A0A5K4F711_SCHMA Loading...

Chymotrypsin AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F711, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 264 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.3	Very low	37.8	Very low	236 Å²	236	170.5 Å²	170.5	100%	1.163	84%	0.836	S	S	*	*				0	117.9	0	-71.3	161.5	71.6	0	0	107.7	N3	M1-N3 PolarHBondContact O-N 3.26Å
2	S	39.4	Very low	37.6	Very low	119 Å²	119	164.6 Å²	164.6	83%	0.832	82%	0.817	S	S	*	*			trans	-70.2	103.3	-168.5	-179.3	0	0	0	0	111.3	R4	S2-R4 PolarHBondContact O-N 2.98Å
3	N	38.1	Very low	37.3	Very low	145 Å²	145	164.2 Å²	164.2	78%	0.775	82%	0.818	S	S	*	*			trans	-87.5	108	175.3	-101.9	0.4	0	0	0	109.8	M1 W5	M1-N3 PolarHBondContact O-N 3.26Å; N3-W5 PolarHBondContact O-N 2.79Å
4	R	41.4	Very low	37.1	Very low	234 Å²	234	164.4 Å²	164.4	88%	0.883	81%	0.812	S	S	*	*			trans	-64.1	112.1	175.6	-71.1	176.9	164.3	-153.6	-4.1	110.1	S2 R6	S2-R4 PolarHBondContact O-N 2.98Å; R4-R6 PolarHBondContact O-N 2.85Å
5	W	39.7	Very low	36.9	Very low	227 Å²	227	162.3 Å²	162.3	86%	0.86	81%	0.812	S	S	*	*			trans	-71.3	112.3	169.1	-74.8	76.9	0	0	0	109.3	N3 F7	N3-W5 PolarHBondContact O-N 2.79Å; W5-F7 PolarHBondContact O-N 3.06Å
6	R	38.9	Very low	36.6	Very low	239 Å²	239	164.5 Å²	164.5	90%	0.902	81%	0.81	S	S	*	*			trans	-72.4	109.1	171.8	-82.4	175.9	154.5	170.8	-6.6	108.6	R4 V8	R4-R6 PolarHBondContact O-N 2.85Å; R6-V8 PolarHBondContact O-N 3.47Å
7	F	37	Very low	36.5	Very low	191 Å²	191	161.2 Å²	161.2	84%	0.838	81%	0.805	S	S	*	*			trans	-66.6	110.6	167	-77.2	-93	0	0	0	109.1	W5 V9	W5-F7 PolarHBondContact O-N 3.06Å; F7-V9 PolarHBondContact O-N 2.8Å
8	V	37.6	Very low	36.4	Very low	131 Å²	131	159.9 Å²	159.9	79%	0.794	80%	0.801	S	S	*	*			trans	-76.7	104.8	169.4	176.2	0	0	0	0	107.1	R6 V10	R6-V8 PolarHBondContact O-N 3.47Å; V8-V10 PolarHBondContact O-N 3.3Å
9	V	35.2	Very low	36.3	Very low	120 Å²	120	157.4 Å²	157.4	73%	0.727	79%	0.794	S	S	*	*			trans	-72.1	107.3	173.7	175.9	0	0	0	0	107.9	F7 V11	F7-V9 PolarHBondContact O-N 2.8Å; V9-V11 HydrophobicContact CG1-CG2 4.24Å; V9-V11 PolarHBondContact O-N 2.88Å; V9-V11 VanDerWaalsContact O-N 3.12Å
10	V	35.1	Very low	36.3	Very low	116 Å²	116	158.7 Å²	158.7	70%	0.703	80%	0.795	S	S	*	*			trans	-70.5	100.4	170.9	178.9	0	0	0	0	107.6	V8 T12	V8-V10 PolarHBondContact O-N 3.3Å; V10-T12 VanDerWaalsContact C-N 3.32Å; V10-T12 HydrophobicContact CG1-CG2 4.22Å; V10-T12 PolarHBondContact O-N 3.31Å
11	V	32.7	Very low	36.2	Very low	118 Å²	118	159.2 Å²	159.2	72%	0.715	80%	0.795	S	S	*	*			trans	-77.8	87.4	171.1	-178.8	0	0	0	0	107.5	V9 L13	V9-V11 HydrophobicContact CG1-CG2 4.24Å; V9-V11 PolarHBondContact O-N 2.88Å; V9-V11 VanDerWaalsContact O-N 3.12Å; V11-L13 PolarHBondContact O-N 3.24Å; V11-L13 VanDerWaalsContact O-N 3.09Å
12	T	35.4	Very low	36.1	Very low	99 Å²	99	158.9 Å²	158.9	61%	0.607	78%	0.781	S	S	*	*			trans	-64.2	105.1	163.8	37.6	0	0	0	0	108.2	V10 F14	V10-T12 VanDerWaalsContact C-N 3.32Å; V10-T12 HydrophobicContact CG1-CG2 4.22Å; V10-T12 PolarHBondContact O-N 3.31Å; T12-F14 VanDerWaalsContact C-N 3.27Å; T12-F14 PolarHBondContact O-N 3.27Å
13	L	33.7	Very low	35.9	Very low	159 Å²	159	158.2 Å²	158.2	83%	0.832	77%	0.772	S	S	*	*			trans	-59.4	90.7	166.7	-86.3	146.1	0	0	0	108.6	V11 T15	V11-L13 PolarHBondContact O-N 3.24Å; V11-L13 VanDerWaalsContact O-N 3.09Å; L13-T15 VanDerWaalsContact C-N 3.31Å; L13-T15 PolarHBondContact O-N 2.59Å
14	F	34.3	Very low	35.9	Very low	167 Å²	167	155.5 Å²	155.5	73%	0.732	76%	0.764	S	S	*	*			trans	-61.9	99.6	161	-93.9	-95.9	0	0	0	106.6	T12 Y16	T12-F14 VanDerWaalsContact C-N 3.27Å; T12-F14 PolarHBondContact O-N 3.27Å; F14-Y16 HydrophobicContact CB-CD2 4.38Å; F14-Y16 PolarHBondContact O-N 3.09Å
15	T	34.8	Very low	35.7	Very low	133 Å²	133	148.7 Å²	148.7	82%	0.816	75%	0.749	S	S	*	*			trans	-58.8	92	159.7	22.8	0	0	0	0	106.1	L13 C17	L13-T15 VanDerWaalsContact C-N 3.31Å; L13-T15 PolarHBondContact O-N 2.59Å; T15-C17 PolarHBondContact O-N 3.2Å
16	Y	32.5	Very low	35.5	Very low	198 Å²	198	143.5 Å²	143.5	78%	0.776	73%	0.729	S	S	*	*			trans	-59.2	96.9	166.6	-101.5	-97	0	0	0	106	F14 L18	F14-Y16 HydrophobicContact CB-CD2 4.38Å; F14-Y16 PolarHBondContact O-N 3.09Å; Y16-L18 PolarHBondContact O-N 3.3Å
17	C	33.5	Very low	35.8	Very low	108 Å²	108	136.6 Å²	136.6	73%	0.73	71%	0.709	S	S	*	*			trans	-62.1	87.7	164.9	-147.9	0	0	0	0	104.7	T15 T19	T15-C17 PolarHBondContact O-N 3.2Å; C17-T19 PolarHBondContact O-N 2.69Å
18	L	35.4	Very low	36.5	Very low	139 Å²	139	127.8 Å²	127.8	73%	0.728	67%	0.671	S	S	*	*			trans	-65.7	81.9	167.2	-70.2	170.9	0	0	0	105.6	Y16 F20	Y16-L18 PolarHBondContact O-N 3.3Å; L18-F20 PolarHBondContact O-N 3.3Å
19	T	33.6	Very low	37.8	Very low	111 Å²	111	126 Å²	126	68%	0.681	65%	0.65	S	S	*	*			trans	-59.7	95.6	158.5	50.1	0	0	0	0	104.6	C17 E21	C17-T19 PolarHBondContact O-N 2.69Å; T19-E21 PolarHBondContact O-N 3.06Å
20	F	37.4	Very low	39.5	Very low	184 Å²	184	123.4 Å²	123.4	81%	0.807	64%	0.637	S	S	*	*			trans	-55.4	95.8	170.9	-117.5	-102.8	0	0	0	106.4	L18 R22	L18-F20 PolarHBondContact O-N 3.3Å; F20-R22 PolarHBondContact O-N 2.82Å; F20-R22 VanDerWaalsContact O-N 3.09Å
21	E	34.4	Very low	41.7	Very low	169 Å²	169	118.7 Å²	118.7	79%	0.79	61%	0.612	S	S	*	*			trans	-58.9	116.9	169.9	-77.2	-172.7	159.8	0	0	106.6	T19 V23	T19-E21 PolarHBondContact O-N 3.06Å; E21-V23 PolarHBondContact O-N 2.78Å
22	R	37.1	Very low	44.4	Very low	229 Å²	229	118.3 Å²	118.3	86%	0.864	60%	0.602	S	S	*	*			trans	-30.1	92.6	175.5	-63	177	-176.4	-170.7	0.8	112.5	F20 S24	F20-R22 PolarHBondContact O-N 2.82Å; F20-R22 VanDerWaalsContact O-N 3.09Å; R22-S24 PolarHBondContact O-N 2.93Å
23	V	35.9	Very low	47	Very low	106 Å²	106	115.2 Å²	115.2	64%	0.642	58%	0.584	S	S	*	*			trans	-70.4	85.7	157.4	-178.9	0	0	0	0	105.4	E21 T25	E21-V23 PolarHBondContact O-N 2.78Å; V23-T25 HydrophobicContact CG1-CG2 3.34Å; V23-T25 PolarHBondContact O-N 3.25Å
24	S	37.4	Very low	49.9	Very low	88 Å²	88	108 Å²	108	62%	0.615	55%	0.546	S	S	*	.			trans	-73.3	60.9	172.8	-62.3	0	0	0	0	108.8	R22 W26	R22-S24 PolarHBondContact O-N 2.93Å; S24-W26 VanDerWaalsContact C-N 3.34Å; S24-W26 PolarHBondContact O-N 2.73Å; S24-W26 VanDerWaalsContact O-N 3.17Å
25	T	37.5	Very low	52.6	Low	91 Å²	91	105.7 Å²	105.7	56%	0.558	54%	0.538	S	S	*	.			trans	-82.4	89.4	169.4	47.8	0	0	0	0	106.7	V23 L27	V23-T25 HydrophobicContact CG1-CG2 3.34Å; V23-T25 PolarHBondContact O-N 3.25Å; T25-L27 PolarHBondContact O-N 3.11Å
26	W	36.7	Very low	55.5	Low	117 Å²	117	105.8 Å²	105.8	44%	0.443	53%	0.529	S	S	.	.			trans	-43.3	99.2	170.3	-68.9	85.9	0	0	0	111	S24 P215 H236	S24-W26 VanDerWaalsContact C-N 3.34Å; S24-W26 PolarHBondContact O-N 2.73Å; S24-W26 VanDerWaalsContact O-N 3.17Å; W26-P215 HydrophobicContact CB-CG 3.88Å; W26-P215 HydrophobicContact CD2-CG 4.16Å; W26-P215 HydrophobicContact CE3-CG 4.42Å; W26-P215 HydrophobicContact CG-CG 3.92Å; W26-H236 HydrophobicContact CH2-CB 4.03Å
27	L	45.6	Very low	58.3	Low	94 Å²	94	98 Å²	98	49%	0.492	50%	0.503	S	S	.	.			trans	-104.4	122.7	-178.5	-99.5	152.2	0	0	0	110.8	T25	T25-L27 PolarHBondContact O-N 3.11Å
28	I	50.3	Low	61.2	Low	7 Å²	7	96.5 Å²	96.5	4%	0.036	50%	0.498	C	S	.	.			trans	-101.6	161.5	-158.5	-48.9	177.1	0	0	0	111	R167 D168 D169 N170 A214	I28-R167 HydrophobicContact CD1-CB 3.26Å; I28-R167 VanDerWaalsContact CG2-O 3.25Å; I28-R167 WeakPolarHBondContact CG2-O 3.41Å; I28-D168 HydrophobicContact CG2-CB 4.2Å; I28-D169 HydrophobicContact CD1-CB 4.33Å; I28-D169 WeakPolarHBondContact CD1-OD2 3.26Å; I28-N170 PolarHBondContact O-ND2 2.73Å; I28-A214 HydrophobicContact CB-CB 3.92Å; I28-A214 HydrophobicContact CD1-CB 3.67Å; I28-A214 HydrophobicContact CG1-CB 3.47Å; I28-A214 VanDerWaalsContact CG1-CB 3.47Å; I28-A214 HydrophobicContact CG2-CB 3.43Å; I28-A214 VanDerWaalsContact CG2-CB 3.43Å
29	R	64.7	Low	64.1	Low	94 Å²	94	92.8 Å²	92.8	36%	0.355	48%	0.477	S	S	.	.	B	Isolated β-bridge	trans	-144.5	116.4	178.8	-59.8	-173.3	-173.2	-144.5	7.7	117	G31 G210 Q211 D245	R29-G31 PolarHBondContact O-N 3.44Å; R29-G210 WeakPolarHBondContact CB-O 3.29Å; R29-G210 WeakPolarHBondContact CD-O 3.12Å; R29-G210 WeakPolarHBondContact CG-O 3.33Å; R29-Q211 VanDerWaalsContact O-CA 3.24Å; R29-Q211 WeakPolarHBondContact O-CA 3.16Å; R29-Q211 WeakPolarHBondContact O-CB 3.44Å; R29-Q211 VanDerWaalsContact O-CG 3.29Å; R29-Q211 WeakPolarHBondContact O-CG 2.97Å; R29-D245 IonicContact CZ-OD1 3.28Å; R29-D245 IonicContact CZ-OD2 2.96Å; R29-D245 IonicContact NE-OD1 3.49Å; R29-D245 IonicContact NE-OD2 3.32Å; R29-D245 PolarHBondContact NE-OD2 3.17Å; R29-D245 IonicContact NH1-OD2 3.36Å; R29-D245 PolarHBondContact NH1-OD2 3.18Å; R29-D245 IonicContact NH2-OD1 3.85Å; R29-D245 PolarHBondContact NH2-OD1 2.98Å; R29-D245 IonicContact NH2-OD2 3Å; R29-D245 PolarHBondContact NH2-OD2 2.92Å
30	S	71.9	Confident	67.1	Low	64 Å²	64	87.6 Å²	87.6	45%	0.448	45%	0.445	S	S	.	.			trans	56.6	37.5	138.4	-51.9	0	0	0	0	118.2	D168 Q211	S30-D168 PolarHBondContact N-OD1 3.35Å; S30-Q211 WeakPolarHBondContact O-CG 3.17Å; S30-Q211 PolarHBondContact O-NE2 2.62Å
31	G	81.5	Confident	70	Confident	18 Å²	18	79.9 Å²	79.9	19%	0.186	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-69.6	144.8	173.5	0	0	0	0	0	112	R29 K184	R29-G31 PolarHBondContact O-N 3.44Å; G31-K184 CarbonylContact C-O 3.44Å; G31-K184 WeakPolarHBondContact CA-O 3.43Å
32	E	88.9	Confident	73	Confident	109 Å²	109	72.1 Å²	72.1	51%	0.509	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	128.4	170.6	-171.4	-167.9	153.5	0	0	109.1	V34 K183 K184	E32-V34 PolarHBondContact O-N 3.14Å; E32-K183 CarbonylContact O-C 3.59Å; E32-K183 VanDerWaalsContact O-CA 3.29Å; E32-K183 WeakPolarHBondContact O-CA 3.37Å; E32-K184 HydrophobicContact CB-CG 4.33Å; E32-K184 PolarHBondContact N-O 2.91Å; E32-K184 PolarHBondContact O-N 3.21Å
33	P	90.8	Very high	76	Confident	34 Å²	34	61.3 Å²	61.3	22%	0.221	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	130.4	171.5	-23.4	33.9	0	0	0	111.5	Q35	P33-Q35 PolarHBondContact O-N 3.36Å; P33-Q35 PolarHBondContact O-NE2 3.3Å
34	V	93.3	Very high	78.9	Confident	7 Å²	7	56.3 Å²	56.3	4%	0.042	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-67.7	130	172	172.1	0	0	0	0	108.9	E32 H36 E39 F40 L84 L182 K184	E32-V34 PolarHBondContact O-N 3.14Å; V34-H36 WeakPolarHBondContact CG1-O 3.35Å; V34-E39 HydrophobicContact CG1-CB 4.02Å; V34-F40 HydrophobicContact CG1-CD2 4.32Å; V34-F40 HydrophobicContact CG2-CD2 3.86Å; V34-F40 HydrophobicContact CG2-CE2 3.75Å; V34-L84 HydrophobicContact CB-CD2 4.12Å; V34-L84 HydrophobicContact CG1-CD2 3.8Å; V34-L84 WeakPolarHBondContact O-CD2 3.48Å; V34-L182 HydrophobicContact CB-CB 4.3Å; V34-L182 HydrophobicContact CB-CD2 3.93Å; V34-L182 HydrophobicContact CB-CG 3.92Å; V34-L182 HydrophobicContact CG1-CD2 3.95Å; V34-L182 HydrophobicContact CG1-CG 4.49Å; V34-L182 HydrophobicContact CG2-CD2 4.03Å; V34-L182 HydrophobicContact CG2-CG 3.76Å; V34-L182 PolarHBondContact N-O 2.64Å; V34-K184 HydrophobicContact CG2-CB 4.12Å; V34-K184 HydrophobicContact CG2-CD 4.16Å; V34-K184 HydrophobicContact CG2-CG 4.2Å
35	Q	92.3	Very high	81.8	Confident	119 Å²	119	52.2 Å²	52.2	56%	0.556	28%	0.277	S	S	*	.	S	Bend	trans	-86.1	-29.1	-175.1	-59.1	-57.2	-55.8	0	0	112.9	P33	P33-Q35 PolarHBondContact O-N 3.36Å; P33-Q35 PolarHBondContact O-NE2 3.3Å
36	H	94.1	Very high	84.7	Confident	135 Å²	135	47.9 Å²	47.9	63%	0.625	25%	0.251	S	S	*	.			trans	-135.6	129.1	-178.7	-62.6	-52.7	0	0	0	110.6	V34 A38 E39	V34-H36 WeakPolarHBondContact CG1-O 3.35Å; H36-A38 PolarHBondContact O-N 2.96Å; H36-E39 WeakPolarHBondContact O-CB 3.4Å; H36-E39 PolarHBondContact O-N 2.78Å
37	P	92.7	Very high	87.5	Confident	35 Å²	35	43.4 Å²	43.4	23%	0.227	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-58.6	-26.5	-179.2	-10.9	14.9	0	0	0	113.4	E39 F40 L82 L84	P37-E39 PolarHBondContact O-N 2.88Å; P37-F40 CarbonylContact O-C 3.57Å; P37-F40 PolarHBondContact O-N 3.03Å; P37-L82 VanDerWaalsContact CB-C 3.49Å; P37-L82 HydrophobicContact CB-CB 4.07Å; P37-L82 HydrophobicContact CB-CD2 4.29Å; P37-L84 HydrophobicContact CB-CD2 4.31Å; P37-L84 HydrophobicContact CG-CD2 4.09Å; P37-L84 HydrophobicContact CG-CG 3.9Å
38	A	94	Very high	89.6	Confident	77 Å²	77	39.5 Å²	39.5	64%	0.636	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-67.9	-8.1	177.4	0	0	0	0	0	114.3	H36 P41	H36-A38 PolarHBondContact O-N 2.96Å; A38-P41 WeakPolarHBondContact O-CD 3.26Å
39	E	95.5	Very high	91.2	Very high	61 Å²	61	45 Å²	45	29%	0.285	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-68.8	-35.8	173.9	-168.7	174.7	-155.1	0	0	111.8	V34 H36 P37 K184	V34-E39 HydrophobicContact CG1-CB 4.02Å; H36-E39 WeakPolarHBondContact O-CB 3.4Å; H36-E39 PolarHBondContact O-N 2.78Å; P37-E39 PolarHBondContact O-N 2.88Å; E39-K184 IonicContact OE1-NZ 3.8Å; E39-K184 PolarHBondContact OE1-NZ 2.88Å; E39-K184 IonicContact OE2-NZ 3.08Å; E39-K184 PolarHBondContact OE2-NZ 3.4Å
40	F	97.5	Very high	92.1	Very high	2 Å²	2	51 Å²	51	1%	0.009	26%	0.264	C	S	.	.	S	Bend	trans	-128.9	67.4	176.6	-61	-84.7	0	0	0	110.3	V34 P37 F42 I43 V163 K184 L223 P226	V34-F40 HydrophobicContact CG1-CD2 4.32Å; V34-F40 HydrophobicContact CG2-CD2 3.86Å; V34-F40 HydrophobicContact CG2-CE2 3.75Å; P37-F40 CarbonylContact O-C 3.57Å; P37-F40 PolarHBondContact O-N 3.03Å; F40-F42 HydrophobicContact CB-CZ 4.38Å; F40-F42 HydrophobicContact CD1-CE1 4.43Å; F40-F42 HydrophobicContact CD1-CE2 4.43Å; F40-F42 AromaticContact CD1-CZ 3.8Å; F40-F42 HydrophobicContact CD1-CZ 3.8Å; F40-F42 PolarHBondContact O-N 2.8Å; F40-I43 HydrophobicContact CB-CB 4.01Å; F40-I43 HydrophobicContact CB-CG2 3.98Å; F40-I43 WeakPolarHBondContact O-CB 3.42Å; F40-I43 WeakPolarHBondContact O-CG2 3.5Å; F40-I43 PolarHBondContact O-N 3.44Å; F40-V163 HydrophobicContact CB-CG2 4.47Å; F40-V163 HydrophobicContact CD1-CB 4.24Å; F40-V163 HydrophobicContact CD1-CG1 3.88Å; F40-V163 HydrophobicContact CD1-CG2 4.1Å; F40-V163 HydrophobicContact CD2-CG2 3.87Å; F40-V163 HydrophobicContact CE1-CB 4.1Å; F40-V163 HydrophobicContact CE1-CG1 3.98Å; F40-V163 HydrophobicContact CE1-CG2 4.28Å; F40-V163 HydrophobicContact CE2-CG2 4.08Å; F40-V163 HydrophobicContact CG-CG1 4.44Å; F40-V163 HydrophobicContact CG-CG2 3.88Å; F40-V163 HydrophobicContact CZ-CB 4.26Å; F40-V163 HydrophobicContact CZ-CG2 4.27Å; F40-K184 HydrophobicContact CE2-CB 3.91Å; F40-K184 HydrophobicContact CE2-CD 3.85Å; F40-K184 HydrophobicContact CE2-CG 4.48Å; F40-K184 HydrophobicContact CZ-CB 3.93Å; F40-K184 HydrophobicContact CZ-CD 4.12Å; F40-L223 HydrophobicContact CD1-CD1 4.37Å; F40-L223 HydrophobicContact CE1-CD1 4.2Å; F40-P226 HydrophobicContact CE1-CB 3.91Å; F40-P226 HydrophobicContact CZ-CB 4.25Å
41	P	97.8	Very high	92.9	Very high	21 Å²	21	51.8 Å²	51.8	14%	0.136	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-4.1	-168.8	28.1	-33	0	0	0	114.3	A38 L82 G141 I142 R143	A38-P41 WeakPolarHBondContact O-CD 3.26Å; P41-L82 HydrophobicContact CB-CD2 4.28Å; P41-G141 WeakPolarHBondContact CB-O 3.36Å; P41-I142 WeakPolarHBondContact O-CA 3.14Å; P41-I142 WeakPolarHBondContact O-CG2 3.39Å; P41-R143 HydrophobicContact CB-CB 4.12Å; P41-R143 HydrophobicContact CB-CG 3.87Å; P41-R143 HydrophobicContact CG-CB 3.85Å; P41-R143 HydrophobicContact CG-CG 3.61Å; P41-R143 PolarHBondContact O-N 2.94Å
42	F	98.6	Very high	93.5	Very high	7 Å²	7	52.2 Å²	52.2	3%	0.031	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-12.5	174.9	54.2	-99.9	0	0	0	113.3	F40 S56 L57 R143 I145 P221 L223 P226	F40-F42 HydrophobicContact CB-CZ 4.38Å; F40-F42 HydrophobicContact CD1-CE1 4.43Å; F40-F42 HydrophobicContact CD1-CE2 4.43Å; F40-F42 AromaticContact CD1-CZ 3.8Å; F40-F42 HydrophobicContact CD1-CZ 3.8Å; F40-F42 PolarHBondContact O-N 2.8Å; F42-S56 WeakPolarHBondContact O-CA 3.01Å; F42-L57 PolarHBondContact O-N 2.81Å; F42-R143 WeakPolarHBondContact CA-O 3.34Å; F42-R143 WeakPolarHBondContact CB-O 3.49Å; F42-I145 HydrophobicContact CB-CB 3.91Å; F42-I145 HydrophobicContact CD1-CB 4.03Å; F42-I145 HydrophobicContact CD1-CD1 4.02Å; F42-I145 HydrophobicContact CD1-CG1 4.03Å; F42-I145 HydrophobicContact CD2-CB 4.12Å; F42-I145 HydrophobicContact CD2-CD1 3.76Å; F42-I145 HydrophobicContact CD2-CG1 4.36Å; F42-I145 HydrophobicContact CE1-CD1 3.77Å; F42-I145 HydrophobicContact CE1-CG1 4.14Å; F42-I145 HydrophobicContact CE2-CD1 3.51Å; F42-I145 HydrophobicContact CE2-CG1 4.48Å; F42-I145 HydrophobicContact CG-CB 3.75Å; F42-I145 HydrophobicContact CG-CD1 4.01Å; F42-I145 HydrophobicContact CG-CG1 4.14Å; F42-I145 HydrophobicContact CZ-CD1 3.49Å; F42-I145 VanDerWaalsContact CZ-CD1 3.49Å; F42-I145 HydrophobicContact CZ-CG1 4.35Å; F42-P221 HydrophobicContact CE2-CG 4.11Å; F42-L223 HydrophobicContact CE2-CD1 4.17Å; F42-L223 HydrophobicContact CZ-CD1 3.76Å; F42-L223 HydrophobicContact CZ-CD2 4.47Å; F42-P226 WeakPolarHBondContact CE1-O 3.26Å
43	I	98.4	Very high	93.8	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	133.2	-172.9	-158.4	72.2	0	0	0	110.1	F40 T54 F81 V163 Y165 L182 P221	F40-I43 HydrophobicContact CB-CB 4.01Å; F40-I43 HydrophobicContact CB-CG2 3.98Å; F40-I43 WeakPolarHBondContact O-CB 3.42Å; F40-I43 WeakPolarHBondContact O-CG2 3.5Å; F40-I43 PolarHBondContact O-N 3.44Å; I43-T54 HydrophobicContact CD1-CG2 3.54Å; I43-T54 HydrophobicContact CG1-CG2 3.89Å; I43-F81 WeakPolarHBondContact O-CD1 3.35Å; I43-V163 HydrophobicContact CD1-CG1 3.86Å; I43-V163 HydrophobicContact CD1-CG2 4.32Å; I43-V163 HydrophobicContact CG1-CG2 4.4Å; I43-Y165 HydrophobicContact CG1-CE2 4.05Å; I43-Y165 HydrophobicContact CG2-CE2 4.36Å; I43-L182 HydrophobicContact CG1-CD1 4.07Å; I43-L182 HydrophobicContact CG2-CD1 4.07Å; I43-L182 HydrophobicContact CG2-CD2 3.85Å; I43-P221 VanDerWaalsContact CD1-CD 3.42Å; I43-P221 HydrophobicContact CD1-CG 3.74Å
44	A	98.5	Very high	94.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	131.6	-177.6	0	0	0	0	0	110.6	L46 T54 G55 V63 V79 S80 F81	A44-L46 HydrophobicContact CB-CD1 3.59Å; A44-T54 CarbonylContact O-C 3.05Å; A44-T54 WeakPolarHBondContact O-CA 3.39Å; A44-G55 PolarHBondContact N-O 2.91Å; A44-G55 PolarHBondContact O-N 3.17Å; A44-V63 HydrophobicContact CB-CG1 3.68Å; A44-V79 HydrophobicContact CB-CG1 3.98Å; A44-S80 WeakPolarHBondContact CA-O 3.44Å; A44-F81 HydrophobicContact CB-CD1 4.2Å; A44-F81 HydrophobicContact CB-CE1 3.58Å; A44-F81 HydrophobicContact CB-CZ 4.05Å
45	F	98.1	Very high	94.5	Very high	3 Å²	3	45.2 Å²	45.2	1%	0.013	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	113	165.4	-174.7	-93.3	0	0	0	109.4	T47 M52 V79 S80 T83 N86 Y165	F45-T47 WeakPolarHBondContact CD1-OG1 3.31Å; F45-T47 VanDerWaalsContact CE1-OG1 3.26Å; F45-T47 WeakPolarHBondContact CE1-OG1 3.31Å; F45-M52 HydrophobicContact CE1-CB 4.32Å; F45-M52 HydrophobicContact CE2-CB 3.93Å; F45-M52 HydrophobicContact CE2-CG 4.22Å; F45-M52 HydrophobicContact CE2-SD 3.53Å; F45-M52 VanDerWaalsContact CE2-SD 3.53Å; F45-M52 HydrophobicContact CZ-CB 3.63Å; F45-M52 HydrophobicContact CZ-CG 4.24Å; F45-M52 HydrophobicContact CZ-SD 3.71Å; F45-V79 WeakPolarHBondContact O-CA 3.38Å; F45-S80 PolarHBondContact N-O 3.02Å; F45-S80 PolarHBondContact O-N 2.84Å; F45-T83 HydrophobicContact CB-CG2 3.94Å; F45-N86 HydrophobicContact CE1-CB 4.26Å; F45-N86 WeakPolarHBondContact CE1-OD1 3.47Å; F45-N86 HydrophobicContact CE2-CB 4.17Å; F45-N86 HydrophobicContact CZ-CB 3.68Å; F45-Y165 HydrophobicContact CB-CD2 4.22Å; F45-Y165 HydrophobicContact CB-CE1 4.36Å; F45-Y165 HydrophobicContact CB-CE2 3.82Å; F45-Y165 AromaticContact CD2-CD1 3.58Å; F45-Y165 HydrophobicContact CD2-CD1 3.58Å; F45-Y165 AromaticContact CD2-CD2 3.7Å; F45-Y165 HydrophobicContact CD2-CD2 3.7Å; F45-Y165 AromaticContact CD2-CE1 3.96Å; F45-Y165 HydrophobicContact CD2-CE1 3.96Å; F45-Y165 HydrophobicContact CD2-CE2 4.09Å; F45-Y165 AromaticContact CD2-CG 3.43Å; F45-Y165 HydrophobicContact CD2-CG 3.43Å; F45-Y165 VanDerWaalsContact CD2-CG 3.43Å; F45-Y165 HydrophobicContact CE2-CD1 4.16Å; F45-Y165 HydrophobicContact CE2-CG 4.02Å; F45-Y165 HydrophobicContact CG-CD2 4.47Å
46	L	97.7	Very high	94.8	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	114.6	179.1	-76.7	62.1	0	0	0	108.4	A44 M52 C53 V63 T65 V76 V79 V130	A44-L46 HydrophobicContact CB-CD1 3.59Å; L46-M52 CarbonylContact O-C 3.53Å; L46-M52 WeakPolarHBondContact O-CA 3.28Å; L46-C53 HydrophobicContact CB-CB 4.1Å; L46-C53 HydrophobicContact CD2-CB 4.46Å; L46-C53 PolarHBondContact N-O 2.88Å; L46-C53 PolarHBondContact O-N 2.79Å; L46-V63 HydrophobicContact CD1-CG1 4.1Å; L46-T65 HydrophobicContact CD2-CG2 3.93Å; L46-V76 HydrophobicContact CB-CG1 4.3Å; L46-V76 HydrophobicContact CG-CG1 4.39Å; L46-V79 HydrophobicContact CD1-CG1 4.48Å; L46-V79 HydrophobicContact CG-CG2 4.49Å; L46-V130 HydrophobicContact CD2-CG2 4.1Å
47	T	95.7	Very high	95	Very high	22 Å²	22	33.1 Å²	33.1	14%	0.135	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	125.7	171.7	-45.3	0	0	0	0	109.1	F45 V76 I77 R78	F45-T47 WeakPolarHBondContact CD1-OG1 3.31Å; F45-T47 VanDerWaalsContact CE1-OG1 3.26Å; F45-T47 WeakPolarHBondContact CE1-OG1 3.31Å; T47-V76 WeakPolarHBondContact O-CA 3.4Å; T47-I77 HydrophobicContact CG2-CD1 4.07Å; T47-I77 HydrophobicContact CG2-CG1 4.07Å; T47-I77 WeakPolarHBondContact O-CG1 3.4Å; T47-I77 PolarHBondContact O-N 2.98Å; T47-R78 PolarHBondContact N-O 3.38Å; T47-R78 PolarHBondContact O-N 3.06Å; T47-R78 PolarHBondContact OG1-NE 2.96Å; T47-R78 PolarHBondContact OG1-NH2 2.79Å
48	T	89.5	Confident	95.3	Very high	12 Å²	12	31.9 Å²	31.9	7%	0.074	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	173	162.9	75.4	0	0	0	0	108.6	R50 T51 V76	T48-R50 PolarHBondContact O-N 3.41Å; T48-R50 PolarHBondContact OG1-N 2.83Å; T48-T51 WeakPolarHBondContact CA-O 3.37Å; T48-T51 WeakPolarHBondContact CB-O 3.23Å; T48-T51 HydrophobicContact CG2-CG2 4.32Å; T48-T51 PolarHBondContact N-O 3.05Å; T48-T51 VanDerWaalsContact OG1-C 3.31Å; T48-T51 WeakPolarHBondContact OG1-CG2 3.33Å; T48-T51 PolarHBondContact OG1-N 2.84Å; T48-T51 PolarHBondContact OG1-O 3.27Å; T48-V76 HydrophobicContact CG2-CG2 4.2Å
49	E	84.3	Confident	95.5	Very high	124 Å²	124	29 Å²	29	58%	0.579	14%	0.139	S	C	*	.	S	Bend	trans	-63	-26.5	178	-67	-168.4	173.4	0	0	114.7	L74 I77	E49-L74 HydrophobicContact CB-CB 4.24Å; E49-L74 HydrophobicContact CB-CD1 4.1Å; E49-L74 HydrophobicContact CG-CB 4.45Å; E49-L74 WeakPolarHBondContact OE2-CD2 3.48Å; E49-I77 HydrophobicContact CG-CG2 4.11Å
50	R	82.1	Confident	95.6	Very high	219 Å²	219	28.4 Å²	28.4	83%	0.826	14%	0.14	S	C	*	.	S	Bend	trans	-117.5	-22.7	-174	-72.4	-173.5	-177.8	-131.1	-0.7	114.9	T48 L74	T48-R50 PolarHBondContact O-N 3.41Å; T48-R50 PolarHBondContact OG1-N 2.83Å; R50-L74 HydrophobicContact CB-CD1 4.46Å; R50-L74 VanDerWaalsContact CD-CD1 3.45Å; R50-L74 HydrophobicContact CG-CD1 3.56Å
51	T	88.6	Confident	95.6	Very high	81 Å²	81	32.4 Å²	32.4	50%	0.497	16%	0.155	S	C	.	.			trans	-146.1	174.6	-173.3	-169.1	0	0	0	0	110.5	T48	T48-T51 WeakPolarHBondContact CA-O 3.37Å; T48-T51 WeakPolarHBondContact CB-O 3.23Å; T48-T51 HydrophobicContact CG2-CG2 4.32Å; T48-T51 PolarHBondContact N-O 3.05Å; T48-T51 VanDerWaalsContact OG1-C 3.31Å; T48-T51 WeakPolarHBondContact OG1-CG2 3.33Å; T48-T51 PolarHBondContact OG1-N 2.84Å; T48-T51 PolarHBondContact OG1-O 3.27Å
52	M	94.2	Very high	95.7	Very high	26 Å²	26	31.4 Å²	31.4	13%	0.128	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	158.4	166.3	64	-168.4	174.2	0	0	109.9	F45 L46 Y165	F45-M52 HydrophobicContact CE1-CB 4.32Å; F45-M52 HydrophobicContact CE2-CB 3.93Å; F45-M52 HydrophobicContact CE2-CG 4.22Å; F45-M52 HydrophobicContact CE2-SD 3.53Å; F45-M52 VanDerWaalsContact CE2-SD 3.53Å; F45-M52 HydrophobicContact CZ-CB 3.63Å; F45-M52 HydrophobicContact CZ-CG 4.24Å; F45-M52 HydrophobicContact CZ-SD 3.71Å; L46-M52 CarbonylContact O-C 3.53Å; L46-M52 WeakPolarHBondContact O-CA 3.28Å; M52-Y165 WeakPolarHBondContact CE-O 3.31Å
53	C	97.1	Very high	95.7	Very high	4 Å²	4	31.1 Å²	31.1	3%	0.027	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	171.7	166.9	-80.4	0	0	0	0	109.3	L46 C69 G216 S218	L46-C53 HydrophobicContact CB-CB 4.1Å; L46-C53 HydrophobicContact CD2-CB 4.46Å; L46-C53 PolarHBondContact N-O 2.88Å; L46-C53 PolarHBondContact O-N 2.79Å; C53-C69 HydrophobicContact CB-CB 3.77Å; C53-C69 WeakPolarHBondContact CB-SG 3.02Å; C53-C69 WeakPolarHBondContact SG-CB 3.32Å; C53-C69 CovalentContact SG-SG 2.04Å; C53-C69 PolarHBondContact SG-SG 3.08Å; C53-G216 CarbonylContact C-O 3.59Å; C53-S218 WeakPolarHBondContact CB-O 3.43Å
54	T	98.2	Very high	95.7	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	154.4	171.7	-56.2	0	0	0	0	108.9	I43 A44 T65 Y165 G216 S218 G219	I43-T54 HydrophobicContact CD1-CG2 3.54Å; I43-T54 HydrophobicContact CG1-CG2 3.89Å; A44-T54 CarbonylContact O-C 3.05Å; A44-T54 WeakPolarHBondContact O-CA 3.39Å; T54-T65 PolarHBondContact O-OG1 3.18Å; T54-Y165 HydrophobicContact CG2-CD2 4.12Å; T54-Y165 HydrophobicContact CG2-CE2 4.49Å; T54-Y165 PolarHBondContact OG1-N 3.01Å; T54-G216 PolarHBondContact N-O 3.22Å; T54-G216 PolarHBondContact OG1-O 3.46Å; T54-S218 PolarHBondContact N-O 2.83Å; T54-G219 CarbonylContact O-C 3.56Å; T54-G219 WeakPolarHBondContact O-CA 3.28Å
55	G	98.7	Very high	95.7	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	-178.5	172.8	0	0	0	0	0	112	A44 L64	A44-G55 PolarHBondContact N-O 2.91Å; A44-G55 PolarHBondContact O-N 3.17Å; G55-L64 CarbonylContact C-O 3.52Å; G55-L64 WeakPolarHBondContact CA-O 3.35Å
56	S	98.8	Very high	95.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	133	177.9	-62.7	0	0	0	0	111.3	F42 V58 V63 L64 P221	F42-S56 WeakPolarHBondContact O-CA 3.01Å; S56-V58 PolarHBondContact O-N 3.32Å; S56-V63 CarbonylContact O-C 3.54Å; S56-V63 WeakPolarHBondContact O-CA 3.4Å; S56-L64 PolarHBondContact N-O 3.38Å; S56-L64 PolarHBondContact O-N 2.84Å; S56-P221 WeakPolarHBondContact OG-CB 3.35Å; S56-P221 WeakPolarHBondContact OG-CG 3.46Å
57	L	98.8	Very high	95.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	114.5	174	-169.2	73.2	0	0	0	110.2	F42 S59 V63 F81 L132 V136 I142 V144 I145	F42-L57 PolarHBondContact O-N 2.81Å; L57-S59 WeakPolarHBondContact CD1-O 3.18Å; L57-S59 WeakPolarHBondContact CG-O 3.34Å; L57-V63 HydrophobicContact CD1-CG2 3.9Å; L57-F81 HydrophobicContact CB-CE1 3.8Å; L57-F81 HydrophobicContact CB-CZ 4.17Å; L57-F81 HydrophobicContact CD1-CE1 4.26Å; L57-F81 HydrophobicContact CD1-CZ 3.75Å; L57-F81 HydrophobicContact CG-CE1 4.46Å; L57-F81 HydrophobicContact CG-CZ 4.42Å; L57-L132 HydrophobicContact CD1-CD1 4.05Å; L57-V136 HydrophobicContact CD1-CG2 3.84Å; L57-V136 HydrophobicContact CD2-CB 4.15Å; L57-V136 HydrophobicContact CD2-CG1 4.04Å; L57-V136 HydrophobicContact CD2-CG2 3.94Å; L57-I142 HydrophobicContact CD2-CG2 3.56Å; L57-V144 HydrophobicContact CD2-CG2 3.86Å; L57-V144 HydrophobicContact CG-CG2 4.15Å; L57-V144 CarbonylContact O-C 3.53Å; L57-V144 WeakPolarHBondContact O-CA 3.19Å; L57-I145 PolarHBondContact O-N 2.89Å
58	V	98.7	Very high	95.7	Very high	8 Å²	8	32.8 Å²	32.8	5%	0.048	15%	0.153	C	C	.	.			trans	-112.2	-10.1	-178.1	-67.6	0	0	0	0	113.5	S56 A62 L64 V144 I145 L147 V230 I264	S56-V58 PolarHBondContact O-N 3.32Å; V58-A62 HydrophobicContact CG2-CB 4.04Å; V58-A62 WeakPolarHBondContact CG2-O 3.4Å; V58-A62 PolarHBondContact N-O 2.85Å; V58-L64 HydrophobicContact CG1-CB 3.74Å; V58-L64 HydrophobicContact CG1-CD2 4.18Å; V58-L64 HydrophobicContact CG2-CB 3.99Å; V58-V144 VanDerWaalsContact O-CG1 3.28Å; V58-V144 WeakPolarHBondContact O-CG1 3.47Å; V58-I145 HydrophobicContact CG1-CG2 3.99Å; V58-L147 HydrophobicContact CB-CD2 4.09Å; V58-L147 HydrophobicContact CG1-CD2 3.87Å; V58-V230 HydrophobicContact CG1-CG1 4.16Å; V58-I264 HydrophobicContact CG2-CG2 3.72Å
59	S	98.4	Very high	96	Very high	18 Å²	18	32.6 Å²	32.6	13%	0.126	15%	0.152	C	C	.	.	S	Bend	trans	-149.8	174.8	161.4	82.1	0	0	0	0	109.5	L57 R61 A62 I264	L57-S59 WeakPolarHBondContact CD1-O 3.18Å; L57-S59 WeakPolarHBondContact CG-O 3.34Å; S59-R61 PolarHBondContact O-N 2.94Å; S59-R61 PolarHBondContact OG-N 2.89Å; S59-A62 PolarHBondContact N-O 2.91Å; S59-A62 PolarHBondContact O-N 3.45Å; S59-A62 VanDerWaalsContact OG-CB 3.23Å; S59-A62 WeakPolarHBondContact OG-CB 3.21Å; S59-A62 PolarHBondContact OG-N 3.26Å; S59-A62 VanDerWaalsContact OG-N 3.14Å; S59-I264 WeakPolarHBondContact CB-OXT 3.5Å; S59-I264 PolarHBondContact OG-OXT 3.48Å
60	T	98.3	Very high	96.5	Very high	48 Å²	48	27.1 Å²	27.1	29%	0.294	13%	0.127	S	C	.	.	S	Bend	trans	-62.8	-8.2	177.7	55.7	0	0	0	0	113.6	M135 V136 L138	T60-M135 CarbonylContact O-C 3.59Å; T60-M135 WeakPolarHBondContact O-CA 3.38Å; T60-V136 PolarHBondContact O-N 2.74Å; T60-L138 HydrophobicContact CG2-CD1 4.11Å; T60-L138 HydrophobicContact CG2-CD2 4.44Å; T60-L138 HydrophobicContact CG2-CG 4.27Å
61	R	98	Very high	97	Very high	86 Å²	86	16.9 Å²	16.9	33%	0.325	9%	0.089	S	C	.	.	S	Bend	trans	-131.4	-2.1	175.3	-60.4	-166.1	75	166.7	-0.8	115.1	S59 M131 L132 A133 M135	S59-R61 PolarHBondContact O-N 2.94Å; S59-R61 PolarHBondContact OG-N 2.89Å; R61-M131 HydrophobicContact CB-CE 4.43Å; R61-M131 CarbonylContact O-C 3.47Å; R61-M131 WeakPolarHBondContact O-CA 3.35Å; R61-L132 PolarHBondContact NE-O 2.86Å; R61-L132 PolarHBondContact NH2-O 3.47Å; R61-L132 PolarHBondContact O-N 2.91Å; R61-A133 PolarHBondContact NH2-O 3.2Å; R61-M135 HydrophobicContact CG-CB 4.26Å; R61-M135 HydrophobicContact CG-CG 3.48Å; R61-M135 VanDerWaalsContact CG-CG 3.48Å
62	A	98.8	Very high	96.8	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	127.2	-172.8	0	0	0	0	0	111.9	V58 S59 I129 M131 I264	V58-A62 HydrophobicContact CG2-CB 4.04Å; V58-A62 WeakPolarHBondContact CG2-O 3.4Å; V58-A62 PolarHBondContact N-O 2.85Å; S59-A62 PolarHBondContact N-O 2.91Å; S59-A62 PolarHBondContact O-N 3.45Å; S59-A62 VanDerWaalsContact OG-CB 3.23Å; S59-A62 WeakPolarHBondContact OG-CB 3.21Å; S59-A62 PolarHBondContact OG-N 3.26Å; S59-A62 VanDerWaalsContact OG-N 3.14Å; A62-I129 HydrophobicContact CB-CG2 3.69Å; A62-M131 HydrophobicContact CB-SD 4.14Å; A62-I264 HydrophobicContact CB-CB 3.96Å; A62-I264 HydrophobicContact CB-CG2 3.61Å
63	V	98.9	Very high	96	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	116.8	173.8	178.2	0	0	0	0	109.5	A44 L46 S56 L57 V79 F81 I129 V130 L132	A44-V63 HydrophobicContact CB-CG1 3.68Å; L46-V63 HydrophobicContact CD1-CG1 4.1Å; S56-V63 CarbonylContact O-C 3.54Å; S56-V63 WeakPolarHBondContact O-CA 3.4Å; L57-V63 HydrophobicContact CD1-CG2 3.9Å; V63-V79 HydrophobicContact CG2-CG1 4.04Å; V63-F81 HydrophobicContact CG2-CE1 4.44Å; V63-F81 HydrophobicContact CG2-CZ 3.69Å; V63-I129 CarbonylContact O-C 3.55Å; V63-I129 VanDerWaalsContact O-CA 3.32Å; V63-I129 WeakPolarHBondContact O-CA 3.39Å; V63-V130 HydrophobicContact CB-CB 4.38Å; V63-V130 PolarHBondContact N-O 3.18Å; V63-V130 PolarHBondContact O-N 2.98Å; V63-L132 HydrophobicContact CG2-CD1 4.21Å; V63-L132 HydrophobicContact CG2-CD2 4.13Å; V63-L132 HydrophobicContact CG2-CG 4.28Å
64	L	98.9	Very high	95.5	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	135.1	174.6	-167.4	69.8	0	0	0	110	G55 S56 V58 I127 I129 V230 V233 V253 V260	G55-L64 CarbonylContact C-O 3.52Å; G55-L64 WeakPolarHBondContact CA-O 3.35Å; S56-L64 PolarHBondContact N-O 3.38Å; S56-L64 PolarHBondContact O-N 2.84Å; V58-L64 HydrophobicContact CG1-CB 3.74Å; V58-L64 HydrophobicContact CG1-CD2 4.18Å; V58-L64 HydrophobicContact CG2-CB 3.99Å; L64-I127 HydrophobicContact CD1-CG2 3.6Å; L64-I129 HydrophobicContact CD1-CG1 3.96Å; L64-V230 HydrophobicContact CD2-CG1 4.01Å; L64-V230 HydrophobicContact CD2-CG2 4.2Å; L64-V233 HydrophobicContact CD2-CG1 3.88Å; L64-V233 HydrophobicContact CG-CG1 3.94Å; L64-V253 HydrophobicContact CD2-CB 4.5Å; L64-V253 HydrophobicContact CD2-CG1 4.07Å; L64-V253 HydrophobicContact CD2-CG2 3.56Å; L64-V260 HydrophobicContact CD1-CG1 4.4Å; L64-V260 HydrophobicContact CD1-CG2 3.85Å
65	T	98.6	Very high	95.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	-179.1	-179.9	-177.3	0	0	0	0	109.8	L46 T54 V70 A128 V130	L46-T65 HydrophobicContact CD2-CG2 3.93Å; T54-T65 PolarHBondContact O-OG1 3.18Å; T65-V70 HydrophobicContact CG2-CG1 4.18Å; T65-A128 HydrophobicContact CG2-CB 4.27Å; T65-A128 PolarHBondContact N-O 3.31Å; T65-A128 PolarHBondContact O-N 3.33Å; T65-V130 HydrophobicContact CG2-CG2 3.92Å
66	A	98.1	Very high	95	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.143	C	C	.	.			trans	-75.3	149.3	170.8	0	0	0	0	0	111.8	C69 D126 G219	A66-C69 WeakPolarHBondContact O-CB 3.4Å; A66-C69 PolarHBondContact O-N 3.46Å; A66-D126 WeakPolarHBondContact CA-O 3.22Å; A66-G219 VanDerWaalsContact N-CA 3.26Å
67	G	96.9	Very high	94.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.16	C	C	.	.	S	Bend	trans	-61.7	-42.5	174.7	0	0	0	0	0	112.4	C69 V70 C71 D126	G67-C69 PolarHBondContact O-N 2.75Å; G67-C69 VanDerWaalsContact O-N 3.14Å; G67-V70 VanDerWaalsContact O-CG2 3.3Å; G67-V70 WeakPolarHBondContact O-CG2 3.34Å; G67-V70 PolarHBondContact O-N 3.35Å; G67-C71 PolarHBondContact O-N 3.01Å; G67-C71 PolarHBondContact O-SG 3.46Å; G67-D126 VanDerWaalsContact CA-OD1 3.23Å; G67-D126 WeakPolarHBondContact CA-OD1 3.36Å; G67-D126 PolarHBondContact N-O 3.44Å; G67-D126 PolarHBondContact N-OD1 2.04Å
68	H	95	Very high	94.7	Very high	63 Å²	63	30.9 Å²	30.9	29%	0.292	17%	0.17	S	C	.	.	H	α-helix	trans	-62.6	-24.2	-179.2	73.9	-96.7	0	0	0	113.6	V70 Y105 D126 S218 S235	H68-V70 PolarHBondContact O-N 2.99Å; H68-Y105 HydrophobicContact CB-CE1 4.23Å; H68-Y105 WeakPolarHBondContact CB-OH 3.21Å; H68-D126 IonicContact CE1-OD2 3.78Å; H68-D126 IonicContact CG-OD2 2.62Å; H68-D126 PolarHBondContact N-OD1 2.93Å; H68-D126 IonicContact ND1-OD1 2.87Å; H68-D126 IonicContact ND1-OD2 3.88Å; H68-D126 PolarHBondContact ND1-OD2 3.3Å; H68-S218 VanDerWaalsContact CE1-CB 3.47Å; H68-S218 WeakPolarHBondContact CE1-CB 3.27Å; H68-S218 PolarHBondContact CE1-OG 2.9Å; H68-S218 VanDerWaalsContact CE1-OG 3.31Å; H68-S218 WeakPolarHBondContact NE2-CB 3.27Å; H68-S218 PolarHBondContact NE2-OG 3.1Å; H68-S235 PolarHBondContact CE1-O 3.46Å
69	C	95.8	Very high	94.7	Very high	7 Å²	7	30.5 Å²	30.5	5%	0.047	17%	0.168	C	C	.	.	H	α-helix	trans	-65.4	-22	174.1	-69.2	0	0	0	0	113.3	C53 A66 G67 S218	C53-C69 HydrophobicContact CB-CB 3.77Å; C53-C69 WeakPolarHBondContact CB-SG 3.02Å; C53-C69 WeakPolarHBondContact SG-CB 3.32Å; C53-C69 CovalentContact SG-SG 2.04Å; C53-C69 PolarHBondContact SG-SG 3.08Å; A66-C69 WeakPolarHBondContact O-CB 3.4Å; A66-C69 PolarHBondContact O-N 3.46Å; G67-C69 PolarHBondContact O-N 2.75Å; G67-C69 VanDerWaalsContact O-N 3.14Å; C69-S218 VanDerWaalsContact SG-CB 3.58Å
70	V	95.3	Very high	94.7	Very high	10 Å²	10	29.8 Å²	29.8	6%	0.061	16%	0.163	C	C	.	.	H	α-helix	trans	-123.4	-4.7	-174.8	-54	0	0	0	0	113.8	T65 G67 H68 S72 V76 V99 V101 A128 V130	T65-V70 HydrophobicContact CG2-CG1 4.18Å; G67-V70 VanDerWaalsContact O-CG2 3.3Å; G67-V70 WeakPolarHBondContact O-CG2 3.34Å; G67-V70 PolarHBondContact O-N 3.35Å; H68-V70 PolarHBondContact O-N 2.99Å; V70-S72 VanDerWaalsContact C-N 3.28Å; V70-S72 PolarHBondContact O-N 2.97Å; V70-V76 HydrophobicContact CG1-CG2 3.9Å; V70-V99 HydrophobicContact CB-CB 4.29Å; V70-V99 HydrophobicContact CB-CG1 4.06Å; V70-V99 HydrophobicContact CB-CG2 4.41Å; V70-V99 HydrophobicContact CG1-CG1 4.03Å; V70-V99 HydrophobicContact CG2-CB 4.34Å; V70-V99 HydrophobicContact CG2-CG2 4.46Å; V70-V101 HydrophobicContact CG2-CG2 3.58Å; V70-A128 HydrophobicContact CG2-CB 3.41Å; V70-A128 VanDerWaalsContact CG2-CB 3.41Å; V70-V130 HydrophobicContact CG1-CG2 3.82Å
71	C	92.6	Very high	94.7	Very high	4 Å²	4	27.5 Å²	27.5	3%	0.027	15%	0.149	C	C	.	.	H	α-helix	trans	-69.3	-28.1	176.2	-71.9	0	0	0	0	112.8	G67 Y105 C109 R113	G67-C71 PolarHBondContact O-N 3.01Å; G67-C71 PolarHBondContact O-SG 3.46Å; C71-Y105 WeakPolarHBondContact SG-CE1 3.36Å; C71-C109 VanDerWaalsContact CA-SG 3.56Å; C71-C109 HydrophobicContact CB-CB 3.75Å; C71-C109 WeakPolarHBondContact CB-SG 3.12Å; C71-C109 WeakPolarHBondContact SG-CA 3.4Å; C71-C109 WeakPolarHBondContact SG-CB 3.35Å; C71-C109 CovalentContact SG-SG 2.03Å; C71-C109 PolarHBondContact SG-SG 3.13Å; C71-R113 WeakPolarHBondContact O-CG 3.34Å; C71-R113 PolarHBondContact O-NE 2.9Å; C71-R113 VanDerWaalsContact O-NE 3.13Å
72	S	83.9	Confident	94.6	Very high	52 Å²	52	24.9 Å²	24.9	36%	0.364	14%	0.141	S	C	.	.	S	Bend	trans	-53.2	142.4	178.6	177.3	0	0	0	0	110.9	V70 L74	V70-S72 VanDerWaalsContact C-N 3.28Å; V70-S72 PolarHBondContact O-N 2.97Å; S72-L74 PolarHBondContact O-N 3.17Å; S72-L74 PolarHBondContact OG-N 2.92Å; S72-L74 VanDerWaalsContact OG-N 3.11Å; S72-L74 PolarHBondContact OG-O 3.35Å
73	P	78.9	Confident	94.5	Very high	102 Å²	102	25 Å²	25	66%	0.662	14%	0.142	S	C	*	.	S	Bend	trans	-63.5	-19.5	170.4	26.7	-33.7	0	0	0	112.6
74	L	85.5	Confident	94.3	Very high	41 Å²	41	27.2 Å²	27.2	22%	0.215	15%	0.153	C	C	.	.	S	Bend	trans	-85.3	118.3	173.1	-53.3	-178.2	0	0	0	109	E49 R50 S72	E49-L74 HydrophobicContact CB-CB 4.24Å; E49-L74 HydrophobicContact CB-CD1 4.1Å; E49-L74 HydrophobicContact CG-CB 4.45Å; E49-L74 WeakPolarHBondContact OE2-CD2 3.48Å; R50-L74 HydrophobicContact CB-CD1 4.46Å; R50-L74 VanDerWaalsContact CD-CD1 3.45Å; R50-L74 HydrophobicContact CG-CD1 3.56Å; S72-L74 PolarHBondContact O-N 3.17Å; S72-L74 PolarHBondContact OG-N 2.92Å; S72-L74 VanDerWaalsContact OG-N 3.11Å; S72-L74 PolarHBondContact OG-O 3.35Å
75	P	90.8	Very high	94	Very high	74 Å²	74	35 Å²	35	48%	0.481	18%	0.182	S	C	.	.	P	Polyproline II helix	trans	-72.8	164	-171.3	30.8	-35.6	0	0	0	112	I77	P75-I77 HydrophobicContact CG-CG2 4.31Å; P75-I77 PolarHBondContact O-N 3.2Å
76	V	95.4	Very high	93.6	Very high	10 Å²	10	39.1 Å²	39.1	6%	0.061	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	125.7	156.2	-178	0	0	0	0	106.5	L46 T47 T48 V70 V79 P96 V130	L46-V76 HydrophobicContact CB-CG1 4.3Å; L46-V76 HydrophobicContact CG-CG1 4.39Å; T47-V76 WeakPolarHBondContact O-CA 3.4Å; T48-V76 HydrophobicContact CG2-CG2 4.2Å; V70-V76 HydrophobicContact CG1-CG2 3.9Å; V76-V79 HydrophobicContact CG1-CG2 4.16Å; V76-P96 HydrophobicContact CB-CG 4.4Å; V76-P96 HydrophobicContact CG1-CG 4.31Å; V76-P96 WeakPolarHBondContact O-CG 3.21Å; V76-V130 HydrophobicContact CG2-CG2 4.27Å
77	I	96	Very high	93	Very high	71 Å²	71	40.9 Å²	40.9	36%	0.364	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	-18.2	-177.4	59.5	170.1	0	0	0	112.4	T47 E49 P75 Q95	T47-I77 HydrophobicContact CG2-CD1 4.07Å; T47-I77 HydrophobicContact CG2-CG1 4.07Å; T47-I77 WeakPolarHBondContact O-CG1 3.4Å; T47-I77 PolarHBondContact O-N 2.98Å; E49-I77 HydrophobicContact CG-CG2 4.11Å; P75-I77 HydrophobicContact CG-CG2 4.31Å; P75-I77 PolarHBondContact O-N 3.2Å; I77-Q95 PolarHBondContact O-OE1 3.39Å; I77-Q95 VanDerWaalsContact O-OE1 3.05Å
78	R	96.8	Very high	92.5	Very high	55 Å²	55	42.3 Å²	42.3	21%	0.208	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	141.8	-179.9	-176.9	178.4	56.5	162.7	-3.7	110.8	T47 H93	T47-R78 PolarHBondContact N-O 3.38Å; T47-R78 PolarHBondContact O-N 3.06Å; T47-R78 PolarHBondContact OG1-NE 2.96Å; T47-R78 PolarHBondContact OG1-NH2 2.79Å; R78-H93 HydrophobicContact CG-CB 4.37Å
79	V	98.1	Very high	92.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	126.2	168.3	-177.9	0	0	0	0	107.6	A44 F45 L46 V63 V76 F81 H94 V130 L132	A44-V79 HydrophobicContact CB-CG1 3.98Å; F45-V79 WeakPolarHBondContact O-CA 3.38Å; L46-V79 HydrophobicContact CD1-CG1 4.48Å; L46-V79 HydrophobicContact CG-CG2 4.49Å; V63-V79 HydrophobicContact CG2-CG1 4.04Å; V76-V79 HydrophobicContact CG1-CG2 4.16Å; V79-F81 HydrophobicContact CG1-CE2 3.78Å; V79-F81 HydrophobicContact CG1-CZ 3.78Å; V79-H94 PolarHBondContact N-O 3.5Å; V79-H94 PolarHBondContact O-N 3.16Å; V79-V130 HydrophobicContact CG2-CG1 4Å; V79-L132 HydrophobicContact CB-CD2 3.81Å; V79-L132 HydrophobicContact CG1-CD2 4.01Å; V79-L132 HydrophobicContact CG2-CD2 3.8Å
80	S	98	Very high	91.9	Very high	2 Å²	2	55 Å²	55	1%	0.014	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	139.5	-179.1	-47.6	0	0	0	0	111.4	A44 F45 I92 H93	A44-S80 WeakPolarHBondContact CA-O 3.44Å; F45-S80 PolarHBondContact N-O 3.02Å; F45-S80 PolarHBondContact O-N 2.84Å; S80-I92 CarbonylContact C-O 3.52Å; S80-I92 WeakPolarHBondContact CA-O 3.36Å; S80-H93 WeakPolarHBondContact CB-ND1 3.42Å; S80-H93 PolarHBondContact OG-ND1 3.38Å
81	F	98.2	Very high	91.8	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	165.8	174.9	-60.3	-81.2	0	0	0	110.6	I43 A44 L57 V63 V79 T83 G91 I92 H94 L132 V136 I142	I43-F81 WeakPolarHBondContact O-CD1 3.35Å; A44-F81 HydrophobicContact CB-CD1 4.2Å; A44-F81 HydrophobicContact CB-CE1 3.58Å; A44-F81 HydrophobicContact CB-CZ 4.05Å; L57-F81 HydrophobicContact CB-CE1 3.8Å; L57-F81 HydrophobicContact CB-CZ 4.17Å; L57-F81 HydrophobicContact CD1-CE1 4.26Å; L57-F81 HydrophobicContact CD1-CZ 3.75Å; L57-F81 HydrophobicContact CG-CE1 4.46Å; L57-F81 HydrophobicContact CG-CZ 4.42Å; V63-F81 HydrophobicContact CG2-CE1 4.44Å; V63-F81 HydrophobicContact CG2-CZ 3.69Å; V79-F81 HydrophobicContact CG1-CE2 3.78Å; V79-F81 HydrophobicContact CG1-CZ 3.78Å; F81-T83 PolarHBondContact O-N 3.2Å; F81-G91 WeakPolarHBondContact O-CA 3.39Å; F81-I92 PolarHBondContact N-O 2.78Å; F81-I92 PolarHBondContact O-N 2.92Å; F81-H94 AromaticContact CD2-CD2 3.87Å; F81-L132 HydrophobicContact CE2-CD1 4.11Å; F81-L132 HydrophobicContact CZ-CD1 4.38Å; F81-V136 HydrophobicContact CE2-CG2 4.19Å; F81-I142 HydrophobicContact CB-CD1 3.62Å; F81-I142 HydrophobicContact CB-CG1 3.74Å; F81-I142 HydrophobicContact CB-CG2 4.38Å; F81-I142 HydrophobicContact CD1-CG2 4.11Å; F81-I142 HydrophobicContact CD2-CD1 3.96Å; F81-I142 HydrophobicContact CG-CD1 3.94Å; F81-I142 HydrophobicContact CG-CG1 4.27Å; F81-I142 HydrophobicContact CG-CG2 4.13Å
82	L	97.3	Very high	92.1	Very high	32 Å²	32	57.1 Å²	57.1	17%	0.168	30%	0.301	C	S	.	.	S	Bend	trans	51.4	38.6	179.2	-55.8	-177.2	0	0	0	113	P37 P41 I92 S140 I142	P37-L82 VanDerWaalsContact CB-C 3.49Å; P37-L82 HydrophobicContact CB-CB 4.07Å; P37-L82 HydrophobicContact CB-CD2 4.29Å; P41-L82 HydrophobicContact CB-CD2 4.28Å; L82-I92 HydrophobicContact CD1-CD1 3.83Å; L82-S140 WeakPolarHBondContact CD1-O 3.39Å; L82-I142 HydrophobicContact CD1-CG1 3.98Å; L82-I142 HydrophobicContact CG-CG1 3.89Å
83	T	96.2	Very high	92.7	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.018	30%	0.3	C	S	.	.			trans	-118.3	130.3	179	169.3	0	0	0	0	110.1	F45 F81 R85 D88 Y165	F45-T83 HydrophobicContact CB-CG2 3.94Å; F81-T83 PolarHBondContact O-N 3.2Å; T83-R85 PolarHBondContact OG1-N 3.01Å; T83-R85 PolarHBondContact OG1-O 2.89Å; T83-D88 VanDerWaalsContact OG1-CB 3.25Å; T83-D88 WeakPolarHBondContact OG1-CB 3.47Å; T83-Y165 HydrophobicContact CG2-CE1 4.43Å; T83-Y165 WeakPolarHBondContact O-CE1 3.41Å; T83-Y165 PolarHBondContact O-OH 3.4Å
84	L	93.8	Very high	93.6	Very high	45 Å²	45	54.3 Å²	54.3	24%	0.236	27%	0.274	C	S	.	.	S	Bend	trans	-86.3	-18.6	173	-66.8	-177.8	0	0	0	112.6	V34 P37 D88 I181 L182	V34-L84 HydrophobicContact CB-CD2 4.12Å; V34-L84 HydrophobicContact CG1-CD2 3.8Å; V34-L84 WeakPolarHBondContact O-CD2 3.48Å; P37-L84 HydrophobicContact CB-CD2 4.31Å; P37-L84 HydrophobicContact CG-CD2 4.09Å; P37-L84 HydrophobicContact CG-CG 3.9Å; L84-D88 PolarHBondContact N-OD2 3.37Å; L84-I181 CarbonylContact O-C 3.55Å; L84-I181 WeakPolarHBondContact O-CA 3.42Å; L84-L182 HydrophobicContact CD2-CD2 4.27Å; L84-L182 PolarHBondContact O-N 2.85Å
85	R	92.8	Very high	94.2	Very high	163 Å²	163	58 Å²	58	62%	0.615	29%	0.29	S	S	*	.	B	Isolated β-bridge	trans	-152.5	152.8	-176.6	63.6	-180	175.2	-179.5	-1.4	113.8	T83 G87 D88 G180 I181	T83-R85 PolarHBondContact OG1-N 3.01Å; T83-R85 PolarHBondContact OG1-O 2.89Å; R85-G87 PolarHBondContact O-N 3.23Å; R85-D88 HydrophobicContact CG-CB 4.13Å; R85-D88 WeakPolarHBondContact O-CB 3.34Å; R85-D88 PolarHBondContact O-N 2.89Å; R85-G180 CarbonylContact C-O 3.55Å; R85-G180 WeakPolarHBondContact CA-O 3.49Å; R85-G180 WeakPolarHBondContact CB-O 3.29Å; R85-I181 HydrophobicContact CB-CG1 4.18Å
86	N	89.9	Confident	94.5	Very high	87 Å²	87	55.9 Å²	55.9	47%	0.465	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	136.2	171.5	-175.1	25.4	0	0	0	110.4	F45 D88 G180	F45-N86 HydrophobicContact CE1-CB 4.26Å; F45-N86 WeakPolarHBondContact CE1-OD1 3.47Å; F45-N86 HydrophobicContact CE2-CB 4.17Å; F45-N86 HydrophobicContact CZ-CB 3.68Å; N86-D88 VanDerWaalsContact C-N 3.27Å; N86-D88 PolarHBondContact O-N 2.89Å; N86-G180 PolarHBondContact N-O 3.22Å
87	G	85.3	Confident	94.6	Very high	37 Å²	37	59 Å²	59	38%	0.381	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	78	4.7	-177.6	0	0	0	0	0	114.9	R85 Q89	R85-G87 PolarHBondContact O-N 3.23Å; G87-Q89 PolarHBondContact O-N 3.27Å; G87-Q89 VanDerWaalsContact O-N 3.1Å; G87-Q89 PolarHBondContact O-NE2 3.32Å
88	D	87.5	Confident	94.6	Very high	31 Å²	31	57.2 Å²	57.2	17%	0.166	30%	0.297	C	S	.	.			trans	-61.4	111	171.1	-172.4	-2	0	0	0	110.9	T83 L84 R85 N86 Q90 G91 H93	T83-D88 VanDerWaalsContact OG1-CB 3.25Å; T83-D88 WeakPolarHBondContact OG1-CB 3.47Å; L84-D88 PolarHBondContact N-OD2 3.37Å; R85-D88 HydrophobicContact CG-CB 4.13Å; R85-D88 WeakPolarHBondContact O-CB 3.34Å; R85-D88 PolarHBondContact O-N 2.89Å; N86-D88 VanDerWaalsContact C-N 3.27Å; N86-D88 PolarHBondContact O-N 2.89Å; D88-Q90 VanDerWaalsContact C-N 3.25Å; D88-Q90 PolarHBondContact O-N 3.25Å; D88-Q90 PolarHBondContact OD1-N 3.45Å; D88-G91 PolarHBondContact O-N 2.87Å; D88-H93 PolarHBondContact O-CE1 3.29Å; D88-H93 PolarHBondContact O-NE2 3.45Å
89	Q	86.7	Confident	94.6	Very high	157 Å²	157	57.6 Å²	57.6	73%	0.734	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-14.6	-178.5	-56.7	-60.1	-60.1	0	0	112.6	G87 G91	G87-Q89 PolarHBondContact O-N 3.27Å; G87-Q89 VanDerWaalsContact O-N 3.1Å; G87-Q89 PolarHBondContact O-NE2 3.32Å; Q89-G91 VanDerWaalsContact C-N 3.32Å
90	Q	90.4	Very high	94.6	Very high	178 Å²	178	62.7 Å²	62.7	83%	0.832	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-8.7	175.2	-60.3	-163.9	3.5	0	0	112.5	D88	D88-Q90 VanDerWaalsContact C-N 3.25Å; D88-Q90 PolarHBondContact O-N 3.25Å; D88-Q90 PolarHBondContact OD1-N 3.45Å
91	G	94.5	Very high	94.6	Very high	8 Å²	8	63.3 Å²	63.3	8%	0.082	33%	0.331	C	S	.	.	S	Bend	trans	-64.6	156.7	172.5	0	0	0	0	0	111.9	F81 D88 Q89 H93	F81-G91 WeakPolarHBondContact O-CA 3.39Å; D88-G91 PolarHBondContact O-N 2.87Å; Q89-G91 VanDerWaalsContact C-N 3.32Å; G91-H93 PolarHBondContact O-CD2 3.06Å; G91-H93 PolarHBondContact O-NE2 2.84Å
92	I	97.2	Very high	94.6	Very high	51 Å²	51	63.3 Å²	63.3	26%	0.262	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	116.8	177.4	-59.4	178.5	0	0	0	108.3	S80 F81 L82 S140 I142	S80-I92 CarbonylContact C-O 3.52Å; S80-I92 WeakPolarHBondContact CA-O 3.36Å; F81-I92 PolarHBondContact N-O 2.78Å; F81-I92 PolarHBondContact O-N 2.92Å; L82-I92 HydrophobicContact CD1-CD1 3.83Å; I92-S140 WeakPolarHBondContact CD1-OG 3.36Å; I92-I142 HydrophobicContact CB-CD1 3.99Å; I92-I142 HydrophobicContact CD1-CD1 3.83Å; I92-I142 HydrophobicContact CD1-CG1 4.21Å; I92-I142 HydrophobicContact CG1-CD1 4.49Å; I92-I142 HydrophobicContact CG2-CD1 3.9Å
93	H	97	Very high	94.6	Very high	74 Å²	74	66.3 Å²	66.3	34%	0.343	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	131.8	-171.7	-52.9	-58.9	0	0	0	111.7	R78 S80 D88 G91	R78-H93 HydrophobicContact CG-CB 4.37Å; S80-H93 WeakPolarHBondContact CB-ND1 3.42Å; S80-H93 PolarHBondContact OG-ND1 3.38Å; D88-H93 PolarHBondContact O-CE1 3.29Å; D88-H93 PolarHBondContact O-NE2 3.45Å; G91-H93 PolarHBondContact O-CD2 3.06Å; G91-H93 PolarHBondContact O-NE2 2.84Å
94	H	98.1	Very high	94.5	Very high	22 Å²	22	67.6 Å²	67.6	10%	0.102	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	145.4	176.3	-71.3	-101.2	0	0	0	110.7	V79 F81 L132	V79-H94 PolarHBondContact N-O 3.5Å; V79-H94 PolarHBondContact O-N 3.16Å; F81-H94 AromaticContact CD2-CD2 3.87Å; H94-L132 HydrophobicContact CB-CD1 4.43Å; H94-L132 HydrophobicContact CB-CD2 3.92Å
95	Q	97.9	Very high	94.7	Very high	118 Å²	118	66.4 Å²	66.4	55%	0.551	36%	0.359	S	S	*	.			trans	-86.8	135.4	171	-67.8	-61.3	-30.9	0	0	110.1	I77 A133	I77-Q95 PolarHBondContact O-OE1 3.39Å; I77-Q95 VanDerWaalsContact O-OE1 3.05Å; Q95-A133 HydrophobicContact CB-CB 4.19Å; Q95-A133 VanDerWaalsContact O-CB 3.31Å; Q95-A133 WeakPolarHBondContact O-CB 3.38Å; Q95-A133 PolarHBondContact O-N 3.31Å
96	P	97.6	Very high	94.8	Very high	29 Å²	29	61.7 Å²	61.7	19%	0.188	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	152.3	168.4	28.6	-28.1	0	0	0	110.6	V76 V130 M131	V76-P96 HydrophobicContact CB-CG 4.4Å; V76-P96 HydrophobicContact CG1-CG 4.31Å; V76-P96 WeakPolarHBondContact O-CG 3.21Å; P96-V130 HydrophobicContact CB-CG1 3.69Å; P96-M131 CarbonylContact C-O 3.54Å; P96-M131 WeakPolarHBondContact CA-O 3.21Å
97	S	97.1	Very high	95	Very high	76 Å²	76	60.4 Å²	60.4	53%	0.531	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	-13	177.5	56.9	0	0	0	0	113.1	M131	S97-M131 PolarHBondContact N-O 2.91Å; S97-M131 PolarHBondContact OG-O 2.76Å
98	G	96.3	Very high	95.4	Very high	34 Å²	34	58.8 Å²	58.8	35%	0.351	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	170.5	174.6	179.1	0	0	0	0	0	111.7	M131	G98-M131 PolarHBondContact O-N 2.84Å
99	V	97.1	Very high	95.7	Very high	63 Å²	63	57.3 Å²	57.3	38%	0.382	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	146.9	178.1	-58.3	0	0	0	0	110.9	V70 I129 V130	V70-V99 HydrophobicContact CB-CB 4.29Å; V70-V99 HydrophobicContact CB-CG1 4.06Å; V70-V99 HydrophobicContact CB-CG2 4.41Å; V70-V99 HydrophobicContact CG1-CG1 4.03Å; V70-V99 HydrophobicContact CG2-CB 4.34Å; V70-V99 HydrophobicContact CG2-CG2 4.46Å; V99-I129 CarbonylContact C-O 3.55Å; V99-I129 VanDerWaalsContact CA-O 3.27Å; V99-I129 WeakPolarHBondContact CA-O 3.24Å; V99-V130 HydrophobicContact CG1-CG2 4.15Å
100	K	97.9	Very high	96	Very high	106 Å²	106	54.3 Å²	54.3	46%	0.461	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	124.9	171.2	-59.7	-68.2	-172.3	176.2	0	107.2	A128 I129 F259 N263	K100-A128 CarbonylContact O-C 3.58Å; K100-A128 WeakPolarHBondContact O-CA 3.42Å; K100-A128 VanDerWaalsContact O-CB 3.24Å; K100-A128 WeakPolarHBondContact O-CB 3.42Å; K100-I129 HydrophobicContact CB-CB 4.4Å; K100-I129 PolarHBondContact N-O 3.04Å; K100-I129 PolarHBondContact O-N 2.92Å; K100-F259 HydrophobicContact CB-CE2 4.39Å; K100-F259 HydrophobicContact CB-CZ 4.11Å; K100-N263 HydrophobicContact CB-CB 4.37Å; K100-N263 WeakPolarHBondContact CD-OD1 3.46Å; K100-N263 HydrophobicContact CG-CB 4.28Å; K100-N263 VanDerWaalsContact CG-OD1 3.27Å; K100-N263 WeakPolarHBondContact CG-OD1 3.25Å
101	V	97.9	Very high	96	Very high	15 Å²	15	47.2 Å²	47.2	9%	0.091	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	138.6	178.2	-178.2	0	0	0	0	108.4	V70 Y105 M106 A128	V70-V101 HydrophobicContact CG2-CG2 3.58Å; V101-Y105 HydrophobicContact CG1-CD1 4.09Å; V101-M106 HydrophobicContact CB-CE 3.71Å; V101-M106 HydrophobicContact CG1-CE 4.2Å; V101-A128 HydrophobicContact CB-CB 4.48Å; V101-A128 HydrophobicContact CG2-CB 4.06Å
102	A	98	Very high	95.7	Very high	0 Å²	0	49 Å²	49	0%	0	29%	0.287	C	S	.	.			trans	-52.2	131.2	174.9	0	0	0	0	0	110.7	G104 Y105 M106 F125 I127 M256 F259	A102-G104 PolarHBondContact O-N 2.76Å; A102-Y105 PolarHBondContact O-N 2.84Å; A102-M106 PolarHBondContact O-N 2.78Å; A102-F125 WeakPolarHBondContact CB-O 3.15Å; A102-I127 HydrophobicContact CB-CB 4.4Å; A102-I127 WeakPolarHBondContact CB-O 3.4Å; A102-I127 PolarHBondContact N-O 2.98Å; A102-M256 HydrophobicContact CB-CE 3.45Å; A102-M256 VanDerWaalsContact CB-CE 3.45Å; A102-F259 HydrophobicContact CB-CD1 4.2Å; A102-F259 HydrophobicContact CB-CD2 4.42Å; A102-F259 HydrophobicContact CB-CE1 4.28Å; A102-F259 HydrophobicContact CB-CE2 4.48Å; A102-F259 HydrophobicContact CB-CG 4.28Å; A102-F259 HydrophobicContact CB-CZ 4.41Å
103	P	96.6	Very high	95.4	Very high	96 Å²	96	52.4 Å²	52.4	62%	0.623	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-54.6	-39.5	-177.6	-29.2	35.3	0	0	0	113.4	Y105 M106	P103-Y105 PolarHBondContact O-N 2.84Å; P103-Y105 VanDerWaalsContact O-N 3.13Å; P103-M106 WeakPolarHBondContact O-CB 3.41Å; P103-M106 PolarHBondContact O-N 3.14Å; P103-M106 VanDerWaalsContact O-N 3.09Å
104	G	95.8	Very high	95	Very high	29 Å²	29	54 Å²	54	30%	0.299	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-62.1	-17.3	176.9	0	0	0	0	0	114.7	A102 L122	A102-G104 PolarHBondContact O-N 2.76Å; G104-L122 WeakPolarHBondContact O-CD1 3.08Å
105	Y	97	Very high	94.5	Very high	20 Å²	20	64.2 Å²	64.2	8%	0.078	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-99.3	-9.8	176.8	-157.9	-108	0	0	0	114	H68 C71 V101 A102 P103 P107 S108 C109 L122 F125 D126	H68-Y105 HydrophobicContact CB-CE1 4.23Å; H68-Y105 WeakPolarHBondContact CB-OH 3.21Å; C71-Y105 WeakPolarHBondContact SG-CE1 3.36Å; V101-Y105 HydrophobicContact CG1-CD1 4.09Å; A102-Y105 PolarHBondContact O-N 2.84Å; P103-Y105 PolarHBondContact O-N 2.84Å; P103-Y105 VanDerWaalsContact O-N 3.13Å; Y105-P107 VanDerWaalsContact C-N 3.3Å; Y105-S108 WeakPolarHBondContact O-CB 3.39Å; Y105-S108 PolarHBondContact O-N 3.01Å; Y105-C109 PolarHBondContact O-N 2.62Å; Y105-L122 HydrophobicContact CD2-CB 3.85Å; Y105-L122 VanDerWaalsContact CD2-O 3.3Å; Y105-L122 WeakPolarHBondContact CD2-O 3.35Å; Y105-L122 HydrophobicContact CE2-CB 4.1Å; Y105-F125 VanDerWaalsContact CB-O 3.32Å; Y105-F125 WeakPolarHBondContact CB-O 3.37Å; Y105-F125 HydrophobicContact CD2-CB 4.46Å; Y105-D126 VanDerWaalsContact CD2-CA 3.47Å; Y105-D126 HydrophobicContact CD2-CB 3.8Å; Y105-D126 WeakPolarHBondContact CE1-OD1 3.41Å; Y105-D126 HydrophobicContact CE2-CB 3.49Å; Y105-D126 VanDerWaalsContact CE2-CB 3.49Å
106	M	95.2	Very high	94.1	Very high	64 Å²	64	66.3 Å²	66.3	32%	0.315	35%	0.345	S	S	.	.	H	α-helix	trans	-57.3	-34.7	-177.8	-154.7	61.4	62.4	0	0	114	V101 A102 P103 S108 C109 M110	V101-M106 HydrophobicContact CB-CE 3.71Å; V101-M106 HydrophobicContact CG1-CE 4.2Å; A102-M106 PolarHBondContact O-N 2.78Å; P103-M106 WeakPolarHBondContact O-CB 3.41Å; P103-M106 PolarHBondContact O-N 3.14Å; P103-M106 VanDerWaalsContact O-N 3.09Å; M106-S108 VanDerWaalsContact C-N 3.29Å; M106-S108 PolarHBondContact O-N 3.46Å; M106-C109 WeakPolarHBondContact O-CB 3.38Å; M106-C109 PolarHBondContact O-N 3.13Å; M106-C109 VanDerWaalsContact O-N 3.15Å; M106-C109 HydrophobicContact SD-CB 4.11Å; M106-M110 WeakPolarHBondContact O-CG 3.24Å; M106-M110 PolarHBondContact O-N 3.09Å
107	P	94.3	Very high	93.6	Very high	60 Å²	60	70.7 Å²	70.7	39%	0.39	37%	0.373	S	S	.	.	H	α-helix	trans	-57.7	-38.7	173.1	-26	35.8	0	0	0	113.8	Y105 M110 S111 L122	Y105-P107 VanDerWaalsContact C-N 3.3Å; P107-M110 HydrophobicContact CB-CE 4.49Å; P107-M110 PolarHBondContact O-N 3.15Å; P107-S111 WeakPolarHBondContact O-CB 3.35Å; P107-S111 PolarHBondContact O-N 3.44Å; P107-S111 PolarHBondContact O-OG 3.18Å; P107-L122 HydrophobicContact CB-CD1 3.95Å; P107-L122 HydrophobicContact CG-CD1 4.2Å
108	S	93.6	Very high	92.8	Very high	4 Å²	4	71.3 Å²	71.3	3%	0.028	37%	0.37	C	S	.	.	H	α-helix	trans	-66.2	-44.2	174	-64.7	0	0	0	0	111.1	Y105 M106 M110 S111 A112 L122	Y105-S108 WeakPolarHBondContact O-CB 3.39Å; Y105-S108 PolarHBondContact O-N 3.01Å; M106-S108 VanDerWaalsContact C-N 3.29Å; M106-S108 PolarHBondContact O-N 3.46Å; S108-M110 PolarHBondContact O-N 3.35Å; S108-S111 PolarHBondContact O-N 3.22Å; S108-A112 WeakPolarHBondContact O-CB 3.3Å; S108-A112 PolarHBondContact O-N 3.01Å; S108-L122 WeakPolarHBondContact OG-CD1 3.38Å
109	C	93.2	Very high	92	Very high	0 Å²	0	74.4 Å²	74.4	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-59.9	-44.2	175.2	-78	0	0	0	0	112.4	C71 Y105 M106 A112 R113	C71-C109 VanDerWaalsContact CA-SG 3.56Å; C71-C109 HydrophobicContact CB-CB 3.75Å; C71-C109 WeakPolarHBondContact CB-SG 3.12Å; C71-C109 WeakPolarHBondContact SG-CA 3.4Å; C71-C109 WeakPolarHBondContact SG-CB 3.35Å; C71-C109 CovalentContact SG-SG 2.03Å; C71-C109 PolarHBondContact SG-SG 3.13Å; Y105-C109 PolarHBondContact O-N 2.62Å; M106-C109 WeakPolarHBondContact O-CB 3.38Å; M106-C109 PolarHBondContact O-N 3.13Å; M106-C109 VanDerWaalsContact O-N 3.15Å; M106-C109 HydrophobicContact SD-CB 4.11Å; C109-A112 PolarHBondContact O-N 2.03Å; C109-R113 WeakPolarHBondContact O-CB 3.5Å; C109-R113 VanDerWaalsContact O-CG 3.25Å; C109-R113 WeakPolarHBondContact O-CG 3.45Å; C109-R113 PolarHBondContact O-N 3.49Å
110	M	93.3	Very high	91.3	Very high	94 Å²	94	77.3 Å²	77.3	46%	0.463	40%	0.401	S	S	.	.	H	α-helix	trans	-62.7	-45.4	178.5	-70.8	-171.2	-64.4	0	0	111.3	M106 P107 S108 A112 R113 Q114	M106-M110 WeakPolarHBondContact O-CG 3.24Å; M106-M110 PolarHBondContact O-N 3.09Å; P107-M110 HydrophobicContact CB-CE 4.49Å; P107-M110 PolarHBondContact O-N 3.15Å; S108-M110 PolarHBondContact O-N 3.35Å; M110-A112 PolarHBondContact O-N 3.17Å; M110-R113 PolarHBondContact O-N 3.49Å; M110-Q114 WeakPolarHBondContact O-CB 3.47Å; M110-Q114 VanDerWaalsContact O-CG 3.31Å; M110-Q114 WeakPolarHBondContact O-CG 3.26Å; M110-Q114 PolarHBondContact O-N 2.89Å
111	S	91.5	Very high	90.6	Very high	28 Å²	28	76 Å²	76	20%	0.196	40%	0.402	C	S	.	.	H	α-helix	trans	-60	-46.1	176.9	-57.1	0	0	0	0	111.3	P107 S108 R113 Q114 R115 R116	P107-S111 WeakPolarHBondContact O-CB 3.35Å; P107-S111 PolarHBondContact O-N 3.44Å; P107-S111 PolarHBondContact O-OG 3.18Å; S108-S111 PolarHBondContact O-N 3.22Å; S111-R113 PolarHBondContact O-N 3.11Å; S111-Q114 CarbonylContact O-C 3.58Å; S111-Q114 PolarHBondContact O-N 2.76Å; S111-R115 PolarHBondContact O-N 3.35Å; S111-R116 PolarHBondContact O-N 2.96Å
112	A	88.4	Confident	90.3	Very high	46 Å²	46	76.4 Å²	76.4	38%	0.38	40%	0.404	S	S	.	.	H	α-helix	trans	-60.8	-46	177.5	0	0	0	0	0	112.6	S108 C109 M110 Q114 R115	S108-A112 WeakPolarHBondContact O-CB 3.3Å; S108-A112 PolarHBondContact O-N 3.01Å; C109-A112 PolarHBondContact O-N 2.03Å; M110-A112 PolarHBondContact O-N 3.17Å; A112-Q114 VanDerWaalsContact C-N 3.33Å; A112-Q114 PolarHBondContact O-N 2.72Å; A112-R115 PolarHBondContact O-N 2.99Å; A112-R115 VanDerWaalsContact O-N 3.09Å
113	R	89.2	Confident	89.9	Confident	123 Å²	123	76.5 Å²	76.5	46%	0.464	40%	0.404	S	S	.	.	H	α-helix	trans	-64.9	-36.4	178.6	-71.1	170.8	-172.7	169	0.7	112.6	C71 C109 M110 S111 R115	C71-R113 WeakPolarHBondContact O-CG 3.34Å; C71-R113 PolarHBondContact O-NE 2.9Å; C71-R113 VanDerWaalsContact O-NE 3.13Å; C109-R113 WeakPolarHBondContact O-CB 3.5Å; C109-R113 VanDerWaalsContact O-CG 3.25Å; C109-R113 WeakPolarHBondContact O-CG 3.45Å; C109-R113 PolarHBondContact O-N 3.49Å; M110-R113 PolarHBondContact O-N 3.49Å; S111-R113 PolarHBondContact O-N 3.11Å; R113-R115 PolarHBondContact O-N 3.24Å
114	Q	90.3	Very high	89.9	Confident	108 Å²	108	72 Å²	72	51%	0.505	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	0.2	175.8	-66.5	177.7	-0.3	0	0	113.1	M110 S111 A112 R116	M110-Q114 WeakPolarHBondContact O-CB 3.47Å; M110-Q114 VanDerWaalsContact O-CG 3.31Å; M110-Q114 WeakPolarHBondContact O-CG 3.26Å; M110-Q114 PolarHBondContact O-N 2.89Å; S111-Q114 CarbonylContact O-C 3.58Å; S111-Q114 PolarHBondContact O-N 2.76Å; A112-Q114 VanDerWaalsContact C-N 3.33Å; A112-Q114 PolarHBondContact O-N 2.72Å; Q114-R116 HydrophobicContact CB-CG 3.99Å; Q114-R116 PolarHBondContact O-N 3.14Å
115	R	86.5	Confident	90	Very high	236 Å²	236	73.6 Å²	73.6	89%	0.891	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	36.2	-173.9	-56.7	-178.3	179.2	169.4	0.7	112.8	S111 A112 R113	S111-R115 PolarHBondContact O-N 3.35Å; A112-R115 PolarHBondContact O-N 2.99Å; A112-R115 VanDerWaalsContact O-N 3.09Å; R113-R115 PolarHBondContact O-N 3.24Å
116	R	88.9	Confident	90.1	Very high	161 Å²	161	72.7 Å²	72.7	61%	0.608	37%	0.371	S	S	*	.			trans	-95	149.8	176.2	-70.8	-178.1	177.5	174.9	-4.9	110.5	S111 Q114 I118	S111-R116 PolarHBondContact O-N 2.96Å; Q114-R116 HydrophobicContact CB-CG 3.99Å; Q114-R116 PolarHBondContact O-N 3.14Å; R116-I118 PolarHBondContact O-N 3.47Å
117	P	86.9	Confident	90.2	Very high	121 Å²	121	69.7 Å²	69.7	79%	0.786	36%	0.356	S	S	*	.			trans	-56	135.9	171.4	-23.3	33.7	0	0	0	111.2	A119	P117-A119 PolarHBondContact O-N 3.3Å
118	I	82	Confident	90.4	Very high	90 Å²	90	66.8 Å²	66.8	46%	0.462	34%	0.337	S	S	.	.			trans	-77	115.5	171.9	-63.5	174.5	0	0	0	107.2	R116 Q120	R116-I118 PolarHBondContact O-N 3.47Å; I118-Q120 VanDerWaalsContact C-N 3.34Å; I118-Q120 WeakPolarHBondContact CG2-O 3.48Å
119	A	78.5	Confident	90.7	Very high	98 Å²	98	66.6 Å²	66.6	81%	0.81	34%	0.336	S	S	*	.	S	Bend	trans	-70.8	-30.4	-177.3	0	0	0	0	0	113	P117	P117-A119 PolarHBondContact O-N 3.3Å
120	Q	81.6	Confident	90.9	Very high	124 Å²	124	66.6 Å²	66.6	58%	0.579	34%	0.336	S	S	*	.	S	Bend	trans	-146.7	138	-176.1	-60.5	-178.3	29.7	0	0	110.5	I118 L122	I118-Q120 VanDerWaalsContact C-N 3.34Å; I118-Q120 WeakPolarHBondContact CG2-O 3.48Å; Q120-L122 PolarHBondContact O-N 2.66Å
121	T	84.4	Confident	91.2	Very high	78 Å²	78	64.2 Å²	64.2	48%	0.479	32%	0.324	S	S	.	.			trans	-72.5	125.8	174	-46.8	0	0	0	0	109.8	N197 H236	T121-N197 WeakPolarHBondContact O-CB 3.49Å; T121-N197 PolarHBondContact O-ND2 2.93Å; T121-H236 WeakPolarHBondContact CG2-CE1 3.26Å
122	L	92	Very high	91.5	Very high	24 Å²	24	62.9 Å²	62.9	13%	0.126	32%	0.315	C	S	.	.			trans	-111	39.7	-177.4	-62	177.9	0	0	0	111.9	G104 Y105 P107 S108 Q120 G124 F125 D126 N197	G104-L122 WeakPolarHBondContact O-CD1 3.08Å; Y105-L122 HydrophobicContact CD2-CB 3.85Å; Y105-L122 VanDerWaalsContact CD2-O 3.3Å; Y105-L122 WeakPolarHBondContact CD2-O 3.35Å; Y105-L122 HydrophobicContact CE2-CB 4.1Å; P107-L122 HydrophobicContact CB-CD1 3.95Å; P107-L122 HydrophobicContact CG-CD1 4.2Å; S108-L122 WeakPolarHBondContact OG-CD1 3.38Å; Q120-L122 PolarHBondContact O-N 2.66Å; L122-G124 PolarHBondContact O-N 2.91Å; L122-F125 HydrophobicContact CB-CD2 4.3Å; L122-F125 HydrophobicContact CD2-CD2 4.41Å; L122-F125 PolarHBondContact O-N 2.95Å; L122-D126 PolarHBondContact O-N 3.43Å; L122-N197 HydrophobicContact CD2-CB 4.01Å
123	S	89.8	Confident	92	Very high	2 Å²	2	62.7 Å²	62.7	1%	0.014	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-60.8	-36.1	-170.4	48.4	0	0	0	0	115.3	F125 D126 H236 E249 A251	S123-F125 PolarHBondContact O-N 3.08Å; S123-F125 VanDerWaalsContact O-N 3.15Å; S123-D126 WeakPolarHBondContact O-CB 3.14Å; S123-D126 PolarHBondContact O-N 3.42Å; S123-D126 VanDerWaalsContact O-N 3.08Å; S123-H236 VanDerWaalsContact CB-CE1 3.45Å; S123-H236 WeakPolarHBondContact CB-CE1 3.13Å; S123-E249 WeakPolarHBondContact CB-OE2 3.25Å; S123-E249 PolarHBondContact OG-OE2 3.26Å; S123-A251 WeakPolarHBondContact O-CA 3.45Å; S123-A251 WeakPolarHBondContact O-CB 3.4Å
124	G	96.2	Very high	92.4	Very high	1 Å²	1	64 Å²	64	1%	0.01	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-63.7	-18.5	174.8	0	0	0	0	0	113.3	L122 N197	L122-G124 PolarHBondContact O-N 2.91Å; G124-N197 VanDerWaalsContact CA-O 3.23Å; G124-N197 WeakPolarHBondContact CA-O 2.97Å; G124-N197 PolarHBondContact N-O 3.48Å
125	F	97.8	Very high	92.8	Very high	64 Å²	64	64.9 Å²	64.9	28%	0.281	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-103	-2.4	175.7	-53.7	-63.7	0	0	0	113.5	A102 Y105 L122 S123 I127 G198 M256	A102-F125 WeakPolarHBondContact CB-O 3.15Å; Y105-F125 VanDerWaalsContact CB-O 3.32Å; Y105-F125 WeakPolarHBondContact CB-O 3.37Å; Y105-F125 HydrophobicContact CD2-CB 4.46Å; L122-F125 HydrophobicContact CB-CD2 4.3Å; L122-F125 HydrophobicContact CD2-CD2 4.41Å; L122-F125 PolarHBondContact O-N 2.95Å; S123-F125 PolarHBondContact O-N 3.08Å; S123-F125 VanDerWaalsContact O-N 3.15Å; F125-I127 PolarHBondContact O-N 2.85Å; F125-G198 VanDerWaalsContact CZ-CA 3.43Å; F125-M256 HydrophobicContact CD1-CE 4.36Å; F125-M256 HydrophobicContact CD1-SD 3.96Å
126	D	98.1	Very high	93.4	Very high	1 Å²	1	54 Å²	54	1%	0.005	29%	0.29	C	S	.	.			trans	-71.3	66.5	-172.5	-170.2	13.6	0	0	0	112.7	A66 G67 H68 Y105 L122 S123 S235 A251	A66-D126 WeakPolarHBondContact CA-O 3.22Å; G67-D126 VanDerWaalsContact CA-OD1 3.23Å; G67-D126 WeakPolarHBondContact CA-OD1 3.36Å; G67-D126 PolarHBondContact N-O 3.44Å; G67-D126 PolarHBondContact N-OD1 2.04Å; H68-D126 IonicContact CE1-OD2 3.78Å; H68-D126 IonicContact CG-OD2 2.62Å; H68-D126 PolarHBondContact N-OD1 2.93Å; H68-D126 IonicContact ND1-OD1 2.87Å; H68-D126 IonicContact ND1-OD2 3.88Å; H68-D126 PolarHBondContact ND1-OD2 3.3Å; Y105-D126 VanDerWaalsContact CD2-CA 3.47Å; Y105-D126 HydrophobicContact CD2-CB 3.8Å; Y105-D126 WeakPolarHBondContact CE1-OD1 3.41Å; Y105-D126 HydrophobicContact CE2-CB 3.49Å; Y105-D126 VanDerWaalsContact CE2-CB 3.49Å; L122-D126 PolarHBondContact O-N 3.43Å; S123-D126 WeakPolarHBondContact O-CB 3.14Å; S123-D126 PolarHBondContact O-N 3.42Å; S123-D126 VanDerWaalsContact O-N 3.08Å; D126-S235 WeakPolarHBondContact CB-OG 3.45Å; D126-S235 WeakPolarHBondContact OD2-CA 3.42Å; D126-S235 VanDerWaalsContact OD2-CB 3.31Å; D126-S235 WeakPolarHBondContact OD2-CB 3.46Å; D126-S235 PolarHBondContact OD2-OG 3.46Å; D126-A251 HydrophobicContact CB-CB 4.33Å; D126-A251 WeakPolarHBondContact O-CB 3.43Å
127	I	98.5	Very high	93.8	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.284	C	S	.	.			trans	-129.8	139.2	-179.6	-64.2	-164.4	0	0	0	109.6	L64 A102 F125 V233 A251 V253 M256 F259 V260	L64-I127 HydrophobicContact CD1-CG2 3.6Å; A102-I127 HydrophobicContact CB-CB 4.4Å; A102-I127 WeakPolarHBondContact CB-O 3.4Å; A102-I127 PolarHBondContact N-O 2.98Å; F125-I127 PolarHBondContact O-N 2.85Å; I127-V233 HydrophobicContact CD1-CG2 4.29Å; I127-V233 HydrophobicContact CG1-CG2 3.78Å; I127-A251 HydrophobicContact CD1-CB 3.87Å; I127-A251 HydrophobicContact CG1-CB 3.38Å; I127-V253 HydrophobicContact CD1-CG2 4.35Å; I127-M256 HydrophobicContact CD1-CB 3.69Å; I127-M256 HydrophobicContact CD1-CG 3.73Å; I127-M256 HydrophobicContact CG1-CG 4.43Å; I127-F259 HydrophobicContact CG2-CD1 4.06Å; I127-F259 HydrophobicContact CG2-CE1 3.82Å; I127-V260 HydrophobicContact CG2-CG2 4.37Å
128	A	98.5	Very high	94.3	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	163.4	166.3	0	0	0	0	0	111.6	T65 V70 K100 V101	T65-A128 HydrophobicContact CG2-CB 4.27Å; T65-A128 PolarHBondContact N-O 3.31Å; T65-A128 PolarHBondContact O-N 3.33Å; V70-A128 HydrophobicContact CG2-CB 3.41Å; V70-A128 VanDerWaalsContact CG2-CB 3.41Å; K100-A128 CarbonylContact O-C 3.58Å; K100-A128 WeakPolarHBondContact O-CA 3.42Å; K100-A128 VanDerWaalsContact O-CB 3.24Å; K100-A128 WeakPolarHBondContact O-CB 3.42Å; V101-A128 HydrophobicContact CB-CB 4.48Å; V101-A128 HydrophobicContact CG2-CB 4.06Å
129	I	98.7	Very high	95	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	128.2	171.6	-67.3	163.1	0	0	0	108.2	A62 V63 L64 V99 K100 M131 F259 V260 N263 I264	A62-I129 HydrophobicContact CB-CG2 3.69Å; V63-I129 CarbonylContact O-C 3.55Å; V63-I129 VanDerWaalsContact O-CA 3.32Å; V63-I129 WeakPolarHBondContact O-CA 3.39Å; L64-I129 HydrophobicContact CD1-CG1 3.96Å; V99-I129 CarbonylContact C-O 3.55Å; V99-I129 VanDerWaalsContact CA-O 3.27Å; V99-I129 WeakPolarHBondContact CA-O 3.24Å; K100-I129 HydrophobicContact CB-CB 4.4Å; K100-I129 PolarHBondContact N-O 3.04Å; K100-I129 PolarHBondContact O-N 2.92Å; I129-M131 HydrophobicContact CG2-SD 3.57Å; I129-M131 VanDerWaalsContact CG2-SD 3.57Å; I129-F259 HydrophobicContact CD1-CE1 4.11Å; I129-F259 HydrophobicContact CD1-CZ 4.49Å; I129-F259 HydrophobicContact CG1-CE1 4.34Å; I129-V260 HydrophobicContact CD1-CG1 4.43Å; I129-N263 HydrophobicContact CD1-CB 3.55Å; I129-I264 HydrophobicContact CD1-CG2 3.83Å
130	V	98.6	Very high	95.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	122.6	167.1	179.2	0	0	0	0	108.1	L46 V63 T65 V70 V76 V79 P96 V99	L46-V130 HydrophobicContact CD2-CG2 4.1Å; V63-V130 HydrophobicContact CB-CB 4.38Å; V63-V130 PolarHBondContact N-O 3.18Å; V63-V130 PolarHBondContact O-N 2.98Å; T65-V130 HydrophobicContact CG2-CG2 3.92Å; V70-V130 HydrophobicContact CG1-CG2 3.82Å; V76-V130 HydrophobicContact CG2-CG2 4.27Å; V79-V130 HydrophobicContact CG2-CG1 4Å; P96-V130 HydrophobicContact CB-CG1 3.69Å; V99-V130 HydrophobicContact CG1-CG2 4.15Å
131	M	98.5	Very high	96.6	Very high	44 Å²	44	45.4 Å²	45.4	22%	0.217	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	128.6	178.4	-60.6	-56.4	-68.8	0	0	110.2	R61 A62 P96 S97 G98 I129	R61-M131 HydrophobicContact CB-CE 4.43Å; R61-M131 CarbonylContact O-C 3.47Å; R61-M131 WeakPolarHBondContact O-CA 3.35Å; A62-M131 HydrophobicContact CB-SD 4.14Å; P96-M131 CarbonylContact C-O 3.54Å; P96-M131 WeakPolarHBondContact CA-O 3.21Å; S97-M131 PolarHBondContact N-O 2.91Å; S97-M131 PolarHBondContact OG-O 2.76Å; G98-M131 PolarHBondContact O-N 2.84Å; I129-M131 HydrophobicContact CG2-SD 3.57Å; I129-M131 VanDerWaalsContact CG2-SD 3.57Å
132	L	98.7	Very high	97.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	138.1	178.6	-54.1	176.6	0	0	0	111.2	L57 R61 V63 V79 F81 H94 Q134 V136	L57-L132 HydrophobicContact CD1-CD1 4.05Å; R61-L132 PolarHBondContact NE-O 2.86Å; R61-L132 PolarHBondContact NH2-O 3.47Å; R61-L132 PolarHBondContact O-N 2.91Å; V63-L132 HydrophobicContact CG2-CD1 4.21Å; V63-L132 HydrophobicContact CG2-CD2 4.13Å; V63-L132 HydrophobicContact CG2-CG 4.28Å; V79-L132 HydrophobicContact CB-CD2 3.81Å; V79-L132 HydrophobicContact CG1-CD2 4.01Å; V79-L132 HydrophobicContact CG2-CD2 3.8Å; F81-L132 HydrophobicContact CE2-CD1 4.11Å; F81-L132 HydrophobicContact CZ-CD1 4.38Å; H94-L132 HydrophobicContact CB-CD1 4.43Å; H94-L132 HydrophobicContact CB-CD2 3.92Å; L132-Q134 WeakPolarHBondContact CB-O 3.43Å; L132-Q134 PolarHBondContact O-N 2.96Å; L132-V136 HydrophobicContact CD1-CG2 3.52Å
133	A	98.4	Very high	97.6	Very high	41 Å²	41	46.5 Å²	46.5	34%	0.339	24%	0.238	S	C	.	.	S	Bend	trans	-64.6	-23.4	179.2	0	0	0	0	0	113.4	R61 Q95	R61-A133 PolarHBondContact NH2-O 3.2Å; Q95-A133 HydrophobicContact CB-CB 4.19Å; Q95-A133 VanDerWaalsContact O-CB 3.31Å; Q95-A133 WeakPolarHBondContact O-CB 3.38Å; Q95-A133 PolarHBondContact O-N 3.31Å
134	Q	98.2	Very high	98	Very high	150 Å²	150	49.1 Å²	49.1	70%	0.701	25%	0.254	S	S	*	.	S	Bend	trans	-134.9	151	174.8	-62.1	-178.7	41.5	0	0	109.7	L132	L132-Q134 WeakPolarHBondContact CB-O 3.43Å; L132-Q134 PolarHBondContact O-N 2.96Å
135	M	98.4	Very high	98.1	Very high	127 Å²	127	49.4 Å²	49.4	63%	0.626	26%	0.255	S	S	*	.			trans	-61.8	140.5	172.6	-71.4	-177.7	178.3	0	0	110.7	T60 R61 N137	T60-M135 CarbonylContact O-C 3.59Å; T60-M135 WeakPolarHBondContact O-CA 3.38Å; R61-M135 HydrophobicContact CG-CB 4.26Å; R61-M135 HydrophobicContact CG-CG 3.48Å; R61-M135 VanDerWaalsContact CG-CG 3.48Å; M135-N137 PolarHBondContact O-N 3.35Å
136	V	98.2	Very high	98.2	Very high	7 Å²	7	49.3 Å²	49.3	4%	0.042	26%	0.262	C	S	.	.			trans	-66.4	127.9	168.3	175.2	0	0	0	0	109.1	L57 T60 F81 L132 L138 I142	L57-V136 HydrophobicContact CD1-CG2 3.84Å; L57-V136 HydrophobicContact CD2-CB 4.15Å; L57-V136 HydrophobicContact CD2-CG1 4.04Å; L57-V136 HydrophobicContact CD2-CG2 3.94Å; T60-V136 PolarHBondContact O-N 2.74Å; F81-V136 HydrophobicContact CE2-CG2 4.19Å; L132-V136 HydrophobicContact CD1-CG2 3.52Å; V136-L138 HydrophobicContact CG1-CD2 4.11Å; V136-L138 PolarHBondContact O-N 3.02Å; V136-I142 HydrophobicContact CG1-CB 3.69Å; V136-I142 HydrophobicContact CG1-CD1 3.62Å; V136-I142 HydrophobicContact CG1-CG1 4.26Å; V136-I142 HydrophobicContact CG1-CG2 3.57Å
137	N	97.9	Very high	98.2	Very high	92 Å²	92	51 Å²	51	49%	0.492	27%	0.271	S	S	.	.			trans	-77.9	105.2	168.1	-178.8	2.5	0	0	0	110	M135 Q139 S140	M135-N137 PolarHBondContact O-N 3.35Å; N137-Q139 PolarHBondContact O-N 2.94Å; N137-Q139 VanDerWaalsContact OD1-CB 3.26Å; N137-Q139 WeakPolarHBondContact OD1-CB 3.25Å; N137-Q139 PolarHBondContact OD1-N 3.22Å; N137-S140 VanDerWaalsContact O-CB 3.26Å; N137-S140 WeakPolarHBondContact O-CB 3.36Å; N137-S140 PolarHBondContact O-N 3.03Å; N137-S140 VanDerWaalsContact O-N 3.09Å; N137-S140 PolarHBondContact O-OG 2.88Å
138	L	97.6	Very high	98.2	Very high	71 Å²	71	51 Å²	51	37%	0.372	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-66.7	-17.7	-179.3	-58.9	-178.9	0	0	0	113.7	T60 V136 S140 G141 R143 V144	T60-L138 HydrophobicContact CG2-CD1 4.11Å; T60-L138 HydrophobicContact CG2-CD2 4.44Å; T60-L138 HydrophobicContact CG2-CG 4.27Å; V136-L138 HydrophobicContact CG1-CD2 4.11Å; V136-L138 PolarHBondContact O-N 3.02Å; L138-S140 PolarHBondContact O-N 3.12Å; L138-G141 PolarHBondContact O-N 2.88Å; L138-R143 PolarHBondContact O-NH1 2.8Å; L138-V144 HydrophobicContact CD2-CG2 4.14Å
139	Q	97.6	Very high	98.1	Very high	181 Å²	181	55.3 Å²	55.3	85%	0.846	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-67.1	-18.3	173.7	-60.8	179.6	-24.8	0	0	112.5	N137 G141	N137-Q139 PolarHBondContact O-N 2.94Å; N137-Q139 VanDerWaalsContact OD1-CB 3.26Å; N137-Q139 WeakPolarHBondContact OD1-CB 3.25Å; N137-Q139 PolarHBondContact OD1-N 3.22Å; Q139-G141 PolarHBondContact O-N 2.9Å
140	S	96.3	Very high	98	Very high	45 Å²	45	59.4 Å²	59.4	32%	0.315	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-70.4	-9.4	176.7	67.4	0	0	0	0	114.8	L82 I92 N137 L138 I142	L82-S140 WeakPolarHBondContact CD1-O 3.39Å; I92-S140 WeakPolarHBondContact CD1-OG 3.36Å; N137-S140 VanDerWaalsContact O-CB 3.26Å; N137-S140 WeakPolarHBondContact O-CB 3.36Å; N137-S140 PolarHBondContact O-N 3.03Å; N137-S140 VanDerWaalsContact O-N 3.09Å; N137-S140 PolarHBondContact O-OG 2.88Å; L138-S140 PolarHBondContact O-N 3.12Å; S140-I142 WeakPolarHBondContact OG-CD1 3.12Å; S140-I142 WeakPolarHBondContact OG-CG1 3.48Å
141	G	97.3	Very high	97.9	Very high	26 Å²	26	64.3 Å²	64.3	27%	0.268	35%	0.352	S	S	.	.	S	Bend	trans	101.8	-14.7	-174.8	0	0	0	0	0	113.9	P41 L138 Q139 R143	P41-G141 WeakPolarHBondContact CB-O 3.36Å; L138-G141 PolarHBondContact O-N 2.88Å; Q139-G141 PolarHBondContact O-N 2.9Å; G141-R143 VanDerWaalsContact C-NH1 3.34Å; G141-R143 PolarHBondContact O-NH1 3.35Å
142	I	98.3	Very high	97.8	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	36%	0.358	C	S	.	.			trans	-61.5	143.5	171.3	-57.1	166.4	0	0	0	109.6	P41 L57 F81 L82 I92 V136 S140	P41-I142 WeakPolarHBondContact O-CA 3.14Å; P41-I142 WeakPolarHBondContact O-CG2 3.39Å; L57-I142 HydrophobicContact CD2-CG2 3.56Å; F81-I142 HydrophobicContact CB-CD1 3.62Å; F81-I142 HydrophobicContact CB-CG1 3.74Å; F81-I142 HydrophobicContact CB-CG2 4.38Å; F81-I142 HydrophobicContact CD1-CG2 4.11Å; F81-I142 HydrophobicContact CD2-CD1 3.96Å; F81-I142 HydrophobicContact CG-CD1 3.94Å; F81-I142 HydrophobicContact CG-CG1 4.27Å; F81-I142 HydrophobicContact CG-CG2 4.13Å; L82-I142 HydrophobicContact CD1-CG1 3.98Å; L82-I142 HydrophobicContact CG-CG1 3.89Å; I92-I142 HydrophobicContact CB-CD1 3.99Å; I92-I142 HydrophobicContact CD1-CD1 3.83Å; I92-I142 HydrophobicContact CD1-CG1 4.21Å; I92-I142 HydrophobicContact CG1-CD1 4.49Å; I92-I142 HydrophobicContact CG2-CD1 3.9Å; V136-I142 HydrophobicContact CG1-CB 3.69Å; V136-I142 HydrophobicContact CG1-CD1 3.62Å; V136-I142 HydrophobicContact CG1-CG1 4.26Å; V136-I142 HydrophobicContact CG1-CG2 3.57Å; S140-I142 WeakPolarHBondContact OG-CD1 3.12Å; S140-I142 WeakPolarHBondContact OG-CG1 3.48Å
143	R	98.2	Very high	97.6	Very high	125 Å²	125	67.4 Å²	67.4	47%	0.472	37%	0.369	S	S	.	.			trans	-127.9	150.6	177.9	-61.4	-67.6	177.6	-97.4	3.8	111.2	P41 F42 L138 G141	P41-R143 HydrophobicContact CB-CB 4.12Å; P41-R143 HydrophobicContact CB-CG 3.87Å; P41-R143 HydrophobicContact CG-CB 3.85Å; P41-R143 HydrophobicContact CG-CG 3.61Å; P41-R143 PolarHBondContact O-N 2.94Å; F42-R143 WeakPolarHBondContact CA-O 3.34Å; F42-R143 WeakPolarHBondContact CB-O 3.49Å; L138-R143 PolarHBondContact O-NH1 2.8Å; G141-R143 VanDerWaalsContact C-NH1 3.34Å; G141-R143 PolarHBondContact O-NH1 3.35Å
144	V	98.5	Very high	97.4	Very high	57 Å²	57	66.3 Å²	66.3	35%	0.345	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-87.2	127.5	168.7	176.4	0	0	0	0	107.9	L57 V58 L138	L57-V144 HydrophobicContact CD2-CG2 3.86Å; L57-V144 HydrophobicContact CG-CG2 4.15Å; L57-V144 CarbonylContact O-C 3.53Å; L57-V144 WeakPolarHBondContact O-CA 3.19Å; V58-V144 VanDerWaalsContact O-CG1 3.28Å; V58-V144 WeakPolarHBondContact O-CG1 3.47Å; L138-V144 HydrophobicContact CD2-CG2 4.14Å
145	I	98.5	Very high	97.3	Very high	7 Å²	7	63.2 Å²	63.2	4%	0.036	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-80.5	146.5	173	-156	176.6	0	0	0	110.2	F42 L57 V58 L223 G228 V230	F42-I145 HydrophobicContact CB-CB 3.91Å; F42-I145 HydrophobicContact CD1-CB 4.03Å; F42-I145 HydrophobicContact CD1-CD1 4.02Å; F42-I145 HydrophobicContact CD1-CG1 4.03Å; F42-I145 HydrophobicContact CD2-CB 4.12Å; F42-I145 HydrophobicContact CD2-CD1 3.76Å; F42-I145 HydrophobicContact CD2-CG1 4.36Å; F42-I145 HydrophobicContact CE1-CD1 3.77Å; F42-I145 HydrophobicContact CE1-CG1 4.14Å; F42-I145 HydrophobicContact CE2-CD1 3.51Å; F42-I145 HydrophobicContact CE2-CG1 4.48Å; F42-I145 HydrophobicContact CG-CB 3.75Å; F42-I145 HydrophobicContact CG-CD1 4.01Å; F42-I145 HydrophobicContact CG-CG1 4.14Å; F42-I145 HydrophobicContact CZ-CD1 3.49Å; F42-I145 VanDerWaalsContact CZ-CD1 3.49Å; F42-I145 HydrophobicContact CZ-CG1 4.35Å; L57-I145 PolarHBondContact O-N 2.89Å; V58-I145 HydrophobicContact CG1-CG2 3.99Å; I145-L223 HydrophobicContact CD1-CD2 3.39Å; I145-G228 VanDerWaalsContact CD1-O 3.24Å; I145-G228 WeakPolarHBondContact CD1-O 3.23Å; I145-G228 WeakPolarHBondContact CG1-O 3.39Å; I145-V230 HydrophobicContact CD1-CB 4.27Å; I145-V230 HydrophobicContact CG2-CB 4.17Å; I145-V230 HydrophobicContact CG2-CG1 3.95Å
146	S	98.3	Very high	97.2	Very high	62 Å²	62	60.9 Å²	60.9	43%	0.434	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-72.2	148.7	177.1	51.1	0	0	0	0	112.1	P229 V230	S146-P229 WeakPolarHBondContact O-CA 3.32Å; S146-P229 WeakPolarHBondContact O-CB 3.39Å; S146-P229 WeakPolarHBondContact OG-CA 3.12Å; S146-V230 PolarHBondContact O-N 2.9Å; S146-V230 VanDerWaalsContact O-N 3.08Å
147	L	98.7	Very high	97	Very high	35 Å²	35	63.3 Å²	63.3	18%	0.183	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-79.3	146.6	168.4	-62.6	-178	0	0	0	110.1	V58 V230 V253 L257 V260 R261 I264	V58-L147 HydrophobicContact CB-CD2 4.09Å; V58-L147 HydrophobicContact CG1-CD2 3.87Å; L147-V230 HydrophobicContact CD2-CG1 4.24Å; L147-V253 HydrophobicContact CD2-CG1 4.18Å; L147-L257 HydrophobicContact CB-CD2 4.14Å; L147-L257 HydrophobicContact CD1-CD2 4.27Å; L147-V260 HydrophobicContact CD1-CG1 3.87Å; L147-V260 HydrophobicContact CD2-CG1 3.77Å; L147-R261 HydrophobicContact CD1-CG 4.12Å; L147-I264 HydrophobicContact CD1-CD1 3.93Å
148	P	98.4	Very high	96.9	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-75	162.7	177	34.1	-37.1	0	0	0	111.1	D152 P229 V230 L231 V253 A254 L257	P148-D152 WeakPolarHBondContact CA-OD2 3.01Å; P148-D152 HydrophobicContact CB-CB 4.03Å; P148-P229 HydrophobicContact CB-CB 4.1Å; P148-P229 HydrophobicContact CB-CG 4.41Å; P148-V230 WeakPolarHBondContact CD-O 3.47Å; P148-V230 VanDerWaalsContact CG-O 3.22Å; P148-V230 WeakPolarHBondContact CG-O 3.46Å; P148-L231 HydrophobicContact CB-CD2 4.22Å; P148-V253 HydrophobicContact CG-CB 3.86Å; P148-V253 HydrophobicContact CG-CG1 3.91Å; P148-A254 HydrophobicContact CB-CB 4.34Å; P148-A254 HydrophobicContact CG-CB 3.98Å; P148-L257 WeakPolarHBondContact O-CD1 3.48Å; P148-L257 WeakPolarHBondContact O-CD2 3.35Å
149	Q	97.8	Very high	96.8	Very high	92 Å²	92	59 Å²	59	43%	0.43	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-96.1	162.1	161.5	-59.1	-59.8	-24.8	0	0	110.4	S151 D152	Q149-S151 PolarHBondContact O-N 2.86Å; Q149-S151 VanDerWaalsContact O-N 3.16Å; Q149-D152 PolarHBondContact N-OD2 3.47Å; Q149-D152 WeakPolarHBondContact O-CB 3.21Å; Q149-D152 PolarHBondContact O-N 3.01Å
150	P	95.8	Very high	96.7	Very high	86 Å²	86	50.5 Å²	50.5	56%	0.558	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-53.6	-33	172.6	-28.3	36.8	0	0	0	113.9	D152 I153 L257	P150-D152 VanDerWaalsContact C-N 3.25Å; P150-D152 PolarHBondContact O-N 3.35Å; P150-I153 WeakPolarHBondContact O-CG1 3.37Å; P150-I153 PolarHBondContact O-N 3.47Å; P150-L257 HydrophobicContact CG-CD1 4.38Å
151	S	95.9	Very high	96.6	Very high	103 Å²	103	50.5 Å²	50.5	72%	0.72	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-70.3	-16	176	53.8	0	0	0	0	114.4	Q149 I153	Q149-S151 PolarHBondContact O-N 2.86Å; Q149-S151 VanDerWaalsContact O-N 3.16Å; S151-I153 VanDerWaalsContact C-N 3.29Å
152	D	96.9	Very high	96.6	Very high	62 Å²	62	49.9 Å²	49.9	33%	0.332	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-83	-8.5	-179	-61	-22.9	0	0	0	112.3	P148 Q149 P150 P154 L231	P148-D152 WeakPolarHBondContact CA-OD2 3.01Å; P148-D152 HydrophobicContact CB-CB 4.03Å; Q149-D152 PolarHBondContact N-OD2 3.47Å; Q149-D152 WeakPolarHBondContact O-CB 3.21Å; Q149-D152 PolarHBondContact O-N 3.01Å; P150-D152 VanDerWaalsContact C-N 3.25Å; P150-D152 PolarHBondContact O-N 3.35Å; D152-P154 WeakPolarHBondContact O-CD 3.48Å; D152-P154 VanDerWaalsContact O-N 3.08Å; D152-L231 HydrophobicContact CB-CD2 3.96Å; D152-L231 WeakPolarHBondContact O-CD2 3.48Å
153	I	95.4	Very high	96.5	Very high	47 Å²	47	50.2 Å²	50.2	24%	0.241	31%	0.305	C	S	.	.	S	Bend	trans	-62.4	112.9	176.5	-60.2	175.8	0	0	0	108.2	P150 S151 A254 R255	P150-I153 WeakPolarHBondContact O-CG1 3.37Å; P150-I153 PolarHBondContact O-N 3.47Å; S151-I153 VanDerWaalsContact C-N 3.29Å; I153-A254 HydrophobicContact CD1-CB 3.8Å; I153-A254 HydrophobicContact CG1-CB 3.62Å; I153-R255 HydrophobicContact CD1-CG 4.11Å
154	P	93.6	Very high	96.4	Very high	17 Å²	17	44.3 Å²	44.3	11%	0.11	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-73.2	144.5	-171.6	29.1	-36.1	0	0	0	111.5	D152 T158 V160 I189 L231	D152-P154 WeakPolarHBondContact O-CD 3.48Å; D152-P154 VanDerWaalsContact O-N 3.08Å; P154-T158 HydrophobicContact CB-CG2 3.8Å; P154-V160 HydrophobicContact CG-CG1 4.4Å; P154-I189 HydrophobicContact CB-CG1 4Å; P154-I189 HydrophobicContact CG-CD1 3.66Å; P154-I189 HydrophobicContact CG-CG1 3.57Å; P154-L231 HydrophobicContact CG-CD1 3.95Å
155	P	96.1	Very high	96.3	Very high	86 Å²	86	41.6 Å²	41.6	56%	0.558	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-70.3	158.9	174.3	28.9	-34	0	0	0	111.8	T158	P155-T158 WeakPolarHBondContact CD-OG1 3.36Å; P155-T158 WeakPolarHBondContact CG-OG1 3.38Å; P155-T158 VanDerWaalsContact O-CB 3.27Å; P155-T158 WeakPolarHBondContact O-CB 3.19Å; P155-T158 PolarHBondContact O-N 3.45Å; P155-T158 PolarHBondContact O-OG1 2.87Å
156	P	95.8	Very high	96.1	Very high	77 Å²	77	41.5 Å²	41.5	50%	0.5	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	141	170	-26.4	35.1	0	0	0	112.8	T158 E191	P156-T158 VanDerWaalsContact C-N 3.33Å; P156-E191 HydrophobicContact CB-CG 4.13Å; P156-E191 HydrophobicContact CG-CG 3.54Å
157	G	94.6	Very high	95.8	Very high	58 Å²	58	44.6 Å²	44.6	60%	0.598	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.6	-11.7	-175.6	0	0	0	0	0	114.6	G159 I189	G157-G159 PolarHBondContact O-N 2.96Å; G157-I189 PolarHBondContact N-O 2.64Å
158	T	95.4	Very high	95.3	Very high	46 Å²	46	43.1 Å²	43.1	28%	0.282	26%	0.262	S	S	.	.			trans	-67.7	132.1	177.6	-55.1	0	0	0	0	111.3	P154 P155 P156 V160 T188 I189	P154-T158 HydrophobicContact CB-CG2 3.8Å; P155-T158 WeakPolarHBondContact CD-OG1 3.36Å; P155-T158 WeakPolarHBondContact CG-OG1 3.38Å; P155-T158 VanDerWaalsContact O-CB 3.27Å; P155-T158 WeakPolarHBondContact O-CB 3.19Å; P155-T158 PolarHBondContact O-N 3.45Å; P155-T158 PolarHBondContact O-OG1 2.87Å; P156-T158 VanDerWaalsContact C-N 3.33Å; T158-V160 HydrophobicContact CG2-CG1 4.45Å; T158-T188 WeakPolarHBondContact O-CA 3.3Å; T158-I189 WeakPolarHBondContact O-CG1 3.4Å; T158-I189 PolarHBondContact O-N 3.17Å
159	G	94.6	Very high	94.5	Very high	28 Å²	28	45.9 Å²	45.9	29%	0.289	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	132.8	170.4	0	0	0	0	0	111.1	G157 A187	G157-G159 PolarHBondContact O-N 2.96Å; G159-A187 WeakPolarHBondContact CA-O 3.41Å
160	V	95.8	Very high	93.7	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	157.8	-175.9	-74.8	0	0	0	0	110.8	P154 T158 R186 A187 I189 L222 L231	P154-V160 HydrophobicContact CG-CG1 4.4Å; T158-V160 HydrophobicContact CG2-CG1 4.45Å; V160-R186 CarbonylContact O-C 3.48Å; V160-R186 WeakPolarHBondContact O-CA 2.99Å; V160-A187 HydrophobicContact CG2-CB 4.23Å; V160-A187 WeakPolarHBondContact CG2-O 3.2Å; V160-A187 PolarHBondContact N-O 2.87Å; V160-A187 PolarHBondContact O-N 3.19Å; V160-I189 HydrophobicContact CB-CD1 4.44Å; V160-I189 HydrophobicContact CG1-CD1 3.76Å; V160-I189 HydrophobicContact CG1-CG1 3.8Å; V160-I189 HydrophobicContact CG2-CD1 3.86Å; V160-I189 HydrophobicContact CG2-CG1 4.22Å; V160-L222 HydrophobicContact CB-CD1 3.93Å; V160-L222 HydrophobicContact CB-CG 4.31Å; V160-L222 HydrophobicContact CG2-CD1 3.61Å; V160-L222 HydrophobicContact CG2-CG 4.32Å; V160-L231 HydrophobicContact CG1-CD1 4.39Å
161	F	95.8	Very high	93	Very high	45 Å²	45	42.1 Å²	42.1	20%	0.197	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	140.6	176	-69.5	-97.7	0	0	0	110.1	G185 R186 L223 P226	F161-G185 WeakPolarHBondContact CA-O 3.28Å; F161-R186 HydrophobicContact CD1-CG 4.1Å; F161-R186 HydrophobicContact CE1-CG 4.11Å; F161-L223 HydrophobicContact CB-CB 4.08Å; F161-L223 PolarHBondContact N-O 3.39Å; F161-L223 PolarHBondContact O-N 2.84Å; F161-P226 HydrophobicContact CD1-CG 3.99Å; F161-P226 HydrophobicContact CE1-CG 3.92Å; F161-P226 HydrophobicContact CG-CG 4.35Å; F161-P226 HydrophobicContact CZ-CG 4.23Å
162	I	95.7	Very high	92.3	Very high	13 Å²	13	49 Å²	49	7%	0.067	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	143.9	173.8	61.4	173.3	0	0	0	108	K184 G185 A187 Q211 P213 L222 Y250	I162-K184 CarbonylContact O-C 3.44Å; I162-K184 WeakPolarHBondContact O-CA 3.46Å; I162-G185 PolarHBondContact N-O 3.32Å; I162-G185 PolarHBondContact O-N 3.45Å; I162-A187 HydrophobicContact CG2-CB 4.19Å; I162-Q211 HydrophobicContact CD1-CB 3.95Å; I162-P213 HydrophobicContact CD1-CG 4.34Å; I162-L222 HydrophobicContact CG2-CD1 3.75Å; I162-Y250 WeakPolarHBondContact CG2-OH 3.44Å
163	V	96.5	Very high	91.6	Very high	8 Å²	8	48.6 Å²	48.6	5%	0.048	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	138.7	179.3	55.3	0	0	0	0	109.8	F40 I43 L182 K183 P221 L223	F40-V163 HydrophobicContact CB-CG2 4.47Å; F40-V163 HydrophobicContact CD1-CB 4.24Å; F40-V163 HydrophobicContact CD1-CG1 3.88Å; F40-V163 HydrophobicContact CD1-CG2 4.1Å; F40-V163 HydrophobicContact CD2-CG2 3.87Å; F40-V163 HydrophobicContact CE1-CB 4.1Å; F40-V163 HydrophobicContact CE1-CG1 3.98Å; F40-V163 HydrophobicContact CE1-CG2 4.28Å; F40-V163 HydrophobicContact CE2-CG2 4.08Å; F40-V163 HydrophobicContact CG-CG1 4.44Å; F40-V163 HydrophobicContact CG-CG2 3.88Å; F40-V163 HydrophobicContact CZ-CB 4.26Å; F40-V163 HydrophobicContact CZ-CG2 4.27Å; I43-V163 HydrophobicContact CD1-CG1 3.86Å; I43-V163 HydrophobicContact CD1-CG2 4.32Å; I43-V163 HydrophobicContact CG1-CG2 4.4Å; V163-L182 HydrophobicContact CG2-CD1 3.58Å; V163-L182 HydrophobicContact CG2-CG 4.32Å; V163-K183 VanDerWaalsContact CA-O 3.3Å; V163-K183 WeakPolarHBondContact CA-O 3.5Å; V163-K183 WeakPolarHBondContact CG2-O 3.09Å; V163-P221 HydrophobicContact CG1-CG 3.69Å; V163-L223 HydrophobicContact CG1-CD1 3.95Å
164	G	97	Very high	90.9	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.8	-175.2	178.2	0	0	0	0	0	113.6	L182 K183 D217	G164-L182 WeakPolarHBondContact O-CA 3.31Å; G164-K183 PolarHBondContact N-O 3.36Å; G164-K183 PolarHBondContact O-N 2.96Å; G164-D217 WeakPolarHBondContact CA-OD1 3.17Å
165	Y	95.7	Very high	90.2	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.305	C	S	.	.			trans	-108.8	15.3	-174.3	-62.6	-90.9	0	0	0	113	I43 F45 M52 T54 T83 G180 L182 D217	I43-Y165 HydrophobicContact CG1-CE2 4.05Å; I43-Y165 HydrophobicContact CG2-CE2 4.36Å; F45-Y165 HydrophobicContact CB-CD2 4.22Å; F45-Y165 HydrophobicContact CB-CE1 4.36Å; F45-Y165 HydrophobicContact CB-CE2 3.82Å; F45-Y165 AromaticContact CD2-CD1 3.58Å; F45-Y165 HydrophobicContact CD2-CD1 3.58Å; F45-Y165 AromaticContact CD2-CD2 3.7Å; F45-Y165 HydrophobicContact CD2-CD2 3.7Å; F45-Y165 AromaticContact CD2-CE1 3.96Å; F45-Y165 HydrophobicContact CD2-CE1 3.96Å; F45-Y165 HydrophobicContact CD2-CE2 4.09Å; F45-Y165 AromaticContact CD2-CG 3.43Å; F45-Y165 HydrophobicContact CD2-CG 3.43Å; F45-Y165 VanDerWaalsContact CD2-CG 3.43Å; F45-Y165 HydrophobicContact CE2-CD1 4.16Å; F45-Y165 HydrophobicContact CE2-CG 4.02Å; F45-Y165 HydrophobicContact CG-CD2 4.47Å; M52-Y165 WeakPolarHBondContact CE-O 3.31Å; T54-Y165 HydrophobicContact CG2-CD2 4.12Å; T54-Y165 HydrophobicContact CG2-CE2 4.49Å; T54-Y165 PolarHBondContact OG1-N 3.01Å; T83-Y165 HydrophobicContact CG2-CE1 4.43Å; T83-Y165 WeakPolarHBondContact O-CE1 3.41Å; T83-Y165 PolarHBondContact O-OH 3.4Å; Y165-G180 PolarHBondContact O-N 3.48Å; Y165-L182 HydrophobicContact CD1-CB 3.94Å; Y165-L182 HydrophobicContact CD1-CD1 4.28Å; Y165-L182 HydrophobicContact CD2-CD1 4.19Å; Y165-L182 HydrophobicContact CE1-CB 3.55Å; Y165-L182 HydrophobicContact CE1-CD1 3.96Å; Y165-L182 HydrophobicContact CE1-CG 4.22Å; Y165-L182 HydrophobicContact CE2-CD1 3.84Å; Y165-L182 HydrophobicContact CG-CD1 4.4Å; Y165-D217 PolarHBondContact N-OD1 3.49Å; Y165-D217 VanDerWaalsContact N-OD1 3.12Å
166	G	94.1	Very high	89.5	Confident	5 Å²	5	53.2 Å²	53.2	5%	0.052	29%	0.29	C	S	.	.			trans	-59.3	166.8	-176.5	0	0	0	0	0	113.7	G179 P215 D217	G166-G179 WeakPolarHBondContact O-CA 3.33Å; G166-P215 VanDerWaalsContact CA-O 3.29Å; G166-P215 WeakPolarHBondContact CA-O 3.46Å; G166-D217 VanDerWaalsContact CA-CG 3.49Å; G166-D217 WeakPolarHBondContact CA-OD1 3.46Å; G166-D217 PolarHBondContact N-OD1 2.93Å
167	R	91.6	Very high	88.9	Confident	126 Å²	126	53 Å²	53	48%	0.475	28%	0.281	S	S	.	.			trans	-53.6	159.9	168.4	-69.7	-178.9	-177.7	-174.9	0.8	110.6	I28 K177 N178 A214 P215	I28-R167 HydrophobicContact CD1-CB 3.26Å; I28-R167 VanDerWaalsContact CG2-O 3.25Å; I28-R167 WeakPolarHBondContact CG2-O 3.41Å; R167-K177 CarbonylContact C-O 3.34Å; R167-K177 WeakPolarHBondContact CA-O 3.31Å; R167-K177 WeakPolarHBondContact CB-O 3.21Å; R167-N178 WeakPolarHBondContact CG-O 3.5Å; R167-A214 WeakPolarHBondContact O-CB 3.44Å; R167-P215 PolarHBondContact N-O 2.86Å
168	D	88	Confident	88.6	Confident	4 Å²	4	56 Å²	56	2%	0.021	28%	0.283	C	S	.	.			trans	-151.7	91.7	168.7	-174.3	0.5	0	0	0	111.3	I28 S30 N170 D171 K177 K183	I28-D168 HydrophobicContact CG2-CB 4.2Å; S30-D168 PolarHBondContact N-OD1 3.35Å; D168-N170 PolarHBondContact O-N 3.09Å; D168-N170 VanDerWaalsContact O-N 3.09Å; D168-N170 PolarHBondContact OD1-N 2.91Å; D168-N170 VanDerWaalsContact OD1-N 3.1Å; D168-D171 HydrophobicContact CB-CB 4.38Å; D168-D171 WeakPolarHBondContact O-CB 3.35Å; D168-D171 PolarHBondContact O-N 2.99Å; D168-D171 PolarHBondContact OD1-N 3.27Å; D168-K177 PolarHBondContact N-O 2.74Å; D168-K177 VanDerWaalsContact O-CA 3.3Å; D168-K177 WeakPolarHBondContact O-CA 3.5Å; D168-K177 WeakPolarHBondContact O-CG 3.34Å; D168-K183 HydrophobicContact CB-CD 4.23Å; D168-K183 VanDerWaalsContact CB-NZ 3.26Å; D168-K183 VanDerWaalsContact CG-NZ 3.34Å; D168-K183 IonicContact OD2-NZ 3.51Å; D168-K183 PolarHBondContact OD2-NZ 3.29Å
169	D	82.5	Confident	88.4	Confident	58 Å²	58	54.7 Å²	54.7	31%	0.31	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-18.4	-176.9	-65	-29.8	0	0	0	113.3	I28 K177	I28-D169 HydrophobicContact CD1-CB 4.33Å; I28-D169 WeakPolarHBondContact CD1-OD2 3.26Å; D169-K177 VanDerWaalsContact O-CE 3.25Å; D169-K177 WeakPolarHBondContact O-CE 3.04Å; D169-K177 PolarHBondContact O-NZ 3.45Å
170	N	81.6	Confident	88.3	Confident	87 Å²	87	53.5 Å²	53.5	47%	0.465	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	3.7	177.5	-72	-46.7	0	0	0	113.1	I28 D168 R172	I28-N170 PolarHBondContact O-ND2 2.73Å; D168-N170 PolarHBondContact O-N 3.09Å; D168-N170 VanDerWaalsContact O-N 3.09Å; D168-N170 PolarHBondContact OD1-N 2.91Å; D168-N170 VanDerWaalsContact OD1-N 3.1Å; N170-R172 PolarHBondContact O-N 3.44Å
171	D	79.9	Confident	88.2	Confident	12 Å²	12	55.2 Å²	55.2	6%	0.064	28%	0.276	C	S	.	.			trans	-61.2	131.9	170.2	-158.9	-42.1	0	0	0	109.7	D168 D173 R176 K177 K183	D168-D171 HydrophobicContact CB-CB 4.38Å; D168-D171 WeakPolarHBondContact O-CB 3.35Å; D168-D171 PolarHBondContact O-N 2.99Å; D168-D171 PolarHBondContact OD1-N 3.27Å; D171-D173 PolarHBondContact O-N 3.15Å; D171-D173 PolarHBondContact OD1-N 2.65Å; D171-R176 HydrophobicContact CB-CB 4.15Å; D171-R176 IonicContact OD1-CZ 2.64Å; D171-R176 IonicContact OD1-NE 3.42Å; D171-R176 IonicContact OD1-NH1 3.69Å; D171-R176 PolarHBondContact OD1-NH1 2.89Å; D171-R176 VanDerWaalsContact OD1-NH1 3.12Å; D171-R176 IonicContact OD1-NH2 2.84Å; D171-R176 PolarHBondContact OD1-NH2 3.15Å; D171-R176 VanDerWaalsContact OD1-NH2 3.08Å; D171-R176 WeakPolarHBondContact OD2-CB 3.17Å; D171-R176 IonicContact OD2-CZ 3.09Å; D171-R176 IonicContact OD2-NE 3.96Å; D171-R176 IonicContact OD2-NH1 3.91Å; D171-R176 PolarHBondContact OD2-NH1 2.88Å; D171-K177 HydrophobicContact CB-CG 4.31Å; D171-K177 WeakPolarHBondContact O-CE 3.16Å; D171-K183 WeakPolarHBondContact OD2-CE 3.48Å; D171-K183 IonicContact OD2-NZ 2.78Å; D171-K183 PolarHBondContact OD2-NZ 2.7Å
172	R	81.6	Confident	88.1	Confident	247 Å²	247	53.1 Å²	53.1	93%	0.932	27%	0.267	S	S	*	.	S	Bend	trans	-64.1	-23.5	176.9	-65.5	-177.9	179.5	171.3	-0.1	112.1	N170 P174	N170-R172 PolarHBondContact O-N 3.44Å; R172-P174 WeakPolarHBondContact O-CD 3.46Å
173	D	81.4	Confident	88.1	Confident	55 Å²	55	53.3 Å²	53.3	29%	0.294	27%	0.267	S	S	.	.	S	Bend	trans	-98.1	113.3	175.5	-179	-13.5	0	0	0	110.4	D171 S175 R176	D171-D173 PolarHBondContact O-N 3.15Å; D171-D173 PolarHBondContact OD1-N 2.65Å; D173-S175 PolarHBondContact O-N 3.09Å; D173-S175 VanDerWaalsContact O-N 3.14Å; D173-S175 WeakPolarHBondContact OD1-CB 3.4Å; D173-S175 PolarHBondContact OD1-N 2.85Å; D173-S175 PolarHBondContact OD1-OG 2.82Å; D173-S175 PolarHBondContact OD2-OG 3.31Å; D173-R176 HydrophobicContact CB-CB 4.33Å; D173-R176 HydrophobicContact CB-CG 3.92Å; D173-R176 VanDerWaalsContact CB-CZ 3.46Å; D173-R176 WeakPolarHBondContact O-CB 3.3Å; D173-R176 PolarHBondContact O-N 2.71Å; D173-R176 IonicContact OD2-CZ 2.85Å; D173-R176 IonicContact OD2-NE 3.12Å; D173-R176 PolarHBondContact OD2-NE 2.81Å; D173-R176 IonicContact OD2-NH2 2.64Å
174	P	81.3	Confident	87.9	Confident	95 Å²	95	54.8 Å²	54.8	62%	0.617	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-56.1	-30.1	-179.8	-26.3	35.5	0	0	0	114.2	R172 R176 K177	R172-P174 WeakPolarHBondContact O-CD 3.46Å; P174-R176 PolarHBondContact O-N 2.82Å; P174-K177 PolarHBondContact O-N 2.9Å
175	S	79.7	Confident	87.7	Confident	89 Å²	89	55.1 Å²	55.1	62%	0.622	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-67.6	-18	179.8	72.4	0	0	0	0	112.9	D173	D173-S175 PolarHBondContact O-N 3.09Å; D173-S175 VanDerWaalsContact O-N 3.14Å; D173-S175 WeakPolarHBondContact OD1-CB 3.4Å; D173-S175 PolarHBondContact OD1-N 2.85Å; D173-S175 PolarHBondContact OD1-OG 2.82Å; D173-S175 PolarHBondContact OD2-OG 3.31Å
176	R	80.9	Confident	87.6	Confident	62 Å²	62	59.7 Å²	59.7	23%	0.234	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-99.1	-9.4	-175.4	-57.9	-159.7	-96	121.8	7.4	113.4	D171 D173 P174 N178 G179 I181	D171-R176 HydrophobicContact CB-CB 4.15Å; D171-R176 IonicContact OD1-CZ 2.64Å; D171-R176 IonicContact OD1-NE 3.42Å; D171-R176 IonicContact OD1-NH1 3.69Å; D171-R176 PolarHBondContact OD1-NH1 2.89Å; D171-R176 VanDerWaalsContact OD1-NH1 3.12Å; D171-R176 IonicContact OD1-NH2 2.84Å; D171-R176 PolarHBondContact OD1-NH2 3.15Å; D171-R176 VanDerWaalsContact OD1-NH2 3.08Å; D171-R176 WeakPolarHBondContact OD2-CB 3.17Å; D171-R176 IonicContact OD2-CZ 3.09Å; D171-R176 IonicContact OD2-NE 3.96Å; D171-R176 IonicContact OD2-NH1 3.91Å; D171-R176 PolarHBondContact OD2-NH1 2.88Å; D173-R176 HydrophobicContact CB-CB 4.33Å; D173-R176 HydrophobicContact CB-CG 3.92Å; D173-R176 VanDerWaalsContact CB-CZ 3.46Å; D173-R176 WeakPolarHBondContact O-CB 3.3Å; D173-R176 PolarHBondContact O-N 2.71Å; D173-R176 IonicContact OD2-CZ 2.85Å; D173-R176 IonicContact OD2-NE 3.12Å; D173-R176 PolarHBondContact OD2-NE 2.81Å; D173-R176 IonicContact OD2-NH2 2.64Å; P174-R176 PolarHBondContact O-N 2.82Å; R176-N178 VanDerWaalsContact C-N 3.32Å; R176-N178 PolarHBondContact O-N 2.77Å; R176-G179 PolarHBondContact O-N 3.12Å; R176-I181 HydrophobicContact CB-CD1 3.61Å; R176-I181 HydrophobicContact CG-CD1 3.22Å
177	K	84.2	Confident	87.6	Confident	74 Å²	74	59.4 Å²	59.4	32%	0.322	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-32.6	-176.7	-63.3	-170.6	176.2	-150.2	0	113.9	R167 D168 D169 D171 P174 G179	R167-K177 CarbonylContact C-O 3.34Å; R167-K177 WeakPolarHBondContact CA-O 3.31Å; R167-K177 WeakPolarHBondContact CB-O 3.21Å; D168-K177 PolarHBondContact N-O 2.74Å; D168-K177 VanDerWaalsContact O-CA 3.3Å; D168-K177 WeakPolarHBondContact O-CA 3.5Å; D168-K177 WeakPolarHBondContact O-CG 3.34Å; D169-K177 VanDerWaalsContact O-CE 3.25Å; D169-K177 WeakPolarHBondContact O-CE 3.04Å; D169-K177 PolarHBondContact O-NZ 3.45Å; D171-K177 HydrophobicContact CB-CG 4.31Å; D171-K177 WeakPolarHBondContact O-CE 3.16Å; P174-K177 PolarHBondContact O-N 2.9Å; K177-G179 PolarHBondContact O-N 3.27Å; K177-G179 VanDerWaalsContact O-N 3.12Å
178	N	87.5	Confident	87.8	Confident	120 Å²	120	54.4 Å²	54.4	64%	0.642	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	3.3	-179.2	-66.8	-33	0	0	0	113.8	R167 R176	R167-N178 WeakPolarHBondContact CG-O 3.5Å; R176-N178 VanDerWaalsContact C-N 3.32Å; R176-N178 PolarHBondContact O-N 2.77Å
179	G	91.1	Very high	88.2	Confident	18 Å²	18	54.5 Å²	54.5	19%	0.186	28%	0.275	C	S	.	.			trans	77.6	-164.1	179.1	0	0	0	0	0	112.5	G166 R176 K177 I181	G166-G179 WeakPolarHBondContact O-CA 3.33Å; R176-G179 PolarHBondContact O-N 3.12Å; K177-G179 PolarHBondContact O-N 3.27Å; K177-G179 VanDerWaalsContact O-N 3.12Å; G179-I181 VanDerWaalsContact C-N 3.31Å
180	G	92.3	Very high	88.7	Confident	4 Å²	4	52.7 Å²	52.7	4%	0.041	27%	0.265	C	S	.	.			trans	79.1	19.4	-173	0	0	0	0	0	111.8	R85 N86 Y165	R85-G180 CarbonylContact C-O 3.55Å; R85-G180 WeakPolarHBondContact CA-O 3.49Å; R85-G180 WeakPolarHBondContact CB-O 3.29Å; N86-G180 PolarHBondContact N-O 3.22Å; Y165-G180 PolarHBondContact O-N 3.48Å
181	I	93.3	Very high	89.4	Confident	37 Å²	37	53.6 Å²	53.6	19%	0.19	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-123.6	130.9	171.8	-66	176.9	0	0	0	107.3	L84 R85 R176 G179 K183	L84-I181 CarbonylContact O-C 3.55Å; L84-I181 WeakPolarHBondContact O-CA 3.42Å; R85-I181 HydrophobicContact CB-CG1 4.18Å; R176-I181 HydrophobicContact CB-CD1 3.61Å; R176-I181 HydrophobicContact CG-CD1 3.22Å; G179-I181 VanDerWaalsContact C-N 3.31Å; I181-K183 HydrophobicContact CG2-CG 4.47Å; I181-K183 PolarHBondContact O-N 3Å
182	L	94.6	Very high	90	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	28%	0.275	C	S	.	.			trans	-67.8	118.2	180	-173.3	59.3	0	0	0	109.5	V34 I43 L84 V163 G164 Y165	V34-L182 HydrophobicContact CB-CB 4.3Å; V34-L182 HydrophobicContact CB-CD2 3.93Å; V34-L182 HydrophobicContact CB-CG 3.92Å; V34-L182 HydrophobicContact CG1-CD2 3.95Å; V34-L182 HydrophobicContact CG1-CG 4.49Å; V34-L182 HydrophobicContact CG2-CD2 4.03Å; V34-L182 HydrophobicContact CG2-CG 3.76Å; V34-L182 PolarHBondContact N-O 2.64Å; I43-L182 HydrophobicContact CG1-CD1 4.07Å; I43-L182 HydrophobicContact CG2-CD1 4.07Å; I43-L182 HydrophobicContact CG2-CD2 3.85Å; L84-L182 HydrophobicContact CD2-CD2 4.27Å; L84-L182 PolarHBondContact O-N 2.85Å; V163-L182 HydrophobicContact CG2-CD1 3.58Å; V163-L182 HydrophobicContact CG2-CG 4.32Å; G164-L182 WeakPolarHBondContact O-CA 3.31Å; Y165-L182 HydrophobicContact CD1-CB 3.94Å; Y165-L182 HydrophobicContact CD1-CD1 4.28Å; Y165-L182 HydrophobicContact CD2-CD1 4.19Å; Y165-L182 HydrophobicContact CE1-CB 3.55Å; Y165-L182 HydrophobicContact CE1-CD1 3.96Å; Y165-L182 HydrophobicContact CE1-CG 4.22Å; Y165-L182 HydrophobicContact CE2-CD1 3.84Å; Y165-L182 HydrophobicContact CG-CD1 4.4Å
183	K	94.4	Very high	90.4	Very high	17 Å²	17	51.9 Å²	51.9	7%	0.074	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	150.9	176.5	-64.9	-173.8	178.7	-162.1	0	110.8	E32 V163 G164 D168 D171 I181	E32-K183 CarbonylContact O-C 3.59Å; E32-K183 VanDerWaalsContact O-CA 3.29Å; E32-K183 WeakPolarHBondContact O-CA 3.37Å; V163-K183 VanDerWaalsContact CA-O 3.3Å; V163-K183 WeakPolarHBondContact CA-O 3.5Å; V163-K183 WeakPolarHBondContact CG2-O 3.09Å; G164-K183 PolarHBondContact N-O 3.36Å; G164-K183 PolarHBondContact O-N 2.96Å; D168-K183 HydrophobicContact CB-CD 4.23Å; D168-K183 VanDerWaalsContact CB-NZ 3.26Å; D168-K183 VanDerWaalsContact CG-NZ 3.34Å; D168-K183 IonicContact OD2-NZ 3.51Å; D168-K183 PolarHBondContact OD2-NZ 3.29Å; D171-K183 WeakPolarHBondContact OD2-CE 3.48Å; D171-K183 IonicContact OD2-NZ 2.78Å; D171-K183 PolarHBondContact OD2-NZ 2.7Å; I181-K183 HydrophobicContact CG2-CG 4.47Å; I181-K183 PolarHBondContact O-N 3Å
184	K	94.2	Very high	90.8	Very high	38 Å²	38	51.6 Å²	51.6	17%	0.165	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	155.2	174	68.1	-172.7	177.9	-162.9	0	110.5	G31 E32 V34 E39 F40 I162	G31-K184 CarbonylContact C-O 3.44Å; G31-K184 WeakPolarHBondContact CA-O 3.43Å; E32-K184 HydrophobicContact CB-CG 4.33Å; E32-K184 PolarHBondContact N-O 2.91Å; E32-K184 PolarHBondContact O-N 3.21Å; V34-K184 HydrophobicContact CG2-CB 4.12Å; V34-K184 HydrophobicContact CG2-CD 4.16Å; V34-K184 HydrophobicContact CG2-CG 4.2Å; E39-K184 IonicContact OE1-NZ 3.8Å; E39-K184 PolarHBondContact OE1-NZ 2.88Å; E39-K184 IonicContact OE2-NZ 3.08Å; E39-K184 PolarHBondContact OE2-NZ 3.4Å; F40-K184 HydrophobicContact CE2-CB 3.91Å; F40-K184 HydrophobicContact CE2-CD 3.85Å; F40-K184 HydrophobicContact CE2-CG 4.48Å; F40-K184 HydrophobicContact CZ-CB 3.93Å; F40-K184 HydrophobicContact CZ-CD 4.12Å; I162-K184 CarbonylContact O-C 3.44Å; I162-K184 WeakPolarHBondContact O-CA 3.46Å
185	G	92.7	Very high	91.3	Very high	9 Å²	9	52 Å²	52	9%	0.093	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	-176.6	177.5	0	0	0	0	0	111.8	F161 I162	F161-G185 WeakPolarHBondContact CA-O 3.28Å; I162-G185 PolarHBondContact N-O 3.32Å; I162-G185 PolarHBondContact O-N 3.45Å
186	R	93.8	Very high	91.9	Very high	95 Å²	95	50 Å²	50	36%	0.358	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	144.9	172.8	-62.1	-178.8	80.7	170.6	5.3	109.8	V160 F161 F209 Q211	V160-R186 CarbonylContact O-C 3.48Å; V160-R186 WeakPolarHBondContact O-CA 2.99Å; F161-R186 HydrophobicContact CD1-CG 4.1Å; F161-R186 HydrophobicContact CE1-CG 4.11Å; R186-F209 HydrophobicContact CB-CB 3.9Å; R186-F209 HydrophobicContact CB-CD1 3.77Å; R186-F209 HydrophobicContact CB-CD2 4.08Å; R186-F209 HydrophobicContact CB-CE1 4.33Å; R186-F209 HydrophobicContact CB-CG 3.64Å; R186-F209 HydrophobicContact CG-CD1 4.4Å; R186-F209 VanDerWaalsContact O-CB 3.28Å; R186-F209 WeakPolarHBondContact O-CB 3.47Å; R186-Q211 PolarHBondContact O-OE1 2.94Å
187	A	93.7	Very high	92.5	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	177.7	175.3	0	0	0	0	0	109.3	G159 V160 I162 V203	G159-A187 WeakPolarHBondContact CA-O 3.41Å; V160-A187 HydrophobicContact CG2-CB 4.23Å; V160-A187 WeakPolarHBondContact CG2-O 3.2Å; V160-A187 PolarHBondContact N-O 2.87Å; V160-A187 PolarHBondContact O-N 3.19Å; I162-A187 HydrophobicContact CG2-CB 4.19Å; A187-V203 HydrophobicContact CB-CB 4.3Å; A187-V203 HydrophobicContact CB-CG2 4.25Å
188	T	94.8	Very high	92.8	Very high	20 Å²	20	47.4 Å²	47.4	12%	0.123	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	131.2	179.3	-57.6	0	0	0	0	110.5	T158 V203 K204 G206	T158-T188 WeakPolarHBondContact O-CA 3.3Å; T188-V203 CarbonylContact O-C 3.58Å; T188-V203 VanDerWaalsContact O-CA 3.3Å; T188-V203 WeakPolarHBondContact O-CA 3.09Å; T188-K204 PolarHBondContact N-O 3Å; T188-K204 PolarHBondContact O-N 2.85Å; T188-G206 WeakPolarHBondContact OG1-CA 3.31Å
189	I	95.9	Very high	93.1	Very high	7 Å²	7	46 Å²	46	4%	0.036	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	141.4	174	-55.7	-63.8	0	0	0	109.8	P154 G157 T158 V160 I201 V203 L222	P154-I189 HydrophobicContact CB-CG1 4Å; P154-I189 HydrophobicContact CG-CD1 3.66Å; P154-I189 HydrophobicContact CG-CG1 3.57Å; G157-I189 PolarHBondContact N-O 2.64Å; T158-I189 WeakPolarHBondContact O-CG1 3.4Å; T158-I189 PolarHBondContact O-N 3.17Å; V160-I189 HydrophobicContact CB-CD1 4.44Å; V160-I189 HydrophobicContact CG1-CD1 3.76Å; V160-I189 HydrophobicContact CG1-CG1 3.8Å; V160-I189 HydrophobicContact CG2-CD1 3.86Å; V160-I189 HydrophobicContact CG2-CG1 4.22Å; I189-I201 HydrophobicContact CD1-CG2 3.71Å; I189-V203 HydrophobicContact CD1-CG1 3.82Å; I189-L222 HydrophobicContact CD1-CD2 3.8Å
190	M	94.9	Very high	93.4	Very high	19 Å²	19	45.2 Å²	45.2	9%	0.094	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	163.9	171.7	65.4	175.5	-78	0	0	111.5	C202 K204 L243 I247	M190-C202 HydrophobicContact CG-CB 3.88Å; M190-C202 PolarHBondContact N-O 3.37Å; M190-K204 HydrophobicContact CB-CD 4.41Å; M190-K204 HydrophobicContact CB-CG 4.28Å; M190-K204 HydrophobicContact CG-CG 4.21Å; M190-K204 HydrophobicContact SD-CB 3.65Å; M190-K204 HydrophobicContact SD-CD 3.74Å; M190-K204 HydrophobicContact SD-CG 3.69Å; M190-L243 HydrophobicContact CE-CD1 3.99Å; M190-I247 HydrophobicContact CE-CG2 4.1Å; M190-I247 HydrophobicContact SD-CB 4.28Å; M190-I247 HydrophobicContact SD-CG2 3.45Å; M190-I247 WeakPolarHBondContact SD-CG2 3.23Å
191	E	94.6	Very high	93.7	Very high	106 Å²	106	45.4 Å²	45.4	50%	0.495	24%	0.24	S	C	.	.			trans	-65.5	136.6	166.9	-60.6	174.1	147.3	0	0	109.8	P156 R193	P156-E191 HydrophobicContact CB-CG 4.13Å; P156-E191 HydrophobicContact CG-CG 3.54Å; E191-R193 HydrophobicContact CB-CG 4.22Å; E191-R193 PolarHBondContact O-N 2.64Å; E191-R193 IonicContact OE2-CZ 3.84Å; E191-R193 IonicContact OE2-NE 3.11Å; E191-R193 PolarHBondContact OE2-NE 2.84Å; E191-R193 IonicContact OE2-NH2 3.76Å; E191-R193 PolarHBondContact OE2-NH2 3.12Å
192	C	93.5	Very high	93.8	Very high	36 Å²	36	43.7 Å²	43.7	24%	0.243	23%	0.232	C	C	.	.			trans	-71.1	98.7	168.4	-59.9	0	0	0	0	108.9	H194 T196 C202	C192-H194 PolarHBondContact O-N 3.08Å; C192-T196 HydrophobicContact CB-CG2 3.82Å; C192-C202 WeakPolarHBondContact CA-SG 3.45Å; C192-C202 HydrophobicContact CB-CB 4.08Å; C192-C202 WeakPolarHBondContact CB-SG 3.44Å; C192-C202 WeakPolarHBondContact SG-CB 3.48Å; C192-C202 CovalentContact SG-SG 2.03Å; C192-C202 PolarHBondContact SG-SG 3.43Å
193	R	89.9	Confident	93.9	Very high	188 Å²	188	43.6 Å²	43.6	71%	0.709	23%	0.231	S	C	*	.			trans	-89.4	41.1	-175.6	-66.8	-176.3	176.3	-170	-3.3	112.6	E191	E191-R193 HydrophobicContact CB-CG 4.22Å; E191-R193 PolarHBondContact O-N 2.64Å; E191-R193 IonicContact OE2-CZ 3.84Å; E191-R193 IonicContact OE2-NE 3.11Å; E191-R193 PolarHBondContact OE2-NE 2.84Å; E191-R193 IonicContact OE2-NH2 3.76Å; E191-R193 PolarHBondContact OE2-NH2 3.12Å
194	H	90.4	Very high	93.8	Very high	49 Å²	49	47 Å²	47	23%	0.227	25%	0.246	C	C	.	.	S	Bend	trans	-159.6	166.4	-178.8	59.6	-69.1	0	0	0	109.3	C192 T196 L240 I247 E249	C192-H194 PolarHBondContact O-N 3.08Å; H194-T196 WeakPolarHBondContact NE2-CG2 3.31Å; H194-T196 PolarHBondContact O-N 2.87Å; H194-L240 HydrophobicContact CB-CD2 3.82Å; H194-I247 WeakPolarHBondContact CE1-CD1 3.36Å; H194-E249 IonicContact CD2-OE1 3.66Å; H194-E249 IonicContact CE1-OE1 3.44Å; H194-E249 PolarHBondContact CE1-OE1 2.83Å; H194-E249 VanDerWaalsContact CE1-OE1 3.3Å; H194-E249 IonicContact NE2-OE1 2.78Å; H194-E249 PolarHBondContact NE2-OE1 3.28Å
195	A	90.9	Very high	93.6	Very high	103 Å²	103	46.2 Å²	46.2	85%	0.851	25%	0.247	S	C	*	.			trans	-65.3	127.6	177.5	0	0	0	0	0	110.2
196	T	92.7	Very high	93.1	Very high	46 Å²	46	46.4 Å²	46.4	28%	0.282	25%	0.249	S	C	.	.			trans	-130	157.1	178.3	61.8	0	0	0	0	110.6	C192 H194 P200 E249	C192-T196 HydrophobicContact CB-CG2 3.82Å; H194-T196 WeakPolarHBondContact NE2-CG2 3.31Å; H194-T196 PolarHBondContact O-N 2.87Å; T196-P200 VanDerWaalsContact CB-CD 3.49Å; T196-P200 HydrophobicContact CG2-CG 3.83Å; T196-P200 WeakPolarHBondContact OG1-CD 3.36Å; T196-E249 WeakPolarHBondContact CG2-OE1 3.29Å
197	N	92.5	Very high	92.3	Very high	56 Å²	56	51.5 Å²	51.5	30%	0.299	28%	0.277	S	S	.	.	S	Bend	trans	-112.5	134.6	172.4	-72.4	-56	0	0	0	109.9	T121 L122 G124 N199	T121-N197 WeakPolarHBondContact O-CB 3.49Å; T121-N197 PolarHBondContact O-ND2 2.93Å; L122-N197 HydrophobicContact CD2-CB 4.01Å; G124-N197 VanDerWaalsContact CA-O 3.23Å; G124-N197 WeakPolarHBondContact CA-O 2.97Å; G124-N197 PolarHBondContact N-O 3.48Å; N197-N199 VanDerWaalsContact C-N 3.29Å; N197-N199 PolarHBondContact O-N 3.23Å
198	G	91	Very high	91.2	Very high	26 Å²	26	58 Å²	58	27%	0.268	31%	0.311	S	S	.	.	S	Bend	trans	75.7	11.4	178.5	0	0	0	0	0	115.1	F125	F125-G198 VanDerWaalsContact CZ-CA 3.43Å
199	N	94.6	Very high	90.2	Very high	90 Å²	90	59.8 Å²	59.8	48%	0.481	32%	0.318	S	S	.	.			trans	52.4	66.7	176.9	-167.3	3.8	0	0	0	112.6	N197 R255	N197-N199 VanDerWaalsContact C-N 3.29Å; N197-N199 PolarHBondContact O-N 3.23Å; N199-R255 VanDerWaalsContact CG-CZ 3.5Å; N199-R255 PolarHBondContact ND2-NE 2.82Å; N199-R255 VanDerWaalsContact O-CD 3.28Å; N199-R255 WeakPolarHBondContact O-CD 3.24Å; N199-R255 PolarHBondContact O-NH1 2.76Å
200	P	97	Very high	89.1	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.013	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-65.3	168.6	175.6	30.7	-34.8	0	0	0	111.6	T196 E249 Y250	T196-P200 VanDerWaalsContact CB-CD 3.49Å; T196-P200 HydrophobicContact CG2-CG 3.83Å; T196-P200 WeakPolarHBondContact OG1-CD 3.36Å; P200-E249 HydrophobicContact CB-CB 4.13Å; P200-E249 HydrophobicContact CB-CG 4.48Å; P200-E249 HydrophobicContact CG-CB 4.45Å; P200-E249 HydrophobicContact CG-CG 4.29Å; P200-Y250 CarbonylContact C-O 3.31Å; P200-Y250 VanDerWaalsContact CA-O 3.29Å; P200-Y250 WeakPolarHBondContact CA-O 3.3Å; P200-Y250 VanDerWaalsContact CB-O 3.28Å; P200-Y250 WeakPolarHBondContact CB-O 3.25Å
201	I	97.7	Very high	88.7	Confident	8 Å²	8	61.8 Å²	61.8	4%	0.041	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	125.2	165.9	-62.5	167.6	0	0	0	107.4	I189 V203 L222 L231 E249 Y250	I189-I201 HydrophobicContact CD1-CG2 3.71Å; I201-V203 HydrophobicContact CG2-CG1 4.29Å; I201-L222 HydrophobicContact CG2-CD2 3.78Å; I201-L231 HydrophobicContact CD1-CB 4.47Å; I201-E249 CarbonylContact O-C 3.53Å; I201-E249 WeakPolarHBondContact O-CA 3.38Å; I201-Y250 PolarHBondContact N-O 3.36Å; I201-Y250 PolarHBondContact O-N 3Å
202	C	96.5	Very high	88.4	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.007	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	135.2	175.3	-69.1	0	0	0	0	110.8	M190 C192 I247	M190-C202 HydrophobicContact CG-CB 3.88Å; M190-C202 PolarHBondContact N-O 3.37Å; C192-C202 WeakPolarHBondContact CA-SG 3.45Å; C192-C202 HydrophobicContact CB-CB 4.08Å; C192-C202 WeakPolarHBondContact CB-SG 3.44Å; C192-C202 WeakPolarHBondContact SG-CB 3.48Å; C192-C202 CovalentContact SG-SG 2.03Å; C192-C202 PolarHBondContact SG-SG 3.43Å; C202-I247 HydrophobicContact CB-CD1 4.25Å
203	V	95.3	Very high	88.4	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	149.4	174.5	-45.8	0	0	0	0	110.6	A187 T188 I189 I201 L212 L222 I247 V248 Y250	A187-V203 HydrophobicContact CB-CB 4.3Å; A187-V203 HydrophobicContact CB-CG2 4.25Å; T188-V203 CarbonylContact O-C 3.58Å; T188-V203 VanDerWaalsContact O-CA 3.3Å; T188-V203 WeakPolarHBondContact O-CA 3.09Å; I189-V203 HydrophobicContact CD1-CG1 3.82Å; I201-V203 HydrophobicContact CG2-CG1 4.29Å; V203-L212 HydrophobicContact CG2-CD2 4.11Å; V203-L222 HydrophobicContact CG1-CD1 4.1Å; V203-L222 HydrophobicContact CG1-CD2 3.88Å; V203-I247 CarbonylContact O-C 3.52Å; V203-I247 VanDerWaalsContact O-CA 3.29Å; V203-I247 WeakPolarHBondContact O-CA 3.47Å; V203-I247 WeakPolarHBondContact O-CB 3.28Å; V203-V248 HydrophobicContact CG2-CB 3.93Å; V203-V248 PolarHBondContact N-O 2.78Å; V203-V248 PolarHBondContact O-N 3.06Å; V203-Y250 HydrophobicContact CB-CE2 4.39Å; V203-Y250 HydrophobicContact CG1-CD2 4Å; V203-Y250 HydrophobicContact CG1-CE2 3.97Å; V203-Y250 HydrophobicContact CG2-CD2 4.1Å; V203-Y250 HydrophobicContact CG2-CE2 3.46Å; V203-Y250 VanDerWaalsContact CG2-CE2 3.46Å
204	K	93.3	Very high	88.4	Confident	88 Å²	88	47 Å²	47	38%	0.383	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	167.2	173.1	57.6	169.2	-178.2	178.7	0	110.5	T188 M190 G206 I247	T188-K204 PolarHBondContact N-O 3Å; T188-K204 PolarHBondContact O-N 2.85Å; M190-K204 HydrophobicContact CB-CD 4.41Å; M190-K204 HydrophobicContact CB-CG 4.28Å; M190-K204 HydrophobicContact CG-CG 4.21Å; M190-K204 HydrophobicContact SD-CB 3.65Å; M190-K204 HydrophobicContact SD-CD 3.74Å; M190-K204 HydrophobicContact SD-CG 3.69Å; K204-G206 PolarHBondContact O-N 2.85Å; K204-I247 HydrophobicContact CB-CG2 4.29Å
205	A	90.5	Very high	88.5	Confident	22 Å²	22	46.6 Å²	46.6	18%	0.182	27%	0.274	C	S	.	.			trans	-54.4	132.2	160.9	0	0	0	0	0	109.4	F209 L212	A205-F209 CarbonylContact C-O 3.46Å; A205-F209 WeakPolarHBondContact CA-O 3.29Å; A205-L212 HydrophobicContact CB-CD1 4.46Å; A205-L212 HydrophobicContact CB-CG 4.48Å
206	G	82.5	Confident	88.6	Confident	13 Å²	13	41.9 Å²	41.9	13%	0.134	24%	0.235	C	C	.	.			trans	-79.6	167.1	172.1	0	0	0	0	0	111.6	T188 K204 N208 F209	T188-G206 WeakPolarHBondContact OG1-CA 3.31Å; K204-G206 PolarHBondContact O-N 2.85Å; G206-N208 PolarHBondContact O-N 3.47Å; G206-F209 PolarHBondContact N-O 2.46Å; G206-F209 CarbonylContact O-C 3.59Å; G206-F209 PolarHBondContact O-N 3.34Å; G206-F209 VanDerWaalsContact O-O 3.1Å
207	Q	76.1	Confident	88.8	Confident	201 Å²	201	40.7 Å²	40.7	94%	0.939	23%	0.227	S	C	*	.	S	Bend	trans	-58.6	-37.1	176	-65.9	-178.6	12.7	0	0	112.2
208	N	71.6	Confident	89	Confident	137 Å²	137	38.9 Å²	38.9	73%	0.733	22%	0.219	S	C	*	.	S	Bend	trans	-104.4	-3	-178.7	-60	-30.6	0	0	0	113.1	G206	G206-N208 PolarHBondContact O-N 3.47Å
209	F	72.5	Confident	89.3	Confident	57 Å²	57	37.7 Å²	37.7	25%	0.25	21%	0.206	C	C	.	.			trans	-135.4	102	-170.9	-48	-63.4	0	0	0	109.2	R186 A205 G206 Q211	R186-F209 HydrophobicContact CB-CB 3.9Å; R186-F209 HydrophobicContact CB-CD1 3.77Å; R186-F209 HydrophobicContact CB-CD2 4.08Å; R186-F209 HydrophobicContact CB-CE1 4.33Å; R186-F209 HydrophobicContact CB-CG 3.64Å; R186-F209 HydrophobicContact CG-CD1 4.4Å; R186-F209 VanDerWaalsContact O-CB 3.28Å; R186-F209 WeakPolarHBondContact O-CB 3.47Å; A205-F209 CarbonylContact C-O 3.46Å; A205-F209 WeakPolarHBondContact CA-O 3.29Å; G206-F209 PolarHBondContact N-O 2.46Å; G206-F209 CarbonylContact O-C 3.59Å; G206-F209 PolarHBondContact O-N 3.34Å; G206-F209 VanDerWaalsContact O-O 3.1Å; F209-Q211 PolarHBondContact O-N 3.09Å
210	G	73.1	Confident	89.5	Confident	30 Å²	30	33.4 Å²	33.4	31%	0.309	18%	0.183	S	C	.	.			trans	-77.5	-4.6	-177.2	0	0	0	0	0	114.2	R29	R29-G210 WeakPolarHBondContact CB-O 3.29Å; R29-G210 WeakPolarHBondContact CD-O 3.12Å; R29-G210 WeakPolarHBondContact CG-O 3.33Å
211	Q	85.5	Confident	89.6	Confident	39 Å²	39	33.3 Å²	33.3	18%	0.182	18%	0.183	C	C	.	.			trans	-79.9	140.5	-164.2	-59.1	83	5.8	0	0	113.7	R29 S30 I162 R186 F209	R29-Q211 VanDerWaalsContact O-CA 3.24Å; R29-Q211 WeakPolarHBondContact O-CA 3.16Å; R29-Q211 WeakPolarHBondContact O-CB 3.44Å; R29-Q211 VanDerWaalsContact O-CG 3.29Å; R29-Q211 WeakPolarHBondContact O-CG 2.97Å; S30-Q211 WeakPolarHBondContact O-CG 3.17Å; S30-Q211 PolarHBondContact O-NE2 2.62Å; I162-Q211 HydrophobicContact CD1-CB 3.95Å; R186-Q211 PolarHBondContact O-OE1 2.94Å; F209-Q211 PolarHBondContact O-N 3.09Å
212	L	90.1	Very high	89.6	Confident	7 Å²	7	33 Å²	33	4%	0.037	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-144	147.2	173.8	-75.7	177.9	0	0	0	110.7	V203 A205 I246 V248	V203-L212 HydrophobicContact CG2-CD2 4.11Å; A205-L212 HydrophobicContact CB-CD1 4.46Å; A205-L212 HydrophobicContact CB-CG 4.48Å; L212-I246 HydrophobicContact CD1-CD1 4.41Å; L212-I246 HydrophobicContact CD1-CG1 3.76Å; L212-I246 WeakPolarHBondContact CD1-O 3.32Å; L212-V248 HydrophobicContact CB-CG2 4.39Å; L212-V248 HydrophobicContact CD2-CG2 4.19Å
213	P	91.7	Very high	89.7	Confident	7 Å²	7	32.9 Å²	32.9	5%	0.045	18%	0.18	C	C	.	.			trans	-58.6	151.6	173.1	-23.6	31.5	0	0	0	113.8	I162 D217 V234 V248 Y250	I162-P213 HydrophobicContact CD1-CG 4.34Å; P213-D217 WeakPolarHBondContact CA-OD2 3.27Å; P213-D217 HydrophobicContact CB-CB 3.81Å; P213-V234 HydrophobicContact CB-CG1 3.82Å; P213-V234 HydrophobicContact CB-CG2 3.84Å; P213-V234 HydrophobicContact CG-CG1 4.39Å; P213-V234 HydrophobicContact CG-CG2 3.79Å; P213-V248 HydrophobicContact CB-CG1 4.24Å; P213-V248 HydrophobicContact CG-CB 4.42Å; P213-V248 HydrophobicContact CG-CG1 4.01Å; P213-V248 HydrophobicContact CG-CG2 4.41Å; P213-Y250 HydrophobicContact CG-CE2 4.22Å; P213-Y250 WeakPolarHBondContact CG-OH 3.3Å
214	A	91.2	Very high	89.7	Confident	6 Å²	6	35.5 Å²	35.5	5%	0.05	20%	0.197	C	C	.	.			trans	-133.8	174.4	-177.1	0	0	0	0	0	112.2	I28 R167 G216 D217	I28-A214 HydrophobicContact CB-CB 3.92Å; I28-A214 HydrophobicContact CD1-CB 3.67Å; I28-A214 HydrophobicContact CG1-CB 3.47Å; I28-A214 VanDerWaalsContact CG1-CB 3.47Å; I28-A214 HydrophobicContact CG2-CB 3.43Å; I28-A214 VanDerWaalsContact CG2-CB 3.43Å; R167-A214 WeakPolarHBondContact O-CB 3.44Å; A214-G216 PolarHBondContact O-N 2.03Å; A214-G216 VanDerWaalsContact O-N 3.15Å; A214-D217 PolarHBondContact N-OD2 3.3Å; A214-D217 VanDerWaalsContact O-CB 3.31Å; A214-D217 WeakPolarHBondContact O-CB 3.18Å; A214-D217 PolarHBondContact O-N 2.79Å
215	P	92.1	Very high	89.9	Confident	40 Å²	40	33.6 Å²	33.6	26%	0.26	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	124.2	173.9	-28.5	36.7	0	0	0	112.1	W26 G166 R167	W26-P215 HydrophobicContact CB-CG 3.88Å; W26-P215 HydrophobicContact CD2-CG 4.16Å; W26-P215 HydrophobicContact CE3-CG 4.42Å; W26-P215 HydrophobicContact CG-CG 3.92Å; G166-P215 VanDerWaalsContact CA-O 3.29Å; G166-P215 WeakPolarHBondContact CA-O 3.46Å; R167-P215 PolarHBondContact N-O 2.86Å
216	G	93.6	Very high	90	Very high	4 Å²	4	33.7 Å²	33.7	4%	0.041	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	103.4	-22	-172.6	0	0	0	0	0	114.4	C53 T54 A214 S218	C53-G216 CarbonylContact C-O 3.59Å; T54-G216 PolarHBondContact N-O 3.22Å; T54-G216 PolarHBondContact OG1-O 3.46Å; A214-G216 PolarHBondContact O-N 2.03Å; A214-G216 VanDerWaalsContact O-N 3.15Å; G216-S218 VanDerWaalsContact C-N 3.27Å
217	D	96.3	Very high	90.6	Very high	21 Å²	21	39.8 Å²	39.8	11%	0.112	22%	0.219	C	C	.	.			trans	-79.5	-10.4	169.3	-66.3	-44.8	0	0	0	112.7	G164 Y165 G166 P213 A214 G219 G220 V234	G164-D217 WeakPolarHBondContact CA-OD1 3.17Å; Y165-D217 PolarHBondContact N-OD1 3.49Å; Y165-D217 VanDerWaalsContact N-OD1 3.12Å; G166-D217 VanDerWaalsContact CA-CG 3.49Å; G166-D217 WeakPolarHBondContact CA-OD1 3.46Å; G166-D217 PolarHBondContact N-OD1 2.93Å; P213-D217 WeakPolarHBondContact CA-OD2 3.27Å; P213-D217 HydrophobicContact CB-CB 3.81Å; A214-D217 PolarHBondContact N-OD2 3.3Å; A214-D217 VanDerWaalsContact O-CB 3.31Å; A214-D217 WeakPolarHBondContact O-CB 3.18Å; A214-D217 PolarHBondContact O-N 2.79Å; D217-G219 PolarHBondContact O-N 2.91Å; D217-G220 VanDerWaalsContact O-CA 3.31Å; D217-G220 WeakPolarHBondContact O-CA 3.19Å; D217-G220 PolarHBondContact O-N 2.87Å; D217-V234 HydrophobicContact CB-CG2 4.47Å; D217-V234 WeakPolarHBondContact O-CB 3.34Å; D217-V234 WeakPolarHBondContact O-CG2 3.48Å
218	S	96.6	Very high	91.5	Very high	18 Å²	18	30.5 Å²	30.5	13%	0.126	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-43.9	128.5	173.2	-68.8	0	0	0	0	112	C53 T54 H68 C69 G216 G220	C53-S218 WeakPolarHBondContact CB-O 3.43Å; T54-S218 PolarHBondContact N-O 2.83Å; H68-S218 VanDerWaalsContact CE1-CB 3.47Å; H68-S218 WeakPolarHBondContact CE1-CB 3.27Å; H68-S218 PolarHBondContact CE1-OG 2.9Å; H68-S218 VanDerWaalsContact CE1-OG 3.31Å; H68-S218 WeakPolarHBondContact NE2-CB 3.27Å; H68-S218 PolarHBondContact NE2-OG 3.1Å; C69-S218 VanDerWaalsContact SG-CB 3.58Å; G216-S218 VanDerWaalsContact C-N 3.27Å; S218-G220 PolarHBondContact O-N 3.38Å
219	G	98.2	Very high	92.8	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	81	-8.3	-174.3	0	0	0	0	0	115.4	T54 A66 D217 V234	T54-G219 CarbonylContact O-C 3.56Å; T54-G219 WeakPolarHBondContact O-CA 3.28Å; A66-G219 VanDerWaalsContact N-CA 3.26Å; D217-G219 PolarHBondContact O-N 2.91Å; G219-V234 PolarHBondContact N-O 2.87Å
220	G	98.2	Very high	94.1	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	14%	0.137	C	C	.	.	P	Polyproline II helix	trans	-64.7	149	176.1	0	0	0	0	0	112.5	D217 S218 V233 V234	D217-G220 VanDerWaalsContact O-CA 3.31Å; D217-G220 WeakPolarHBondContact O-CA 3.19Å; D217-G220 PolarHBondContact O-N 2.87Å; S218-G220 PolarHBondContact O-N 3.38Å; G220-V233 CarbonylContact O-C 3.59Å; G220-V233 VanDerWaalsContact O-CA 3.31Å; G220-V233 WeakPolarHBondContact O-CA 3.37Å; G220-V234 WeakPolarHBondContact O-CG2 3.4Å; G220-V234 PolarHBondContact O-N 3.35Å
221	P	98.4	Very high	95.3	Very high	1 Å²	1	21 Å²	21	1%	0.006	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	143.7	-172	32.1	-35.3	0	0	0	113	F42 I43 S56 V163 L223 V230 G232	F42-P221 HydrophobicContact CE2-CG 4.11Å; I43-P221 VanDerWaalsContact CD1-CD 3.42Å; I43-P221 HydrophobicContact CD1-CG 3.74Å; S56-P221 WeakPolarHBondContact OG-CB 3.35Å; S56-P221 WeakPolarHBondContact OG-CG 3.46Å; V163-P221 HydrophobicContact CG1-CG 3.69Å; P221-L223 HydrophobicContact CB-CD2 3.85Å; P221-L223 HydrophobicContact CB-CG 4.03Å; P221-L223 HydrophobicContact CG-CD1 4.22Å; P221-L223 HydrophobicContact CG-CD2 4.36Å; P221-L223 HydrophobicContact CG-CG 4.23Å; P221-V230 HydrophobicContact CB-CB 4.41Å; P221-V230 HydrophobicContact CB-CG2 3.68Å; P221-G232 CarbonylContact C-O 3.55Å; P221-G232 WeakPolarHBondContact CA-O 3.34Å
222	L	98.2	Very high	95.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	128.3	158.5	-165.6	63.3	0	0	0	109.3	V160 I162 I189 I201 V203 L231 G232 Y250	V160-L222 HydrophobicContact CB-CD1 3.93Å; V160-L222 HydrophobicContact CB-CG 4.31Å; V160-L222 HydrophobicContact CG2-CD1 3.61Å; V160-L222 HydrophobicContact CG2-CG 4.32Å; I162-L222 HydrophobicContact CG2-CD1 3.75Å; I189-L222 HydrophobicContact CD1-CD2 3.8Å; I201-L222 HydrophobicContact CG2-CD2 3.78Å; V203-L222 HydrophobicContact CG1-CD1 4.1Å; V203-L222 HydrophobicContact CG1-CD2 3.88Å; L222-L231 HydrophobicContact CB-CB 4.31Å; L222-L231 WeakPolarHBondContact O-CB 3.29Å; L222-L231 PolarHBondContact O-N 2.96Å; L222-G232 PolarHBondContact N-O 2.88Å; L222-Y250 HydrophobicContact CB-CD1 3.6Å; L222-Y250 HydrophobicContact CB-CE1 3.58Å; L222-Y250 HydrophobicContact CB-CG 4.28Å; L222-Y250 HydrophobicContact CD1-CE1 4Å; L222-Y250 HydrophobicContact CD1-CE2 4.28Å; L222-Y250 HydrophobicContact CD2-CD1 4.37Å; L222-Y250 HydrophobicContact CD2-CD2 4.44Å; L222-Y250 HydrophobicContact CD2-CG 4.23Å; L222-Y250 HydrophobicContact CG-CD1 4.4Å; L222-Y250 HydrophobicContact CG-CE1 4.29Å
223	L	98.1	Very high	96.3	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	141	-170.5	-58.9	173	0	0	0	111.4	F40 F42 I145 F161 V163 P221 S225	F40-L223 HydrophobicContact CD1-CD1 4.37Å; F40-L223 HydrophobicContact CE1-CD1 4.2Å; F42-L223 HydrophobicContact CE2-CD1 4.17Å; F42-L223 HydrophobicContact CZ-CD1 3.76Å; F42-L223 HydrophobicContact CZ-CD2 4.47Å; I145-L223 HydrophobicContact CD1-CD2 3.39Å; F161-L223 HydrophobicContact CB-CB 4.08Å; F161-L223 PolarHBondContact N-O 3.39Å; F161-L223 PolarHBondContact O-N 2.84Å; V163-L223 HydrophobicContact CG1-CD1 3.95Å; P221-L223 HydrophobicContact CB-CD2 3.85Å; P221-L223 HydrophobicContact CB-CG 4.03Å; P221-L223 HydrophobicContact CG-CD1 4.22Å; P221-L223 HydrophobicContact CG-CD2 4.36Å; P221-L223 HydrophobicContact CG-CG 4.23Å; L223-S225 VanDerWaalsContact C-N 3.32Å; L223-S225 WeakPolarHBondContact CB-O 3.48Å
224	P	97	Very high	96.6	Very high	55 Å²	55	18.9 Å²	18.9	36%	0.357	11%	0.113	S	C	.	.	S	Bend	trans	-75.8	-26.9	173.1	31	-30.1	0	0	0	111.4	P229 L231	P224-P229 WeakPolarHBondContact CD-O 3.35Å; P224-P229 HydrophobicContact CG-CG 4.26Å; P224-L231 HydrophobicContact CB-CD1 4.15Å; P224-L231 HydrophobicContact CG-CD1 4.33Å; P224-L231 HydrophobicContact CG-CD2 4.4Å; P224-L231 HydrophobicContact CG-CG 4.46Å
225	S	95.7	Very high	96.9	Very high	47 Å²	47	18.9 Å²	18.9	33%	0.329	11%	0.112	S	C	.	.	S	Bend	trans	-153.8	162.9	174.2	65	0	0	0	0	108.8	L223 Q227 G228	L223-S225 VanDerWaalsContact C-N 3.32Å; L223-S225 WeakPolarHBondContact CB-O 3.48Å; S225-Q227 PolarHBondContact O-N 3.09Å; S225-G228 PolarHBondContact O-N 2.97Å; S225-G228 PolarHBondContact OG-N 3.14Å
226	P	94	Very high	97	Very high	25 Å²	25	19.1 Å²	19.1	16%	0.162	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-23.3	-177	-27.9	36.9	0	0	0	115.3	F40 F42 F161	F40-P226 HydrophobicContact CE1-CB 3.91Å; F40-P226 HydrophobicContact CZ-CB 4.25Å; F42-P226 WeakPolarHBondContact CE1-O 3.26Å; F161-P226 HydrophobicContact CD1-CG 3.99Å; F161-P226 HydrophobicContact CE1-CG 3.92Å; F161-P226 HydrophobicContact CG-CG 4.35Å; F161-P226 HydrophobicContact CZ-CG 4.23Å
227	Q	93.8	Very high	96.9	Very high	140 Å²	140	19.7 Å²	19.7	65%	0.654	12%	0.116	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.8	5.6	176	-61.9	75.3	31.3	0	0	113.4	S225	S225-Q227 PolarHBondContact O-N 3.09Å
228	G	96.7	Very high	96.7	Very high	7 Å²	7	19.8 Å²	19.8	7%	0.072	12%	0.118	C	C	.	.	S	Bend	trans	-75.2	171.6	-179.4	0	0	0	0	0	113.3	I145 S225	I145-G228 VanDerWaalsContact CD1-O 3.24Å; I145-G228 WeakPolarHBondContact CD1-O 3.23Å; I145-G228 WeakPolarHBondContact CG1-O 3.39Å; S225-G228 PolarHBondContact O-N 2.97Å; S225-G228 PolarHBondContact OG-N 3.14Å
229	P	98.4	Very high	96.4	Very high	22 Å²	22	24.4 Å²	24.4	14%	0.143	15%	0.145	C	C	.	.			trans	-65.2	156	178.8	27.7	-35.8	0	0	0	112.6	S146 P148 P224 L231	S146-P229 WeakPolarHBondContact O-CA 3.32Å; S146-P229 WeakPolarHBondContact O-CB 3.39Å; S146-P229 WeakPolarHBondContact OG-CA 3.12Å; P148-P229 HydrophobicContact CB-CB 4.1Å; P148-P229 HydrophobicContact CB-CG 4.41Å; P224-P229 WeakPolarHBondContact CD-O 3.35Å; P224-P229 HydrophobicContact CG-CG 4.26Å; P229-L231 HydrophobicContact CG-CD2 4.42Å; P229-L231 PolarHBondContact O-N 2.83Å; P229-L231 VanDerWaalsContact O-N 3.14Å
230	V	98.7	Very high	95.8	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.151	C	C	.	.			trans	-75.3	97.4	176	56.5	0	0	0	0	111.4	V58 L64 I145 S146 L147 P148 P221 V233 V253	V58-V230 HydrophobicContact CG1-CG1 4.16Å; L64-V230 HydrophobicContact CD2-CG1 4.01Å; L64-V230 HydrophobicContact CD2-CG2 4.2Å; I145-V230 HydrophobicContact CD1-CB 4.27Å; I145-V230 HydrophobicContact CG2-CB 4.17Å; I145-V230 HydrophobicContact CG2-CG1 3.95Å; S146-V230 PolarHBondContact O-N 2.9Å; S146-V230 VanDerWaalsContact O-N 3.08Å; L147-V230 HydrophobicContact CD2-CG1 4.24Å; P148-V230 WeakPolarHBondContact CD-O 3.47Å; P148-V230 VanDerWaalsContact CG-O 3.22Å; P148-V230 WeakPolarHBondContact CG-O 3.46Å; P221-V230 HydrophobicContact CB-CB 4.41Å; P221-V230 HydrophobicContact CB-CG2 3.68Å; V230-V233 HydrophobicContact CG2-CG1 4.47Å; V230-V253 HydrophobicContact CG1-CG1 4.39Å; V230-V253 HydrophobicContact CG1-CG2 4.39Å; V230-V253 HydrophobicContact CG2-CG2 4.05Å; V230-V253 VanDerWaalsContact O-CB 3.26Å; V230-V253 WeakPolarHBondContact O-CB 3.29Å; V230-V253 WeakPolarHBondContact O-CG2 3.15Å
231	L	98.6	Very high	95.1	Very high	3 Å²	3	31.6 Å²	31.6	2%	0.016	19%	0.19	C	C	.	.			trans	-69.3	-36.9	-175.9	-56.1	174.6	0	0	0	112.8	P148 D152 P154 V160 I201 L222 P224 P229 V253	P148-L231 HydrophobicContact CB-CD2 4.22Å; D152-L231 HydrophobicContact CB-CD2 3.96Å; D152-L231 WeakPolarHBondContact O-CD2 3.48Å; P154-L231 HydrophobicContact CG-CD1 3.95Å; V160-L231 HydrophobicContact CG1-CD1 4.39Å; I201-L231 HydrophobicContact CD1-CB 4.47Å; L222-L231 HydrophobicContact CB-CB 4.31Å; L222-L231 WeakPolarHBondContact O-CB 3.29Å; L222-L231 PolarHBondContact O-N 2.96Å; P224-L231 HydrophobicContact CB-CD1 4.15Å; P224-L231 HydrophobicContact CG-CD1 4.33Å; P224-L231 HydrophobicContact CG-CD2 4.4Å; P224-L231 HydrophobicContact CG-CG 4.46Å; P229-L231 HydrophobicContact CG-CD2 4.42Å; P229-L231 PolarHBondContact O-N 2.83Å; P229-L231 VanDerWaalsContact O-N 3.14Å; L231-V253 PolarHBondContact O-N 2.84Å
232	G	98.5	Very high	94.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	164.7	-174.8	0	0	0	0	0	111.8	P221 L222 A251	P221-G232 CarbonylContact C-O 3.55Å; P221-G232 WeakPolarHBondContact CA-O 3.34Å; L222-G232 PolarHBondContact N-O 2.88Å; G232-A251 CarbonylContact C-O 3.54Å; G232-A251 WeakPolarHBondContact CA-O 3.44Å
233	V	98.6	Very high	93.4	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	137.9	170.7	-61.7	0	0	0	0	110.8	L64 I127 G220 V230 S235 Y250 A251 V253	L64-V233 HydrophobicContact CD2-CG1 3.88Å; L64-V233 HydrophobicContact CG-CG1 3.94Å; I127-V233 HydrophobicContact CD1-CG2 4.29Å; I127-V233 HydrophobicContact CG1-CG2 3.78Å; G220-V233 CarbonylContact O-C 3.59Å; G220-V233 VanDerWaalsContact O-CA 3.31Å; G220-V233 WeakPolarHBondContact O-CA 3.37Å; V230-V233 HydrophobicContact CG2-CG1 4.47Å; V233-S235 PolarHBondContact O-N 3.36Å; V233-Y250 CarbonylContact O-C 3.59Å; V233-Y250 WeakPolarHBondContact O-CA 3.02Å; V233-A251 HydrophobicContact CG2-CB 3.98Å; V233-A251 PolarHBondContact N-O 3.32Å; V233-A251 PolarHBondContact O-N 2.88Å; V233-V253 HydrophobicContact CG1-CG2 4.38Å
234	V	97.9	Very high	92.4	Very high	8 Å²	8	48.4 Å²	48.4	5%	0.048	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	120.5	-178.7	177	0	0	0	0	109.8	P213 D217 G219 G220 V248 Y250	P213-V234 HydrophobicContact CB-CG1 3.82Å; P213-V234 HydrophobicContact CB-CG2 3.84Å; P213-V234 HydrophobicContact CG-CG1 4.39Å; P213-V234 HydrophobicContact CG-CG2 3.79Å; D217-V234 HydrophobicContact CB-CG2 4.47Å; D217-V234 WeakPolarHBondContact O-CB 3.34Å; D217-V234 WeakPolarHBondContact O-CG2 3.48Å; G219-V234 PolarHBondContact N-O 2.87Å; G220-V234 WeakPolarHBondContact O-CG2 3.4Å; G220-V234 PolarHBondContact O-N 3.35Å; V234-V248 HydrophobicContact CG1-CG1 4.08Å; V234-Y250 HydrophobicContact CB-CD1 4.48Å; V234-Y250 HydrophobicContact CB-CE1 4.14Å; V234-Y250 HydrophobicContact CG2-CD1 4.07Å; V234-Y250 HydrophobicContact CG2-CE1 3.29Å; V234-Y250 HydrophobicContact CG2-CE2 4.37Å; V234-Y250 VanDerWaalsContact CG2-CZ 3.5Å; V234-Y250 VanDerWaalsContact N-CD1 3.33Å
235	S	97.1	Very high	91.7	Very high	5 Å²	5	47.5 Å²	47.5	4%	0.035	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-72.4	172.6	178.6	0	0	0	0	110.2	H68 D126 V233 E249	H68-S235 PolarHBondContact CE1-O 3.46Å; D126-S235 WeakPolarHBondContact CB-OG 3.45Å; D126-S235 WeakPolarHBondContact OD2-CA 3.42Å; D126-S235 VanDerWaalsContact OD2-CB 3.31Å; D126-S235 WeakPolarHBondContact OD2-CB 3.46Å; D126-S235 PolarHBondContact OD2-OG 3.46Å; V233-S235 PolarHBondContact O-N 3.36Å; S235-E249 WeakPolarHBondContact CB-O 3.05Å; S235-E249 PolarHBondContact N-O 3.1Å
236	H	94.2	Very high	91.4	Very high	45 Å²	45	46.6 Å²	46.6	21%	0.208	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	164	-174.9	72.4	-72.1	0	0	0	111.7	W26 T121 S123 V238 E249	W26-H236 HydrophobicContact CH2-CB 4.03Å; T121-H236 WeakPolarHBondContact CG2-CE1 3.26Å; S123-H236 VanDerWaalsContact CB-CE1 3.45Å; S123-H236 WeakPolarHBondContact CB-CE1 3.13Å; H236-V238 VanDerWaalsContact NE2-CG2 3.34Å; H236-V238 WeakPolarHBondContact NE2-CG2 3.23Å; H236-E249 IonicContact CE1-OE2 3.3Å; H236-E249 PolarHBondContact CE1-OE2 3.49Å; H236-E249 PolarHBondContact N-O 3.34Å; H236-E249 IonicContact ND1-OE2 3.77Å; H236-E249 IonicContact NE2-OE2 2.62Å; H236-E249 PolarHBondContact O-N 2.82Å
237	G	92.6	Very high	91.3	Very high	17 Å²	17	45.4 Å²	45.4	18%	0.175	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	145.3	174	0	0	0	0	0	112	I247	G237-I247 CarbonylContact C-O 3.54Å; G237-I247 VanDerWaalsContact CA-O 3.23Å; G237-I247 WeakPolarHBondContact CA-O 3.41Å
238	V	91.5	Very high	91.4	Very high	23 Å²	23	38.9 Å²	38.9	14%	0.139	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	125.4	179	-175.8	0	0	0	0	109.1	H236 L240 I246 I247 E249	H236-V238 VanDerWaalsContact NE2-CG2 3.34Å; H236-V238 WeakPolarHBondContact NE2-CG2 3.23Å; V238-L240 HydrophobicContact CG1-CD2 3.65Å; V238-L240 HydrophobicContact CG1-CG 4.11Å; V238-I246 WeakPolarHBondContact O-CA 3.45Å; V238-I247 HydrophobicContact CB-CD1 4.21Å; V238-I247 HydrophobicContact CB-CG1 3.73Å; V238-I247 HydrophobicContact CG2-CG1 4.48Å; V238-I247 PolarHBondContact N-O 2.88Å; V238-I247 PolarHBondContact O-N 2.91Å; V238-E249 HydrophobicContact CG2-CG 3.96Å
239	T	89.5	Confident	91.4	Very high	115 Å²	115	38.8 Å²	38.8	71%	0.706	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89	122.5	168.5	-51.4	0	0	0	0	108.9
240	L	85.8	Confident	91.4	Very high	22 Å²	22	37.8 Å²	37.8	12%	0.115	22%	0.224	C	C	.	.			trans	-109.1	136.1	177.9	-63.8	-178.8	0	0	0	110.2	H194 V238 N242 L243 I247	H194-L240 HydrophobicContact CB-CD2 3.82Å; V238-L240 HydrophobicContact CG1-CD2 3.65Å; V238-L240 HydrophobicContact CG1-CG 4.11Å; L240-N242 PolarHBondContact O-N 3.27Å; L240-N242 VanDerWaalsContact O-N 3.1Å; L240-L243 HydrophobicContact CB-CB 4.31Å; L240-L243 HydrophobicContact CB-CD1 4.15Å; L240-L243 HydrophobicContact CB-CG 4.25Å; L240-L243 HydrophobicContact CD1-CD1 3.72Å; L240-L243 HydrophobicContact CG-CD1 4.39Å; L240-L243 PolarHBondContact O-N 2.75Å; L240-L243 VanDerWaalsContact O-N 3.15Å; L240-I247 HydrophobicContact CD1-CD1 3.8Å; L240-I247 HydrophobicContact CD1-CG1 4.38Å; L240-I247 HydrophobicContact CG-CD1 4.42Å
241	P	83.8	Confident	91.4	Very high	128 Å²	128	37.8 Å²	37.8	83%	0.831	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-30.3	-176.9	-26.7	33.9	0	0	0	114.8
242	N	81.7	Confident	91.3	Very high	159 Å²	159	37.6 Å²	37.6	85%	0.85	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.8	9.6	-173.9	-61.3	-22.8	0	0	0	113.2	L240	L240-N242 PolarHBondContact O-N 3.27Å; L240-N242 VanDerWaalsContact O-N 3.1Å
243	L	79	Confident	91.3	Very high	59 Å²	59	37.6 Å²	37.6	31%	0.309	22%	0.223	S	C	.	.			trans	-118.5	136.5	174.6	-67.4	178.8	0	0	0	109.7	M190 L240 D245 I247	M190-L243 HydrophobicContact CE-CD1 3.99Å; L240-L243 HydrophobicContact CB-CB 4.31Å; L240-L243 HydrophobicContact CB-CD1 4.15Å; L240-L243 HydrophobicContact CB-CG 4.25Å; L240-L243 HydrophobicContact CD1-CD1 3.72Å; L240-L243 HydrophobicContact CG-CD1 4.39Å; L240-L243 PolarHBondContact O-N 2.75Å; L240-L243 VanDerWaalsContact O-N 3.15Å; L243-D245 WeakPolarHBondContact CB-O 3.34Å; L243-D245 PolarHBondContact O-N 3.29Å; L243-I247 HydrophobicContact CD1-CG2 3.53Å
244	P	77.2	Confident	91.3	Very high	137 Å²	137	38 Å²	38	89%	0.89	23%	0.227	S	C	*	.	S	Bend	trans	-71	-11.5	178.5	30.9	-36.2	0	0	0	112.8
245	D	83	Confident	91.3	Very high	36 Å²	36	42.3 Å²	42.3	19%	0.193	24%	0.242	C	C	.	.	S	Bend	trans	-136	165.1	-175.3	-152.3	-1.8	0	0	0	110.5	R29 L243	R29-D245 IonicContact CZ-OD1 3.28Å; R29-D245 IonicContact CZ-OD2 2.96Å; R29-D245 IonicContact NE-OD1 3.49Å; R29-D245 IonicContact NE-OD2 3.32Å; R29-D245 PolarHBondContact NE-OD2 3.17Å; R29-D245 IonicContact NH1-OD2 3.36Å; R29-D245 PolarHBondContact NH1-OD2 3.18Å; R29-D245 IonicContact NH2-OD1 3.85Å; R29-D245 PolarHBondContact NH2-OD1 2.98Å; R29-D245 IonicContact NH2-OD2 3Å; R29-D245 PolarHBondContact NH2-OD2 2.92Å; L243-D245 WeakPolarHBondContact CB-O 3.34Å; L243-D245 PolarHBondContact O-N 3.29Å
246	I	88.9	Confident	91.3	Very high	27 Å²	27	43.2 Å²	43.2	14%	0.138	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	155.4	172.7	65.5	169.6	0	0	0	110.6	L212 V238	L212-I246 HydrophobicContact CD1-CD1 4.41Å; L212-I246 HydrophobicContact CD1-CG1 3.76Å; L212-I246 WeakPolarHBondContact CD1-O 3.32Å; V238-I246 WeakPolarHBondContact O-CA 3.45Å
247	I	92.6	Very high	91.5	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	162.3	162.6	67.3	168	0	0	0	108.4	M190 H194 C202 V203 K204 G237 V238 L240 L243	M190-I247 HydrophobicContact CE-CG2 4.1Å; M190-I247 HydrophobicContact SD-CB 4.28Å; M190-I247 HydrophobicContact SD-CG2 3.45Å; M190-I247 WeakPolarHBondContact SD-CG2 3.23Å; H194-I247 WeakPolarHBondContact CE1-CD1 3.36Å; C202-I247 HydrophobicContact CB-CD1 4.25Å; V203-I247 CarbonylContact O-C 3.52Å; V203-I247 VanDerWaalsContact O-CA 3.29Å; V203-I247 WeakPolarHBondContact O-CA 3.47Å; V203-I247 WeakPolarHBondContact O-CB 3.28Å; K204-I247 HydrophobicContact CB-CG2 4.29Å; G237-I247 CarbonylContact C-O 3.54Å; G237-I247 VanDerWaalsContact CA-O 3.23Å; G237-I247 WeakPolarHBondContact CA-O 3.41Å; V238-I247 HydrophobicContact CB-CD1 4.21Å; V238-I247 HydrophobicContact CB-CG1 3.73Å; V238-I247 HydrophobicContact CG2-CG1 4.48Å; V238-I247 PolarHBondContact N-O 2.88Å; V238-I247 PolarHBondContact O-N 2.91Å; L240-I247 HydrophobicContact CD1-CD1 3.8Å; L240-I247 HydrophobicContact CD1-CG1 4.38Å; L240-I247 HydrophobicContact CG-CD1 4.42Å; L243-I247 HydrophobicContact CD1-CG2 3.53Å
248	V	94.8	Very high	91.7	Very high	2 Å²	2	47 Å²	47	1%	0.012	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.4	171.7	179.9	0	0	0	0	109.5	V203 L212 P213 V234 Y250	V203-V248 HydrophobicContact CG2-CB 3.93Å; V203-V248 PolarHBondContact N-O 2.78Å; V203-V248 PolarHBondContact O-N 3.06Å; L212-V248 HydrophobicContact CB-CG2 4.39Å; L212-V248 HydrophobicContact CD2-CG2 4.19Å; P213-V248 HydrophobicContact CB-CG1 4.24Å; P213-V248 HydrophobicContact CG-CB 4.42Å; P213-V248 HydrophobicContact CG-CG1 4.01Å; P213-V248 HydrophobicContact CG-CG2 4.41Å; V234-V248 HydrophobicContact CG1-CG1 4.08Å; V248-Y250 HydrophobicContact CB-CE2 4.16Å; V248-Y250 HydrophobicContact CG1-CD2 4.13Å; V248-Y250 HydrophobicContact CG1-CE2 3.69Å
249	E	96.7	Very high	92.1	Very high	5 Å²	5	47.1 Å²	47.1	2%	0.023	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	138.5	174	-66.4	-168.6	169	0	0	110.9	S123 H194 T196 P200 I201 S235 H236 V238	S123-E249 WeakPolarHBondContact CB-OE2 3.25Å; S123-E249 PolarHBondContact OG-OE2 3.26Å; H194-E249 IonicContact CD2-OE1 3.66Å; H194-E249 IonicContact CE1-OE1 3.44Å; H194-E249 PolarHBondContact CE1-OE1 2.83Å; H194-E249 VanDerWaalsContact CE1-OE1 3.3Å; H194-E249 IonicContact NE2-OE1 2.78Å; H194-E249 PolarHBondContact NE2-OE1 3.28Å; T196-E249 WeakPolarHBondContact CG2-OE1 3.29Å; P200-E249 HydrophobicContact CB-CB 4.13Å; P200-E249 HydrophobicContact CB-CG 4.48Å; P200-E249 HydrophobicContact CG-CB 4.45Å; P200-E249 HydrophobicContact CG-CG 4.29Å; I201-E249 CarbonylContact O-C 3.53Å; I201-E249 WeakPolarHBondContact O-CA 3.38Å; S235-E249 WeakPolarHBondContact CB-O 3.05Å; S235-E249 PolarHBondContact N-O 3.1Å; H236-E249 IonicContact CE1-OE2 3.3Å; H236-E249 PolarHBondContact CE1-OE2 3.49Å; H236-E249 PolarHBondContact N-O 3.34Å; H236-E249 IonicContact ND1-OE2 3.77Å; H236-E249 IonicContact NE2-OE2 2.62Å; H236-E249 PolarHBondContact O-N 2.82Å; V238-E249 HydrophobicContact CG2-CG 3.96Å
250	Y	98.2	Very high	92.5	Very high	1 Å²	1	41.7 Å²	41.7	0%	0.004	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	132.5	174.2	-73	-110.1	0	0	0	109.2	I162 P200 I201 V203 P213 L222 V233 V234 V248 S252	I162-Y250 WeakPolarHBondContact CG2-OH 3.44Å; P200-Y250 CarbonylContact C-O 3.31Å; P200-Y250 VanDerWaalsContact CA-O 3.29Å; P200-Y250 WeakPolarHBondContact CA-O 3.3Å; P200-Y250 VanDerWaalsContact CB-O 3.28Å; P200-Y250 WeakPolarHBondContact CB-O 3.25Å; I201-Y250 PolarHBondContact N-O 3.36Å; I201-Y250 PolarHBondContact O-N 3Å; V203-Y250 HydrophobicContact CB-CE2 4.39Å; V203-Y250 HydrophobicContact CG1-CD2 4Å; V203-Y250 HydrophobicContact CG1-CE2 3.97Å; V203-Y250 HydrophobicContact CG2-CD2 4.1Å; V203-Y250 HydrophobicContact CG2-CE2 3.46Å; V203-Y250 VanDerWaalsContact CG2-CE2 3.46Å; P213-Y250 HydrophobicContact CG-CE2 4.22Å; P213-Y250 WeakPolarHBondContact CG-OH 3.3Å; L222-Y250 HydrophobicContact CB-CD1 3.6Å; L222-Y250 HydrophobicContact CB-CE1 3.58Å; L222-Y250 HydrophobicContact CB-CG 4.28Å; L222-Y250 HydrophobicContact CD1-CE1 4Å; L222-Y250 HydrophobicContact CD1-CE2 4.28Å; L222-Y250 HydrophobicContact CD2-CD1 4.37Å; L222-Y250 HydrophobicContact CD2-CD2 4.44Å; L222-Y250 HydrophobicContact CD2-CG 4.23Å; L222-Y250 HydrophobicContact CG-CD1 4.4Å; L222-Y250 HydrophobicContact CG-CE1 4.29Å; V233-Y250 CarbonylContact O-C 3.59Å; V233-Y250 WeakPolarHBondContact O-CA 3.02Å; V234-Y250 HydrophobicContact CB-CD1 4.48Å; V234-Y250 HydrophobicContact CB-CE1 4.14Å; V234-Y250 HydrophobicContact CG2-CD1 4.07Å; V234-Y250 HydrophobicContact CG2-CE1 3.29Å; V234-Y250 HydrophobicContact CG2-CE2 4.37Å; V234-Y250 VanDerWaalsContact CG2-CZ 3.5Å; V234-Y250 VanDerWaalsContact N-CD1 3.33Å; V248-Y250 HydrophobicContact CB-CE2 4.16Å; V248-Y250 HydrophobicContact CG1-CD2 4.13Å; V248-Y250 HydrophobicContact CG1-CE2 3.69Å; Y250-S252 PolarHBondContact O-N 3.28Å
251	A	98.3	Very high	93.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	124.4	167.7	0	0	0	0	0	108.2	S123 D126 I127 G232 V233 V253	S123-A251 WeakPolarHBondContact O-CA 3.45Å; S123-A251 WeakPolarHBondContact O-CB 3.4Å; D126-A251 HydrophobicContact CB-CB 4.33Å; D126-A251 WeakPolarHBondContact O-CB 3.43Å; I127-A251 HydrophobicContact CD1-CB 3.87Å; I127-A251 HydrophobicContact CG1-CB 3.38Å; G232-A251 CarbonylContact C-O 3.54Å; G232-A251 WeakPolarHBondContact CA-O 3.44Å; V233-A251 HydrophobicContact CG2-CB 3.98Å; V233-A251 PolarHBondContact N-O 3.32Å; V233-A251 PolarHBondContact O-N 2.88Å; A251-V253 PolarHBondContact O-N 2.82Å
252	S	98.4	Very high	93.8	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	117.6	-175.1	177.2	0	0	0	0	110.5	Y250 A254 R255 M256	Y250-S252 PolarHBondContact O-N 3.28Å; S252-A254 VanDerWaalsContact C-N 3.29Å; S252-A254 PolarHBondContact O-N 3.23Å; S252-R255 PolarHBondContact O-N 3.15Å; S252-R255 WeakPolarHBondContact OG-CG 3.37Å; S252-R255 PolarHBondContact OG-N 3.1Å; S252-M256 WeakPolarHBondContact O-CG 2.92Å; S252-M256 PolarHBondContact O-N 2.85Å
253	V	98.7	Very high	94.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-39.4	176.9	-179.2	0	0	0	0	110.4	L64 I127 L147 P148 V230 L231 V233 A251 R255 M256 L257 V260	L64-V253 HydrophobicContact CD2-CB 4.5Å; L64-V253 HydrophobicContact CD2-CG1 4.07Å; L64-V253 HydrophobicContact CD2-CG2 3.56Å; I127-V253 HydrophobicContact CD1-CG2 4.35Å; L147-V253 HydrophobicContact CD2-CG1 4.18Å; P148-V253 HydrophobicContact CG-CB 3.86Å; P148-V253 HydrophobicContact CG-CG1 3.91Å; V230-V253 HydrophobicContact CG1-CG1 4.39Å; V230-V253 HydrophobicContact CG1-CG2 4.39Å; V230-V253 HydrophobicContact CG2-CG2 4.05Å; V230-V253 VanDerWaalsContact O-CB 3.26Å; V230-V253 WeakPolarHBondContact O-CB 3.29Å; V230-V253 WeakPolarHBondContact O-CG2 3.15Å; L231-V253 PolarHBondContact O-N 2.84Å; V233-V253 HydrophobicContact CG1-CG2 4.38Å; A251-V253 PolarHBondContact O-N 2.82Å; V253-R255 VanDerWaalsContact C-N 3.28Å; V253-R255 PolarHBondContact O-N 3.09Å; V253-M256 CarbonylContact O-C 3.56Å; V253-M256 VanDerWaalsContact O-C 3.31Å; V253-M256 PolarHBondContact O-N 2.76Å; V253-L257 PolarHBondContact O-N 2.81Å; V253-V260 HydrophobicContact CG1-CG2 4.34Å
254	A	98.1	Very high	95.3	Very high	9 Å²	9	40.3 Å²	40.3	7%	0.074	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-57.8	-38.3	177	0	0	0	0	0	112.6	P148 I153 S252 M256 L257	P148-A254 HydrophobicContact CB-CB 4.34Å; P148-A254 HydrophobicContact CG-CB 3.98Å; I153-A254 HydrophobicContact CD1-CB 3.8Å; I153-A254 HydrophobicContact CG1-CB 3.62Å; S252-A254 VanDerWaalsContact C-N 3.29Å; S252-A254 PolarHBondContact O-N 3.23Å; A254-M256 VanDerWaalsContact C-N 3.31Å; A254-L257 WeakPolarHBondContact O-CD1 3.13Å; A254-L257 WeakPolarHBondContact O-CG 3.47Å
255	R	97.3	Very high	96.2	Very high	97 Å²	97	35.5 Å²	35.5	37%	0.366	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-78.5	-16.2	177	-63.9	177.5	179	119.1	5.7	113.4	I153 N199 S252 V253	I153-R255 HydrophobicContact CD1-CG 4.11Å; N199-R255 VanDerWaalsContact CG-CZ 3.5Å; N199-R255 PolarHBondContact ND2-NE 2.82Å; N199-R255 VanDerWaalsContact O-CD 3.28Å; N199-R255 WeakPolarHBondContact O-CD 3.24Å; N199-R255 PolarHBondContact O-NH1 2.76Å; S252-R255 PolarHBondContact O-N 3.15Å; S252-R255 WeakPolarHBondContact OG-CG 3.37Å; S252-R255 PolarHBondContact OG-N 3.1Å; V253-R255 VanDerWaalsContact C-N 3.28Å; V253-R255 PolarHBondContact O-N 3.09Å
256	M	97.7	Very high	96.9	Very high	24 Å²	24	35.5 Å²	35.5	12%	0.118	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-110.6	17.7	-179.4	-63.6	-60.7	-64.8	0	0	112.3	A102 F125 I127 S252 V253 A254 D258 F259 V260	A102-M256 HydrophobicContact CB-CE 3.45Å; A102-M256 VanDerWaalsContact CB-CE 3.45Å; F125-M256 HydrophobicContact CD1-CE 4.36Å; F125-M256 HydrophobicContact CD1-SD 3.96Å; I127-M256 HydrophobicContact CD1-CB 3.69Å; I127-M256 HydrophobicContact CD1-CG 3.73Å; I127-M256 HydrophobicContact CG1-CG 4.43Å; S252-M256 WeakPolarHBondContact O-CG 2.92Å; S252-M256 PolarHBondContact O-N 2.85Å; V253-M256 CarbonylContact O-C 3.56Å; V253-M256 VanDerWaalsContact O-C 3.31Å; V253-M256 PolarHBondContact O-N 2.76Å; A254-M256 VanDerWaalsContact C-N 3.31Å; M256-D258 VanDerWaalsContact C-N 3.3Å; M256-D258 PolarHBondContact O-N 2.8Å; M256-F259 HydrophobicContact CE-CB 4.25Å; M256-F259 PolarHBondContact O-N 2.81Å; M256-V260 WeakPolarHBondContact O-CG2 3.43Å; M256-V260 PolarHBondContact O-N 3.06Å
257	L	97.6	Very high	97.3	Very high	10 Å²	10	35.9 Å²	35.9	5%	0.052	18%	0.18	C	C	.	.	H	α-helix	trans	-57.7	-39.5	-173.8	-84.4	171	0	0	0	113.2	L147 P148 P150 V253 A254 F259 V260 R261	L147-L257 HydrophobicContact CB-CD2 4.14Å; L147-L257 HydrophobicContact CD1-CD2 4.27Å; P148-L257 WeakPolarHBondContact O-CD1 3.48Å; P148-L257 WeakPolarHBondContact O-CD2 3.35Å; P150-L257 HydrophobicContact CG-CD1 4.38Å; V253-L257 PolarHBondContact O-N 2.81Å; A254-L257 WeakPolarHBondContact O-CD1 3.13Å; A254-L257 WeakPolarHBondContact O-CG 3.47Å; L257-F259 VanDerWaalsContact C-N 3.34Å; L257-F259 PolarHBondContact O-N 2.95Å; L257-V260 PolarHBondContact O-N 3.09Å; L257-R261 VanDerWaalsContact O-CB 3.31Å; L257-R261 WeakPolarHBondContact O-CB 3.45Å; L257-R261 WeakPolarHBondContact O-CG 3.01Å; L257-R261 PolarHBondContact O-N 3.12Å
258	D	97.9	Very high	97.6	Very high	132 Å²	132	38 Å²	38	71%	0.706	19%	0.19	S	C	*	.	H	α-helix	trans	-62.1	-44.2	-179.8	-67.1	-16.1	0	0	0	111.3	M256 S262	M256-D258 VanDerWaalsContact C-N 3.3Å; M256-D258 PolarHBondContact O-N 2.8Å; D258-S262 VanDerWaalsContact O-CB 3.26Å; D258-S262 WeakPolarHBondContact O-CB 3.36Å; D258-S262 PolarHBondContact O-N 3.22Å; D258-S262 VanDerWaalsContact O-N 3.11Å; D258-S262 PolarHBondContact O-OG 3.29Å
259	F	98.4	Very high	97.8	Very high	26 Å²	26	40.3 Å²	40.3	11%	0.114	20%	0.202	C	C	.	.	H	α-helix	trans	-61.8	-48.4	173.9	167.2	-98.9	0	0	0	111	K100 A102 I127 I129 M256 L257 S262 N263	K100-F259 HydrophobicContact CB-CE2 4.39Å; K100-F259 HydrophobicContact CB-CZ 4.11Å; A102-F259 HydrophobicContact CB-CD1 4.2Å; A102-F259 HydrophobicContact CB-CD2 4.42Å; A102-F259 HydrophobicContact CB-CE1 4.28Å; A102-F259 HydrophobicContact CB-CE2 4.48Å; A102-F259 HydrophobicContact CB-CG 4.28Å; A102-F259 HydrophobicContact CB-CZ 4.41Å; I127-F259 HydrophobicContact CG2-CD1 4.06Å; I127-F259 HydrophobicContact CG2-CE1 3.82Å; I129-F259 HydrophobicContact CD1-CE1 4.11Å; I129-F259 HydrophobicContact CD1-CZ 4.49Å; I129-F259 HydrophobicContact CG1-CE1 4.34Å; M256-F259 HydrophobicContact CE-CB 4.25Å; M256-F259 PolarHBondContact O-N 2.81Å; L257-F259 VanDerWaalsContact C-N 3.34Å; L257-F259 PolarHBondContact O-N 2.95Å; F259-S262 PolarHBondContact O-N 2.86Å; F259-N263 PolarHBondContact O-ND2 3.29Å
260	V	98.5	Very high	97.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.4	-52.4	-176.7	176.3	0	0	0	0	110.4	L64 I127 I129 L147 V253 M256 L257 S262 N263 I264	L64-V260 HydrophobicContact CD1-CG1 4.4Å; L64-V260 HydrophobicContact CD1-CG2 3.85Å; I127-V260 HydrophobicContact CG2-CG2 4.37Å; I129-V260 HydrophobicContact CD1-CG1 4.43Å; L147-V260 HydrophobicContact CD1-CG1 3.87Å; L147-V260 HydrophobicContact CD2-CG1 3.77Å; V253-V260 HydrophobicContact CG1-CG2 4.34Å; M256-V260 WeakPolarHBondContact O-CG2 3.43Å; M256-V260 PolarHBondContact O-N 3.06Å; L257-V260 PolarHBondContact O-N 3.09Å; V260-S262 VanDerWaalsContact C-N 3.26Å; V260-S262 PolarHBondContact O-N 3.23Å; V260-N263 PolarHBondContact O-N 3.32Å; V260-I264 HydrophobicContact CG1-CG2 4.16Å; V260-I264 WeakPolarHBondContact O-CG2 3.12Å; V260-I264 PolarHBondContact O-N 3.17Å
261	R	98	Very high	97.8	Very high	122 Å²	122	45.6 Å²	45.6	46%	0.46	23%	0.228	S	C	.	.	H	α-helix	trans	-60.9	-32.8	-178.9	-71.5	178.6	176.8	168.3	2.5	113.1	L147 L257 N263	L147-R261 HydrophobicContact CD1-CG 4.12Å; L257-R261 VanDerWaalsContact O-CB 3.31Å; L257-R261 WeakPolarHBondContact O-CB 3.45Å; L257-R261 WeakPolarHBondContact O-CG 3.01Å; L257-R261 PolarHBondContact O-N 3.12Å; R261-N263 PolarHBondContact O-N 3.28Å
262	S	98	Very high	97.8	Very high	97 Å²	97	49.1 Å²	49.1	68%	0.678	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-4.9	178.9	-56.8	0	0	0	0	114.1	D258 F259 V260	D258-S262 VanDerWaalsContact O-CB 3.26Å; D258-S262 WeakPolarHBondContact O-CB 3.36Å; D258-S262 PolarHBondContact O-N 3.22Å; D258-S262 VanDerWaalsContact O-N 3.11Å; D258-S262 PolarHBondContact O-OG 3.29Å; F259-S262 PolarHBondContact O-N 2.86Å; V260-S262 VanDerWaalsContact C-N 3.26Å; V260-S262 PolarHBondContact O-N 3.23Å
263	N	97.8	Very high	97.7	Very high	36 Å²	36	53.2 Å²	53.2	19%	0.193	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.8	11	-171.6	-72.6	-84.7	0	0	0	114.2	K100 I129 F259 V260 R261	K100-N263 HydrophobicContact CB-CB 4.37Å; K100-N263 WeakPolarHBondContact CD-OD1 3.46Å; K100-N263 HydrophobicContact CG-CB 4.28Å; K100-N263 VanDerWaalsContact CG-OD1 3.27Å; K100-N263 WeakPolarHBondContact CG-OD1 3.25Å; I129-N263 HydrophobicContact CD1-CB 3.55Å; F259-N263 PolarHBondContact O-ND2 3.29Å; V260-N263 PolarHBondContact O-N 3.32Å; R261-N263 PolarHBondContact O-N 3.28Å
264	I	94.9	Very high	97.6	Very high	85 Å²	85	58 Å²	58	44%	0.436	29%	0.291	S	S	.	.			trans	-112.2	0	-179.1	62.5	169.4	0	0	0	114.8	V58 S59 A62 I129 L147 V260	V58-I264 HydrophobicContact CG2-CG2 3.72Å; S59-I264 WeakPolarHBondContact CB-OXT 3.5Å; S59-I264 PolarHBondContact OG-OXT 3.48Å; A62-I264 HydrophobicContact CB-CB 3.96Å; A62-I264 HydrophobicContact CB-CG2 3.61Å; I129-I264 HydrophobicContact CD1-CG2 3.83Å; L147-I264 HydrophobicContact CD1-CD1 3.93Å; V260-I264 HydrophobicContact CG1-CG2 4.16Å; V260-I264 WeakPolarHBondContact O-CG2 3.12Å; V260-I264 PolarHBondContact O-N 3.17Å

Retrieved 264 of 264 residues in 300.2 ms (Link to these results)

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