179.3	-60.4	0	0	0	0	111.2	G51 E52 C81 T133	C49-G51 PolarHBondContact O-N 2.87Å; C49-E52 HydrophobicContact CB-CG 4.17Å; C49-E52 PolarHBondContact N-OE2 2.79Å; C49-E52 WeakPolarHBondContact O-CB 3.44Å; C49-E52 WeakPolarHBondContact O-CG 3.31Å; C49-E52 PolarHBondContact O-N 2.85Å; C49-C81 VanDerWaalsContact CA-SG 3.59Å; C49-C81 HydrophobicContact CB-CB 3.95Å; C49-C81 WeakPolarHBondContact CB-SG 3.38Å; C49-C81 WeakPolarHBondContact SG-CA 3.45Å; C49-C81 WeakPolarHBondContact SG-CB 3.47Å; C49-C81 CovalentContact SG-SG 2.03Å; C49-C81 PolarHBondContact SG-SG 2.89Å; C49-T133 PolarHBondContact O-OG1 2.83Å
50	E	82.5	Confident	86.9	Confident	29 Å²	29	63.9 Å²	63.9	14%	0.136	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	130.2	176.6	-163.7	165.9	-165.3	0	0	112.7	E52 G134 R136 G147 R148	E50-E52 VanDerWaalsContact C-N 3.3Å; E50-G134 WeakPolarHBondContact CG-O 3.07Å; E50-R136 HydrophobicContact CG-CG 4.06Å; E50-R136 WeakPolarHBondContact OE1-CA 3.32Å; E50-G147 WeakPolarHBondContact OE2-CA 3.42Å; E50-R148 WeakPolarHBondContact CB-O 2.88Å; E50-R148 PolarHBondContact N-O 3.46Å; E50-R148 PolarHBondContact OE2-N 3.45Å
51	G	78.6	Confident	88.3	Confident	41 Å²	41	66.2 Å²	66.2	42%	0.423	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	-1.1	-174.6	0	0	0	0	0	115.4	C49 T133 G134	C49-G51 PolarHBondContact O-N 2.87Å; G51-T133 PolarHBondContact N-OG1 2.84Å; G51-G134 PolarHBondContact N-O 3.46Å; G51-G134 VanDerWaalsContact N-O 3.15Å
52	E	85.6	Confident	89	Confident	63 Å²	63	65.6 Å²	65.6	29%	0.294	32%	0.324	S	S	.	.			trans	-82.3	155.9	170.8	-62.1	-167.8	135.4	0	0	112.3	Y48 C49 E50 T133	Y48-E52 WeakPolarHBondContact CA-OE2 3.12Å; C49-E52 HydrophobicContact CB-CG 4.17Å; C49-E52 PolarHBondContact N-OE2 2.79Å; C49-E52 WeakPolarHBondContact O-CB 3.44Å; C49-E52 WeakPolarHBondContact O-CG 3.31Å; C49-E52 PolarHBondContact O-N 2.85Å; E50-E52 VanDerWaalsContact C-N 3.3Å; E52-T133 PolarHBondContact N-OG1 3.15Å; E52-T133 PolarHBondContact O-N 2.84Å; E52-T133 VanDerWaalsContact O-N 3.15Å; E52-T133 PolarHBondContact O-OG1 3.08Å
53	K	87.8	Confident	89.4	Confident	89 Å²	89	57.2 Å²	57.2	39%	0.387	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	105.9	175.1	-171.1	169.7	-171.6	157.5	0	109.7	A55 D103 W130	K53-A55 PolarHBondContact O-N 2.76Å; K53-D103 IonicContact NZ-OD1 2.65Å; K53-D103 PolarHBondContact NZ-OD1 2.93Å; K53-W130 HydrophobicContact CD-CB 4.42Å; K53-W130 VanDerWaalsContact CE-CB 3.47Å; K53-W130 HydrophobicContact CG-CB 4.16Å
54	A	90.7	Very high	89.6	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	119	175	0	0	0	0	0	110	Y48 F56 W130 I131 T133 F150	Y48-A54 HydrophobicContact CD1-CB 4.15Å; Y48-A54 HydrophobicContact CD2-CB 3.52Å; Y48-A54 HydrophobicContact CE1-CB 4.27Å; Y48-A54 HydrophobicContact CE2-CB 3.63Å; Y48-A54 HydrophobicContact CG-CB 3.75Å; A54-F56 HydrophobicContact CB-CE2 4.25Å; A54-W130 CarbonylContact O-C 3.6Å; A54-W130 WeakPolarHBondContact O-CA 3.34Å; A54-I131 HydrophobicContact CB-CB 4.23Å; A54-I131 PolarHBondContact N-O 2.94Å; A54-I131 PolarHBondContact O-N 3.49Å; A54-T133 HydrophobicContact CB-CG2 4.43Å; A54-F150 HydrophobicContact CB-CD1 3.73Å; A54-F150 HydrophobicContact CB-CE1 3.74Å
55	A	92.3	Very high	89.6	Confident	50 Å²	50	50.2 Å²	50.2	41%	0.413	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	120.6	-174	0	0	0	0	0	112.5	K46 Y48 K53	K46-A55 PolarHBondContact NZ-O 2.83Å; K46-A55 VanDerWaalsContact NZ-O 3.15Å; Y48-A55 PolarHBondContact OH-N 2.95Å; Y48-A55 VanDerWaalsContact OH-N 3.13Å; Y48-A55 PolarHBondContact OH-O 2.94Å; K53-A55 PolarHBondContact O-N 2.76Å
56	F	94.3	Very high	89.5	Confident	5 Å²	5	44.6 Å²	44.6	2%	0.022	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	133.1	-179.8	-53.5	-86.9	0	0	0	110.6	A54 I64 I66 R128 C129 I131 F150 V152 Y154	A54-F56 HydrophobicContact CB-CE2 4.25Å; F56-I64 HydrophobicContact CB-CD1 3.41Å; F56-I64 VanDerWaalsContact CB-CD1 3.41Å; F56-I64 HydrophobicContact CB-CG1 4.2Å; F56-I64 HydrophobicContact CG-CD1 4.4Å; F56-I66 HydrophobicContact CE1-CD1 4.46Å; F56-R128 WeakPolarHBondContact O-CA 3.43Å; F56-C129 HydrophobicContact CB-CB 4.22Å; F56-C129 HydrophobicContact CD2-CB 4.15Å; F56-C129 PolarHBondContact N-O 3.48Å; F56-C129 PolarHBondContact O-N 2.82Å; F56-I131 HydrophobicContact CE2-CB 4.48Å; F56-I131 HydrophobicContact CE2-CD1 3.89Å; F56-I131 HydrophobicContact CE2-CG1 4.17Å; F56-I131 HydrophobicContact CZ-CD1 4.4Å; F56-F150 HydrophobicContact CE2-CE1 4.38Å; F56-F150 AromaticContact CZ-CE1 3.73Å; F56-F150 HydrophobicContact CZ-CE1 3.73Å; F56-F150 HydrophobicContact CZ-CZ 4.08Å; F56-V152 HydrophobicContact CE1-CB 4.1Å; F56-V152 HydrophobicContact CE1-CG1 3.39Å; F56-V152 HydrophobicContact CE1-CG2 3.63Å; F56-V152 HydrophobicContact CZ-CB 4.28Å; F56-V152 HydrophobicContact CZ-CG1 3.68Å; F56-V152 HydrophobicContact CZ-CG2 3.98Å; F56-Y154 AromaticContact CD1-CD1 3.69Å; F56-Y154 HydrophobicContact CD1-CD1 3.69Å; F56-Y154 HydrophobicContact CD1-CD2 4.44Å; F56-Y154 AromaticContact CD1-CE1 3.7Å; F56-Y154 HydrophobicContact CD1-CE1 3.7Å; F56-Y154 HydrophobicContact CD1-CE2 4.45Å; F56-Y154 HydrophobicContact CD1-CG 4.07Å; F56-Y154 AromaticContact CE1-CD1 3.98Å; F56-Y154 HydrophobicContact CE1-CD1 3.98Å; F56-Y154 HydrophobicContact CE1-CE1 4.28Å; F56-Y154 HydrophobicContact CE1-CG 4.49Å
57	K	94.6	Very high	89.2	Confident	134 Å²	134	42.4 Å²	42.4	58%	0.583	23%	0.231	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-143.9	131.7	179.5	-174.3	178	179.5	-173.8	0	110.1	R128 Y154	K57-R128 HydrophobicContact CG-CG 4.31Å; K57-Y154 PolarHBondContact O-OH 2.75Å
58	C	92.6	Very high	89	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.014	23%	0.226	C	C	.	.			trans	-116.4	151.4	169.3	-72.3	0	0	0	0	111.2	T62 R127 C156	C58-T62 WeakPolarHBondContact CB-OG1 3.26Å; C58-R127 HydrophobicContact CB-CG 4.42Å; C58-R127 PolarHBondContact N-O 2.78Å; C58-R127 VanDerWaalsContact O-CG 3.27Å; C58-R127 WeakPolarHBondContact O-CG 3.44Å; C58-C156 WeakPolarHBondContact CA-SG 3.26Å; C58-C156 HydrophobicContact CB-CB 3.75Å; C58-C156 WeakPolarHBondContact CB-SG 3.44Å; C58-C156 WeakPolarHBondContact SG-CA 3.44Å; C58-C156 WeakPolarHBondContact SG-CB 3.36Å; C58-C156 CovalentContact SG-SG 2.04Å; C58-C156 PolarHBondContact SG-SG 3.12Å
59	P	89.6	Confident	88.9	Confident	64 Å²	64	41.3 Å²	41.3	42%	0.416	22%	0.221	S	C	.	.			trans	-55.6	170.2	171.5	-25.6	34.9	0	0	0	113.7	T62 R127	P59-T62 VanDerWaalsContact CD-OG1 3.31Å; P59-T62 WeakPolarHBondContact CD-OG1 3.05Å; P59-T62 PolarHBondContact O-N 3.49Å; P59-T62 PolarHBondContact O-OG1 2.86Å; P59-R127 WeakPolarHBondContact O-CD 3.03Å
60	M	87.2	Confident	88.8	Confident	117 Å²	117	41.1 Å²	41.1	58%	0.576	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	148.7	172.9	-63.1	-63.5	-86.7	0	0	110.8	T62	M60-T62 PolarHBondContact O-N 2.76Å; M60-T62 VanDerWaalsContact O-N 3.09Å
61	H	85.7	Confident	88.9	Confident	122 Å²	122	40.1 Å²	40.1	57%	0.565	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.7	19.6	-177.9	-46.1	-74.7	0	0	0	115.2	P158 S159	H61-P158 WeakPolarHBondContact O-CA 2.96Å; H61-S159 PolarHBondContact O-N 3.09Å; H61-S159 PolarHBondContact O-OG 3.01Å
62	T	88.8	Confident	88.9	Confident	8 Å²	8	38.7 Å²	38.7	5%	0.049	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	155	171.2	60.9	0	0	0	0	110.6	C58 P59 M60 R157	C58-T62 WeakPolarHBondContact CB-OG1 3.26Å; P59-T62 VanDerWaalsContact CD-OG1 3.31Å; P59-T62 WeakPolarHBondContact CD-OG1 3.05Å; P59-T62 PolarHBondContact O-N 3.49Å; P59-T62 PolarHBondContact O-OG1 2.86Å; M60-T62 PolarHBondContact O-N 2.76Å; M60-T62 VanDerWaalsContact O-N 3.09Å; T62-R157 CarbonylContact C-O 3.58Å; T62-R157 WeakPolarHBondContact CA-O 3.39Å; T62-R157 VanDerWaalsContact CB-O 3.28Å; T62-R157 WeakPolarHBondContact CB-O 3.37Å
63	Q	92.7	Very high	88.6	Confident	29 Å²	29	40.3 Å²	40.3	14%	0.136	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	153.7	-179	65.2	-166.8	46.9	0	0	111	A65 N125 C156 R157	Q63-A65 PolarHBondContact O-N 3.18Å; Q63-N125 PolarHBondContact NE2-OD1 3.03Å; Q63-C156 CarbonylContact O-C 3.51Å; Q63-C156 WeakPolarHBondContact O-CA 3.28Å; Q63-R157 HydrophobicContact CG-CG 3.8Å; Q63-R157 PolarHBondContact N-O 3.3Å; Q63-R157 VanDerWaalsContact NE2-CZ 3.31Å; Q63-R157 VanDerWaalsContact NE2-NH2 3.15Å; Q63-R157 PolarHBondContact O-N 2.67Å
64	I	92.7	Very high	88.2	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	131.4	179	-63.8	158	0	0	0	108.7	F56 I66 C123 N125 K126 C129 Y154	F56-I64 HydrophobicContact CB-CD1 3.41Å; F56-I64 VanDerWaalsContact CB-CD1 3.41Å; F56-I64 HydrophobicContact CB-CG1 4.2Å; F56-I64 HydrophobicContact CG-CD1 4.4Å; I64-I66 HydrophobicContact CG2-CD1 3.7Å; I64-I66 HydrophobicContact CG2-CG1 4.2Å; I64-C123 HydrophobicContact CG2-CB 4.37Å; I64-N125 PolarHBondContact O-N 2.9Å; I64-K126 WeakPolarHBondContact CB-O 2.97Å; I64-K126 VanDerWaalsContact CD1-O 3.29Å; I64-K126 WeakPolarHBondContact CD1-O 2.99Å; I64-K126 WeakPolarHBondContact CG1-O 3.4Å; I64-K126 PolarHBondContact N-O 2.88Å; I64-C129 HydrophobicContact CD1-CB 3.76Å; I64-Y154 HydrophobicContact CG1-CD2 4.44Å; I64-Y154 HydrophobicContact CG2-CD2 4.09Å
65	A	91.9	Very high	87.5	Confident	12 Å²	12	42.8 Å²	42.8	10%	0.099	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	109.7	163.7	0	0	0	0	0	107.4	Q63 Y154 R155 R157	Q63-A65 PolarHBondContact O-N 3.18Å; A65-Y154 CarbonylContact O-C 3.51Å; A65-Y154 VanDerWaalsContact O-CA 3.31Å; A65-Y154 WeakPolarHBondContact O-CA 3.13Å; A65-Y154 WeakPolarHBondContact O-CB 3.47Å; A65-R155 PolarHBondContact N-O 3.22Å; A65-R155 PolarHBondContact O-N 3.32Å; A65-R157 HydrophobicContact CB-CG 4.17Å
66	I	89.7	Confident	87	Confident	7 Å²	7	48.7 Å²	48.7	4%	0.036	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	134.9	173.1	-58.7	-59.8	0	0	0	108	F56 I64 V69 C123 V152	F56-I66 HydrophobicContact CE1-CD1 4.46Å; I64-I66 HydrophobicContact CG2-CD1 3.7Å; I64-I66 HydrophobicContact CG2-CG1 4.2Å; I66-V69 HydrophobicContact CG2-CG2 3.49Å; I66-V69 VanDerWaalsContact CG2-CG2 3.49Å; I66-C123 HydrophobicContact CD1-CB 4.25Å; I66-C123 HydrophobicContact CG1-CB 4.49Å; I66-V152 HydrophobicContact CD1-CG2 4.14Å
67	D	86.8	Confident	86.3	Confident	32 Å²	32	48.4 Å²	48.4	17%	0.171	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	-63.1	-177.8	-165.3	56.5	0	0	0	109.1	L43 S153 R155	L43-D67 HydrophobicContact CD1-CB 4.43Å; D67-S153 WeakPolarHBondContact CB-O 3.22Å; D67-S153 PolarHBondContact N-O 2.75Å; D67-R155 IonicContact OD1-CZ 3.68Å; D67-R155 IonicContact OD1-NE 3.84Å; D67-R155 IonicContact OD1-NH2 2.74Å; D67-R155 PolarHBondContact OD1-NH2 3.22Å; D67-R155 IonicContact OD2-CZ 3.52Å; D67-R155 IonicContact OD2-NH2 2.74Å; D67-R155 PolarHBondContact OD2-NH2 3.4Å
68	E	86.4	Confident	85.5	Confident	50 Å²	50	44 Å²	44	23%	0.234	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	148.1	179	-47.9	176.7	165.6	0	0	110.7	W15 H17 V152 S153	W15-E68 HydrophobicContact CE3-CB 4.16Å; W15-E68 HydrophobicContact CZ3-CB 4.31Å; H17-E68 IonicContact CE1-OE1 2.94Å; H17-E68 PolarHBondContact CE1-OE1 3.16Å; H17-E68 IonicContact CE1-OE2 3.88Å; H17-E68 VanDerWaalsContact ND1-CD 3.25Å; H17-E68 WeakPolarHBondContact ND1-CG 3.46Å; H17-E68 IonicContact ND1-OE1 2.84Å; H17-E68 PolarHBondContact ND1-OE1 2.79Å; E68-V152 WeakPolarHBondContact O-CA 3.4Å; E68-S153 WeakPolarHBondContact CA-OG 3.29Å; E68-S153 WeakPolarHBondContact CB-OG 3.47Å; E68-S153 WeakPolarHBondContact CG-OG 3.44Å; E68-S153 PolarHBondContact N-O 3.15Å; E68-S153 PolarHBondContact N-OG 2.8Å; E68-S153 PolarHBondContact O-N 3.12Å; E68-S153 PolarHBondContact O-OG 3.1Å
69	V	87.6	Confident	85.1	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	138.1	179.5	-179.2	0	0	0	0	109.4	C16 I66 C116 A119 F150 Q151 V152	C16-V69 PolarHBondContact N-O 2.81Å; C16-V69 VanDerWaalsContact N-O 3.09Å; C16-V69 PolarHBondContact O-N 2.84Å; I66-V69 HydrophobicContact CG2-CG2 3.49Å; I66-V69 VanDerWaalsContact CG2-CG2 3.49Å; V69-C116 HydrophobicContact CB-CB 4.05Å; V69-A119 HydrophobicContact CG1-CB 4.37Å; V69-A119 HydrophobicContact CG2-CB 3.87Å; V69-F150 HydrophobicContact CG1-CD2 4.11Å; V69-F150 HydrophobicContact CG1-CE2 3.41Å; V69-F150 VanDerWaalsContact CG1-CE2 3.41Å; V69-F150 HydrophobicContact CG1-CZ 4.17Å; V69-Q151 WeakPolarHBondContact CA-O 3.45Å; V69-V152 HydrophobicContact CG2-CG2 4.07Å
70	F	86.4	Confident	84.9	Confident	10 Å²	10	49.2 Å²	49.2	4%	0.044	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	130.2	169.2	171.8	-84.2	0	0	0	108.2	G14 W15 H149 F150 Q151	G14-F70 VanDerWaalsContact C-CD2 3.49Å; G14-F70 WeakPolarHBondContact O-CD2 3.11Å; W15-F70 HydrophobicContact CD2-CB 3.98Å; W15-F70 HydrophobicContact CE3-CB 3.91Å; W15-F70 HydrophobicContact CH2-CB 4.42Å; W15-F70 HydrophobicContact CZ2-CB 4.41Å; W15-F70 HydrophobicContact CZ3-CB 4.14Å; F70-H149 AromaticContact CD1-CE1 3.53Å; F70-H149 AromaticContact CD1-NE2 3.55Å; F70-H149 AromaticContact CE1-CE1 3.14Å; F70-H149 WeakPolarHBondContact CE1-CE1 3.41Å; F70-H149 AromaticContact CE1-ND1 3.65Å; F70-H149 AromaticContact CE1-NE2 3.68Å; F70-F150 CarbonylContact O-C 3.54Å; F70-F150 WeakPolarHBondContact O-CA 3.25Å; F70-Q151 HydrophobicContact CB-CB 4.22Å; F70-Q151 HydrophobicContact CD1-CB 4.42Å; F70-Q151 PolarHBondContact N-O 2.99Å; F70-Q151 PolarHBondContact O-N 2.03Å
71	Y	84.1	Confident	84.8	Confident	7 Å²	7	44.6 Å²	44.6	3%	0.027	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	114.9	166.9	-176.1	-114.6	0	0	0	109.7	M108 G134 R148 H149 F150	Y71-M108 HydrophobicContact CD1-CB 3.62Å; Y71-M108 HydrophobicContact CD1-CE 4.13Å; Y71-M108 HydrophobicContact CD2-CE 3.69Å; Y71-M108 HydrophobicContact CE1-CB 3.63Å; Y71-M108 WeakPolarHBondContact CE1-O 3.43Å; Y71-M108 HydrophobicContact CE2-CE 4.25Å; Y71-M108 HydrophobicContact CG-CB 4.28Å; Y71-M108 HydrophobicContact CG-CE 3.6Å; Y71-G134 WeakPolarHBondContact OH-CA 3.43Å; Y71-G134 PolarHBondContact OH-N 3.16Å; Y71-R148 HydrophobicContact CE2-CB 4.38Å; Y71-H149 WeakPolarHBondContact CA-O 3.41Å; Y71-F150 HydrophobicContact CD2-CB 3.78Å; Y71-F150 HydrophobicContact CD2-CD2 4.19Å; Y71-F150 HydrophobicContact CD2-CG 4.47Å; Y71-F150 HydrophobicContact CE2-CB 4.3Å
72	G	79.9	Confident	84.3	Confident	12 Å²	12	41.5 Å²	41.5	12%	0.124	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.6	-158.5	-177.3	0	0	0	0	0	112.7	R148 H149	G72-R148 CarbonylContact O-C 3.58Å; G72-R148 VanDerWaalsContact O-CA 3.32Å; G72-R148 WeakPolarHBondContact O-CA 3.21Å; G72-R148 WeakPolarHBondContact O-CB 3.16Å; G72-H149 PolarHBondContact N-O 2.97Å; G72-H149 VanDerWaalsContact N-O 3.1Å; G72-H149 PolarHBondContact O-N 3.4Å
73	H	79.6	Confident	83	Confident	97 Å²	97	47.3 Å²	47.3	45%	0.449	26%	0.264	S	S	.	.			trans	-108.8	129.4	173.8	-177.7	83.4	0	0	0	109	I146 G147	H73-I146 VanDerWaalsContact CE1-CG2 3.43Å; H73-I146 WeakPolarHBondContact CE1-CG2 3.27Å; H73-I146 PolarHBondContact ND1-O 3.4Å; H73-G147 PolarHBondContact ND1-O 3.24Å
74	S	78.4	Confident	81.2	Confident	35 Å²	35	47.2 Å²	47.2	25%	0.245	27%	0.268	C	S	.	.			trans	-123.7	165	172.1	76.5	0	0	0	0	111.2	R76 T77 H149	S74-R76 PolarHBondContact O-N 3.1Å; S74-R76 VanDerWaalsContact O-N 3.11Å; S74-R76 PolarHBondContact OG-N 3.04Å; S74-T77 WeakPolarHBondContact CA-OG1 3.31Å; S74-T77 PolarHBondContact N-OG1 2.88Å; S74-T77 VanDerWaalsContact O-CB 3.32Å; S74-T77 WeakPolarHBondContact O-CB 3.3Å; S74-T77 PolarHBondContact O-N 2.93Å; S74-T77 PolarHBondContact O-OG1 3.05Å; S74-T77 PolarHBondContact OG-N 3.21Å; S74-T77 PolarHBondContact OG-OG1 3.49Å; S74-T77 VanDerWaalsContact OG-OG1 3.12Å; S74-H149 PolarHBondContact OG-CE1 3.34Å
75	A	77.2	Confident	79.1	Confident	105 Å²	105	51.4 Å²	51.4	87%	0.868	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-28.3	173.4	0	0	0	0	0	113.4
76	R	80.2	Confident	77	Confident	174 Å²	174	56.6 Å²	56.6	66%	0.657	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-2.1	179.1	-63.9	-169.7	-177.5	-173.2	1.5	114	S74 A78 E79 I80	S74-R76 PolarHBondContact O-N 3.1Å; S74-R76 VanDerWaalsContact O-N 3.11Å; S74-R76 PolarHBondContact OG-N 3.04Å; R76-A78 PolarHBondContact O-N 3Å; R76-E79 WeakPolarHBondContact O-CB 3.27Å; R76-E79 PolarHBondContact O-N 3.15Å; R76-I80 HydrophobicContact CB-CD1 4Å; R76-I80 HydrophobicContact CB-CG1 4.35Å; R76-I80 WeakPolarHBondContact O-CB 3.42Å; R76-I80 VanDerWaalsContact O-CG1 3.27Å; R76-I80 WeakPolarHBondContact O-CG1 3.04Å; R76-I80 PolarHBondContact O-N 2.04Å
77	T	80.9	Confident	74.8	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-60.7	-38.5	-175.4	-45.3	0	0	0	0	111.7	S74 C81 I146 G147 H149	S74-T77 WeakPolarHBondContact CA-OG1 3.31Å; S74-T77 PolarHBondContact N-OG1 2.88Å; S74-T77 VanDerWaalsContact O-CB 3.32Å; S74-T77 WeakPolarHBondContact O-CB 3.3Å; S74-T77 PolarHBondContact O-N 2.93Å; S74-T77 PolarHBondContact O-OG1 3.05Å; S74-T77 PolarHBondContact OG-N 3.21Å; S74-T77 PolarHBondContact OG-OG1 3.49Å; S74-T77 VanDerWaalsContact OG-OG1 3.12Å; T77-C81 VanDerWaalsContact O-CB 3.25Å; T77-C81 WeakPolarHBondContact O-CB 3.47Å; T77-C81 PolarHBondContact O-N 3.02Å; T77-I146 HydrophobicContact CG2-CG2 3.87Å; T77-G147 WeakPolarHBondContact CG2-O 3.42Å; T77-H149 HydrophobicContact CG2-CB 4.01Å; T77-H149 PolarHBondContact OG1-ND1 3.32Å
78	A	78.1	Confident	72.8	Confident	41 Å²	41	71.2 Å²	71.2	34%	0.339	39%	0.39	S	S	.	.	H	α-helix	trans	-61.7	-45.2	175.4	0	0	0	0	0	111.3	R76 A82 I146	R76-A78 PolarHBondContact O-N 3Å; A78-A82 WeakPolarHBondContact O-CA 3.5Å; A78-A82 WeakPolarHBondContact O-CB 3.38Å; A78-A82 PolarHBondContact O-N 3.11Å; A78-I146 HydrophobicContact CB-CD1 3.88Å; A78-I146 HydrophobicContact CB-CG1 4.03Å; A78-I146 HydrophobicContact CB-CG2 4Å
79	E	84.3	Confident	70.4	Confident	130 Å²	130	80.4 Å²	80.4	61%	0.607	42%	0.422	S	S	*	.	H	α-helix	trans	-64.4	-48.7	178	-173.8	-173.1	176.2	0	0	111.8	R76 C81	R76-E79 WeakPolarHBondContact O-CB 3.27Å; R76-E79 PolarHBondContact O-N 3.15Å; E79-C81 VanDerWaalsContact C-N 3.31Å; E79-C81 PolarHBondContact O-N 3.48Å
80	I	84.2	Confident	67.7	Low	45 Å²	45	85.8 Å²	85.8	23%	0.231	46%	0.455	C	S	.	.	H	α-helix	trans	-59.1	-43.6	179.3	-66.5	165.7	0	0	0	110.5	R76	R76-I80 HydrophobicContact CB-CD1 4Å; R76-I80 HydrophobicContact CB-CG1 4.35Å; R76-I80 WeakPolarHBondContact O-CB 3.42Å; R76-I80 VanDerWaalsContact O-CG1 3.27Å; R76-I80 WeakPolarHBondContact O-CG1 3.04Å; R76-I80 PolarHBondContact O-N 2.04Å
81	C	85.7	Confident	65.2	Low	21 Å²	21	92.3 Å²	92.3	14%	0.142	50%	0.496	C	S	.	.	H	α-helix	trans	-96.7	-10.4	-173.1	-64.9	0	0	0	0	115.5	C49 T77 E79 I83 A84 S85	C49-C81 VanDerWaalsContact CA-SG 3.59Å; C49-C81 HydrophobicContact CB-CB 3.95Å; C49-C81 WeakPolarHBondContact CB-SG 3.38Å; C49-C81 WeakPolarHBondContact SG-CA 3.45Å; C49-C81 WeakPolarHBondContact SG-CB 3.47Å; C49-C81 CovalentContact SG-SG 2.03Å; C49-C81 PolarHBondContact SG-SG 2.89Å; T77-C81 VanDerWaalsContact O-CB 3.25Å; T77-C81 WeakPolarHBondContact O-CB 3.47Å; T77-C81 PolarHBondContact O-N 3.02Å; E79-C81 VanDerWaalsContact C-N 3.31Å; E79-C81 PolarHBondContact O-N 3.48Å; C81-I83 PolarHBondContact O-N 2.87Å; C81-A84 PolarHBondContact O-N 2.65Å; C81-S85 PolarHBondContact O-N 2.87Å; C81-S85 PolarHBondContact O-OG 3.06Å
82	A	75.3	Confident	62.7	Low	57 Å²	57	98 Å²	98	47%	0.471	53%	0.532	S	S	.	.	H	α-helix	trans	-59.7	-39.4	170.7	0	0	0	0	0	110.6	A78 S85	A78-A82 WeakPolarHBondContact O-CA 3.5Å; A78-A82 WeakPolarHBondContact O-CB 3.38Å; A78-A82 PolarHBondContact O-N 3.11Å; A82-S85 PolarHBondContact O-N 3.08Å
83	I	60.5	Low	60.4	Low	130 Å²	130	106.5 Å²	106.5	67%	0.667	57%	0.568	S	S	*	*	H	α-helix	trans	-69.2	-37.3	-178.7	-53.3	176.1	0	0	0	111.4	C81 S85 T86	C81-I83 PolarHBondContact O-N 2.87Å; I83-S85 VanDerWaalsContact C-N 3.33Å; I83-S85 PolarHBondContact O-N 3.37Å; I83-T86 PolarHBondContact O-N 2.87Å
84	A	54.7	Low	58.2	Low	26 Å²	26	105.5 Å²	105.5	22%	0.215	59%	0.585	C	S	.	*	H	α-helix	trans	-68.1	-32.4	-179.4	0	0	0	0	0	112.8	C81 T86 K87	C81-A84 PolarHBondContact O-N 2.65Å; A84-T86 PolarHBondContact O-N 2.81Å; A84-K87 PolarHBondContact O-N 3.38Å
85	S	50.2	Low	56.1	Low	88 Å²	88	115.6 Å²	115.6	62%	0.615	62%	0.617	S	S	*	*	H	α-helix	trans	-64.3	-25.9	-178	-56.5	0	0	0	0	112.9	C81 A82 I83	C81-S85 PolarHBondContact O-N 2.87Å; C81-S85 PolarHBondContact O-OG 3.06Å; A82-S85 PolarHBondContact O-N 3.08Å; I83-S85 VanDerWaalsContact C-N 3.33Å; I83-S85 PolarHBondContact O-N 3.37Å
86	T	47	Very low	54.1	Low	121 Å²	121	118.5 Å²	118.5	74%	0.742	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-21.9	-178.8	-46.7	0	0	0	0	112.9	I83 A84	I83-T86 PolarHBondContact O-N 2.87Å; A84-T86 PolarHBondContact O-N 2.81Å
87	K	43.3	Very low	52	Low	182 Å²	182	113.5 Å²	113.5	79%	0.791	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-7.9	-175.4	-95.2	-180	177.7	174.9	0	115.5	A84 R89	A84-K87 PolarHBondContact O-N 3.38Å; K87-R89 PolarHBondContact O-N 3.37Å
88	K	44.3	Very low	49.7	Very low	164 Å²	164	121 Å²	121	71%	0.713	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	7.8	-169.5	-131.4	177	-173.4	175.5	0	115.5
89	R	36.9	Very low	47.9	Very low	243 Å²	243	127.6 Å²	127.6	92%	0.917	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	0.9	-177.1	-90.1	-172	147.6	166.2	-4.9	116.5	K87	K87-R89 PolarHBondContact O-N 3.37Å
90	T	31	Very low	45.6	Very low	113 Å²	113	133.6 Å²	133.6	69%	0.693	71%	0.705	S	S	*	*			trans	-139.3	99.2	179	49.4	0	0	0	0	110.9
91	T	34.1	Very low	43.5	Very low	148 Å²	148	138.1 Å²	138.1	91%	0.908	72%	0.723	S	S	*	*			trans	-171.5	83.3	141.7	18.9	0	0	0	0	108.7
92	T	31.9	Very low	41.5	Very low	126 Å²	126	141 Å²	141	77%	0.773	74%	0.739	S	S	*	*			trans	-66.1	142.9	151.2	6.3	0	0	0	0	109.3
93	E	31.6	Very low	39.8	Very low	190 Å²	190	142.2 Å²	142.2	89%	0.888	74%	0.738	S	S	*	*			trans	74	126.5	154.1	-62.5	-175.8	165.1	0	0	121.2
94	G	32.3	Very low	38.9	Very low	77 Å²	77	140.9 Å²	140.9	79%	0.794	73%	0.725	S	S	*	*				120.7	107.2	119.6	0	0	0	0	0	118.6
95	R	34.4	Very low	38.1	Very low	246 Å²	246	144.8 Å²	144.8	93%	0.928	74%	0.743	S	S	*	*			trans	93.5	104.3	137.3	-144.5	167.4	-176.7	137.5	-0.8	119.5
96	N	34.8	Very low	37.6	Very low	167 Å²	167	144.5 Å²	144.5	89%	0.893	73%	0.733	S	S	*	*			trans	17.3	110.3	140	-71.2	-8.7	0	0	0	118.4
97	G	36.2	Very low	37.6	Very low	68 Å²	68	147.4 Å²	147.4	70%	0.701	73%	0.73	S	S	*	*			trans	-165.9	88.9	160.2	0	0	0	0	0	109.9	K99	G97-K99 PolarHBondContact O-N 2.89Å
98	T	33.7	Very low	37.8	Very low	157 Å²	157	139.3 Å²	139.3	96%	0.963	70%	0.696	S	S	*	*			trans	-65.5	77.2	176.7	15.5	0	0	0	0	110.8
99	K	39.3	Very low	37.7	Very low	181 Å²	181	134.3 Å²	134.3	79%	0.787	68%	0.682	S	S	*	*			trans	-96.5	114.2	157.5	-72.6	-175.6	179.3	176.3	0	106.7	G97 K101	G97-K99 PolarHBondContact O-N 2.89Å; K99-K101 VanDerWaalsContact C-N 3.28Å; K99-K101 PolarHBondContact O-N 2.78Å
100	R	37	Very low	38.3	Very low	255 Å²	255	126.9 Å²	126.9	96%	0.962	67%	0.667	S	S	*	*			trans	-56.6	91	172.5	-75.8	-176.9	173.4	118.7	-2.9	109.1
101	K	40	Very low	39.1	Very low	141 Å²	141	128 Å²	128	61%	0.613	66%	0.664	S	S	*	*			trans	-84.7	114.4	165.6	-73.4	177.6	-178.8	170.4	0	105.3	K99 D103 W130	K99-K101 VanDerWaalsContact C-N 3.28Å; K99-K101 PolarHBondContact O-N 2.78Å; K101-D103 VanDerWaalsContact C-N 3.27Å; K101-D103 PolarHBondContact O-N 2.04Å; K101-W130 HydrophobicContact CB-CH2 4.49Å; K101-W130 HydrophobicContact CB-CZ2 4.14Å
102	V	43.3	Very low	40	Very low	80 Å²	80	122.4 Å²	122.4	49%	0.485	63%	0.631	S	S	.	*			trans	-66.9	87.8	171.7	-174	0	0	0	0	108.8	Y104 W130	V102-Y104 HydrophobicContact CB-CE2 4.04Å; V102-Y104 HydrophobicContact CG1-CD1 4.36Å; V102-Y104 HydrophobicContact CG1-CD2 4.05Å; V102-Y104 HydrophobicContact CG1-CE1 3.83Å; V102-Y104 HydrophobicContact CG1-CE2 3.47Å; V102-Y104 VanDerWaalsContact CG1-CE2 3.47Å; V102-Y104 HydrophobicContact CG1-CG 4.46Å; V102-Y104 WeakPolarHBondContact O-CD2 3.28Å; V102-Y104 PolarHBondContact O-N 3.16Å; V102-Y104 VanDerWaalsContact O-N 3.16Å; V102-W130 HydrophobicContact CB-CZ2 4.38Å; V102-W130 WeakPolarHBondContact O-CZ2 3.07Å; V102-W130 PolarHBondContact O-NE1 3.33Å
103	D	38.4	Very low	41	Very low	83 Å²	83	121.8 Å²	121.8	44%	0.444	62%	0.623	S	S	.	*			trans	-77	98.5	175.6	-77.5	-29.2	0	0	0	109.3	K53 K101 N105 W130	K53-D103 IonicContact NZ-OD1 2.65Å; K53-D103 PolarHBondContact NZ-OD1 2.93Å; K101-D103 VanDerWaalsContact C-N 3.27Å; K101-D103 PolarHBondContact O-N 2.04Å; D103-N105 PolarHBondContact O-N 3.45Å; D103-W130 PolarHBondContact OD1-NE1 3.41Å
104	Y	42.9	Very low	42.7	Very low	103 Å²	103	115.6 Å²	115.6	40%	0.404	60%	0.596	S	S	.	*			trans	-71.7	97.1	167.5	-60.2	-82.2	0	0	0	108.1	V102 I106	V102-Y104 HydrophobicContact CB-CE2 4.04Å; V102-Y104 HydrophobicContact CG1-CD1 4.36Å; V102-Y104 HydrophobicContact CG1-CD2 4.05Å; V102-Y104 HydrophobicContact CG1-CE1 3.83Å; V102-Y104 HydrophobicContact CG1-CE2 3.47Å; V102-Y104 VanDerWaalsContact CG1-CE2 3.47Å; V102-Y104 HydrophobicContact CG1-CG 4.46Å; V102-Y104 WeakPolarHBondContact O-CD2 3.28Å; V102-Y104 PolarHBondContact O-N 3.16Å; V102-Y104 VanDerWaalsContact O-N 3.16Å; Y104-I106 PolarHBondContact O-N 2.79Å
105	N	37.3	Very low	44.5	Very low	108 Å²	108	112 Å²	112	58%	0.578	56%	0.558	S	S	*	*			trans	-84.1	85	171.6	-66.5	-50.5	0	0	0	108	D103 K132	D103-N105 PolarHBondContact O-N 3.45Å; N105-K132 WeakPolarHBondContact OD1-CD 3.12Å; N105-K132 PolarHBondContact OD1-NZ 2.67Å
106	I	40.3	Very low	46.4	Very low	82 Å²	82	100.3 Å²	100.3	42%	0.421	52%	0.515	S	S	.	.			trans	-124.5	122.2	177.7	-57.3	174.4	0	0	0	108	Y104 M108 F118	Y104-I106 PolarHBondContact O-N 2.79Å; I106-M108 PolarHBondContact O-N 2.95Å; I106-F118 HydrophobicContact CB-CE2 3.63Å; I106-F118 HydrophobicContact CB-CZ 3.82Å; I106-F118 HydrophobicContact CD1-CE2 3.8Å; I106-F118 HydrophobicContact CD1-CZ 4.41Å; I106-F118 HydrophobicContact CG1-CE2 4.27Å; I106-F118 HydrophobicContact CG2-CD2 4.2Å; I106-F118 HydrophobicContact CG2-CE2 3.58Å; I106-F118 HydrophobicContact CG2-CZ 4.19Å
107	R	45.7	Very low	48.6	Very low	181 Å²	181	97.5 Å²	97.5	68%	0.683	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-70.6	119.1	174.3	-86	176.8	166.2	145.1	-6.7	107.8	S109	R107-S109 PolarHBondContact O-N 3.32Å
108	M	48.9	Very low	50.9	Low	12 Å²	12	95.6 Å²	95.6	6%	0.059	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-70.4	121.6	164.6	-97.1	125.7	69	0	0	109.3	Y71 I106 F118 I131 F150	Y71-M108 HydrophobicContact CD1-CB 3.62Å; Y71-M108 HydrophobicContact CD1-CE 4.13Å; Y71-M108 HydrophobicContact CD2-CE 3.69Å; Y71-M108 HydrophobicContact CE1-CB 3.63Å; Y71-M108 WeakPolarHBondContact CE1-O 3.43Å; Y71-M108 HydrophobicContact CE2-CE 4.25Å; Y71-M108 HydrophobicContact CG-CB 4.28Å; Y71-M108 HydrophobicContact CG-CE 3.6Å; I106-M108 PolarHBondContact O-N 2.95Å; M108-F118 HydrophobicContact CG-CB 4.45Å; M108-F118 HydrophobicContact CG-CD1 3.8Å; M108-F118 HydrophobicContact CG-CE1 4.39Å; M108-F118 HydrophobicContact CG-CG 4.21Å; M108-F118 HydrophobicContact SD-CD1 3.3Å; M108-F118 WeakPolarHBondContact SD-CD1 3.2Å; M108-F118 HydrophobicContact SD-CE1 3.56Å; M108-F118 VanDerWaalsContact SD-CE1 3.56Å; M108-F118 HydrophobicContact SD-CG 4.27Å; M108-I131 HydrophobicContact SD-CG2 3.96Å; M108-F150 HydrophobicContact CE-CD2 3.2Å; M108-F150 HydrophobicContact CE-CE2 3.42Å; M108-F150 VanDerWaalsContact CE-CE2 3.42Å; M108-F150 HydrophobicContact CE-CG 4.08Å; M108-F150 HydrophobicContact CE-CZ 4.48Å
109	S	42.3	Very low	53.5	Low	60 Å²	60	88.1 Å²	88.1	42%	0.42	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-63.1	152.3	165.9	39.1	0	0	0	0	109.8	R107 Q111 D114	R107-S109 PolarHBondContact O-N 3.32Å; S109-Q111 PolarHBondContact O-N 3.34Å; S109-D114 PolarHBondContact OG-OD2 2.74Å
110	S	48.9	Very low	55.9	Low	87 Å²	87	80.4 Å²	80.4	61%	0.608	39%	0.391	S	S	*	.	S	Bend	trans	-74.2	18.7	-170.6	43.1	0	0	0	0	115.3
111	Q	48.8	Very low	58.3	Low	135 Å²	135	74.9 Å²	74.9	63%	0.631	38%	0.376	S	S	*	.			trans	-105.1	127.5	173.3	-102.1	165.3	-10.9	0	0	109.7	S109 N113 D114 S115	S109-Q111 PolarHBondContact O-N 3.34Å; Q111-N113 PolarHBondContact O-N 2.93Å; Q111-D114 PolarHBondContact O-N 3.01Å; Q111-S115 PolarHBondContact O-N 2.81Å
112	S	51.5	Low	60.7	Low	31 Å²	31	69 Å²	69	22%	0.217	35%	0.352	C	S	.	.	H	α-helix	trans	-58.5	-33.6	-175.6	53	0	0	0	0	112.6	G14 C16 S115 C116	G14-S112 WeakPolarHBondContact O-CB 3.5Å; C16-S112 WeakPolarHBondContact CB-O 3.44Å; C16-S112 WeakPolarHBondContact SG-CB 3.31Å; C16-S112 PolarHBondContact SG-O 3.13Å; C16-S112 VanDerWaalsContact SG-O 3.34Å; C16-S112 PolarHBondContact SG-OG 3.3Å; S112-S115 PolarHBondContact O-N 2.88Å; S112-S115 PolarHBondContact O-OG 2.88Å; S112-C116 PolarHBondContact O-N 2.96Å
113	N	52.5	Low	63.1	Low	114 Å²	114	65.1 Å²	65.1	61%	0.61	33%	0.329	S	S	*	.	H	α-helix	trans	-62.4	-50.6	178.2	-79.7	-20.7	0	0	0	111.2	C16 Q111 S115 C116 E117	C16-N113 VanDerWaalsContact SG-CA 3.51Å; C16-N113 PolarHBondContact SG-N 2.87Å; C16-N113 PolarHBondContact SG-OD1 3.16Å; Q111-N113 PolarHBondContact O-N 2.93Å; N113-S115 PolarHBondContact O-N 2.9Å; N113-C116 PolarHBondContact O-N 3.36Å; N113-C116 VanDerWaalsContact O-N 3.12Å; N113-E117 PolarHBondContact O-N 2.92Å; N113-E117 VanDerWaalsContact O-N 3.13Å
114	D	67.9	Low	65.6	Low	60 Å²	60	62.3 Å²	62.3	32%	0.321	31%	0.313	S	S	.	.	H	α-helix	trans	-57.2	-38.8	176.8	-59.8	4	0	0	0	111.5	S109 Q111 C116 F118	S109-D114 PolarHBondContact OG-OD2 2.74Å; Q111-D114 PolarHBondContact O-N 3.01Å; D114-C116 VanDerWaalsContact C-N 3.3Å; D114-C116 PolarHBondContact O-N 2.74Å; D114-F118 WeakPolarHBondContact O-CB 2.83Å; D114-F118 PolarHBondContact O-N 3.33Å
115	S	69.5	Low	68	Low	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-66.7	-33	-178.3	76.5	0	0	0	0	113.1	Q111 S112 N113 A119	Q111-S115 PolarHBondContact O-N 2.81Å; S112-S115 PolarHBondContact O-N 2.88Å; S112-S115 PolarHBondContact O-OG 2.88Å; N113-S115 PolarHBondContact O-N 2.9Å; S115-A119 VanDerWaalsContact O-CB 3.31Å; S115-A119 WeakPolarHBondContact O-CB 3.38Å; S115-A119 PolarHBondContact O-N 3.42Å; S115-A119 VanDerWaalsContact O-N 3.07Å
116	C	74.9	Confident	70.7	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.014	30%	0.303	C	S	.	.	H	α-helix	trans	-78.1	-43.8	179.7	-160.2	0	0	0	0	111.8	C16 N18 V69 S112 N113 D114 A119 T120	C16-C116 HydrophobicContact CB-CB 3.55Å; C16-C116 PolarHBondContact O-SG 3.11Å; N18-C116 WeakPolarHBondContact CB-SG 3.32Å; N18-C116 PolarHBondContact ND2-O 2.74Å; N18-C116 VanDerWaalsContact ND2-O 3.09Å; N18-C116 PolarHBondContact ND2-SG 3.07Å; V69-C116 HydrophobicContact CB-CB 4.05Å; S112-C116 PolarHBondContact O-N 2.96Å; N113-C116 PolarHBondContact O-N 3.36Å; N113-C116 VanDerWaalsContact O-N 3.12Å; D114-C116 VanDerWaalsContact C-N 3.3Å; D114-C116 PolarHBondContact O-N 2.74Å; C116-A119 PolarHBondContact O-N 3.13Å; C116-T120 VanDerWaalsContact O-CB 3.25Å; C116-T120 WeakPolarHBondContact O-CB 3.32Å; C116-T120 PolarHBondContact O-N 2.88Å; C116-T120 PolarHBondContact O-OG1 2.88Å
117	E	81.7	Confident	73.3	Confident	107 Å²	107	59.5 Å²	59.5	50%	0.5	30%	0.296	S	S	.	.	H	α-helix	trans	-57.5	-51.4	172.6	-175.7	169.3	-160.5	0	0	110.1	N18 N113 A119 T120 E121	N18-E117 PolarHBondContact ND2-N 3.29Å; N113-E117 PolarHBondContact O-N 2.92Å; N113-E117 VanDerWaalsContact O-N 3.13Å; E117-A119 PolarHBondContact O-N 2.74Å; E117-T120 CarbonylContact O-C 3.51Å; E117-T120 WeakPolarHBondContact O-CB 3.39Å; E117-T120 PolarHBondContact O-N 3.12Å; E117-T120 VanDerWaalsContact O-N 3.12Å; E117-E121 HydrophobicContact CG-CG 4.35Å; E117-E121 WeakPolarHBondContact O-CG 3.41Å; E117-E121 PolarHBondContact O-N 3.5Å
118	F	84.5	Confident	75.7	Confident	28 Å²	28	58.2 Å²	58.2	12%	0.123	29%	0.291	C	S	.	.	H	α-helix	trans	-56.4	-49.3	178	175.1	-96.6	0	0	0	113.1	I106 M108 D114 T120 E121 T122 I131	I106-F118 HydrophobicContact CB-CE2 3.63Å; I106-F118 HydrophobicContact CB-CZ 3.82Å; I106-F118 HydrophobicContact CD1-CE2 3.8Å; I106-F118 HydrophobicContact CD1-CZ 4.41Å; I106-F118 HydrophobicContact CG1-CE2 4.27Å; I106-F118 HydrophobicContact CG2-CD2 4.2Å; I106-F118 HydrophobicContact CG2-CE2 3.58Å; I106-F118 HydrophobicContact CG2-CZ 4.19Å; M108-F118 HydrophobicContact CG-CB 4.45Å; M108-F118 HydrophobicContact CG-CD1 3.8Å; M108-F118 HydrophobicContact CG-CE1 4.39Å; M108-F118 HydrophobicContact CG-CG 4.21Å; M108-F118 HydrophobicContact SD-CD1 3.3Å; M108-F118 WeakPolarHBondContact SD-CD1 3.2Å; M108-F118 HydrophobicContact SD-CE1 3.56Å; M108-F118 VanDerWaalsContact SD-CE1 3.56Å; M108-F118 HydrophobicContact SD-CG 4.27Å; D114-F118 WeakPolarHBondContact O-CB 2.83Å; D114-F118 PolarHBondContact O-N 3.33Å; F118-T120 VanDerWaalsContact C-N 3.28Å; F118-T120 PolarHBondContact O-N 3.06Å; F118-E121 PolarHBondContact O-N 2.94Å; F118-T122 WeakPolarHBondContact CE2-OG1 3.47Å; F118-T122 HydrophobicContact CZ-CG2 4.49Å; F118-T122 WeakPolarHBondContact CZ-OG1 3.48Å; F118-T122 WeakPolarHBondContact O-CB 3.07Å; F118-T122 PolarHBondContact O-N 3.12Å; F118-T122 PolarHBondContact O-OG1 2.8Å; F118-I131 HydrophobicContact CD1-CD1 4.41Å; F118-I131 HydrophobicContact CE1-CB 4.49Å; F118-I131 HydrophobicContact CE1-CD1 4.1Å; F118-I131 HydrophobicContact CE1-CG1 4.05Å; F118-I131 HydrophobicContact CE1-CG2 3.76Å
119	A	87.4	Confident	77.9	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64.5	-37	-179.9	0	0	0	0	0	111.7	V69 S115 C116 E117 C123 I131 F150	V69-A119 HydrophobicContact CG1-CB 4.37Å; V69-A119 HydrophobicContact CG2-CB 3.87Å; S115-A119 VanDerWaalsContact O-CB 3.31Å; S115-A119 WeakPolarHBondContact O-CB 3.38Å; S115-A119 PolarHBondContact O-N 3.42Å; S115-A119 VanDerWaalsContact O-N 3.07Å; C116-A119 PolarHBondContact O-N 3.13Å; E117-A119 PolarHBondContact O-N 2.74Å; A119-C123 VanDerWaalsContact O-CB 3.29Å; A119-C123 WeakPolarHBondContact O-CB 3.28Å; A119-C123 PolarHBondContact O-N 3.41Å; A119-I131 HydrophobicContact CB-CD1 3.84Å; A119-F150 HydrophobicContact CB-CE2 4.5Å; A119-F150 HydrophobicContact CB-CZ 4.32Å
120	T	89.4	Confident	80.3	Confident	20 Å²	20	58.4 Å²	58.4	12%	0.123	28%	0.284	C	S	.	.	H	α-helix	trans	-65.8	-56.1	176.2	-59.6	0	0	0	0	110.1	N18 C116 E117 F118 T122 C123 Q124	N18-T120 PolarHBondContact ND2-OG1 2.74Å; N18-T120 VanDerWaalsContact ND2-OG1 3.13Å; C116-T120 VanDerWaalsContact O-CB 3.25Å; C116-T120 WeakPolarHBondContact O-CB 3.32Å; C116-T120 PolarHBondContact O-N 2.88Å; C116-T120 PolarHBondContact O-OG1 2.88Å; E117-T120 CarbonylContact O-C 3.51Å; E117-T120 WeakPolarHBondContact O-CB 3.39Å; E117-T120 PolarHBondContact O-N 3.12Å; E117-T120 VanDerWaalsContact O-N 3.12Å; F118-T120 VanDerWaalsContact C-N 3.28Å; F118-T120 PolarHBondContact O-N 3.06Å; T120-T122 PolarHBondContact O-N 3.23Å; T120-C123 PolarHBondContact O-N 3.26Å; T120-Q124 HydrophobicContact CG2-CB 3.98Å; T120-Q124 HydrophobicContact CG2-CG 4.22Å; T120-Q124 WeakPolarHBondContact O-CA 3.2Å; T120-Q124 WeakPolarHBondContact O-CB 3.27Å; T120-Q124 PolarHBondContact O-N 2.79Å
121	E	89	Confident	82.2	Confident	138 Å²	138	54.3 Å²	54.3	65%	0.645	26%	0.255	S	S	*	.	H	α-helix	trans	-56.9	-39.8	177.9	-69	-174.1	149.3	0	0	112.6	E117 F118	E117-E121 HydrophobicContact CG-CG 4.35Å; E117-E121 WeakPolarHBondContact O-CG 3.41Å; E117-E121 PolarHBondContact O-N 3.5Å; F118-E121 PolarHBondContact O-N 2.94Å
122	T	89.8	Confident	83.8	Confident	17 Å²	17	53 Å²	53	10%	0.104	25%	0.247	C	C	.	.	H	α-helix	trans	-74.5	-39.4	-176.3	-58.5	0	0	0	0	112.2	F118 T120 K126 C129 I131	F118-T122 WeakPolarHBondContact CE2-OG1 3.47Å; F118-T122 HydrophobicContact CZ-CG2 4.49Å; F118-T122 WeakPolarHBondContact CZ-OG1 3.48Å; F118-T122 WeakPolarHBondContact O-CB 3.07Å; F118-T122 PolarHBondContact O-N 3.12Å; F118-T122 PolarHBondContact O-OG1 2.8Å; T120-T122 PolarHBondContact O-N 3.23Å; T122-K126 VanDerWaalsContact O-CD 3.27Å; T122-K126 WeakPolarHBondContact O-CD 3.5Å; T122-K126 WeakPolarHBondContact O-CE 3.44Å; T122-K126 PolarHBondContact O-NZ 3.15Å; T122-C129 PolarHBondContact O-SG 2.97Å; T122-C129 VanDerWaalsContact O-SG 3.41Å; T122-I131 HydrophobicContact CG2-CG1 4.12Å
123	C	94.2	Very high	85	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-118	-20.2	-167.8	-64.6	0	0	0	0	115.9	I64 I66 A119 T120 N125 K126 C129	I64-C123 HydrophobicContact CG2-CB 4.37Å; I66-C123 HydrophobicContact CD1-CB 4.25Å; I66-C123 HydrophobicContact CG1-CB 4.49Å; A119-C123 VanDerWaalsContact O-CB 3.29Å; A119-C123 WeakPolarHBondContact O-CB 3.28Å; A119-C123 PolarHBondContact O-N 3.41Å; T120-C123 PolarHBondContact O-N 3.26Å; C123-N125 PolarHBondContact O-N 2.78Å; C123-K126 WeakPolarHBondContact O-CB 3.49Å; C123-K126 PolarHBondContact O-N 2.74Å; C123-C129 WeakPolarHBondContact CA-SG 3.29Å; C123-C129 HydrophobicContact CB-CB 3.54Å; C123-C129 WeakPolarHBondContact CB-SG 3.16Å; C123-C129 WeakPolarHBondContact SG-CB 3.12Å; C123-C129 CovalentContact SG-SG 2.04Å; C123-C129 PolarHBondContact SG-SG 2.87Å
124	Q	91.1	Very high	85.8	Confident	23 Å²	23	46.4 Å²	46.4	11%	0.107	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	139.3	-179.6	-169.4	68.6	7.4	0	0	110.3	N21 T120 K126	N21-Q124 PolarHBondContact ND2-NE2 2.94Å; T120-Q124 HydrophobicContact CG2-CB 3.98Å; T120-Q124 HydrophobicContact CG2-CG 4.22Å; T120-Q124 WeakPolarHBondContact O-CA 3.2Å; T120-Q124 WeakPolarHBondContact O-CB 3.27Å; T120-Q124 PolarHBondContact O-N 2.79Å; Q124-K126 PolarHBondContact O-N 3.03Å
125	N	92.1	Very high	85.4	Confident	84 Å²	84	46.4 Å²	46.4	45%	0.449	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	7.1	178.4	-50.7	-35.4	0	0	0	115.5	Q63 I64 C123 R157	Q63-N125 PolarHBondContact NE2-OD1 3.03Å; I64-N125 PolarHBondContact O-N 2.9Å; C123-N125 PolarHBondContact O-N 2.78Å; N125-R157 PolarHBondContact OD1-NH2 3.06Å
126	K	94.7	Very high	84.7	Confident	77 Å²	77	54.9 Å²	54.9	34%	0.335	25%	0.251	S	S	.	.			trans	-94.1	149	172.1	-60.3	-176.2	-174.1	171.1	0	110.3	I64 T122 C123 Q124	I64-K126 WeakPolarHBondContact CB-O 2.97Å; I64-K126 VanDerWaalsContact CD1-O 3.29Å; I64-K126 WeakPolarHBondContact CD1-O 2.99Å; I64-K126 WeakPolarHBondContact CG1-O 3.4Å; I64-K126 PolarHBondContact N-O 2.88Å; T122-K126 VanDerWaalsContact O-CD 3.27Å; T122-K126 WeakPolarHBondContact O-CD 3.5Å; T122-K126 WeakPolarHBondContact O-CE 3.44Å; T122-K126 PolarHBondContact O-NZ 3.15Å; C123-K126 WeakPolarHBondContact O-CB 3.49Å; C123-K126 PolarHBondContact O-N 2.74Å; Q124-K126 PolarHBondContact O-N 3.03Å
127	R	94.5	Very high	83.7	Confident	73 Å²	73	58.9 Å²	58.9	28%	0.275	27%	0.273	S	S	.	.	S	Bend	trans	-79.1	-33.7	172.7	-172.9	179.4	74.1	93.8	-13.1	112.5	C58 P59	C58-R127 HydrophobicContact CB-CG 4.42Å; C58-R127 PolarHBondContact N-O 2.78Å; C58-R127 VanDerWaalsContact O-CG 3.27Å; C58-R127 WeakPolarHBondContact O-CG 3.44Å; P59-R127 WeakPolarHBondContact O-CD 3.03Å
128	R	95.7	Very high	82.4	Confident	154 Å²	154	59.3 Å²	59.3	58%	0.581	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.7	131.3	179.6	-67.4	-179.9	-69.1	-170.8	-2.5	107.7	F56 K57	F56-R128 WeakPolarHBondContact O-CA 3.43Å; K57-R128 HydrophobicContact CG-CG 4.31Å
129	C	95.5	Very high	80.8	Confident	10 Å²	10	61.4 Å²	61.4	7%	0.068	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	152.7	178	-173	0	0	0	0	109.2	F56 I64 T122 C123	F56-C129 HydrophobicContact CB-CB 4.22Å; F56-C129 HydrophobicContact CD2-CB 4.15Å; F56-C129 PolarHBondContact N-O 3.48Å; F56-C129 PolarHBondContact O-N 2.82Å; I64-C129 HydrophobicContact CD1-CB 3.76Å; T122-C129 PolarHBondContact O-SG 2.97Å; T122-C129 VanDerWaalsContact O-SG 3.41Å; C123-C129 WeakPolarHBondContact CA-SG 3.29Å; C123-C129 HydrophobicContact CB-CB 3.54Å; C123-C129 WeakPolarHBondContact CB-SG 3.16Å; C123-C129 WeakPolarHBondContact SG-CB 3.12Å; C123-C129 CovalentContact SG-SG 2.04Å; C123-C129 PolarHBondContact SG-SG 2.87Å
130	W	92.3	Very high	79.2	Confident	67 Å²	67	66.7 Å²	66.7	25%	0.254	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	142.9	166.8	53.9	81.3	0	0	0	110.4	K53 A54 K101 V102 D103	K53-W130 HydrophobicContact CD-CB 4.42Å; K53-W130 VanDerWaalsContact CE-CB 3.47Å; K53-W130 HydrophobicContact CG-CB 4.16Å; A54-W130 CarbonylContact O-C 3.6Å; A54-W130 WeakPolarHBondContact O-CA 3.34Å; K101-W130 HydrophobicContact CB-CH2 4.49Å; K101-W130 HydrophobicContact CB-CZ2 4.14Å; V102-W130 HydrophobicContact CB-CZ2 4.38Å; V102-W130 WeakPolarHBondContact O-CZ2 3.07Å; V102-W130 PolarHBondContact O-NE1 3.33Å; D103-W130 PolarHBondContact OD1-NE1 3.41Å
131	I	89	Confident	76.9	Confident	1 Å²	1	72.2 Å²	72.2	1%	0.005	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	132.9	173.5	-69	172	0	0	0	107	A54 F56 M108 F118 A119 T122 F150	A54-I131 HydrophobicContact CB-CB 4.23Å; A54-I131 PolarHBondContact N-O 2.94Å; A54-I131 PolarHBondContact O-N 3.49Å; F56-I131 HydrophobicContact CE2-CB 4.48Å; F56-I131 HydrophobicContact CE2-CD1 3.89Å; F56-I131 HydrophobicContact CE2-CG1 4.17Å; F56-I131 HydrophobicContact CZ-CD1 4.4Å; M108-I131 HydrophobicContact SD-CG2 3.96Å; F118-I131 HydrophobicContact CD1-CD1 4.41Å; F118-I131 HydrophobicContact CE1-CB 4.49Å; F118-I131 HydrophobicContact CE1-CD1 4.1Å; F118-I131 HydrophobicContact CE1-CG1 4.05Å; F118-I131 HydrophobicContact CE1-CG2 3.76Å; A119-I131 HydrophobicContact CB-CD1 3.84Å; T122-I131 HydrophobicContact CG2-CG1 4.12Å; I131-F150 HydrophobicContact CD1-CZ 4.08Å
132	K	83.2	Confident	74.9	Confident	107 Å²	107	73 Å²	73	47%	0.465	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	112.2	169.6	-166.2	176.4	-174.4	-179.5	0	107.1	N105	N105-K132 WeakPolarHBondContact OD1-CD 3.12Å; N105-K132 PolarHBondContact OD1-NZ 2.67Å
133	T	76.7	Confident	72.9	Confident	1 Å²	1	78.3 Å²	78.3	1%	0.006	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-63.3	143.1	172.1	62.9	0	0	0	0	108	C49 G51 E52 A54 F150	C49-T133 PolarHBondContact O-OG1 2.83Å; G51-T133 PolarHBondContact N-OG1 2.84Å; E52-T133 PolarHBondContact N-OG1 3.15Å; E52-T133 PolarHBondContact O-N 2.84Å; E52-T133 VanDerWaalsContact O-N 3.15Å; E52-T133 PolarHBondContact O-OG1 3.08Å; A54-T133 HydrophobicContact CB-CG2 4.43Å; T133-F150 HydrophobicContact CG2-CB 3.51Å; T133-F150 HydrophobicContact CG2-CD1 4.17Å; T133-F150 HydrophobicContact CG2-CG 4.06Å
134	G	69.5	Low	71	Confident	5 Å²	5	81.9 Å²	81.9	5%	0.052	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-50.4	152.1	-171.8	0	0	0	0	0	112.8	E50 G51 Y71	E50-G134 WeakPolarHBondContact CG-O 3.07Å; G51-G134 PolarHBondContact N-O 3.46Å; G51-G134 VanDerWaalsContact N-O 3.15Å; Y71-G134 WeakPolarHBondContact OH-CA 3.43Å; Y71-G134 PolarHBondContact OH-N 3.16Å
135	A	58.8	Low	69.2	Low	61 Å²	61	89.3 Å²	89.3	50%	0.504	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-75.7	141.6	170.8	0	0	0	0	0	109.4	D137	A135-D137 PolarHBondContact O-N 3.07Å
136	R	55.9	Low	67.8	Low	177 Å²	177	88.8 Å²	88.8	67%	0.668	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-46.7	126	171.9	-82.2	-174.6	-172.6	173.9	0.6	109.6	E50 P138	E50-R136 HydrophobicContact CG-CG 4.06Å; E50-R136 WeakPolarHBondContact OE1-CA 3.32Å; R136-P138 WeakPolarHBondContact O-CD 3.03Å
137	D	54	Low	66.8	Low	86 Å²	86	86.1 Å²	86.1	46%	0.46	46%	0.459	S	S	.	.			trans	-69.6	113.7	175.9	-142.6	-22.1	0	0	0	108.4	A135 A139 L140	A135-D137 PolarHBondContact O-N 3.07Å; D137-A139 PolarHBondContact O-N 3.36Å; D137-A139 VanDerWaalsContact O-N 3.13Å; D137-L140 HydrophobicContact CB-CB 4.46Å; D137-L140 PolarHBondContact O-N 3.17Å
138	P	52.6	Low	66.1	Low	117 Å²	117	85.6 Å²	85.6	76%	0.76	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-21.2	-176.6	-17.9	30.7	0	0	0	112.5	R136	R136-P138 WeakPolarHBondContact O-CD 3.03Å
139	A	51.6	Low	65.6	Low	71 Å²	71	78.3 Å²	78.3	59%	0.587	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-4.9	-177.7	0	0	0	0	0	114	D137 N141	D137-A139 PolarHBondContact O-N 3.36Å; D137-A139 VanDerWaalsContact O-N 3.13Å; A139-N141 VanDerWaalsContact C-N 3.31Å; A139-N141 PolarHBondContact O-N 3.09Å; A139-N141 PolarHBondContact O-OD1 3.43Å
140	L	53.1	Low	65.2	Low	112 Å²	112	77.9 Å²	77.9	59%	0.586	43%	0.426	S	S	*	.	S	Bend	trans	-82.6	83.5	176.7	-143.4	79	0	0	0	109.7	D137 N142	D137-L140 HydrophobicContact CB-CB 4.46Å; D137-L140 PolarHBondContact O-N 3.17Å; L140-N142 PolarHBondContact O-N 3.15Å
141	N	41.6	Very low	65.1	Low	135 Å²	135	76.5 Å²	76.5	72%	0.722	42%	0.423	S	S	*	.			trans	-56.7	119	-177.8	-56.3	-30.2	0	0	0	112	A139 C143	A139-N141 VanDerWaalsContact C-N 3.31Å; A139-N141 PolarHBondContact O-N 3.09Å; A139-N141 PolarHBondContact O-OD1 3.43Å; N141-C143 VanDerWaalsContact C-N 3.3Å; N141-C143 PolarHBondContact O-N 2.9Å
142	N	47.6	Very low	65.2	Low	156 Å²	156	76.5 Å²	76.5	83%	0.834	42%	0.423	S	S	*	.	S	Bend	trans	45.1	0.2	146.5	-73.5	-9.5	0	0	0	123.6	L140	L140-N142 PolarHBondContact O-N 3.15Å
143	C	47.5	Very low	65.6	Low	128 Å²	128	71.4 Å²	71.4	87%	0.865	40%	0.401	S	S	*	.	S	Bend	trans	-117	-5	179.7	-80.6	0	0	0	0	116	N141	N141-C143 VanDerWaalsContact C-N 3.3Å; N141-C143 PolarHBondContact O-N 2.9Å
144	S	53.2	Low	66.3	Low	74 Å²	74	71.4 Å²	71.4	52%	0.517	40%	0.401	S	S	.	.			trans	-120.7	80.4	165.7	-113.5	0	0	0	0	109.1	I146	S144-I146 PolarHBondContact O-N 3.13Å
145	Q	55.2	Low	67.4	Low	179 Å²	179	72.2 Å²	72.2	84%	0.836	40%	0.402	S	S	*	.			trans	-63	-21.3	175.8	-70.5	-150.8	-3.6	0	0	112.5	G147	Q145-G147 PolarHBondContact O-N 3.48Å
146	I	62	Low	68.9	Low	74 Å²	74	70 Å²	70	38%	0.379	38%	0.383	S	S	.	.	S	Bend	trans	-91	106.9	179.1	-55.3	156.1	0	0	0	106.8	H73 T77 A78 S144	H73-I146 VanDerWaalsContact CE1-CG2 3.43Å; H73-I146 WeakPolarHBondContact CE1-CG2 3.27Å; H73-I146 PolarHBondContact ND1-O 3.4Å; T77-I146 HydrophobicContact CG2-CG2 3.87Å; A78-I146 HydrophobicContact CB-CD1 3.88Å; A78-I146 HydrophobicContact CB-CG1 4.03Å; A78-I146 HydrophobicContact CB-CG2 4Å; S144-I146 PolarHBondContact O-N 3.13Å
147	G	73.5	Confident	70.4	Confident	20 Å²	20	64.7 Å²	64.7	21%	0.206	36%	0.363	C	S	.	.			trans	-61	-168.7	177.4	0	0	0	0	0	113.1	E50 H73 T77 Q145	E50-G147 WeakPolarHBondContact OE2-CA 3.42Å; H73-G147 PolarHBondContact ND1-O 3.24Å; T77-G147 WeakPolarHBondContact CG2-O 3.42Å; Q145-G147 PolarHBondContact O-N 3.48Å
148	R	80.1	Confident	72	Confident	63 Å²	63	60.9 Å²	60.9	24%	0.238	34%	0.343	C	S	.	.			trans	-91.5	159	176.7	-61.4	175.9	-170.3	167.9	5.2	111.4	E50 Y71 G72	E50-R148 WeakPolarHBondContact CB-O 2.88Å; E50-R148 PolarHBondContact N-O 3.46Å; E50-R148 PolarHBondContact OE2-N 3.45Å; Y71-R148 HydrophobicContact CE2-CB 4.38Å; G72-R148 CarbonylContact O-C 3.58Å; G72-R148 VanDerWaalsContact O-CA 3.32Å; G72-R148 WeakPolarHBondContact O-CA 3.21Å; G72-R148 WeakPolarHBondContact O-CB 3.16Å
149	H	85.1	Confident	73.6	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	150.1	165.5	78.8	-73.6	0	0	0	111.3	Y48 F70 Y71 G72 S74 T77 Q151	Y48-H149 CarbonylContact O-C 3.58Å; Y48-H149 VanDerWaalsContact O-CA 3.28Å; Y48-H149 WeakPolarHBondContact O-CA 3.06Å; Y48-H149 WeakPolarHBondContact O-CB 3.37Å; F70-H149 AromaticContact CD1-CE1 3.53Å; F70-H149 AromaticContact CD1-NE2 3.55Å; F70-H149 AromaticContact CE1-CE1 3.14Å; F70-H149 WeakPolarHBondContact CE1-CE1 3.41Å; F70-H149 AromaticContact CE1-ND1 3.65Å; F70-H149 AromaticContact CE1-NE2 3.68Å; Y71-H149 WeakPolarHBondContact CA-O 3.41Å; G72-H149 PolarHBondContact N-O 2.97Å; G72-H149 VanDerWaalsContact N-O 3.1Å; G72-H149 PolarHBondContact O-N 3.4Å; S74-H149 PolarHBondContact OG-CE1 3.34Å; T77-H149 HydrophobicContact CG2-CB 4.01Å; T77-H149 PolarHBondContact OG1-ND1 3.32Å; H149-Q151 PolarHBondContact NE2-OE1 2.93Å; H149-Q151 VanDerWaalsContact NE2-OE1 3.12Å
150	F	87.7	Confident	75.3	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	113.4	170.5	175.8	-111.1	0	0	0	108.4	S47 Y48 A54 F56 V69 F70 Y71 M108 A119 I131 T133 V152	S47-F150 CarbonylContact C-O 3.55Å; S47-F150 WeakPolarHBondContact CA-O 3.29Å; Y48-F150 AromaticContact CD2-CD1 3.83Å; Y48-F150 HydrophobicContact CD2-CD1 3.83Å; Y48-F150 HydrophobicContact CD2-CE1 4.41Å; Y48-F150 PolarHBondContact N-O 2.94Å; Y48-F150 PolarHBondContact O-N 2.93Å; A54-F150 HydrophobicContact CB-CD1 3.73Å; A54-F150 HydrophobicContact CB-CE1 3.74Å; F56-F150 HydrophobicContact CE2-CE1 4.38Å; F56-F150 AromaticContact CZ-CE1 3.73Å; F56-F150 HydrophobicContact CZ-CE1 3.73Å; F56-F150 HydrophobicContact CZ-CZ 4.08Å; V69-F150 HydrophobicContact CG1-CD2 4.11Å; V69-F150 HydrophobicContact CG1-CE2 3.41Å; V69-F150 VanDerWaalsContact CG1-CE2 3.41Å; V69-F150 HydrophobicContact CG1-CZ 4.17Å; F70-F150 CarbonylContact O-C 3.54Å; F70-F150 WeakPolarHBondContact O-CA 3.25Å; Y71-F150 HydrophobicContact CD2-CB 3.78Å; Y71-F150 HydrophobicContact CD2-CD2 4.19Å; Y71-F150 HydrophobicContact CD2-CG 4.47Å; Y71-F150 HydrophobicContact CE2-CB 4.3Å; M108-F150 HydrophobicContact CE-CD2 3.2Å; M108-F150 HydrophobicContact CE-CE2 3.42Å; M108-F150 VanDerWaalsContact CE-CE2 3.42Å; M108-F150 HydrophobicContact CE-CG 4.08Å; M108-F150 HydrophobicContact CE-CZ 4.48Å; A119-F150 HydrophobicContact CB-CE2 4.5Å; A119-F150 HydrophobicContact CB-CZ 4.32Å; I131-F150 HydrophobicContact CD1-CZ 4.08Å; T133-F150 HydrophobicContact CG2-CB 3.51Å; T133-F150 HydrophobicContact CG2-CD1 4.17Å; T133-F150 HydrophobicContact CG2-CG 4.06Å; F150-V152 HydrophobicContact CD1-CG1 4.33Å; F150-V152 HydrophobicContact CE1-CB 3.94Å; F150-V152 HydrophobicContact CE1-CG1 3.69Å; F150-V152 HydrophobicContact CZ-CB 3.95Å; F150-V152 HydrophobicContact CZ-CG1 4.22Å; F150-V152 HydrophobicContact CZ-CG2 4.44Å
151	Q	90.2	Very high	76.9	Confident	38 Å²	38	60.2 Å²	60.2	18%	0.178	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	138.5	175.1	-179.7	167.3	-4	0	0	109.5	W15 K46 S47 V69 F70 H149	W15-Q151 HydrophobicContact CH2-CB 4.38Å; W15-Q151 HydrophobicContact CH2-CG 3.57Å; W15-Q151 VanDerWaalsContact CH2-NE2 3.25Å; W15-Q151 HydrophobicContact CZ2-CG 4.33Å; W15-Q151 HydrophobicContact CZ3-CG 4.19Å; K46-Q151 WeakPolarHBondContact O-CA 3.49Å; S47-Q151 WeakPolarHBondContact OG-CG 3.31Å; V69-Q151 WeakPolarHBondContact CA-O 3.45Å; F70-Q151 HydrophobicContact CB-CB 4.22Å; F70-Q151 HydrophobicContact CD1-CB 4.42Å; F70-Q151 PolarHBondContact N-O 2.99Å; F70-Q151 PolarHBondContact O-N 2.03Å; H149-Q151 PolarHBondContact NE2-OE1 2.93Å; H149-Q151 VanDerWaalsContact NE2-OE1 3.12Å
152	V	89.9	Confident	79	Confident	1 Å²	1	58 Å²	58	1%	0.006	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	132	-173.2	56	0	0	0	0	110	E45 K46 Y48 F56 I66 E68 V69 F150	E45-V152 WeakPolarHBondContact CA-O 3.33Å; K46-V152 HydrophobicContact CB-CG1 4.37Å; K46-V152 PolarHBondContact N-O 2.94Å; K46-V152 PolarHBondContact O-N 3.35Å; Y48-V152 HydrophobicContact CE2-CG1 4.23Å; F56-V152 HydrophobicContact CE1-CB 4.1Å; F56-V152 HydrophobicContact CE1-CG1 3.39Å; F56-V152 HydrophobicContact CE1-CG2 3.63Å; F56-V152 HydrophobicContact CZ-CB 4.28Å; F56-V152 HydrophobicContact CZ-CG1 3.68Å; F56-V152 HydrophobicContact CZ-CG2 3.98Å; I66-V152 HydrophobicContact CD1-CG2 4.14Å; E68-V152 WeakPolarHBondContact O-CA 3.4Å; V69-V152 HydrophobicContact CG2-CG2 4.07Å; F150-V152 HydrophobicContact CD1-CG1 4.33Å; F150-V152 HydrophobicContact CE1-CB 3.94Å; F150-V152 HydrophobicContact CE1-CG1 3.69Å; F150-V152 HydrophobicContact CZ-CB 3.95Å; F150-V152 HydrophobicContact CZ-CG1 4.22Å; F150-V152 HydrophobicContact CZ-CG2 4.44Å
153	S	91.9	Very high	80.9	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.007	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	130.3	166.9	69	0	0	0	0	108.4	R44 D67 E68	R44-S153 WeakPolarHBondContact O-CA 3.5Å; D67-S153 WeakPolarHBondContact CB-O 3.22Å; D67-S153 PolarHBondContact N-O 2.75Å; E68-S153 WeakPolarHBondContact CA-OG 3.29Å; E68-S153 WeakPolarHBondContact CB-OG 3.47Å; E68-S153 WeakPolarHBondContact CG-OG 3.44Å; E68-S153 PolarHBondContact N-O 3.15Å; E68-S153 PolarHBondContact N-OG 2.8Å; E68-S153 PolarHBondContact O-N 3.12Å; E68-S153 PolarHBondContact O-OG 3.1Å
154	Y	92.2	Very high	82.7	Confident	1 Å²	1	50.4 Å²	50.4	0%	0.004	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	153.1	179.3	78.1	-80.9	0	0	0	111.8	R44 K46 F56 K57 I64 A65	R44-Y154 HydrophobicContact CB-CD1 3.96Å; R44-Y154 HydrophobicContact CB-CE1 3.64Å; R44-Y154 HydrophobicContact CB-CE2 4.42Å; R44-Y154 HydrophobicContact CB-CG 4.48Å; R44-Y154 WeakPolarHBondContact CB-O 3.36Å; R44-Y154 WeakPolarHBondContact CD-OH 3.21Å; R44-Y154 PolarHBondContact N-O 3.15Å; R44-Y154 WeakPolarHBondContact O-CD1 3.39Å; R44-Y154 PolarHBondContact O-N 3.09Å; K46-Y154 HydrophobicContact CD-CE1 4.31Å; F56-Y154 AromaticContact CD1-CD1 3.69Å; F56-Y154 HydrophobicContact CD1-CD1 3.69Å; F56-Y154 HydrophobicContact CD1-CD2 4.44Å; F56-Y154 AromaticContact CD1-CE1 3.7Å; F56-Y154 HydrophobicContact CD1-CE1 3.7Å; F56-Y154 HydrophobicContact CD1-CE2 4.45Å; F56-Y154 HydrophobicContact CD1-CG 4.07Å; F56-Y154 AromaticContact CE1-CD1 3.98Å; F56-Y154 HydrophobicContact CE1-CD1 3.98Å; F56-Y154 HydrophobicContact CE1-CE1 4.28Å; F56-Y154 HydrophobicContact CE1-CG 4.49Å; K57-Y154 PolarHBondContact O-OH 2.75Å; I64-Y154 HydrophobicContact CG1-CD2 4.44Å; I64-Y154 HydrophobicContact CG2-CD2 4.09Å; A65-Y154 CarbonylContact O-C 3.51Å; A65-Y154 VanDerWaalsContact O-CA 3.31Å; A65-Y154 WeakPolarHBondContact O-CA 3.13Å; A65-Y154 WeakPolarHBondContact O-CB 3.47Å
155	R	91.7	Very high	84.2	Confident	21 Å²	21	48.8 Å²	48.8	8%	0.079	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	159	175.4	-69.1	178.3	-112.1	-113.5	0.6	110.2	Y25 L41 L43 A65 D67	Y25-R155 VanDerWaalsContact CE1-CZ 3.49Å; Y25-R155 VanDerWaalsContact CZ-CZ 3.49Å; Y25-R155 PolarHBondContact OH-NH1 3.25Å; L41-R155 HydrophobicContact CB-CB 4.32Å; L41-R155 HydrophobicContact CB-CG 4.4Å; L43-R155 HydrophobicContact CD1-CG 3.81Å; A65-R155 PolarHBondContact N-O 3.22Å; A65-R155 PolarHBondContact O-N 3.32Å; D67-R155 IonicContact OD1-CZ 3.68Å; D67-R155 IonicContact OD1-NE 3.84Å; D67-R155 IonicContact OD1-NH2 2.74Å; D67-R155 PolarHBondContact OD1-NH2 3.22Å; D67-R155 IonicContact OD2-CZ 3.52Å; D67-R155 IonicContact OD2-NH2 2.74Å; D67-R155 PolarHBondContact OD2-NH2 3.4Å
156	C	90.9	Very high	85.7	Confident	15 Å²	15	41.4 Å²	41.4	10%	0.101	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	100.5	171.4	-65.7	0	0	0	0	109	L41 C58 Q63	L41-C156 WeakPolarHBondContact CD2-O 3.17Å; C58-C156 WeakPolarHBondContact CA-SG 3.26Å; C58-C156 HydrophobicContact CB-CB 3.75Å; C58-C156 WeakPolarHBondContact CB-SG 3.44Å; C58-C156 WeakPolarHBondContact SG-CA 3.44Å; C58-C156 WeakPolarHBondContact SG-CB 3.36Å; C58-C156 CovalentContact SG-SG 2.04Å; C58-C156 PolarHBondContact SG-SG 3.12Å; Q63-C156 CarbonylContact O-C 3.51Å; Q63-C156 WeakPolarHBondContact O-CA 3.28Å
157	R	87.9	Confident	86.9	Confident	65 Å²	65	38.4 Å²	38.4	25%	0.245	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	152.1	177.5	69.3	-179.4	-176.8	115	-11.3	110.9	L41 T62 Q63 A65 N125	L41-R157 HydrophobicContact CD1-CB 3.85Å; T62-R157 CarbonylContact C-O 3.58Å; T62-R157 WeakPolarHBondContact CA-O 3.39Å; T62-R157 VanDerWaalsContact CB-O 3.28Å; T62-R157 WeakPolarHBondContact CB-O 3.37Å; Q63-R157 HydrophobicContact CG-CG 3.8Å; Q63-R157 PolarHBondContact N-O 3.3Å; Q63-R157 VanDerWaalsContact NE2-CZ 3.31Å; Q63-R157 VanDerWaalsContact NE2-NH2 3.15Å; Q63-R157 PolarHBondContact O-N 2.67Å; A65-R157 HydrophobicContact CB-CG 4.17Å; N125-R157 PolarHBondContact OD1-NH2 3.06Å
158	P	87.5	Confident	87.5	Confident	7 Å²	7	40.6 Å²	40.6	5%	0.045	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	142.2	172.2	-22.2	33.1	0	0	0	111.5	H61 Q160 F161 H185	H61-P158 WeakPolarHBondContact O-CA 2.96Å; P158-Q160 VanDerWaalsContact C-N 3.29Å; P158-Q160 WeakPolarHBondContact CB-O 3.44Å; P158-F161 HydrophobicContact CB-CB 4.49Å; P158-H185 HydrophobicContact CG-CB 4.21Å; P158-H185 WeakPolarHBondContact CG-CD2 3.49Å; P158-H185 WeakPolarHBondContact CG-CE1 3.45Å; P158-H185 WeakPolarHBondContact CG-ND1 3.01Å; P158-H185 WeakPolarHBondContact CG-NE2 3.28Å
159	S	86.2	Confident	87.6	Confident	53 Å²	53	44.9 Å²	44.9	37%	0.371	23%	0.234	S	C	.	.	S	Bend	trans	-72.6	-28.2	169.3	55.1	0	0	0	0	112.1	H61	H61-S159 PolarHBondContact O-N 3.09Å; H61-S159 PolarHBondContact O-OG 3.01Å
160	Q	86.5	Confident	87.4	Confident	150 Å²	150	50.2 Å²	50.2	70%	0.701	26%	0.259	S	S	*	.	S	Bend	trans	-140	144.8	175.2	-64.4	-179.7	6.9	0	0	108.5	P158 Q216	P158-Q160 VanDerWaalsContact C-N 3.29Å; P158-Q160 WeakPolarHBondContact CB-O 3.44Å; Q160-Q216 PolarHBondContact O-NE2 3.22Å
161	F	87.1	Confident	87.1	Confident	83 Å²	83	58.3 Å²	58.3	36%	0.364	30%	0.302	S	S	.	.			trans	-143.5	150.6	178	58.6	-92.9	0	0	0	109.5	P158 R214 F215	P158-F161 HydrophobicContact CB-CB 4.49Å; F161-R214 HydrophobicContact CB-CB 4.47Å; F161-R214 HydrophobicContact CD2-CB 3.77Å; F161-R214 HydrophobicContact CD2-CG 3.71Å; F161-R214 HydrophobicContact CE2-CB 4.36Å; F161-R214 VanDerWaalsContact CE2-CD 3.41Å; F161-R214 HydrophobicContact CE2-CG 3.81Å; F161-R214 HydrophobicContact CG-CB 4.26Å; F161-F215 CarbonylContact C-O 3.48Å; F161-F215 VanDerWaalsContact CA-O 3.31Å; F161-F215 WeakPolarHBondContact CA-O 3.43Å; F161-F215 WeakPolarHBondContact CB-O 3Å
162	N	86.3	Confident	86.8	Confident	87 Å²	87	59.7 Å²	59.7	47%	0.465	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	140.6	167.8	-63.5	-3.2	0	0	0	107.8	R214 F215	N162-R214 CarbonylContact O-C 3.58Å; N162-R214 VanDerWaalsContact O-CA 3.26Å; N162-R214 WeakPolarHBondContact O-CA 3.5Å; N162-F215 HydrophobicContact CB-CD1 4.48Å; N162-F215 HydrophobicContact CB-CD2 4.17Å; N162-F215 HydrophobicContact CB-CE1 4.08Å; N162-F215 HydrophobicContact CB-CE2 3.75Å; N162-F215 HydrophobicContact CB-CZ 3.71Å; N162-F215 PolarHBondContact N-O 3.05Å; N162-F215 PolarHBondContact O-N 3Å
163	G	86.4	Confident	86.5	Confident	43 Å²	43	63.7 Å²	63.7	44%	0.443	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.7	175.7	0	0	0	0	0	109.5	L213	G163-L213 CarbonylContact C-O 3.52Å; G163-L213 VanDerWaalsContact CA-O 3.26Å; G163-L213 WeakPolarHBondContact CA-O 3.06Å
164	E	85.6	Confident	86.1	Confident	82 Å²	82	65.9 Å²	65.9	38%	0.383	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	140.1	179.6	-161.2	166.7	-163	0	0	110.2	F166 L174 F212 L213 F215	E164-F166 HydrophobicContact CB-CE2 3.8Å; E164-F166 HydrophobicContact CB-CZ 4.16Å; E164-F166 VanDerWaalsContact CD-CZ 3.43Å; E164-F166 HydrophobicContact CG-CE1 4.39Å; E164-F166 HydrophobicContact CG-CE2 3.73Å; E164-F166 HydrophobicContact CG-CZ 3.66Å; E164-F166 WeakPolarHBondContact OE2-CZ 3.46Å; E164-L174 WeakPolarHBondContact OE2-CD2 3.48Å; E164-F212 CarbonylContact O-C 3.57Å; E164-F212 WeakPolarHBondContact O-CA 3.2Å; E164-L213 PolarHBondContact N-O 2.86Å; E164-L213 PolarHBondContact O-N 2.78Å; E164-F215 HydrophobicContact CB-CE1 3.85Å
165	F	84.9	Confident	85.8	Confident	41 Å²	41	70.6 Å²	70.6	18%	0.18	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.5	-178.7	-176	-104.7	0	0	0	109.6	V192 C200 I211 F212	F165-V192 HydrophobicContact CE1-CG2 4.07Å; F165-V192 HydrophobicContact CE2-CG1 4.4Å; F165-V192 HydrophobicContact CE2-CG2 4.12Å; F165-V192 HydrophobicContact CZ-CG2 3.71Å; F165-C200 VanDerWaalsContact CE1-SG 3.54Å; F165-I211 WeakPolarHBondContact CA-O 3.18Å; F165-F212 HydrophobicContact CB-CD2 4.07Å; F165-F212 HydrophobicContact CD2-CB 4.17Å; F165-F212 HydrophobicContact CD2-CD2 4.26Å
166	F	86.2	Confident	85.6	Confident	24 Å²	24	71.7 Å²	71.7	11%	0.105	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	129.5	179.2	-63	-87	0	0	0	109.1	E164 M172 L174 G210 I211 L213	E164-F166 HydrophobicContact CB-CE2 3.8Å; E164-F166 HydrophobicContact CB-CZ 4.16Å; E164-F166 VanDerWaalsContact CD-CZ 3.43Å; E164-F166 HydrophobicContact CG-CE1 4.39Å; E164-F166 HydrophobicContact CG-CE2 3.73Å; E164-F166 HydrophobicContact CG-CZ 3.66Å; E164-F166 WeakPolarHBondContact OE2-CZ 3.46Å; F166-M172 HydrophobicContact CB-CB 4.41Å; F166-M172 HydrophobicContact CB-CE 3.36Å; F166-M172 HydrophobicContact CB-CG 3.57Å; F166-M172 HydrophobicContact CB-SD 3.55Å; F166-M172 VanDerWaalsContact CB-SD 3.55Å; F166-M172 HydrophobicContact CD1-CB 3.87Å; F166-M172 HydrophobicContact CD1-CG 3.93Å; F166-M172 HydrophobicContact CD2-CB 4.41Å; F166-M172 HydrophobicContact CD2-CG 4.3Å; F166-M172 HydrophobicContact CD2-SD 4.02Å; F166-M172 HydrophobicContact CE1-CB 4.23Å; F166-M172 HydrophobicContact CG-CB 3.97Å; F166-M172 HydrophobicContact CG-CE 4.31Å; F166-M172 HydrophobicContact CG-CG 3.67Å; F166-M172 HydrophobicContact CG-SD 3.83Å; F166-L174 HydrophobicContact CE2-CD2 4.25Å; F166-L174 HydrophobicContact CZ-CD2 3.76Å; F166-L174 HydrophobicContact CZ-CG 4.12Å; F166-G210 CarbonylContact O-C 3.57Å; F166-G210 WeakPolarHBondContact O-CA 3.46Å; F166-I211 PolarHBondContact N-O 3.13Å; F166-I211 PolarHBondContact O-N 3.34Å; F166-L213 HydrophobicContact CD2-CD1 3.97Å; F166-L213 HydrophobicContact CD2-CG 4.23Å; F166-L213 HydrophobicContact CE2-CB 4.46Å; F166-L213 HydrophobicContact CE2-CD1 3.69Å; F166-L213 HydrophobicContact CE2-CG 4.21Å
167	C	86.6	Confident	85.6	Confident	11 Å²	11	77.2 Å²	77.2	7%	0.074	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	150.4	-179.6	-51.9	0	0	0	0	111.6	Q170 C200	C167-Q170 HydrophobicContact CB-CB 4.35Å; C167-Q170 HydrophobicContact CB-CG 3.94Å; C167-Q170 PolarHBondContact O-N 3.42Å; C167-Q170 PolarHBondContact SG-OE1 3.25Å; C167-C200 WeakPolarHBondContact CA-SG 3.3Å; C167-C200 HydrophobicContact CB-CB 3.64Å; C167-C200 WeakPolarHBondContact CB-SG 3.31Å; C167-C200 WeakPolarHBondContact SG-CA 3.25Å; C167-C200 WeakPolarHBondContact SG-CB 3.48Å; C167-C200 CovalentContact SG-SG 2.01Å; C167-C200 PolarHBondContact SG-SG 2.92Å
168	D	86.3	Confident	85.7	Confident	66 Å²	66	83.7 Å²	83.7	35%	0.353	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	146.2	169.1	-170.7	32.6	0	0	0	111	Q170 Y189 I209	D168-Q170 PolarHBondContact O-N 2.68Å; D168-Q170 VanDerWaalsContact O-N 3.14Å; D168-Y189 HydrophobicContact CB-CE2 4.15Å; D168-Y189 PolarHBondContact OD1-OH 3.2Å; D168-Y189 PolarHBondContact OD2-OH 3.27Å; D168-I209 HydrophobicContact CB-CB 4.39Å; D168-I209 HydrophobicContact CB-CG2 4.25Å; D168-I209 WeakPolarHBondContact CB-O 3.32Å; D168-I209 PolarHBondContact N-O 3.12Å
169	N	82.3	Confident	85.8	Confident	152 Å²	152	85.1 Å²	85.1	81%	0.813	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	18.5	-177.3	-53.1	-57	0	0	0	116.1
170	Q	82.1	Confident	85.9	Confident	113 Å²	113	84.4 Å²	84.4	53%	0.528	46%	0.46	S	S	.	.	S	Bend	trans	-107.8	147.7	170.5	-68.5	-173.5	-7.8	0	0	111.8	C167 D168 M172	C167-Q170 HydrophobicContact CB-CB 4.35Å; C167-Q170 HydrophobicContact CB-CG 3.94Å; C167-Q170 PolarHBondContact O-N 3.42Å; C167-Q170 PolarHBondContact SG-OE1 3.25Å; D168-Q170 PolarHBondContact O-N 2.68Å; D168-Q170 VanDerWaalsContact O-N 3.14Å; Q170-M172 PolarHBondContact O-N 3.23Å
171	L	80.6	Confident	85.9	Confident	170 Å²	170	85 Å²	85	89%	0.89	46%	0.456	S	S	*	.			trans	-69.4	121.8	174.8	-161.8	91.4	0	0	0	109.8
172	M	83.4	Confident	85.9	Confident	68 Å²	68	83.8 Å²	83.8	34%	0.335	45%	0.453	S	S	.	.			trans	-87.5	116	177.8	-51.1	-169.2	175.7	0	0	109.5	F166 Q170 I211	F166-M172 HydrophobicContact CB-CB 4.41Å; F166-M172 HydrophobicContact CB-CE 3.36Å; F166-M172 HydrophobicContact CB-CG 3.57Å; F166-M172 HydrophobicContact CB-SD 3.55Å; F166-M172 VanDerWaalsContact CB-SD 3.55Å; F166-M172 HydrophobicContact CD1-CB 3.87Å; F166-M172 HydrophobicContact CD1-CG 3.93Å; F166-M172 HydrophobicContact CD2-CB 4.41Å; F166-M172 HydrophobicContact CD2-CG 4.3Å; F166-M172 HydrophobicContact CD2-SD 4.02Å; F166-M172 HydrophobicContact CE1-CB 4.23Å; F166-M172 HydrophobicContact CG-CB 3.97Å; F166-M172 HydrophobicContact CG-CE 4.31Å; F166-M172 HydrophobicContact CG-CG 3.67Å; F166-M172 HydrophobicContact CG-SD 3.83Å; Q170-M172 PolarHBondContact O-N 3.23Å; M172-I211 HydrophobicContact CE-CB 3.54Å; M172-I211 HydrophobicContact CE-CD1 3.5Å; M172-I211 HydrophobicContact CE-CG1 3.5Å; M172-I211 HydrophobicContact SD-CB 3.94Å; M172-I211 HydrophobicContact SD-CD1 3.85Å; M172-I211 HydrophobicContact SD-CG1 4.22Å; M172-I211 HydrophobicContact SD-CG2 4.49Å
173	S	83.6	Confident	85.7	Confident	85 Å²	85	80.9 Å²	80.9	59%	0.594	44%	0.441	S	S	*	.			trans	-115.5	112.3	178.1	178.8	0	0	0	0	110.5
174	L	84.7	Confident	85.6	Confident	46 Å²	46	82.8 Å²	82.8	24%	0.241	44%	0.44	C	S	.	.			trans	-110.9	119.5	169.6	-70.1	175.8	0	0	0	108.7	E164 F166 L182 I184 L213 F215	E164-L174 WeakPolarHBondContact OE2-CD2 3.48Å; F166-L174 HydrophobicContact CE2-CD2 4.25Å; F166-L174 HydrophobicContact CZ-CD2 3.76Å; F166-L174 HydrophobicContact CZ-CG 4.12Å; L174-L182 HydrophobicContact CB-CD1 3.91Å; L174-L182 HydrophobicContact CB-CD2 3.95Å; L174-L182 HydrophobicContact CD1-CD1 4.25Å; L174-L182 HydrophobicContact CD1-CD2 3.64Å; L174-L182 HydrophobicContact CG-CD2 4.45Å; L174-I184 HydrophobicContact CD1-CD1 4.42Å; L174-L213 HydrophobicContact CD1-CD1 3.61Å; L174-L213 HydrophobicContact CG-CD1 4.49Å; L174-F215 HydrophobicContact CD1-CD1 4.33Å; L174-F215 HydrophobicContact CD1-CE1 4.5Å; L174-F215 HydrophobicContact CD2-CD1 4.37Å; L174-F215 HydrophobicContact CD2-CE1 3.75Å; L174-F215 HydrophobicContact CD2-CE2 4.33Å; L174-F215 HydrophobicContact CD2-CZ 3.72Å
175	S	85.2	Confident	85.3	Confident	100 Å²	100	79.5 Å²	79.5	70%	0.699	43%	0.425	S	S	*	.			trans	-118.2	151.2	178.1	60.2	0	0	0	0	111.1
176	C	87.3	Confident	85.1	Confident	44 Å²	44	77.9 Å²	77.9	30%	0.297	42%	0.418	S	S	.	.			trans	-127.4	155.6	173.5	-49.6	0	0	0	0	108.3	Q180 L182	C176-Q180 HydrophobicContact CB-CB 3.84Å; C176-L182 VanDerWaalsContact SG-CB 3.59Å; C176-L182 PolarHBondContact SG-N 2.77Å
177	L	90.2	Very high	85	Confident	132 Å²	132	78.7 Å²	78.7	69%	0.691	43%	0.43	S	S	*	.			trans	-69	162.5	171.8	-64.5	170.3	0	0	0	110.7	G179 Q180	L177-G179 PolarHBondContact O-N 3.24Å; L177-Q180 HydrophobicContact CB-CG 4.47Å; L177-Q180 VanDerWaalsContact N-OE1 3.14Å; L177-Q180 VanDerWaalsContact O-CB 3.31Å; L177-Q180 WeakPolarHBondContact O-CB 3.14Å; L177-Q180 PolarHBondContact O-N 3.22Å
178	Q	91.4	Very high	84.8	Confident	200 Å²	200	79.4 Å²	79.4	94%	0.935	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	138.9	175	-166.5	160.1	1	0	0	110.7	Q180	Q178-Q180 VanDerWaalsContact C-N 3.27Å
179	G	88.7	Confident	84.8	Confident	38 Å²	38	81 Å²	81	39%	0.392	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	6.3	-172.9	0	0	0	0	0	114.4	L177 F219 I220	L177-G179 PolarHBondContact O-N 3.24Å; G179-F219 WeakPolarHBondContact O-CA 3.38Å; G179-I220 WeakPolarHBondContact O-CG1 3.45Å; G179-I220 PolarHBondContact O-N 3.47Å
180	Q	89.4	Confident	84.7	Confident	37 Å²	37	79.7 Å²	79.7	17%	0.173	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	159.6	171.7	-61.7	175.9	-14	0	0	111.7	C176 L177 Q178 I217 R218 F219	C176-Q180 HydrophobicContact CB-CB 3.84Å; L177-Q180 HydrophobicContact CB-CG 4.47Å; L177-Q180 VanDerWaalsContact N-OE1 3.14Å; L177-Q180 VanDerWaalsContact O-CB 3.31Å; L177-Q180 WeakPolarHBondContact O-CB 3.14Å; L177-Q180 PolarHBondContact O-N 3.22Å; Q178-Q180 VanDerWaalsContact C-N 3.27Å; Q180-I217 HydrophobicContact CB-CG2 3.85Å; Q180-I217 HydrophobicContact CG-CG2 4.1Å; Q180-I217 VanDerWaalsContact OE1-CG2 3.31Å; Q180-R218 CarbonylContact C-O 3.48Å; Q180-R218 WeakPolarHBondContact CA-O 3.4Å; Q180-F219 HydrophobicContact CG-CD1 3.76Å; Q180-F219 HydrophobicContact CG-CE1 3.76Å; Q180-F219 HydrophobicContact CG-CG 4.35Å; Q180-F219 HydrophobicContact CG-CZ 4.33Å; Q180-F219 VanDerWaalsContact NE2-CE1 3.33Å
181	R	86.6	Confident	84.7	Confident	163 Å²	163	76.6 Å²	76.6	62%	0.615	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.2	137.2	174.8	-80.2	175.6	-177.8	173.3	0.6	110.4	R218 I220	R181-R218 PolarHBondContact N-O 3.37Å; R181-R218 PolarHBondContact O-N 3.01Å; R181-I220 HydrophobicContact CB-CG1 4.41Å; R181-I220 HydrophobicContact CG-CD1 3.73Å; R181-I220 HydrophobicContact CG-CG1 3.6Å
182	L	86	Confident	84.5	Confident	57 Å²	57	69.5 Å²	69.5	30%	0.298	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	129.2	168.4	-160.4	95	0	0	0	109.6	L174 C176 I184 F215 I217	L174-L182 HydrophobicContact CB-CD1 3.91Å; L174-L182 HydrophobicContact CB-CD2 3.95Å; L174-L182 HydrophobicContact CD1-CD1 4.25Å; L174-L182 HydrophobicContact CD1-CD2 3.64Å; L174-L182 HydrophobicContact CG-CD2 4.45Å; C176-L182 VanDerWaalsContact SG-CB 3.59Å; C176-L182 PolarHBondContact SG-N 2.77Å; L182-I184 HydrophobicContact CD2-CD1 3.85Å; L182-I184 HydrophobicContact CD2-CG1 3.54Å; L182-I184 HydrophobicContact CG-CG1 4.43Å; L182-F215 HydrophobicContact CD1-CD2 3.72Å; L182-F215 HydrophobicContact CD1-CE2 4.09Å; L182-F215 HydrophobicContact CD1-CG 4.37Å; L182-F215 HydrophobicContact CG-CD2 4.43Å; L182-I217 HydrophobicContact CD1-CG1 4.49Å
183	A	83	Confident	83.9	Confident	27 Å²	27	69.9 Å²	69.9	22%	0.223	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	107.2	168.9	0	0	0	0	0	109.6	H185 F215 Q216	A183-H185 PolarHBondContact O-CD2 2.86Å; A183-H185 PolarHBondContact O-NE2 3.32Å; A183-F215 CarbonylContact O-C 3.42Å; A183-F215 WeakPolarHBondContact O-CA 3.24Å; A183-F215 WeakPolarHBondContact O-CB 3.27Å; A183-Q216 PolarHBondContact N-O 2.94Å; A183-Q216 PolarHBondContact O-N 3.06Å
184	I	83.6	Confident	82.9	Confident	82 Å²	82	68.1 Å²	68.1	42%	0.421	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	125.1	175.7	-56.9	178	0	0	0	108.9	L174 L182 L213 F215	L174-I184 HydrophobicContact CD1-CD1 4.42Å; L182-I184 HydrophobicContact CD2-CD1 3.85Å; L182-I184 HydrophobicContact CD2-CG1 3.54Å; L182-I184 HydrophobicContact CG-CG1 4.43Å; I184-L213 HydrophobicContact CG2-CD2 4.42Å; I184-F215 HydrophobicContact CG1-CB 4.38Å
185	H	78.7	Confident	81.9	Confident	14 Å²	14	76 Å²	76	7%	0.065	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	-32	-175.9	-66.5	-64.5	0	0	0	113.2	S40 L41 P158 A183 R214 Q216	S40-H185 PolarHBondContact OG-O 2.98Å; L41-H185 WeakPolarHBondContact CD2-ND1 3.39Å; P158-H185 HydrophobicContact CG-CB 4.21Å; P158-H185 WeakPolarHBondContact CG-CD2 3.49Å; P158-H185 WeakPolarHBondContact CG-CE1 3.45Å; P158-H185 WeakPolarHBondContact CG-ND1 3.01Å; P158-H185 WeakPolarHBondContact CG-NE2 3.28Å; A183-H185 PolarHBondContact O-CD2 2.86Å; A183-H185 PolarHBondContact O-NE2 3.32Å; H185-R214 PolarHBondContact N-O 3.26Å; H185-Q216 WeakPolarHBondContact NE2-CB 3.49Å
186	S	81.5	Confident	80.6	Confident	6 Å²	6	72.9 Å²	72.9	4%	0.042	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	145.7	177.2	72.9	0	0	0	0	110.5	G37 F188 R214	G37-S186 WeakPolarHBondContact O-CB 3.19Å; S186-F188 VanDerWaalsContact OG-CE2 3.32Å; S186-F188 WeakPolarHBondContact OG-CE2 3.37Å; S186-R214 PolarHBondContact N-O 3.27Å; S186-R214 PolarHBondContact O-N 2.76Å; S186-R214 WeakPolarHBondContact OG-CB 3.21Å; S186-R214 WeakPolarHBondContact OG-CD 3.49Å; S186-R214 WeakPolarHBondContact OG-CG 3.46Å
187	A	83.2	Confident	79.3	Confident	42 Å²	42	76.9 Å²	76.9	35%	0.347	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	134.2	171.7	0	0	0	0	0	108.9	I211 F212 L213	A187-I211 HydrophobicContact CB-CG2 4.25Å; A187-F212 WeakPolarHBondContact CA-O 3.41Å; A187-L213 HydrophobicContact CB-CD2 3.4Å
188	F	83.4	Confident	77.9	Confident	25 Å²	25	70.9 Å²	70.9	11%	0.11	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	115.7	179.4	-55.6	-83.4	0	0	0	109.9	L24 A35 S186 R190 I211 F212	L24-F188 HydrophobicContact CD2-CE1 3.98Å; L24-F188 HydrophobicContact CD2-CZ 3.8Å; A35-F188 HydrophobicContact CB-CD1 4.43Å; A35-F188 HydrophobicContact CB-CE1 4Å; S186-F188 VanDerWaalsContact OG-CE2 3.32Å; S186-F188 WeakPolarHBondContact OG-CE2 3.37Å; F188-R190 PolarHBondContact O-N 3.45Å; F188-I211 CarbonylContact O-C 3.58Å; F188-I211 WeakPolarHBondContact O-CA 3.44Å; F188-F212 PolarHBondContact N-O 3.02Å; F188-F212 PolarHBondContact O-N 3.2Å
189	Y	86.5	Confident	76.9	Confident	101 Å²	101	69.1 Å²	69.1	40%	0.396	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	120.9	165.1	-169.7	-107.9	0	0	0	108.5	D168 I209 G210 I211	D168-Y189 HydrophobicContact CB-CE2 4.15Å; D168-Y189 PolarHBondContact OD1-OH 3.2Å; D168-Y189 PolarHBondContact OD2-OH 3.27Å; Y189-I209 HydrophobicContact CE1-CG2 3.61Å; Y189-I209 HydrophobicContact CE2-CG2 3.89Å; Y189-I209 WeakPolarHBondContact OH-CG2 3.46Å; Y189-G210 CarbonylContact C-O 3.37Å; Y189-G210 WeakPolarHBondContact CA-O 3.32Å; Y189-I211 HydrophobicContact CD2-CG1 3.62Å; Y189-I211 HydrophobicContact CE2-CG1 4.46Å; Y189-I211 HydrophobicContact CG-CG1 4.49Å
190	R	80.1	Confident	76.4	Confident	123 Å²	123	68 Å²	68	46%	0.464	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	161.7	-179.5	69.8	170.5	-66.5	178.2	0.8	112.4	F188 V192 G210	F188-R190 PolarHBondContact O-N 3.45Å; R190-V192 HydrophobicContact CG-CG1 3.87Å; R190-G210 PolarHBondContact N-O 3.28Å; R190-G210 PolarHBondContact O-N 3.16Å; R190-G210 VanDerWaalsContact O-N 3.09Å
191	S	81.5	Confident	75.7	Confident	49 Å²	49	75 Å²	75	34%	0.343	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	134	162.8	-175	0	0	0	0	110	L207 Y208	S191-L207 WeakPolarHBondContact OG-CB 3.34Å; S191-L207 WeakPolarHBondContact OG-CD1 3.05Å; S191-Y208 CarbonylContact C-O 3.42Å; S191-Y208 VanDerWaalsContact CA-O 3.28Å; S191-Y208 WeakPolarHBondContact CA-O 3.14Å
192	V	75.9	Confident	75	Confident	21 Å²	21	72.7 Å²	72.7	13%	0.127	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	144.7	176.3	-66	0	0	0	0	111.5	F165 R190 Y208	F165-V192 HydrophobicContact CE1-CG2 4.07Å; F165-V192 HydrophobicContact CE2-CG1 4.4Å; F165-V192 HydrophobicContact CE2-CG2 4.12Å; F165-V192 HydrophobicContact CZ-CG2 3.71Å; R190-V192 HydrophobicContact CG-CG1 3.87Å; V192-Y208 HydrophobicContact CG2-CD2 4.42Å; V192-Y208 PolarHBondContact N-O 3.47Å; V192-Y208 PolarHBondContact O-N 3.4Å
193	P	71.1	Confident	74.4	Confident	75 Å²	75	71.6 Å²	71.6	49%	0.487	39%	0.386	S	S	.	.			trans	-58	155.9	174.7	-22.5	32.8	0	0	0	112.7	K195 G196	P193-K195 PolarHBondContact O-N 3.18Å; P193-G196 PolarHBondContact O-N 3.26Å
194	P	63.2	Low	73.9	Confident	48 Å²	48	77.2 Å²	77.2	31%	0.312	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-10.1	-174.7	24.9	-30.2	0	0	0	114.1	K202 E206 Y208	P194-K202 HydrophobicContact CB-CD 4.42Å; P194-E206 WeakPolarHBondContact CB-O 3.25Å; P194-E206 WeakPolarHBondContact CD-O 3.4Å; P194-E206 VanDerWaalsContact CG-O 3.27Å; P194-E206 WeakPolarHBondContact CG-O 3.11Å; P194-Y208 VanDerWaalsContact CA-CE2 3.42Å; P194-Y208 HydrophobicContact CB-CE2 4.07Å
195	K	63	Low	73.5	Confident	212 Å²	212	77.2 Å²	77.2	92%	0.922	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-1	171.4	-63.3	-175.2	178.9	-179.6	0	113.3	P193	P193-K195 PolarHBondContact O-N 3.18Å
196	G	58.9	Low	73.4	Confident	35 Å²	35	82.6 Å²	82.6	36%	0.361	45%	0.453	S	S	.	.	S	Bend	trans	-73.4	161.8	173.1	0	0	0	0	0	112.5	P193 G198	P193-G196 PolarHBondContact O-N 3.26Å; G196-G198 PolarHBondContact O-N 2.62Å
197	S	60.3	Low	73.1	Confident	127 Å²	127	84.9 Å²	84.9	89%	0.888	46%	0.464	S	S	*	.	S	Bend	trans	-68.5	14	-178.8	-176.7	0	0	0	0	115.3
198	G	60.9	Low	72.8	Confident	6 Å²	6	84 Å²	84	6%	0.062	45%	0.452	C	S	.	.			trans	-93.7	123.2	-173.3	0	0	0	0	0	112.6	G196 C200 Y208	G196-G198 PolarHBondContact O-N 2.62Å; G198-C200 PolarHBondContact O-N 2.75Å; G198-C200 VanDerWaalsContact O-N 3.15Å; G198-Y208 VanDerWaalsContact O-CE2 3.3Å; G198-Y208 WeakPolarHBondContact O-CE2 3.43Å
199	N	69.8	Low	72.8	Confident	163 Å²	163	85.5 Å²	85.5	87%	0.872	46%	0.461	S	S	*	.			trans	-83.5	33.5	172.8	-72	-15.9	0	0	0	112.7
200	C	77.3	Confident	72.8	Confident	14 Å²	14	80.7 Å²	80.7	10%	0.095	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-78.7	167.5	-173.8	-49.1	0	0	0	0	111.7	F165 C167 G198 Y208	F165-C200 VanDerWaalsContact CE1-SG 3.54Å; C167-C200 WeakPolarHBondContact CA-SG 3.3Å; C167-C200 HydrophobicContact CB-CB 3.64Å; C167-C200 WeakPolarHBondContact CB-SG 3.31Å; C167-C200 WeakPolarHBondContact SG-CA 3.25Å; C167-C200 WeakPolarHBondContact SG-CB 3.48Å; C167-C200 CovalentContact SG-SG 2.01Å; C167-C200 PolarHBondContact SG-SG 2.92Å; G198-C200 PolarHBondContact O-N 2.75Å; G198-C200 VanDerWaalsContact O-N 3.15Å; C200-Y208 HydrophobicContact CB-CD1 3.53Å; C200-Y208 HydrophobicContact CB-CE1 4.18Å; C200-Y208 HydrophobicContact CB-CG 4.11Å; C200-Y208 WeakPolarHBondContact O-CE1 3.42Å
201	Q	75.5	Confident	73.1	Confident	185 Å²	185	77.2 Å²	77.2	86%	0.864	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-68.9	134.2	161.3	-88.6	-177.5	-40.8	0	0	109.2
202	K	71.9	Confident	73.2	Confident	115 Å²	115	77.9 Å²	77.9	50%	0.5	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-74.5	140.4	175.8	-64.9	-178.9	-176.3	178.3	0	109.4	P194 L207 Y208	P194-K202 HydrophobicContact CB-CD 4.42Å; K202-L207 WeakPolarHBondContact CA-O 3.44Å; K202-Y208 HydrophobicContact CB-CE1 4.29Å; K202-Y208 HydrophobicContact CD-CE1 4.35Å; K202-Y208 WeakPolarHBondContact CE-OH 3.32Å; K202-Y208 HydrophobicContact CG-CD1 3.98Å; K202-Y208 HydrophobicContact CG-CE1 3.28Å
203	T	73.2	Confident	73.7	Confident	33 Å²	33	77.6 Å²	77.6	20%	0.202	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-68	166.9	166.7	60.6	0	0	0	0	110.6	S205 E206 L207 I209	T203-S205 PolarHBondContact O-N 3.12Å; T203-S205 PolarHBondContact OG1-OG 2.98Å; T203-E206 WeakPolarHBondContact O-CA 2.94Å; T203-E206 PolarHBondContact O-N 3Å; T203-L207 PolarHBondContact N-O 3.11Å; T203-L207 PolarHBondContact OG1-N 2.89Å; T203-L207 VanDerWaalsContact OG1-N 3.1Å; T203-L207 PolarHBondContact OG1-O 3.21Å; T203-I209 HydrophobicContact CG2-CD1 3.57Å; T203-I209 HydrophobicContact CG2-CG1 3.79Å
204	P	72.5	Confident	74.4	Confident	146 Å²	146	78.1 Å²	78.1	95%	0.948	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-23.2	171.9	-26	34.9	0	0	0	114	E206	P204-E206 VanDerWaalsContact C-N 3.29Å
205	S	76	Confident	75.5	Confident	81 Å²	81	76.4 Å²	76.4	57%	0.566	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	15.9	174.6	47.5	0	0	0	0	114.3	T203 L207	T203-S205 PolarHBondContact O-N 3.12Å; T203-S205 PolarHBondContact OG1-OG 2.98Å; S205-L207 PolarHBondContact O-N 3.28Å
206	E	75.9	Confident	76.5	Confident	128 Å²	128	67.3 Å²	67.3	60%	0.598	37%	0.367	S	S	*	.	S	Bend	trans	57.5	24.8	-177.7	-56.9	-163.7	147.4	0	0	115.5	P194 T203 P204	P194-E206 WeakPolarHBondContact CB-O 3.25Å; P194-E206 WeakPolarHBondContact CD-O 3.4Å; P194-E206 VanDerWaalsContact CG-O 3.27Å; P194-E206 WeakPolarHBondContact CG-O 3.11Å; T203-E206 WeakPolarHBondContact O-CA 2.94Å; T203-E206 PolarHBondContact O-N 3Å; P204-E206 VanDerWaalsContact C-N 3.29Å
207	L	74.9	Confident	77.6	Confident	53 Å²	53	68.6 Å²	68.6	28%	0.277	37%	0.365	S	S	.	.			trans	-105	154.5	-179.8	-69.9	156.4	0	0	0	111.4	S191 K202 T203 S205	S191-L207 WeakPolarHBondContact OG-CB 3.34Å; S191-L207 WeakPolarHBondContact OG-CD1 3.05Å; K202-L207 WeakPolarHBondContact CA-O 3.44Å; T203-L207 PolarHBondContact N-O 3.11Å; T203-L207 PolarHBondContact OG1-N 2.89Å; T203-L207 VanDerWaalsContact OG1-N 3.1Å; T203-L207 PolarHBondContact OG1-O 3.21Å; S205-L207 PolarHBondContact O-N 3.28Å
208	Y	77.4	Confident	78.5	Confident	24 Å²	24	66 Å²	66	9%	0.094	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	131.3	166.6	-59	-58.4	0	0	0	109.7	S191 V192 P194 G198 C200 K202	S191-Y208 CarbonylContact C-O 3.42Å; S191-Y208 VanDerWaalsContact CA-O 3.28Å; S191-Y208 WeakPolarHBondContact CA-O 3.14Å; V192-Y208 HydrophobicContact CG2-CD2 4.42Å; V192-Y208 PolarHBondContact N-O 3.47Å; V192-Y208 PolarHBondContact O-N 3.4Å; P194-Y208 VanDerWaalsContact CA-CE2 3.42Å; P194-Y208 HydrophobicContact CB-CE2 4.07Å; G198-Y208 VanDerWaalsContact O-CE2 3.3Å; G198-Y208 WeakPolarHBondContact O-CE2 3.43Å; C200-Y208 HydrophobicContact CB-CD1 3.53Å; C200-Y208 HydrophobicContact CB-CE1 4.18Å; C200-Y208 HydrophobicContact CB-CG 4.11Å; C200-Y208 WeakPolarHBondContact O-CE1 3.42Å; K202-Y208 HydrophobicContact CB-CE1 4.29Å; K202-Y208 HydrophobicContact CD-CE1 4.35Å; K202-Y208 WeakPolarHBondContact CE-OH 3.32Å; K202-Y208 HydrophobicContact CG-CD1 3.98Å; K202-Y208 HydrophobicContact CG-CE1 3.28Å
209	I	84.1	Confident	79.3	Confident	57 Å²	57	73.6 Å²	73.6	29%	0.292	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	136.1	174.9	-56.4	179.7	0	0	0	108.4	D168 Y189 T203	D168-I209 HydrophobicContact CB-CB 4.39Å; D168-I209 HydrophobicContact CB-CG2 4.25Å; D168-I209 WeakPolarHBondContact CB-O 3.32Å; D168-I209 PolarHBondContact N-O 3.12Å; Y189-I209 HydrophobicContact CE1-CG2 3.61Å; Y189-I209 HydrophobicContact CE2-CG2 3.89Å; Y189-I209 WeakPolarHBondContact OH-CG2 3.46Å; T203-I209 HydrophobicContact CG2-CD1 3.57Å; T203-I209 HydrophobicContact CG2-CG1 3.79Å
210	G	84.8	Confident	79.5	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.6	178.4	-179.9	0	0	0	0	0	114.2	F166 Y189 R190	F166-G210 CarbonylContact O-C 3.57Å; F166-G210 WeakPolarHBondContact O-CA 3.46Å; Y189-G210 CarbonylContact C-O 3.37Å; Y189-G210 WeakPolarHBondContact CA-O 3.32Å; R190-G210 PolarHBondContact N-O 3.28Å; R190-G210 PolarHBondContact O-N 3.16Å; R190-G210 VanDerWaalsContact O-N 3.09Å
211	I	86.3	Confident	79.6	Confident	49 Å²	49	75.7 Å²	75.7	25%	0.251	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	127.2	175	-56.8	-178.7	0	0	0	109.6	F165 F166 M172 A187 F188 Y189 L213	F165-I211 WeakPolarHBondContact CA-O 3.18Å; F166-I211 PolarHBondContact N-O 3.13Å; F166-I211 PolarHBondContact O-N 3.34Å; M172-I211 HydrophobicContact CE-CB 3.54Å; M172-I211 HydrophobicContact CE-CD1 3.5Å; M172-I211 HydrophobicContact CE-CG1 3.5Å; M172-I211 HydrophobicContact SD-CB 3.94Å; M172-I211 HydrophobicContact SD-CD1 3.85Å; M172-I211 HydrophobicContact SD-CG1 4.22Å; M172-I211 HydrophobicContact SD-CG2 4.49Å; A187-I211 HydrophobicContact CB-CG2 4.25Å; F188-I211 CarbonylContact O-C 3.58Å; F188-I211 WeakPolarHBondContact O-CA 3.44Å; Y189-I211 HydrophobicContact CD2-CG1 3.62Å; Y189-I211 HydrophobicContact CE2-CG1 4.46Å; Y189-I211 HydrophobicContact CG-CG1 4.49Å; I211-L213 HydrophobicContact CG2-CD2 3.63Å; I211-L213 HydrophobicContact CG2-CG 4Å
212	F	85.3	Confident	79.8	Confident	64 Å²	64	69.9 Å²	69.9	28%	0.281	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	115.3	165.5	-167.9	-92.7	0	0	0	110	E164 F165 A187 F188 R214	E164-F212 CarbonylContact O-C 3.57Å; E164-F212 WeakPolarHBondContact O-CA 3.2Å; F165-F212 HydrophobicContact CB-CD2 4.07Å; F165-F212 HydrophobicContact CD2-CB 4.17Å; F165-F212 HydrophobicContact CD2-CD2 4.26Å; A187-F212 WeakPolarHBondContact CA-O 3.41Å; F188-F212 PolarHBondContact N-O 3.02Å; F188-F212 PolarHBondContact O-N 3.2Å; F212-R214 HydrophobicContact CD1-CG 4.16Å; F212-R214 HydrophobicContact CE1-CG 3.67Å
213	L	85.8	Confident	80.2	Confident	15 Å²	15	67.4 Å²	67.4	8%	0.079	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	136.2	176	-63.7	-178.2	0	0	0	110.1	G163 E164 F166 L174 I184 A187 I211 F215	G163-L213 CarbonylContact C-O 3.52Å; G163-L213 VanDerWaalsContact CA-O 3.26Å; G163-L213 WeakPolarHBondContact CA-O 3.06Å; E164-L213 PolarHBondContact N-O 2.86Å; E164-L213 PolarHBondContact O-N 2.78Å; F166-L213 HydrophobicContact CD2-CD1 3.97Å; F166-L213 HydrophobicContact CD2-CG 4.23Å; F166-L213 HydrophobicContact CE2-CB 4.46Å; F166-L213 HydrophobicContact CE2-CD1 3.69Å; F166-L213 HydrophobicContact CE2-CG 4.21Å; L174-L213 HydrophobicContact CD1-CD1 3.61Å; L174-L213 HydrophobicContact CG-CD1 4.49Å; I184-L213 HydrophobicContact CG2-CD2 4.42Å; A187-L213 HydrophobicContact CB-CD2 3.4Å; I211-L213 HydrophobicContact CG2-CD2 3.63Å; I211-L213 HydrophobicContact CG2-CG 4Å; L213-F215 HydrophobicContact CB-CD1 4.29Å
214	R	85.6	Confident	80.6	Confident	86 Å²	86	69.5 Å²	69.5	33%	0.325	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.3	159.9	-58	178.3	172.3	-174.8	-1.9	109.1	F161 N162 H185 S186 F212	F161-R214 HydrophobicContact CB-CB 4.47Å; F161-R214 HydrophobicContact CD2-CB 3.77Å; F161-R214 HydrophobicContact CD2-CG 3.71Å; F161-R214 HydrophobicContact CE2-CB 4.36Å; F161-R214 VanDerWaalsContact CE2-CD 3.41Å; F161-R214 HydrophobicContact CE2-CG 3.81Å; F161-R214 HydrophobicContact CG-CB 4.26Å; N162-R214 CarbonylContact O-C 3.58Å; N162-R214 VanDerWaalsContact O-CA 3.26Å; N162-R214 WeakPolarHBondContact O-CA 3.5Å; H185-R214 PolarHBondContact N-O 3.26Å; S186-R214 PolarHBondContact N-O 3.27Å; S186-R214 PolarHBondContact O-N 2.76Å; S186-R214 WeakPolarHBondContact OG-CB 3.21Å; S186-R214 WeakPolarHBondContact OG-CD 3.49Å; S186-R214 WeakPolarHBondContact OG-CG 3.46Å; F212-R214 HydrophobicContact CD1-CG 4.16Å; F212-R214 HydrophobicContact CE1-CG 3.67Å
215	F	85.3	Confident	81.2	Confident	12 Å²	12	64.7 Å²	64.7	5%	0.053	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	169.2	-176.1	62.6	-87.4	0	0	0	111.4	F161 N162 E164 L174 L182 A183 I184 L213 I217	F161-F215 CarbonylContact C-O 3.48Å; F161-F215 VanDerWaalsContact CA-O 3.31Å; F161-F215 WeakPolarHBondContact CA-O 3.43Å; F161-F215 WeakPolarHBondContact CB-O 3Å; N162-F215 HydrophobicContact CB-CD1 4.48Å; N162-F215 HydrophobicContact CB-CD2 4.17Å; N162-F215 HydrophobicContact CB-CE1 4.08Å; N162-F215 HydrophobicContact CB-CE2 3.75Å; N162-F215 HydrophobicContact CB-CZ 3.71Å; N162-F215 PolarHBondContact N-O 3.05Å; N162-F215 PolarHBondContact O-N 3Å; E164-F215 HydrophobicContact CB-CE1 3.85Å; L174-F215 HydrophobicContact CD1-CD1 4.33Å; L174-F215 HydrophobicContact CD1-CE1 4.5Å; L174-F215 HydrophobicContact CD2-CD1 4.37Å; L174-F215 HydrophobicContact CD2-CE1 3.75Å; L174-F215 HydrophobicContact CD2-CE2 4.33Å; L174-F215 HydrophobicContact CD2-CZ 3.72Å; L182-F215 HydrophobicContact CD1-CD2 3.72Å; L182-F215 HydrophobicContact CD1-CE2 4.09Å; L182-F215 HydrophobicContact CD1-CG 4.37Å; L182-F215 HydrophobicContact CG-CD2 4.43Å; A183-F215 CarbonylContact O-C 3.42Å; A183-F215 WeakPolarHBondContact O-CA 3.24Å; A183-F215 WeakPolarHBondContact O-CB 3.27Å; I184-F215 HydrophobicContact CG1-CB 4.38Å; L213-F215 HydrophobicContact CB-CD1 4.29Å; F215-I217 HydrophobicContact CD2-CG1 4.39Å; F215-I217 HydrophobicContact CE2-CD1 4.43Å; F215-I217 HydrophobicContact CE2-CG1 4.27Å
216	Q	84.4	Confident	81.5	Confident	20 Å²	20	63.6 Å²	63.6	9%	0.093	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	133.3	174.1	-160.4	-176.7	18.6	0	0	108.9	Q160 A183 H185	Q160-Q216 PolarHBondContact O-NE2 3.22Å; A183-Q216 PolarHBondContact N-O 2.94Å; A183-Q216 PolarHBondContact O-N 3.06Å; H185-Q216 WeakPolarHBondContact NE2-CB 3.49Å
217	I	82.6	Confident	81.9	Confident	62 Å²	62	59 Å²	59	32%	0.318	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	128.8	170.8	-61.1	172.1	0	0	0	107.6	Q180 L182 F215	Q180-I217 HydrophobicContact CB-CG2 3.85Å; Q180-I217 HydrophobicContact CG-CG2 4.1Å; Q180-I217 VanDerWaalsContact OE1-CG2 3.31Å; L182-I217 HydrophobicContact CD1-CG1 4.49Å; F215-I217 HydrophobicContact CD2-CG1 4.39Å; F215-I217 HydrophobicContact CE2-CD1 4.43Å; F215-I217 HydrophobicContact CE2-CG1 4.27Å
218	R	78.9	Confident	82.4	Confident	73 Å²	73	59.5 Å²	59.5	28%	0.275	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	141.7	179.9	-62.8	-173.5	178.9	-175.4	1.8	110.1	Q180 R181	Q180-R218 CarbonylContact C-O 3.48Å; Q180-R218 WeakPolarHBondContact CA-O 3.4Å; R181-R218 PolarHBondContact N-O 3.37Å; R181-R218 PolarHBondContact O-N 3.01Å
219	F	78.8	Confident	82.9	Confident	166 Å²	166	62.4 Å²	62.4	73%	0.728	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	144.8	167.8	-69.7	-86.4	0	0	0	110.2	G179 Q180	G179-F219 WeakPolarHBondContact O-CA 3.38Å; Q180-F219 HydrophobicContact CG-CD1 3.76Å; Q180-F219 HydrophobicContact CG-CE1 3.76Å; Q180-F219 HydrophobicContact CG-CG 4.35Å; Q180-F219 HydrophobicContact CG-CZ 4.33Å; Q180-F219 VanDerWaalsContact NE2-CE1 3.33Å
220	I	72.6	Confident	82.8	Confident	145 Å²	145	62.9 Å²	62.9	74%	0.744	29%	0.286	S	S	*	.			trans	-78.8	0	176.6	-58.5	175.5	0	0	0	109.8	G179 R181	G179-I220 WeakPolarHBondContact O-CG1 3.45Å; G179-I220 PolarHBondContact O-N 3.47Å; R181-I220 HydrophobicContact CB-CG1 4.41Å; R181-I220 HydrophobicContact CG-CD1 3.73Å; R181-I220 HydrophobicContact CG-CG1 3.6Å

Retrieved 220 of 220 residues in 453 ms (Link to these results)

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