A0A3Q0KEH3_SCHMA Loading...

Ig-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KEH3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 794 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure 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	59.7	Low	72.7	Confident	207 Å²	207	121.9 Å²	121.9	100%	1.02	63%	0.631	S	S	*	*				0	-54.7	0	-88.6	176.8	167.1	0	0	113.2	H3 K4 L5	M1-H3 VanDerWaalsContact C-N 3.28Å; M1-H3 PolarHBondContact O-N 3.37Å; M1-K4 PolarHBondContact O-N 3.31Å; M1-L5 PolarHBondContact O-N 3.19Å
2	L	65	Low	73	Confident	142 Å²	142	120.1 Å²	120.1	74%	0.743	62%	0.622	S	S	*	*	H	α-helix	trans	-43.3	-45.5	-172.7	-84.4	71	0	0	0	115.2	K4 L5 Y6	L2-K4 PolarHBondContact O-N 2.95Å; L2-L5 WeakPolarHBondContact O-CB 3.38Å; L2-L5 PolarHBondContact O-N 3.48Å; L2-Y6 PolarHBondContact O-N 3.43Å
3	H	66.8	Low	73.4	Confident	165 Å²	165	117.7 Å²	117.7	76%	0.764	61%	0.61	S	S	*	*	H	α-helix	trans	-63	-23.2	-178.7	-153	-57.6	0	0	0	114.8	M1 S7	M1-H3 VanDerWaalsContact C-N 3.28Å; M1-H3 PolarHBondContact O-N 3.37Å; H3-S7 PolarHBondContact O-N 3.5Å
4	K	73.2	Confident	73.5	Confident	180 Å²	180	120.1 Å²	120.1	78%	0.783	61%	0.609	S	S	*	*	H	α-helix	trans	-79.4	-39.4	170	-74.6	-164.2	172.9	-168.7	0	111.9	M1 L2 S8	M1-K4 PolarHBondContact O-N 3.31Å; L2-K4 PolarHBondContact O-N 2.95Å; K4-S8 WeakPolarHBondContact O-CB 3.25Å; K4-S8 PolarHBondContact O-N 3.18Å
5	L	73.1	Confident	73.6	Confident	109 Å²	109	117.1 Å²	117.1	57%	0.571	60%	0.603	S	S	*	*	H	α-helix	trans	-63.2	-43.3	174.9	-76.5	160.3	0	0	0	111.5	M1 L2 S8 L9	M1-L5 PolarHBondContact O-N 3.19Å; L2-L5 WeakPolarHBondContact O-CB 3.38Å; L2-L5 PolarHBondContact O-N 3.48Å; L5-S8 PolarHBondContact O-N 2.91Å; L5-L9 PolarHBondContact O-N 2.88Å
6	Y	77.7	Confident	73.4	Confident	168 Å²	168	117 Å²	117	66%	0.659	60%	0.603	S	S	*	*	H	α-helix	trans	-64.3	-45.2	179.7	-157	-104.8	0	0	0	112.1	L2 S8 L9 I10	L2-Y6 PolarHBondContact O-N 3.43Å; Y6-S8 VanDerWaalsContact C-N 3.34Å; Y6-S8 PolarHBondContact O-N 3.18Å; Y6-L9 PolarHBondContact O-N 2.84Å; Y6-I10 HydrophobicContact CD1-CD1 3.69Å; Y6-I10 HydrophobicContact CE1-CD1 3.67Å; Y6-I10 WeakPolarHBondContact O-CG1 3.49Å; Y6-I10 PolarHBondContact O-N 3.25Å
7	S	74.8	Confident	73.1	Confident	77 Å²	77	116.2 Å²	116.2	54%	0.538	60%	0.599	S	S	.	*	H	α-helix	trans	-62.4	-40.1	173.8	-169.4	0	0	0	0	112.1	H3 I10 G11	H3-S7 PolarHBondContact O-N 3.5Å; S7-I10 PolarHBondContact O-N 3.32Å; S7-G11 PolarHBondContact O-N 3.48Å
8	S	76.6	Confident	72.9	Confident	76 Å²	76	116 Å²	116	53%	0.531	60%	0.599	S	S	.	*	H	α-helix	trans	-65.9	-37.3	176	-163.8	0	0	0	0	113	K4 L5 Y6 L12	K4-S8 WeakPolarHBondContact O-CB 3.25Å; K4-S8 PolarHBondContact O-N 3.18Å; L5-S8 PolarHBondContact O-N 2.91Å; Y6-S8 VanDerWaalsContact C-N 3.34Å; Y6-S8 PolarHBondContact O-N 3.18Å; S8-L12 WeakPolarHBondContact O-CB 3.24Å; S8-L12 PolarHBondContact O-N 3.39Å; S8-L12 VanDerWaalsContact O-N 3.14Å
9	L	73.8	Confident	72.6	Confident	102 Å²	102	114.1 Å²	114.1	53%	0.534	59%	0.594	S	S	.	*	H	α-helix	trans	-65.7	-44.6	174.2	-107	79.5	0	0	0	111.4	L5 Y6 G11 L12 I13	L5-L9 PolarHBondContact O-N 2.88Å; Y6-L9 PolarHBondContact O-N 2.84Å; L9-G11 VanDerWaalsContact C-N 3.35Å; L9-G11 PolarHBondContact O-N 3.28Å; L9-L12 PolarHBondContact O-N 2.8Å; L9-I13 WeakPolarHBondContact O-CB 3.39Å; L9-I13 VanDerWaalsContact O-CG1 3.29Å; L9-I13 WeakPolarHBondContact O-CG1 3.2Å; L9-I13 PolarHBondContact O-N 2.94Å
10	I	80.5	Confident	72.2	Confident	74 Å²	74	111.3 Å²	111.3	38%	0.379	59%	0.585	S	S	.	*	H	α-helix	trans	-59.6	-46.3	178	-70.4	168.2	0	0	0	110.5	Y6 S7 L12 I13 Y14	Y6-I10 HydrophobicContact CD1-CD1 3.69Å; Y6-I10 HydrophobicContact CE1-CD1 3.67Å; Y6-I10 WeakPolarHBondContact O-CG1 3.49Å; Y6-I10 PolarHBondContact O-N 3.25Å; S7-I10 PolarHBondContact O-N 3.32Å; I10-L12 VanDerWaalsContact C-N 3.32Å; I10-L12 PolarHBondContact O-N 2.92Å; I10-I13 PolarHBondContact O-N 3.08Å; I10-Y14 HydrophobicContact CG2-CD2 3.76Å; I10-Y14 HydrophobicContact CG2-CE2 3.87Å; I10-Y14 WeakPolarHBondContact O-CD2 3.39Å; I10-Y14 PolarHBondContact O-N 3.24Å
11	G	78.9	Confident	71.8	Confident	41 Å²	41	111.5 Å²	111.5	42%	0.423	59%	0.586	S	S	.	*	H	α-helix	trans	-58.2	-42	175.6	0	0	0	0	0	113.1	S7 L9 Y14 S15	S7-G11 PolarHBondContact O-N 3.48Å; L9-G11 VanDerWaalsContact C-N 3.35Å; L9-G11 PolarHBondContact O-N 3.28Å; G11-Y14 PolarHBondContact O-N 3.31Å; G11-S15 WeakPolarHBondContact O-CB 3.36Å; G11-S15 PolarHBondContact O-N 3.12Å; G11-S15 PolarHBondContact O-OG 3.06Å
12	L	76.6	Confident	72.2	Confident	100 Å²	100	104.8 Å²	104.8	52%	0.524	56%	0.56	S	S	.	*	H	α-helix	trans	-66.6	-43.4	178.6	-134.5	159.1	0	0	0	111.6	S8 L9 I10 S15 L16	S8-L12 WeakPolarHBondContact O-CB 3.24Å; S8-L12 PolarHBondContact O-N 3.39Å; S8-L12 VanDerWaalsContact O-N 3.14Å; L9-L12 PolarHBondContact O-N 2.8Å; I10-L12 VanDerWaalsContact C-N 3.32Å; I10-L12 PolarHBondContact O-N 2.92Å; L12-S15 WeakPolarHBondContact CA-OG 3.41Å; L12-S15 PolarHBondContact O-N 3.36Å; L12-S15 PolarHBondContact O-OG 2.84Å; L12-L16 HydrophobicContact CD2-CD1 3.7Å; L12-L16 HydrophobicContact CD2-CG 4.25Å; L12-L16 WeakPolarHBondContact O-CG 3.45Å; L12-L16 PolarHBondContact O-N 2.91Å; L12-L16 VanDerWaalsContact O-N 3.09Å
13	I	77.1	Confident	72.1	Confident	89 Å²	89	102.9 Å²	102.9	46%	0.456	55%	0.549	S	S	.	.	H	α-helix	trans	-60.8	-46.6	175.5	-70.4	164.1	0	0	0	111.3	L9 I10 S15 L16 L17	L9-I13 WeakPolarHBondContact O-CB 3.39Å; L9-I13 VanDerWaalsContact O-CG1 3.29Å; L9-I13 WeakPolarHBondContact O-CG1 3.2Å; L9-I13 PolarHBondContact O-N 2.94Å; I10-I13 PolarHBondContact O-N 3.08Å; I13-S15 PolarHBondContact O-N 3.4Å; I13-L16 PolarHBondContact O-N 3.36Å; I13-L17 HydrophobicContact CG2-CD1 3.67Å; I13-L17 HydrophobicContact CG2-CG 4.48Å; I13-L17 WeakPolarHBondContact O-CB 3.43Å; I13-L17 WeakPolarHBondContact O-CG 3.48Å; I13-L17 PolarHBondContact O-N 3.16Å
14	Y	74.8	Confident	71.6	Confident	152 Å²	152	100.3 Å²	100.3	60%	0.596	54%	0.541	S	S	*	.	H	α-helix	trans	-62.7	-41.7	175.1	-89.5	-79.3	0	0	0	112.2	I10 G11 L16 L17 L18	I10-Y14 HydrophobicContact CG2-CD2 3.76Å; I10-Y14 HydrophobicContact CG2-CE2 3.87Å; I10-Y14 WeakPolarHBondContact O-CD2 3.39Å; I10-Y14 PolarHBondContact O-N 3.24Å; G11-Y14 PolarHBondContact O-N 3.31Å; Y14-L16 VanDerWaalsContact C-N 3.26Å; Y14-L16 PolarHBondContact O-N 3.3Å; Y14-L17 PolarHBondContact O-N 3.43Å; Y14-L18 HydrophobicContact CD1-CD1 3.9Å; Y14-L18 WeakPolarHBondContact O-CD1 3.24Å; Y14-L18 PolarHBondContact O-N 3.08Å; Y14-L18 VanDerWaalsContact O-N 3.11Å
15	S	75	Confident	70.9	Confident	75 Å²	75	96.7 Å²	96.7	52%	0.524	53%	0.529	S	S	.	.	H	α-helix	trans	-64.2	-28	179	71.3	0	0	0	0	114	G11 L12 I13 P19	G11-S15 WeakPolarHBondContact O-CB 3.36Å; G11-S15 PolarHBondContact O-N 3.12Å; G11-S15 PolarHBondContact O-OG 3.06Å; L12-S15 WeakPolarHBondContact CA-OG 3.41Å; L12-S15 PolarHBondContact O-N 3.36Å; L12-S15 PolarHBondContact O-OG 2.84Å; I13-S15 PolarHBondContact O-N 3.4Å; S15-P19 VanDerWaalsContact O-CD 3.26Å; S15-P19 WeakPolarHBondContact O-CD 3.42Å
16	L	70.9	Confident	70.2	Confident	115 Å²	115	96.6 Å²	96.6	60%	0.602	53%	0.529	S	S	*	.	H	α-helix	trans	-84.6	-36.3	176.5	-71.8	168.1	0	0	0	112.6	L12 I13 Y14 P19 S20	L12-L16 HydrophobicContact CD2-CD1 3.7Å; L12-L16 HydrophobicContact CD2-CG 4.25Å; L12-L16 WeakPolarHBondContact O-CG 3.45Å; L12-L16 PolarHBondContact O-N 2.91Å; L12-L16 VanDerWaalsContact O-N 3.09Å; I13-L16 PolarHBondContact O-N 3.36Å; Y14-L16 VanDerWaalsContact C-N 3.26Å; Y14-L16 PolarHBondContact O-N 3.3Å; L16-P19 WeakPolarHBondContact O-CD 3.27Å; L16-P19 WeakPolarHBondContact O-CG 3.46Å; L16-S20 PolarHBondContact O-OG 3.44Å
17	L	68.5	Low	69	Low	103 Å²	103	94.6 Å²	94.6	54%	0.539	52%	0.524	S	S	.	.	H	α-helix	trans	-79.2	-35	-176.1	-73.2	171.8	0	0	0	114.1	I13 Y14 S20 L21	I13-L17 HydrophobicContact CG2-CD1 3.67Å; I13-L17 HydrophobicContact CG2-CG 4.48Å; I13-L17 WeakPolarHBondContact O-CB 3.43Å; I13-L17 WeakPolarHBondContact O-CG 3.48Å; I13-L17 PolarHBondContact O-N 3.16Å; Y14-L17 PolarHBondContact O-N 3.43Å; L17-S20 WeakPolarHBondContact CA-OG 3.27Å; L17-S20 PolarHBondContact O-N 2.83Å; L17-S20 PolarHBondContact O-OG 3.31Å; L17-L21 PolarHBondContact O-N 3.44Å
18	L	69.8	Low	68	Low	113 Å²	113	94 Å²	94	59%	0.592	52%	0.52	S	S	*	.	H	α-helix	trans	-55.2	-51.5	179.8	-102.3	73	0	0	0	114.3	Y14 S20 L21 S22	Y14-L18 HydrophobicContact CD1-CD1 3.9Å; Y14-L18 WeakPolarHBondContact O-CD1 3.24Å; Y14-L18 PolarHBondContact O-N 3.08Å; Y14-L18 VanDerWaalsContact O-N 3.11Å; L18-S20 PolarHBondContact O-N 3.04Å; L18-L21 PolarHBondContact O-N 3.23Å; L18-S22 PolarHBondContact O-N 3.45Å
19	P	66.4	Low	66.8	Low	79 Å²	79	96.8 Å²	96.8	51%	0.513	52%	0.523	S	S	.	.	H	α-helix	trans	-63.8	-39.1	-179.1	23.3	-33.1	0	0	0	112.4	S15 L16 L21 S22 L23	S15-P19 VanDerWaalsContact O-CD 3.26Å; S15-P19 WeakPolarHBondContact O-CD 3.42Å; L16-P19 WeakPolarHBondContact O-CD 3.27Å; L16-P19 WeakPolarHBondContact O-CG 3.46Å; P19-L21 VanDerWaalsContact C-N 3.35Å; P19-L21 PolarHBondContact O-N 3.31Å; P19-S22 PolarHBondContact O-N 2.96Å; P19-L23 PolarHBondContact O-N 3.49Å
20	S	64.7	Low	65.9	Low	58 Å²	58	98 Å²	98	41%	0.406	53%	0.526	S	S	.	.	H	α-helix	trans	-64.4	-36	176	45.7	0	0	0	0	113.4	L16 L17 L18 L23 L24	L16-S20 PolarHBondContact O-OG 3.44Å; L17-S20 WeakPolarHBondContact CA-OG 3.27Å; L17-S20 PolarHBondContact O-N 2.83Å; L17-S20 PolarHBondContact O-OG 3.31Å; L18-S20 PolarHBondContact O-N 3.04Å; S20-L23 PolarHBondContact O-N 3.27Å; S20-L24 PolarHBondContact O-N 2.82Å; S20-L24 VanDerWaalsContact O-N 3.11Å
21	L	65	Low	64.4	Low	116 Å²	116	98.8 Å²	98.8	61%	0.607	53%	0.534	S	S	*	.	H	α-helix	trans	-71.9	-36.6	178	-144.9	76.5	0	0	0	111.7	L17 L18 P19 L24 L25	L17-L21 PolarHBondContact O-N 3.44Å; L18-L21 PolarHBondContact O-N 3.23Å; P19-L21 VanDerWaalsContact C-N 3.35Å; P19-L21 PolarHBondContact O-N 3.31Å; L21-L24 PolarHBondContact O-N 3.27Å; L21-L25 WeakPolarHBondContact O-CG 3.07Å; L21-L25 PolarHBondContact O-N 3.46Å; L21-L25 VanDerWaalsContact O-N 3.13Å
22	S	68.2	Low	63	Low	67 Å²	67	99.9 Å²	99.9	47%	0.469	54%	0.535	S	S	.	.	H	α-helix	trans	-63.5	-42.1	173.5	-161	0	0	0	0	111.7	L18 P19 L25 L26	L18-S22 PolarHBondContact O-N 3.45Å; P19-S22 PolarHBondContact O-N 2.96Å; S22-L25 PolarHBondContact O-N 3.21Å; S22-L26 WeakPolarHBondContact O-CG 3.14Å; S22-L26 PolarHBondContact O-N 2.9Å
23	L	61.3	Low	61.5	Low	101 Å²	101	101.9 Å²	101.9	53%	0.529	54%	0.54	S	S	.	.	H	α-helix	trans	-64	-43.2	177.7	-149.2	76.9	0	0	0	112	P19 S20 L25 L26 F27	P19-L23 PolarHBondContact O-N 3.49Å; S20-L23 PolarHBondContact O-N 3.27Å; L23-L25 VanDerWaalsContact C-N 3.32Å; L23-L25 PolarHBondContact O-N 3.29Å; L23-L26 PolarHBondContact O-N 2.89Å; L23-F27 HydrophobicContact CD2-CE2 4.02Å; L23-F27 HydrophobicContact CG-CD2 4.23Å; L23-F27 HydrophobicContact CG-CE2 3.9Å; L23-F27 VanDerWaalsContact O-CD2 3.27Å; L23-F27 WeakPolarHBondContact O-CD2 3.41Å; L23-F27 PolarHBondContact O-N 3.3Å
24	L	57.5	Low	60.1	Low	111 Å²	111	103.4 Å²	103.4	58%	0.581	55%	0.548	S	S	*	.	H	α-helix	trans	-61.9	-36.1	175.2	-87	161.9	0	0	0	113.2	S20 L21 S28	S20-L24 PolarHBondContact O-N 2.82Å; S20-L24 VanDerWaalsContact O-N 3.11Å; L21-L24 PolarHBondContact O-N 3.27Å; L24-S28 WeakPolarHBondContact O-CB 3.44Å; L24-S28 PolarHBondContact O-N 3.25Å; L24-S28 VanDerWaalsContact O-N 3.15Å; L24-S28 PolarHBondContact O-OG 3.1Å
25	L	58.2	Low	58.4	Low	104 Å²	104	100 Å²	100	55%	0.545	55%	0.546	S	S	.	.	H	α-helix	trans	-68.5	-42.6	174.1	-73.7	168.6	0	0	0	111.6	L21 S22 L23 S28 F29	L21-L25 WeakPolarHBondContact O-CG 3.07Å; L21-L25 PolarHBondContact O-N 3.46Å; L21-L25 VanDerWaalsContact O-N 3.13Å; S22-L25 PolarHBondContact O-N 3.21Å; L23-L25 VanDerWaalsContact C-N 3.32Å; L23-L25 PolarHBondContact O-N 3.29Å; L25-S28 WeakPolarHBondContact O-CB 3.29Å; L25-S28 PolarHBondContact O-N 3.05Å; L25-S28 VanDerWaalsContact O-N 3.16Å; L25-F29 WeakPolarHBondContact O-CD2 3.45Å; L25-F29 PolarHBondContact O-N 3.49Å; L25-F29 VanDerWaalsContact O-N 3.07Å
26	L	58.5	Low	56.9	Low	107 Å²	107	102.1 Å²	102.1	56%	0.56	55%	0.55	S	S	*	*	H	α-helix	trans	-59.9	-48.3	176.4	-73.2	166.2	0	0	0	112.1	S22 L23 S28 F29 E30	S22-L26 WeakPolarHBondContact O-CG 3.14Å; S22-L26 PolarHBondContact O-N 2.9Å; L23-L26 PolarHBondContact O-N 2.89Å; L26-S28 PolarHBondContact O-N 3.31Å; L26-F29 PolarHBondContact O-N 2.77Å; L26-F29 VanDerWaalsContact O-N 3.08Å; L26-E30 PolarHBondContact O-N 2.69Å; L26-E30 VanDerWaalsContact O-N 3.14Å
27	F	52.8	Low	55.4	Low	126 Å²	126	107.9 Å²	107.9	55%	0.553	56%	0.564	S	S	*	*	H	α-helix	trans	-60.5	-32.5	175	-79.2	-62.4	0	0	0	113.2	L23 T31	L23-F27 HydrophobicContact CD2-CE2 4.02Å; L23-F27 HydrophobicContact CG-CD2 4.23Å; L23-F27 HydrophobicContact CG-CE2 3.9Å; L23-F27 VanDerWaalsContact O-CD2 3.27Å; L23-F27 WeakPolarHBondContact O-CD2 3.41Å; L23-F27 PolarHBondContact O-N 3.3Å; F27-T31 PolarHBondContact O-N 3.43Å; F27-T31 PolarHBondContact O-OG1 3.43Å; F27-T31 VanDerWaalsContact O-OG1 3.12Å
28	S	53.2	Low	54.2	Low	65 Å²	65	109.4 Å²	109.4	46%	0.455	57%	0.572	S	S	.	*	H	α-helix	trans	-71.2	-29.4	176.1	-57.3	0	0	0	0	113	L24 L25 L26 T31 S32	L24-S28 WeakPolarHBondContact O-CB 3.44Å; L24-S28 PolarHBondContact O-N 3.25Å; L24-S28 VanDerWaalsContact O-N 3.15Å; L24-S28 PolarHBondContact O-OG 3.1Å; L25-S28 WeakPolarHBondContact O-CB 3.29Å; L25-S28 PolarHBondContact O-N 3.05Å; L25-S28 VanDerWaalsContact O-N 3.16Å; L26-S28 PolarHBondContact O-N 3.31Å; S28-T31 PolarHBondContact O-OG1 3.48Å; S28-S32 PolarHBondContact O-OG 3.34Å
29	F	51.2	Low	52.5	Low	134 Å²	134	111.1 Å²	111.1	59%	0.588	58%	0.581	S	S	*	*	H	α-helix	trans	-77.4	-43.1	177	-93.4	-81.9	0	0	0	112.4	L25 L26 T31 S32 F33	L25-F29 WeakPolarHBondContact O-CD2 3.45Å; L25-F29 PolarHBondContact O-N 3.49Å; L25-F29 VanDerWaalsContact O-N 3.07Å; L26-F29 PolarHBondContact O-N 2.77Å; L26-F29 VanDerWaalsContact O-N 3.08Å; F29-T31 PolarHBondContact O-N 3.34Å; F29-S32 WeakPolarHBondContact O-CB 3.05Å; F29-S32 PolarHBondContact O-N 2.9Å; F29-S32 VanDerWaalsContact O-N 3.12Å; F29-F33 HydrophobicContact CD1-CE2 4.27Å; F29-F33 WeakPolarHBondContact O-CD2 3.15Å; F29-F33 PolarHBondContact O-N 3.18Å; F29-F33 VanDerWaalsContact O-N 3.16Å
30	E	54.1	Low	50.8	Low	129 Å²	129	110.7 Å²	110.7	60%	0.603	59%	0.591	S	S	*	*	H	α-helix	trans	-62.8	-43.5	179.1	-69.8	-165.7	137.3	0	0	112.5	L26 S32 F33 I34	L26-E30 PolarHBondContact O-N 2.69Å; L26-E30 VanDerWaalsContact O-N 3.14Å; E30-S32 PolarHBondContact O-N 2.88Å; E30-F33 PolarHBondContact O-N 2.91Å; E30-I34 WeakPolarHBondContact O-CG1 3.5Å; E30-I34 PolarHBondContact O-N 2.92Å; E30-I34 VanDerWaalsContact O-N 3.16Å
31	T	50.1	Low	49.3	Very low	89 Å²	89	117.1 Å²	117.1	55%	0.546	62%	0.615	S	S	.	*	H	α-helix	trans	-61.9	-27.7	175.4	51.9	0	0	0	0	113.1	F27 S28 F29 S35	F27-T31 PolarHBondContact O-N 3.43Å; F27-T31 PolarHBondContact O-OG1 3.43Å; F27-T31 VanDerWaalsContact O-OG1 3.12Å; S28-T31 PolarHBondContact O-OG1 3.48Å; F29-T31 PolarHBondContact O-N 3.34Å; T31-S35 PolarHBondContact O-OG 2.83Å
32	S	49	Very low	47.7	Very low	65 Å²	65	116.8 Å²	116.8	46%	0.455	62%	0.622	S	S	.	*	H	α-helix	trans	-75.1	-36.8	177.3	-60.6	0	0	0	0	112.3	S28 F29 E30	S28-S32 PolarHBondContact O-OG 3.34Å; F29-S32 WeakPolarHBondContact O-CB 3.05Å; F29-S32 PolarHBondContact O-N 2.9Å; F29-S32 VanDerWaalsContact O-N 3.12Å; E30-S32 PolarHBondContact O-N 2.88Å
33	F	45.9	Very low	46.3	Very low	142 Å²	142	120.7 Å²	120.7	62%	0.623	64%	0.643	S	S	*	*	H	α-helix	trans	-74.7	-37.2	178.3	-85.6	-75.3	0	0	0	113.4	F29 E30 S35 I36	F29-F33 HydrophobicContact CD1-CE2 4.27Å; F29-F33 WeakPolarHBondContact O-CD2 3.15Å; F29-F33 PolarHBondContact O-N 3.18Å; F29-F33 VanDerWaalsContact O-N 3.16Å; E30-F33 PolarHBondContact O-N 2.91Å; F33-S35 PolarHBondContact O-N 3.49Å; F33-I36 PolarHBondContact O-N 2.92Å
34	I	46.6	Very low	45	Very low	120 Å²	120	122.9 Å²	122.9	62%	0.615	66%	0.655	S	S	*	*	H	α-helix	trans	-60.5	-29.2	176.1	-66.1	166.1	0	0	0	111.3	E30 I36	E30-I34 WeakPolarHBondContact O-CG1 3.5Å; E30-I34 PolarHBondContact O-N 2.92Å; E30-I34 VanDerWaalsContact O-N 3.16Å; I34-I36 VanDerWaalsContact C-N 3.3Å; I34-I36 PolarHBondContact O-N 3.26Å
35	S	39.5	Very low	44	Very low	80 Å²	80	123.4 Å²	123.4	56%	0.559	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-14.3	-179.9	-59.8	0	0	0	0	114.9	T31 F33	T31-S35 PolarHBondContact O-OG 2.83Å; F33-S35 PolarHBondContact O-N 3.49Å
36	I	44.3	Very low	42.9	Very low	121 Å²	121	126 Å²	126	62%	0.621	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	-21.6	-169.9	-71.7	164.4	0	0	0	113.2	F33 I34 I38	F33-I36 PolarHBondContact O-N 2.92Å; I34-I36 VanDerWaalsContact C-N 3.3Å; I34-I36 PolarHBondContact O-N 3.26Å; I36-I38 PolarHBondContact O-N 3.48Å
37	W	39.3	Very low	41.9	Very low	236 Å²	236	126 Å²	126	89%	0.894	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-0	-174.5	-108.8	76.5	0	0	0	115.9
38	I	42.1	Very low	41	Very low	135 Å²	135	127.8 Å²	127.8	69%	0.692	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	-16.3	-171	-62.4	177.4	0	0	0	113.2	I36	I36-I38 PolarHBondContact O-N 3.48Å
39	N	34.7	Very low	39.9	Very low	149 Å²	149	130.7 Å²	130.7	80%	0.797	73%	0.726	S	S	*	*			trans	-109.7	44.4	-177.1	-72.3	-62.9	0	0	0	113.4
40	G	31.7	Very low	38.9	Very low	70 Å²	70	128.5 Å²	128.5	72%	0.722	73%	0.733	S	S	*	*			trans	-91.1	4.7	-169.3	0	0	0	0	0	118.1
41	Q	32.5	Very low	37.7	Very low	193 Å²	193	127.6 Å²	127.6	90%	0.902	74%	0.741	S	S	*	*	S	Bend	trans	-142.7	77.3	-175.5	-68	-167.1	12.5	0	0	114.9
42	S	31.5	Very low	36.7	Very low	109 Å²	109	128.9 Å²	128.9	76%	0.762	75%	0.745	S	S	*	*			trans	-177.2	117.7	143.1	58.4	0	0	0	0	111.8
43	V	38.3	Very low	35.7	Very low	148 Å²	148	132.6 Å²	132.6	90%	0.897	76%	0.764	S	S	*	*			trans	-145.6	117.4	158.7	-101.9	0	0	0	0	109.2
44	N	33.4	Very low	34.9	Very low	147 Å²	147	135 Å²	135	79%	0.786	77%	0.77	S	S	*	*			trans	-82.8	133.6	-178.1	-55.9	-59	0	0	0	110.8	L46	N44-L46 HydrophobicContact CB-CD1 3.78Å
45	S	37.7	Very low	34	Very low	123 Å²	123	137.8 Å²	137.8	86%	0.86	78%	0.78	S	S	*	*			trans	-98.6	90.9	161.8	47.2	0	0	0	0	110.4
46	L	34.1	Very low	33.4	Very low	158 Å²	158	140 Å²	140	83%	0.827	79%	0.792	S	S	*	*			trans	-77.6	124.9	168.9	-91.1	75.5	0	0	0	110.4	N44	N44-L46 HydrophobicContact CB-CD1 3.78Å
47	S	38.5	Very low	32.9	Very low	108 Å²	108	144.9 Å²	144.9	76%	0.755	80%	0.803	S	S	*	*			trans	-157.9	108.1	154.5	58.4	0	0	0	0	111.2
48	N	32.5	Very low	33	Very low	163 Å²	163	138.4 Å²	138.4	87%	0.872	79%	0.794	S	S	*	*			trans	11.8	122.2	158.3	-52.7	-18.9	0	0	0	117
49	S	31.4	Very low	33.5	Very low	125 Å²	125	135.5 Å²	135.5	87%	0.874	78%	0.784	S	S	*	*				-169.4	-171	73.3	45.1	0	0	0	0	112.8
50	A	30.3	Very low	34.7	Very low	88 Å²	88	132.1 Å²	132.1	73%	0.727	77%	0.768	S	S	*	*			trans	-71.6	146.6	-155.7	0	0	0	0	0	117.5
51	S	27.8	Very low	36.6	Very low	111 Å²	111	134.1 Å²	134.1	78%	0.776	75%	0.754	S	S	*	*			trans	52.4	101.4	145.6	61	0	0	0	0	120.3
52	D	29.8	Very low	39	Very low	116 Å²	116	125.9 Å²	125.9	62%	0.62	72%	0.716	S	S	*	*				-151.4	143.2	98.6	-164.7	-1.3	0	0	0	109.7	R54	D52-R54 PolarHBondContact O-N 2.9Å; D52-R54 WeakPolarHBondContact OD2-CD 3.37Å; D52-R54 IonicContact OD2-CZ 2.67Å; D52-R54 IonicContact OD2-NE 3.61Å; D52-R54 PolarHBondContact OD2-NE 3.48Å; D52-R54 IonicContact OD2-NH2 3.77Å; D52-R54 PolarHBondContact OD2-NH2 3.25Å
53	T	27.6	Very low	41.6	Very low	142 Å²	142	120.7 Å²	120.7	87%	0.871	68%	0.68	S	S	*	*			trans	-100.4	58.5	-175.6	-41.6	0	0	0	0	110.9
54	R	29.7	Very low	44	Very low	194 Å²	194	116 Å²	116	73%	0.732	65%	0.646	S	S	*	*			trans	-98.8	115.5	175.3	-65	-172.9	-167.9	-150.3	-2.4	110.7	D52	D52-R54 PolarHBondContact O-N 2.9Å; D52-R54 WeakPolarHBondContact OD2-CD 3.37Å; D52-R54 IonicContact OD2-CZ 2.67Å; D52-R54 IonicContact OD2-NE 3.61Å; D52-R54 PolarHBondContact OD2-NE 3.48Å; D52-R54 IonicContact OD2-NH2 3.77Å; D52-R54 PolarHBondContact OD2-NH2 3.25Å
55	Q	27.4	Very low	46.6	Very low	177 Å²	177	109.8 Å²	109.8	83%	0.827	61%	0.613	S	S	*	*			trans	-54.1	144.4	161.5	-64.4	173.6	-61.4	0	0	109.2	R57	Q55-R57 PolarHBondContact O-N 3.34Å
56	P	28	Very low	49.1	Very low	127 Å²	127	104.7 Å²	104.7	83%	0.825	58%	0.576	S	S	*	*			trans	-60.5	111.1	166.2	26.6	-32.4	0	0	0	107.7	S58	P56-S58 PolarHBondContact O-N 3.34Å
57	R	32.6	Very low	51.8	Low	223 Å²	223	102 Å²	102	84%	0.842	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-57.9	135	172.8	-92	-172.6	165.1	111.6	-2.2	108.2	Q55	Q55-R57 PolarHBondContact O-N 3.34Å
58	S	41	Very low	54.3	Low	100 Å²	100	100.1 Å²	100.1	70%	0.699	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-50.5	129.4	165.5	48.1	0	0	0	0	108.9	P56 T60	P56-S58 PolarHBondContact O-N 3.34Å; S58-T60 PolarHBondContact O-N 2.89Å
59	P	53.8	Low	57.2	Low	74 Å²	74	94.6 Å²	94.6	48%	0.481	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-60.3	125.4	-177.8	24.6	-33.6	0	0	0	109.4	R61	P59-R61 PolarHBondContact O-N 3.36Å
60	T	60.1	Low	60	Low	78 Å²	78	93 Å²	93	48%	0.479	50%	0.499	S	S	.	.			trans	-62	102.3	-178.3	-49.5	0	0	0	0	109.5	S58 L62 V127	S58-T60 PolarHBondContact O-N 2.89Å; T60-L62 HydrophobicContact CG2-CD2 4.03Å; T60-L62 HydrophobicContact CG2-CG 4.3Å; T60-L62 PolarHBondContact O-N 3.47Å; T60-V127 WeakPolarHBondContact O-CG1 3.26Å
61	R	70.8	Confident	63	Low	113 Å²	113	92.4 Å²	92.4	43%	0.426	49%	0.49	S	S	.	.			trans	-77.6	104.1	-179.2	-79.3	-170.9	164.8	-174.4	-2.3	110	P59 E128 L195 S271	P59-R61 PolarHBondContact O-N 3.36Å; R61-E128 IonicContact NE-OE2 3.8Å; R61-E128 IonicContact NH2-OE2 3.43Å; R61-L195 HydrophobicContact CB-CB 4.46Å; R61-L195 HydrophobicContact CB-CD1 4.25Å; R61-L195 PolarHBondContact O-N 2.88Å; R61-S271 PolarHBondContact NH1-OG 2.99Å
62	L	83.6	Confident	66	Low	19 Å²	19	88.3 Å²	88.3	10%	0.099	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	145.6	177	-61.3	174.6	0	0	0	110.8	T60 Y64 E128 M129 S130 G193	T60-L62 HydrophobicContact CG2-CD2 4.03Å; T60-L62 HydrophobicContact CG2-CG 4.3Å; T60-L62 PolarHBondContact O-N 3.47Å; L62-Y64 HydrophobicContact CB-CE2 3.94Å; L62-E128 PolarHBondContact N-O 2.82Å; L62-M129 HydrophobicContact CB-CB 4.47Å; L62-M129 HydrophobicContact CB-CG 4.18Å; L62-M129 HydrophobicContact CD1-CE 4.2Å; L62-M129 HydrophobicContact CD1-CG 4.36Å; L62-M129 HydrophobicContact CD1-SD 4.2Å; L62-M129 CarbonylContact O-C 3.53Å; L62-M129 WeakPolarHBondContact O-CA 3.15Å; L62-S130 PolarHBondContact O-N 2.84Å; L62-G193 CarbonylContact C-O 3.54Å; L62-G193 VanDerWaalsContact CA-O 3.32Å; L62-G193 WeakPolarHBondContact CA-O 3.45Å
63	G	86.3	Confident	69	Low	0 Å²	0	86.6 Å²	86.6	0%	0	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	132.1	-177.3	0	0	0	0	0	112.1	S130 G193	G63-S130 CarbonylContact C-O 3.56Å; G63-S130 VanDerWaalsContact CA-O 3.3Å; G63-S130 WeakPolarHBondContact CA-O 3.46Å; G63-G193 PolarHBondContact N-O 2.74Å; G63-G193 WeakPolarHBondContact O-CA 3.43Å
64	Y	88.4	Confident	72	Confident	50 Å²	50	79.9 Å²	79.9	20%	0.196	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	127.5	-178.1	-57.5	-83.3	0	0	0	110.5	L62 L72 L74 M129 S130 V131 R132	L62-Y64 HydrophobicContact CB-CE2 3.94Å; Y64-L72 HydrophobicContact CD1-CD1 4.09Å; Y64-L72 HydrophobicContact CD1-CD2 4.41Å; Y64-L72 HydrophobicContact CD2-CD2 4.4Å; Y64-L72 HydrophobicContact CG-CD1 4.41Å; Y64-L72 HydrophobicContact CG-CD2 3.9Å; Y64-L74 HydrophobicContact CD2-CD2 3.57Å; Y64-L74 HydrophobicContact CE2-CD2 3.49Å; Y64-L74 VanDerWaalsContact CE2-CD2 3.49Å; Y64-L74 HydrophobicContact CG-CD2 4.24Å; Y64-M129 HydrophobicContact CE2-CB 4.39Å; Y64-M129 HydrophobicContact CE2-SD 4.48Å; Y64-S130 PolarHBondContact N-O 2.62Å; Y64-V131 HydrophobicContact CD2-CG2 4.29Å; Y64-V131 WeakPolarHBondContact O-CA 3.47Å; Y64-R132 PolarHBondContact O-N 3.44Å
65	L	88.3	Confident	74.9	Confident	17 Å²	17	75.2 Å²	75.2	9%	0.089	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	117.7	173.6	-175.7	66.6	0	0	0	109.2	R132 I134 C160 V187 T189	L65-R132 WeakPolarHBondContact CA-O 3.29Å; L65-R132 HydrophobicContact CD1-CB 3.84Å; L65-R132 HydrophobicContact CD1-CG 3.59Å; L65-I134 HydrophobicContact CD1-CD1 3.77Å; L65-I134 HydrophobicContact CD1-CG1 3.82Å; L65-I134 HydrophobicContact CD1-CG2 4.26Å; L65-I134 HydrophobicContact CD2-CD1 4.07Å; L65-I134 HydrophobicContact CG-CD1 4.05Å; L65-I134 HydrophobicContact CG-CG1 4.33Å; L65-C160 HydrophobicContact CD1-CB 3.91Å; L65-C160 HydrophobicContact CD2-CB 4.31Å; L65-C160 WeakPolarHBondContact CD2-SG 3.38Å; L65-V187 HydrophobicContact CB-CG2 4.27Å; L65-V187 HydrophobicContact CD1-CG2 4.29Å; L65-T189 HydrophobicContact CB-CG2 3.97Å; L65-T189 HydrophobicContact CD2-CG2 4.24Å; L65-T189 HydrophobicContact CG-CG2 4.49Å
66	I	89.3	Confident	78	Confident	16 Å²	16	66.8 Å²	66.8	8%	0.082	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	159.6	-176.1	64.4	176.5	0	0	0	112.1	L72 A106 V131 R132 V133 I134	I66-L72 HydrophobicContact CD1-CB 3.8Å; I66-L72 HydrophobicContact CD1-CD2 4.08Å; I66-L72 HydrophobicContact CG2-CB 4.3Å; I66-L72 HydrophobicContact CG2-CD1 4.32Å; I66-L72 HydrophobicContact CG2-CD2 4.09Å; I66-L72 HydrophobicContact CG2-CG 4.47Å; I66-A106 HydrophobicContact CD1-CB 3.58Å; I66-A106 HydrophobicContact CG1-CB 4.41Å; I66-V131 HydrophobicContact CD1-CG1 4.07Å; I66-V131 HydrophobicContact CG1-CG1 4.35Å; I66-R132 PolarHBondContact N-O 2.86Å; I66-V133 HydrophobicContact CD1-CG2 4.02Å; I66-V133 HydrophobicContact CG1-CB 4.37Å; I66-V133 HydrophobicContact CG1-CG1 4.35Å; I66-V133 HydrophobicContact CG1-CG2 3.87Å; I66-V133 WeakPolarHBondContact O-CA 3.33Å; I66-I134 PolarHBondContact O-N 2.85Å
67	R	90.2	Very high	80.8	Confident	101 Å²	101	64 Å²	64	38%	0.381	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	151	176.3	-62	175.2	-178	-98.5	-8.8	111	G69 Q70 I134 F136	R67-G69 PolarHBondContact O-N 3.47Å; R67-Q70 HydrophobicContact CB-CG 3.96Å; R67-Q70 WeakPolarHBondContact O-CB 3.3Å; R67-Q70 PolarHBondContact O-N 2.9Å; R67-I134 WeakPolarHBondContact CA-O 3.27Å; R67-F136 HydrophobicContact CG-CD2 3.73Å; R67-F136 HydrophobicContact CG-CE2 3.51Å; R67-F136 VanDerWaalsContact CZ-CE2 3.47Å; R67-F136 VanDerWaalsContact NH1-CD2 3.29Å; R67-F136 VanDerWaalsContact NH2-CE1 3.3Å; R67-F136 VanDerWaalsContact NH2-CZ 3.34Å
68	V	92.6	Very high	83.4	Confident	68 Å²	68	56 Å²	56	41%	0.412	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	134.2	165.2	176.8	0	0	0	0	109.7	Q70 A106 L108 V133 I134 D135	V68-Q70 VanDerWaalsContact C-N 3.3Å; V68-Q70 PolarHBondContact O-N 3.28Å; V68-A106 CarbonylContact C-O 3.59Å; V68-A106 WeakPolarHBondContact CA-O 3.28Å; V68-L108 HydrophobicContact CG2-CD2 3.56Å; V68-L108 HydrophobicContact CG2-CG 3.98Å; V68-V133 HydrophobicContact CB-CG1 4.49Å; V68-V133 HydrophobicContact CG2-CG1 3.88Å; V68-I134 PolarHBondContact N-O 2.79Å; V68-I134 VanDerWaalsContact N-O 3.16Å; V68-D135 HydrophobicContact CG2-CB 4.13Å
69	G	92.3	Very high	85.5	Confident	47 Å²	47	57.7 Å²	57.7	49%	0.485	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	-11.6	-177.2	0	0	0	0	0	115.7	R67 A106	R67-G69 PolarHBondContact O-N 3.47Å; G69-A106 PolarHBondContact N-O 2.9Å
70	Q	91	Very high	87.2	Confident	91 Å²	91	54.8 Å²	54.8	43%	0.425	29%	0.294	S	S	.	.			trans	-72.7	157	170.1	-73.5	-178.5	-34.9	0	0	111	R67 V68 A106	R67-Q70 HydrophobicContact CB-CG 3.96Å; R67-Q70 WeakPolarHBondContact O-CB 3.3Å; R67-Q70 PolarHBondContact O-N 2.9Å; V68-Q70 VanDerWaalsContact C-N 3.3Å; V68-Q70 PolarHBondContact O-N 3.28Å; Q70-A106 VanDerWaalsContact O-CB 3.23Å; Q70-A106 WeakPolarHBondContact O-CB 3.44Å; Q70-A106 PolarHBondContact O-N 2.98Å
71	S	92.4	Very high	88.5	Confident	77 Å²	77	56.4 Å²	56.4	54%	0.538	30%	0.303	S	S	.	.			trans	-110.3	138.9	171.7	-57.8	0	0	0	0	109.8	I103 S105	S71-I103 CarbonylContact C-O 3.53Å; S71-I103 WeakPolarHBondContact CA-O 3.48Å; S71-I103 WeakPolarHBondContact CB-O 3.44Å; S71-S105 PolarHBondContact OG-N 3.45Å; S71-S105 VanDerWaalsContact OG-N 3.09Å
72	L	90.9	Very high	89.5	Confident	25 Å²	25	57.8 Å²	57.8	13%	0.131	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	132.4	-178.2	176.5	64.6	0	0	0	109.1	Y64 I66 L74 T102 I103 V131	Y64-L72 HydrophobicContact CD1-CD1 4.09Å; Y64-L72 HydrophobicContact CD1-CD2 4.41Å; Y64-L72 HydrophobicContact CD2-CD2 4.4Å; Y64-L72 HydrophobicContact CG-CD1 4.41Å; Y64-L72 HydrophobicContact CG-CD2 3.9Å; I66-L72 HydrophobicContact CD1-CB 3.8Å; I66-L72 HydrophobicContact CD1-CD2 4.08Å; I66-L72 HydrophobicContact CG2-CB 4.3Å; I66-L72 HydrophobicContact CG2-CD1 4.32Å; I66-L72 HydrophobicContact CG2-CD2 4.09Å; I66-L72 HydrophobicContact CG2-CG 4.47Å; L72-L74 HydrophobicContact CD2-CD2 3.72Å; L72-L74 HydrophobicContact CG-CD2 4.02Å; L72-T102 CarbonylContact O-C 3.56Å; L72-T102 WeakPolarHBondContact O-CA 3.33Å; L72-I103 PolarHBondContact N-O 3.01Å; L72-I103 PolarHBondContact O-N 2.95Å; L72-V131 HydrophobicContact CD2-CG1 3.87Å; L72-V131 HydrophobicContact CD2-CG2 3.93Å
73	N	92.2	Very high	90	Very high	80 Å²	80	58.1 Å²	58.1	43%	0.428	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	106.8	173.9	-164.7	26.9	0	0	0	109.8	F100 Y101 T102	N73-F100 WeakPolarHBondContact ND2-CD1 3.43Å; N73-Y101 PolarHBondContact OD1-O 3.13Å; N73-T102 HydrophobicContact CB-CG2 4.46Å; N73-T102 PolarHBondContact OD1-OG1 3.08Å
74	L	91.3	Very high	90.4	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	136.1	171.7	-57.1	-175.7	0	0	0	108.9	Y64 L72 W85 F100 Y101 Y114 M129 V131	Y64-L74 HydrophobicContact CD2-CD2 3.57Å; Y64-L74 HydrophobicContact CE2-CD2 3.49Å; Y64-L74 VanDerWaalsContact CE2-CD2 3.49Å; Y64-L74 HydrophobicContact CG-CD2 4.24Å; L72-L74 HydrophobicContact CD2-CD2 3.72Å; L72-L74 HydrophobicContact CG-CD2 4.02Å; L74-W85 HydrophobicContact CB-CH2 3.54Å; L74-W85 HydrophobicContact CB-CZ2 4.25Å; L74-W85 HydrophobicContact CB-CZ3 3.9Å; L74-W85 HydrophobicContact CD1-CH2 4.44Å; L74-W85 HydrophobicContact CD1-CZ3 3.93Å; L74-F100 CarbonylContact O-C 3.6Å; L74-F100 VanDerWaalsContact O-CA 3.29Å; L74-F100 WeakPolarHBondContact O-CA 3.19Å; L74-Y101 HydrophobicContact CD1-CD1 4.22Å; L74-Y101 PolarHBondContact N-O 3.24Å; L74-Y101 PolarHBondContact O-N 2.93Å; L74-Y114 HydrophobicContact CD1-CD1 4.47Å; L74-Y114 HydrophobicContact CD1-CD2 4.25Å; L74-Y114 HydrophobicContact CD1-CG 3.97Å; L74-M129 HydrophobicContact CB-SD 4.24Å; L74-M129 HydrophobicContact CD1-SD 4.49Å; L74-V131 HydrophobicContact CD1-CG2 4.01Å; L74-V131 HydrophobicContact CD2-CG2 3.97Å
75	K	91.2	Very high	90.6	Very high	97 Å²	97	58.3 Å²	58.3	42%	0.422	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	130.9	172.1	-171.5	-164	174	-169.1	0	109.3	Q99 F100 M129	K75-Q99 HydrophobicContact CG-CG 4.22Å; K75-F100 HydrophobicContact CB-CD1 3.84Å; K75-F100 HydrophobicContact CB-CE1 3.72Å; K75-F100 HydrophobicContact CD-CE1 3.76Å; K75-F100 HydrophobicContact CD-CZ 3.89Å; K75-F100 HydrophobicContact CG-CD1 3.81Å; K75-F100 HydrophobicContact CG-CE1 3.41Å; K75-F100 VanDerWaalsContact CG-CE1 3.41Å; K75-F100 HydrophobicContact CG-CZ 3.83Å; K75-M129 WeakPolarHBondContact O-CE 3.48Å
76	C	91.1	Very high	90.9	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.311	C	S	.	.			trans	-65.7	125.5	167.4	-153.4	0	0	0	0	110	Y83 W85 Q99 C116	C76-Y83 HydrophobicContact CB-CD1 3.82Å; C76-Y83 HydrophobicContact CB-CE1 3.93Å; C76-W85 HydrophobicContact CB-CZ2 4.07Å; C76-Q99 HydrophobicContact CB-CG 4.19Å; C76-Q99 PolarHBondContact N-O 3.16Å; C76-C116 HydrophobicContact CB-CB 3.9Å; C76-C116 WeakPolarHBondContact CB-SG 3.31Å; C76-C116 WeakPolarHBondContact SG-CB 3.48Å; C76-C116 CovalentContact SG-SG 2.03Å; C76-C116 PolarHBondContact SG-SG 2.98Å
77	P	87.7	Confident	91.1	Very high	68 Å²	68	57.6 Å²	57.6	44%	0.442	31%	0.312	S	S	.	.	S	Bend	trans	-78.6	-22.1	-174.4	31.9	-36.6	0	0	0	113.2	V127	P77-V127 HydrophobicContact CG-CB 4.4Å; P77-V127 HydrophobicContact CG-CG1 4.06Å; P77-V127 HydrophobicContact CG-CG2 3.85Å
78	D	86.3	Confident	91	Very high	54 Å²	54	55.4 Å²	55.4	29%	0.289	31%	0.309	S	S	.	.	S	Bend	trans	-78.3	153.9	174.3	-65.7	-22.7	0	0	0	111.1	Y83 Q99 A118 S125	D78-Y83 PolarHBondContact O-OH 2.89Å; D78-Q99 PolarHBondContact O-NE2 3.36Å; D78-A118 HydrophobicContact CB-CB 3.9Å; D78-S125 VanDerWaalsContact OD2-CB 3.25Å; D78-S125 WeakPolarHBondContact OD2-CB 3.27Å; D78-S125 PolarHBondContact OD2-OG 3.24Å
79	D	86.4	Confident	90.6	Very high	136 Å²	136	58 Å²	58	73%	0.727	32%	0.321	S	S	*	.			trans	-113.3	89.9	-176.6	-164.5	32.6	0	0	0	111	H120	D79-H120 PolarHBondContact O-CD2 3.03Å; D79-H120 PolarHBondContact O-NE2 3.44Å
80	A	88.4	Confident	90.5	Very high	14 Å²	14	60.2 Å²	60.2	12%	0.116	32%	0.318	C	S	.	.			trans	-112.8	166	-172.9	0	0	0	0	0	113.4	Y83 A118 V119	A80-Y83 HydrophobicContact CB-CD1 4.47Å; A80-Y83 HydrophobicContact CB-CE1 3.96Å; A80-Y83 PolarHBondContact N-OH 2.92Å; A80-Y83 WeakPolarHBondContact O-CE2 3.32Å; A80-Y83 PolarHBondContact O-OH 2.86Å; A80-Y83 VanDerWaalsContact O-OH 3.08Å; A80-A118 HydrophobicContact CB-CB 3.68Å; A80-V119 WeakPolarHBondContact CB-O 3.35Å
81	V	88.7	Confident	90.3	Very high	111 Å²	111	59.8 Å²	59.8	67%	0.673	32%	0.323	S	S	*	.	S	Bend	trans	-80.6	-35.2	175	-175.6	0	0	0	0	111.1	V119	V81-V119 PolarHBondContact N-O 3.18Å
82	F	92	Very high	90.1	Very high	142 Å²	142	61.4 Å²	61.4	62%	0.623	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.9	139.5	176.9	-60.5	-84.3	0	0	0	110.6	V119	F82-V119 HydrophobicContact CB-CB 4.32Å; F82-V119 PolarHBondContact N-O 2.78Å; F82-V119 PolarHBondContact O-N 3.05Å
83	Y	93.8	Very high	90.1	Very high	26 Å²	26	65 Å²	65	10%	0.102	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	153.1	174.5	-56.9	-90.6	0	0	0	109.5	C76 D78 A80 E97 E98 Q99 H117 A118	C76-Y83 HydrophobicContact CB-CD1 3.82Å; C76-Y83 HydrophobicContact CB-CE1 3.93Å; D78-Y83 PolarHBondContact O-OH 2.89Å; A80-Y83 HydrophobicContact CB-CD1 4.47Å; A80-Y83 HydrophobicContact CB-CE1 3.96Å; A80-Y83 PolarHBondContact N-OH 2.92Å; A80-Y83 WeakPolarHBondContact O-CE2 3.32Å; A80-Y83 PolarHBondContact O-OH 2.86Å; A80-Y83 VanDerWaalsContact O-OH 3.08Å; Y83-E97 CarbonylContact O-C 3.55Å; Y83-E97 VanDerWaalsContact O-CA 3.29Å; Y83-E97 WeakPolarHBondContact O-CA 3.49Å; Y83-E98 WeakPolarHBondContact CB-O 3.47Å; Y83-Q99 HydrophobicContact CD1-CB 4.25Å; Y83-Q99 HydrophobicContact CD1-CG 4.29Å; Y83-Q99 HydrophobicContact CD2-CB 3.95Å; Y83-Q99 HydrophobicContact CE1-CB 3.98Å; Y83-Q99 HydrophobicContact CE1-CG 3.69Å; Y83-Q99 HydrophobicContact CE2-CB 3.69Å; Y83-Q99 HydrophobicContact CE2-CG 4.18Å; Y83-Q99 HydrophobicContact CG-CB 4.23Å; Y83-Q99 PolarHBondContact OH-NE2 2.91Å; Y83-H117 CarbonylContact C-O 3.53Å; Y83-H117 WeakPolarHBondContact CA-O 3.48Å; Y83-A118 HydrophobicContact CD1-CB 4.22Å; Y83-A118 HydrophobicContact CE1-CB 4.3Å
84	Q	93.2	Very high	90	Very high	55 Å²	55	65 Å²	65	26%	0.257	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	114.7	173.4	-177.2	-168.1	6	0	0	108.7	I94 H117	Q84-I94 HydrophobicContact CG-CD1 4.21Å; Q84-I94 HydrophobicContact CG-CG1 4.18Å; Q84-I94 HydrophobicContact CG-CG2 4.23Å; Q84-H117 HydrophobicContact CB-CB 4.32Å; Q84-H117 PolarHBondContact N-O 2.89Å; Q84-H117 PolarHBondContact O-N 3.39Å
85	W	94.4	Very high	90	Very high	0 Å²	0	67 Å²	67	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	135.7	174.4	-67	87.7	0	0	0	111.1	L74 C76 I94 L95 S96 E98 Y101 I115 C116 M129	L74-W85 HydrophobicContact CB-CH2 3.54Å; L74-W85 HydrophobicContact CB-CZ2 4.25Å; L74-W85 HydrophobicContact CB-CZ3 3.9Å; L74-W85 HydrophobicContact CD1-CH2 4.44Å; L74-W85 HydrophobicContact CD1-CZ3 3.93Å; C76-W85 HydrophobicContact CB-CZ2 4.07Å; W85-I94 CarbonylContact O-C 3.54Å; W85-I94 WeakPolarHBondContact O-CA 3.21Å; W85-L95 HydrophobicContact CB-CB 4.04Å; W85-L95 PolarHBondContact O-N 3.17Å; W85-S96 PolarHBondContact N-O 3.15Å; W85-E98 VanDerWaalsContact CD1-O 3.3Å; W85-E98 PolarHBondContact NE1-O 3.25Å; W85-Y101 HydrophobicContact CD2-CG 4.49Å; W85-Y101 HydrophobicContact CG-CG 4.48Å; W85-I115 WeakPolarHBondContact CA-O 3.43Å; W85-C116 HydrophobicContact CD2-CB 4.06Å; W85-C116 HydrophobicContact CE3-CB 3.9Å; W85-C116 HydrophobicContact CH2-CB 3.86Å; W85-C116 HydrophobicContact CZ2-CB 4Å; W85-C116 HydrophobicContact CZ3-CB 3.8Å; W85-M129 HydrophobicContact CH2-CE 3.64Å; W85-M129 HydrophobicContact CH2-SD 3.65Å; W85-M129 HydrophobicContact CZ3-CE 4.01Å; W85-M129 HydrophobicContact CZ3-SD 3.76Å
86	S	94.3	Very high	90.1	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	171.5	173.4	63.6	0	0	0	0	111.1	Q93 Y114 I115	S86-Q93 WeakPolarHBondContact CA-O 3.32Å; S86-Q93 WeakPolarHBondContact CB-O 3.34Å; S86-Y114 CarbonylContact O-C 3.59Å; S86-Y114 WeakPolarHBondContact O-CA 3.29Å; S86-I115 PolarHBondContact N-O 2.87Å; S86-I115 PolarHBondContact O-N 2.84Å
87	L	92.5	Very high	90.2	Very high	18 Å²	18	70 Å²	70	9%	0.094	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	143.9	168.8	-62.4	176.9	0	0	0	109.9	N89 Q90 L95 N112 R113 Y114	L87-N89 PolarHBondContact O-N 3.14Å; L87-Q90 HydrophobicContact CB-CB 4.24Å; L87-Q90 CarbonylContact O-C 3.58Å; L87-Q90 PolarHBondContact O-N 3.45Å; L87-L95 HydrophobicContact CD2-CD1 4.01Å; L87-L95 HydrophobicContact CG-CD1 4.11Å; L87-N112 HydrophobicContact CD2-CB 4.02Å; L87-R113 WeakPolarHBondContact CA-O 3.43Å; L87-Y114 HydrophobicContact CD2-CD1 3.65Å; L87-Y114 HydrophobicContact CD2-CD2 4.45Å; L87-Y114 HydrophobicContact CD2-CE1 3.48Å; L87-Y114 VanDerWaalsContact CD2-CE1 3.48Å; L87-Y114 HydrophobicContact CD2-CE2 4.3Å; L87-Y114 HydrophobicContact CD2-CG 4.14Å
88	V	88.2	Confident	90.4	Very high	54 Å²	54	73.2 Å²	73.2	33%	0.327	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-41.1	173.4	172.5	0	0	0	0	111.4	Q90 R113 I115 E128	V88-Q90 VanDerWaalsContact C-N 3.34Å; V88-R113 HydrophobicContact CB-CB 3.91Å; V88-R113 HydrophobicContact CG2-CB 3.36Å; V88-R113 HydrophobicContact CG2-CG 4.39Å; V88-R113 PolarHBondContact N-O 2.97Å; V88-I115 HydrophobicContact CB-CD1 4.46Å; V88-I115 HydrophobicContact CG2-CD1 3.82Å; V88-I115 HydrophobicContact CG2-CG1 3.55Å; V88-E128 HydrophobicContact CG2-CG 4.43Å
89	N	85.1	Confident	90.7	Very high	123 Å²	123	72.5 Å²	72.5	66%	0.658	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-11.9	-178	-63	-5.7	0	0	0	113.6	L87	L87-N89 PolarHBondContact O-N 3.14Å
90	Q	89	Confident	91	Very high	93 Å²	93	69.8 Å²	69.8	44%	0.435	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-142.1	62.8	-177.3	-64.1	178.4	-26.1	0	0	110.4	L87 V88 S92 Q93	L87-Q90 HydrophobicContact CB-CB 4.24Å; L87-Q90 CarbonylContact O-C 3.58Å; L87-Q90 PolarHBondContact O-N 3.45Å; V88-Q90 VanDerWaalsContact C-N 3.34Å; Q90-S92 PolarHBondContact O-N 3.04Å; Q90-S92 VanDerWaalsContact O-N 3.1Å; Q90-Q93 HydrophobicContact CB-CB 4.37Å; Q90-Q93 PolarHBondContact O-N 3.33Å
91	P	86.6	Confident	91.2	Very high	82 Å²	82	71.2 Å²	71.2	53%	0.532	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-13.1	-171.6	28.7	-36.8	0	0	0	114
92	S	88.3	Confident	91.5	Very high	112 Å²	112	68.9 Å²	68.9	78%	0.783	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-16.5	173.1	50.3	0	0	0	0	113.9	Q90	Q90-S92 PolarHBondContact O-N 3.04Å; Q90-S92 VanDerWaalsContact O-N 3.1Å
93	Q	90.7	Very high	91.6	Very high	101 Å²	101	62.4 Å²	62.4	47%	0.472	33%	0.325	S	S	.	.	S	Bend	trans	-92.2	114.5	177.6	-177.3	169.4	-17.3	0	0	110.1	S86 Q90 L95	S86-Q93 WeakPolarHBondContact CA-O 3.32Å; S86-Q93 WeakPolarHBondContact CB-O 3.34Å; Q90-Q93 HydrophobicContact CB-CB 4.37Å; Q90-Q93 PolarHBondContact O-N 3.33Å; Q93-L95 HydrophobicContact CG-CD2 4.45Å
94	I	90.3	Very high	91.5	Very high	78 Å²	78	69 Å²	69	40%	0.4	35%	0.354	S	S	.	.			trans	-81.2	131.4	173.6	-53.9	-176.7	0	0	0	109	Q84 W85 E97	Q84-I94 HydrophobicContact CG-CD1 4.21Å; Q84-I94 HydrophobicContact CG-CG1 4.18Å; Q84-I94 HydrophobicContact CG-CG2 4.23Å; W85-I94 CarbonylContact O-C 3.54Å; W85-I94 WeakPolarHBondContact O-CA 3.21Å; I94-E97 HydrophobicContact CG2-CG 3.91Å
95	L	92	Very high	91.5	Very high	43 Å²	43	70.2 Å²	70.2	23%	0.225	37%	0.37	C	S	.	.			trans	-102.4	-31.7	-179.9	-58	174.9	0	0	0	112.7	W85 L87 Q93 Y101 Y114	W85-L95 HydrophobicContact CB-CB 4.04Å; W85-L95 PolarHBondContact O-N 3.17Å; L87-L95 HydrophobicContact CD2-CD1 4.01Å; L87-L95 HydrophobicContact CG-CD1 4.11Å; Q93-L95 HydrophobicContact CG-CD2 4.45Å; L95-Y101 HydrophobicContact CB-CD2 4.11Å; L95-Y101 HydrophobicContact CB-CE2 3.68Å; L95-Y101 HydrophobicContact CD1-CE1 4.36Å; L95-Y114 HydrophobicContact CD1-CD1 3.58Å; L95-Y114 HydrophobicContact CD1-CE1 3.74Å
96	S	92.7	Very high	91.4	Very high	24 Å²	24	70.2 Å²	70.2	17%	0.168	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-166.4	152.2	178.3	172.8	0	0	0	0	109.1	W85 E98 F100	W85-S96 PolarHBondContact N-O 3.15Å; S96-E98 PolarHBondContact OG-N 2.82Å; S96-E98 VanDerWaalsContact OG-N 3.08Å; S96-F100 PolarHBondContact OG-O 2.84Å; S96-F100 VanDerWaalsContact OG-O 3.13Å
97	E	93.1	Very high	91.4	Very high	136 Å²	136	73.3 Å²	73.3	64%	0.636	39%	0.388	S	S	*	.	S	Bend	trans	-110.8	6	172	-61.4	-177.5	171	0	0	112.1	Y83 I94	Y83-E97 CarbonylContact O-C 3.55Å; Y83-E97 VanDerWaalsContact O-CA 3.29Å; Y83-E97 WeakPolarHBondContact O-CA 3.49Å; I94-E97 HydrophobicContact CG2-CG 3.91Å
98	E	93	Very high	91.3	Very high	136 Å²	136	77.4 Å²	77.4	64%	0.636	41%	0.41	S	S	*	.	S	Bend	trans	-89.5	161.2	177.3	-59.5	-178.6	-178.6	0	0	112	Y83 W85 S96 F100	Y83-E98 WeakPolarHBondContact CB-O 3.47Å; W85-E98 VanDerWaalsContact CD1-O 3.3Å; W85-E98 PolarHBondContact NE1-O 3.25Å; S96-E98 PolarHBondContact OG-N 2.82Å; S96-E98 VanDerWaalsContact OG-N 3.08Å; E98-F100 PolarHBondContact O-N 3.48Å
99	Q	92.6	Very high	91.4	Very high	38 Å²	38	83.8 Å²	83.8	18%	0.178	43%	0.433	C	S	.	.	S	Bend	trans	-58.8	-19.5	171.8	-171.4	177.5	58.9	0	0	112.6	K75 C76 D78 Y83	K75-Q99 HydrophobicContact CG-CG 4.22Å; C76-Q99 HydrophobicContact CB-CG 4.19Å; C76-Q99 PolarHBondContact N-O 3.16Å; D78-Q99 PolarHBondContact O-NE2 3.36Å; Y83-Q99 HydrophobicContact CD1-CB 4.25Å; Y83-Q99 HydrophobicContact CD1-CG 4.29Å; Y83-Q99 HydrophobicContact CD2-CB 3.95Å; Y83-Q99 HydrophobicContact CE1-CB 3.98Å; Y83-Q99 HydrophobicContact CE1-CG 3.69Å; Y83-Q99 HydrophobicContact CE2-CB 3.69Å; Y83-Q99 HydrophobicContact CE2-CG 4.18Å; Y83-Q99 HydrophobicContact CG-CB 4.23Å; Y83-Q99 PolarHBondContact OH-NE2 2.91Å
100	F	92.1	Very high	91.8	Very high	79 Å²	79	79.8 Å²	79.8	35%	0.346	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	149.1	-177.9	-62.4	-90	0	0	0	111.8	N73 L74 K75 S96 E98	N73-F100 WeakPolarHBondContact ND2-CD1 3.43Å; L74-F100 CarbonylContact O-C 3.6Å; L74-F100 VanDerWaalsContact O-CA 3.29Å; L74-F100 WeakPolarHBondContact O-CA 3.19Å; K75-F100 HydrophobicContact CB-CD1 3.84Å; K75-F100 HydrophobicContact CB-CE1 3.72Å; K75-F100 HydrophobicContact CD-CE1 3.76Å; K75-F100 HydrophobicContact CD-CZ 3.89Å; K75-F100 HydrophobicContact CG-CD1 3.81Å; K75-F100 HydrophobicContact CG-CE1 3.41Å; K75-F100 VanDerWaalsContact CG-CE1 3.41Å; K75-F100 HydrophobicContact CG-CZ 3.83Å; S96-F100 PolarHBondContact OG-O 2.84Å; S96-F100 VanDerWaalsContact OG-O 3.13Å; E98-F100 PolarHBondContact O-N 3.48Å
101	Y	93.7	Very high	91.9	Very high	44 Å²	44	76.7 Å²	76.7	17%	0.173	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	113.3	169.1	176	-108.1	0	0	0	109.9	N73 L74 W85 L95 I103 Y114	N73-Y101 PolarHBondContact OD1-O 3.13Å; L74-Y101 HydrophobicContact CD1-CD1 4.22Å; L74-Y101 PolarHBondContact N-O 3.24Å; L74-Y101 PolarHBondContact O-N 2.93Å; W85-Y101 HydrophobicContact CD2-CG 4.49Å; W85-Y101 HydrophobicContact CG-CG 4.48Å; L95-Y101 HydrophobicContact CB-CD2 4.11Å; L95-Y101 HydrophobicContact CB-CE2 3.68Å; L95-Y101 HydrophobicContact CD1-CE1 4.36Å; Y101-I103 HydrophobicContact CD1-CG1 4.17Å; Y101-I103 HydrophobicContact CE1-CD1 4.33Å; Y101-I103 HydrophobicContact CE1-CG1 3.59Å; Y101-Y114 HydrophobicContact CD1-CD1 4.11Å; Y101-Y114 HydrophobicContact CD1-CE1 4.24Å; Y101-Y114 AromaticContact CE1-CD1 3.75Å; Y101-Y114 HydrophobicContact CE1-CD1 3.75Å; Y101-Y114 AromaticContact CE1-CE1 3.43Å; Y101-Y114 HydrophobicContact CE1-CE1 3.43Å; Y101-Y114 VanDerWaalsContact CE1-CE1 3.43Å
102	T	94	Very high	92.2	Very high	63 Å²	63	74.5 Å²	74.5	39%	0.387	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	110.1	-178.4	-48.4	0	0	0	0	111.7	L72 N73 K104	L72-T102 CarbonylContact O-C 3.56Å; L72-T102 WeakPolarHBondContact O-CA 3.33Å; N73-T102 HydrophobicContact CB-CG2 4.46Å; N73-T102 PolarHBondContact OD1-OG1 3.08Å; T102-K104 HydrophobicContact CG2-CG 3.9Å; T102-K104 PolarHBondContact O-N 3.01Å
103	I	93.7	Very high	92.3	Very high	5 Å²	5	70.4 Å²	70.4	3%	0.026	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	116.8	163.5	-57.3	171.6	0	0	0	107	S71 L72 Y101 A106 D110 Y114 V131	S71-I103 CarbonylContact C-O 3.53Å; S71-I103 WeakPolarHBondContact CA-O 3.48Å; S71-I103 WeakPolarHBondContact CB-O 3.44Å; L72-I103 PolarHBondContact N-O 3.01Å; L72-I103 PolarHBondContact O-N 2.95Å; Y101-I103 HydrophobicContact CD1-CG1 4.17Å; Y101-I103 HydrophobicContact CE1-CD1 4.33Å; Y101-I103 HydrophobicContact CE1-CG1 3.59Å; I103-A106 HydrophobicContact CG2-CB 3.71Å; I103-D110 HydrophobicContact CG2-CB 4.05Å; I103-Y114 HydrophobicContact CD1-CE1 4.45Å; I103-Y114 HydrophobicContact CD1-CE2 4.1Å; I103-V131 HydrophobicContact CD1-CB 4.45Å; I103-V131 HydrophobicContact CD1-CG1 4.04Å; I103-V131 HydrophobicContact CD1-CG2 4.18Å
104	K	93	Very high	92.4	Very high	164 Å²	164	65.9 Å²	65.9	71%	0.713	33%	0.33	S	S	*	.			trans	-104.6	129.2	-178.9	-64.8	177.1	-175.9	172.9	0	109.9	T102 A106	T102-K104 HydrophobicContact CG2-CG 3.9Å; T102-K104 PolarHBondContact O-N 3.01Å; K104-A106 PolarHBondContact O-N 2.71Å
105	S	92.2	Very high	92.5	Very high	82 Å²	82	63.6 Å²	63.6	57%	0.573	32%	0.319	S	S	*	.	S	Bend	trans	51.2	54.9	-179.9	-56.7	0	0	0	0	113.3	S71	S71-S105 PolarHBondContact OG-N 3.45Å; S71-S105 VanDerWaalsContact OG-N 3.09Å
106	A	93.2	Very high	92.5	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.308	C	S	.	.			trans	-50	137	-168	0	0	0	0	0	114	I66 V68 G69 Q70 I103 K104 V133	I66-A106 HydrophobicContact CD1-CB 3.58Å; I66-A106 HydrophobicContact CG1-CB 4.41Å; V68-A106 CarbonylContact C-O 3.59Å; V68-A106 WeakPolarHBondContact CA-O 3.28Å; G69-A106 PolarHBondContact N-O 2.9Å; Q70-A106 VanDerWaalsContact O-CB 3.23Å; Q70-A106 WeakPolarHBondContact O-CB 3.44Å; Q70-A106 PolarHBondContact O-N 2.98Å; I103-A106 HydrophobicContact CG2-CB 3.71Å; K104-A106 PolarHBondContact O-N 2.71Å; A106-V133 HydrophobicContact CB-CG1 4.03Å; A106-V133 HydrophobicContact CB-CG2 4.02Å
107	T	93.9	Very high	92.5	Very high	64 Å²	64	61.3 Å²	61.3	39%	0.393	30%	0.304	S	S	.	.			trans	-109.3	165.2	177.6	76	0	0	0	0	110.2	K109 D110 V133	T107-K109 PolarHBondContact O-N 3.38Å; T107-K109 PolarHBondContact OG1-N 3.31Å; T107-D110 WeakPolarHBondContact CA-OD2 3.36Å; T107-D110 WeakPolarHBondContact CB-OD2 3.02Å; T107-D110 PolarHBondContact N-OD2 2.87Å; T107-D110 PolarHBondContact O-N 3Å; T107-D110 PolarHBondContact OG1-OD2 2.71Å; T107-V133 WeakPolarHBondContact O-CB 3.08Å; T107-V133 WeakPolarHBondContact O-CG1 3.43Å; T107-V133 VanDerWaalsContact O-CG2 3.31Å; T107-V133 WeakPolarHBondContact O-CG2 3.26Å
108	L	90.6	Very high	92.5	Very high	104 Å²	104	54.9 Å²	54.9	55%	0.545	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-56.7	-25	176.2	-61.9	176.7	0	0	0	113.1	V68 D110 S111 V133	V68-L108 HydrophobicContact CG2-CD2 3.56Å; V68-L108 HydrophobicContact CG2-CG 3.98Å; L108-D110 VanDerWaalsContact C-N 3.31Å; L108-D110 PolarHBondContact O-N 3.25Å; L108-S111 VanDerWaalsContact O-CB 3.3Å; L108-S111 WeakPolarHBondContact O-CB 3.3Å; L108-S111 PolarHBondContact O-N 3.27Å; L108-S111 PolarHBondContact O-OG 2.57Å; L108-V133 WeakPolarHBondContact CD2-O 3.29Å
109	K	90.3	Very high	92.3	Very high	189 Å²	189	51.1 Å²	51.1	82%	0.822	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-72.7	-19.6	177.9	-62.9	-178	178.1	180	0	113.9	T107 S111	T107-K109 PolarHBondContact O-N 3.38Å; T107-K109 PolarHBondContact OG1-N 3.31Å; K109-S111 PolarHBondContact O-N 3.48Å
110	D	92.3	Very high	92.1	Very high	39 Å²	39	52 Å²	52	21%	0.209	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-82.2	6.6	175.9	-51.6	-73	0	0	0	111.8	I103 T107 L108 N112 Y114 V133	I103-D110 HydrophobicContact CG2-CB 4.05Å; T107-D110 WeakPolarHBondContact CA-OD2 3.36Å; T107-D110 WeakPolarHBondContact CB-OD2 3.02Å; T107-D110 PolarHBondContact N-OD2 2.87Å; T107-D110 PolarHBondContact O-N 3Å; T107-D110 PolarHBondContact OG1-OD2 2.71Å; L108-D110 VanDerWaalsContact C-N 3.31Å; L108-D110 PolarHBondContact O-N 3.25Å; D110-N112 PolarHBondContact O-N 3.06Å; D110-Y114 PolarHBondContact O-OH 3.25Å; D110-V133 HydrophobicContact CB-CG2 4.05Å
111	S	91.8	Very high	91.7	Very high	27 Å²	27	52 Å²	52	19%	0.189	29%	0.286	C	S	.	.			trans	-74.8	94.1	167.2	-55	0	0	0	0	109.8	L108 K109 V131 V133	L108-S111 VanDerWaalsContact O-CB 3.3Å; L108-S111 WeakPolarHBondContact O-CB 3.3Å; L108-S111 PolarHBondContact O-N 3.27Å; L108-S111 PolarHBondContact O-OG 2.57Å; K109-S111 PolarHBondContact O-N 3.48Å; S111-V131 CarbonylContact C-O 3.6Å; S111-V131 VanDerWaalsContact CA-O 3.24Å; S111-V131 WeakPolarHBondContact CA-O 3.24Å; S111-V133 PolarHBondContact OG-N 3.01Å; S111-V133 PolarHBondContact OG-O 3.4Å
112	N	91.9	Very high	91.2	Very high	36 Å²	36	61.2 Å²	61.2	19%	0.193	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	174	-173.4	-142.7	-42.3	0	0	0	112.6	L87 D110 Y114 V131	L87-N112 HydrophobicContact CD2-CB 4.02Å; D110-N112 PolarHBondContact O-N 3.06Å; N112-Y114 HydrophobicContact CB-CE2 3.91Å; N112-V131 PolarHBondContact N-O 2.97Å; N112-V131 PolarHBondContact O-N 3.49Å
113	R	91.1	Very high	90.8	Very high	26 Å²	26	60.1 Å²	60.1	10%	0.098	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	118.2	170.5	-59.1	168.9	-168.3	-114.3	6.3	109.5	L87 V88 E128 L162 D183 D185 Q272	L87-R113 WeakPolarHBondContact CA-O 3.43Å; V88-R113 HydrophobicContact CB-CB 3.91Å; V88-R113 HydrophobicContact CG2-CB 3.36Å; V88-R113 HydrophobicContact CG2-CG 4.39Å; V88-R113 PolarHBondContact N-O 2.97Å; R113-E128 WeakPolarHBondContact CD-OE1 3.32Å; R113-E128 IonicContact CZ-OE1 3.37Å; R113-E128 IonicContact NE-OE1 3.82Å; R113-E128 IonicContact NH1-OE1 3.19Å; R113-E128 PolarHBondContact NH1-OE1 2.93Å; R113-L162 HydrophobicContact CG-CD2 3.79Å; R113-D183 IonicContact NH2-OD1 2.74Å; R113-D185 IonicContact CZ-OD2 3.65Å; R113-D185 IonicContact NH1-OD2 2.69Å; R113-D185 PolarHBondContact NH1-OD2 2.97Å; R113-D185 IonicContact NH2-OD2 3.5Å; R113-D185 PolarHBondContact NH2-OD2 2.89Å; R113-Q272 VanDerWaalsContact NH2-NE2 3.12Å
114	Y	92.7	Very high	90.5	Very high	6 Å²	6	67.1 Å²	67.1	2%	0.024	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	132.7	177.1	-63.5	-99.1	0	0	0	108.6	L74 S86 L87 L95 Y101 I103 D110 N112 M129 V131	L74-Y114 HydrophobicContact CD1-CD1 4.47Å; L74-Y114 HydrophobicContact CD1-CD2 4.25Å; L74-Y114 HydrophobicContact CD1-CG 3.97Å; S86-Y114 CarbonylContact O-C 3.59Å; S86-Y114 WeakPolarHBondContact O-CA 3.29Å; L87-Y114 HydrophobicContact CD2-CD1 3.65Å; L87-Y114 HydrophobicContact CD2-CD2 4.45Å; L87-Y114 HydrophobicContact CD2-CE1 3.48Å; L87-Y114 VanDerWaalsContact CD2-CE1 3.48Å; L87-Y114 HydrophobicContact CD2-CE2 4.3Å; L87-Y114 HydrophobicContact CD2-CG 4.14Å; L95-Y114 HydrophobicContact CD1-CD1 3.58Å; L95-Y114 HydrophobicContact CD1-CE1 3.74Å; Y101-Y114 HydrophobicContact CD1-CD1 4.11Å; Y101-Y114 HydrophobicContact CD1-CE1 4.24Å; Y101-Y114 AromaticContact CE1-CD1 3.75Å; Y101-Y114 HydrophobicContact CE1-CD1 3.75Å; Y101-Y114 AromaticContact CE1-CE1 3.43Å; Y101-Y114 HydrophobicContact CE1-CE1 3.43Å; Y101-Y114 VanDerWaalsContact CE1-CE1 3.43Å; I103-Y114 HydrophobicContact CD1-CE1 4.45Å; I103-Y114 HydrophobicContact CD1-CE2 4.1Å; D110-Y114 PolarHBondContact O-OH 3.25Å; N112-Y114 HydrophobicContact CB-CE2 3.91Å; Y114-M129 PolarHBondContact N-O 3.45Å; Y114-M129 PolarHBondContact O-N 2.67Å; Y114-V131 HydrophobicContact CD2-CB 4.17Å; Y114-V131 HydrophobicContact CD2-CG2 3.78Å; Y114-V131 HydrophobicContact CE2-CB 3.91Å; Y114-V131 HydrophobicContact CE2-CG2 3.91Å
115	I	92.4	Very high	90.2	Very high	31 Å²	31	60.9 Å²	60.9	16%	0.159	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125	170.2	-48.4	177.5	0	0	0	107.7	W85 S86 V88 H117 V127	W85-I115 WeakPolarHBondContact CA-O 3.43Å; S86-I115 PolarHBondContact N-O 2.87Å; S86-I115 PolarHBondContact O-N 2.84Å; V88-I115 HydrophobicContact CB-CD1 4.46Å; V88-I115 HydrophobicContact CG2-CD1 3.82Å; V88-I115 HydrophobicContact CG2-CG1 3.55Å; I115-H117 VanDerWaalsContact CG2-CE1 3.49Å; I115-H117 WeakPolarHBondContact CG2-CE1 3.37Å; I115-V127 WeakPolarHBondContact CA-O 3.48Å
116	C	93	Very high	90	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	128.8	154.8	175.3	0	0	0	0	108.6	C76 W85 S126 V127 M129	C76-C116 HydrophobicContact CB-CB 3.9Å; C76-C116 WeakPolarHBondContact CB-SG 3.31Å; C76-C116 WeakPolarHBondContact SG-CB 3.48Å; C76-C116 CovalentContact SG-SG 2.03Å; C76-C116 PolarHBondContact SG-SG 2.98Å; W85-C116 HydrophobicContact CD2-CB 4.06Å; W85-C116 HydrophobicContact CE3-CB 3.9Å; W85-C116 HydrophobicContact CH2-CB 3.86Å; W85-C116 HydrophobicContact CZ2-CB 4Å; W85-C116 HydrophobicContact CZ3-CB 3.8Å; C116-S126 CarbonylContact O-C 3.51Å; C116-S126 VanDerWaalsContact O-CA 3.24Å; C116-S126 WeakPolarHBondContact O-CA 3.39Å; C116-V127 PolarHBondContact N-O 2.82Å; C116-V127 PolarHBondContact O-N 2.76Å; C116-M129 HydrophobicContact CB-CE 4.26Å
117	H	91.9	Very high	89.8	Confident	19 Å²	19	60.2 Å²	60.2	9%	0.088	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132.3	161.3	-60.5	-70.4	0	0	0	109.7	Y83 Q84 I115 R124 S125 S126	Y83-H117 CarbonylContact C-O 3.53Å; Y83-H117 WeakPolarHBondContact CA-O 3.48Å; Q84-H117 HydrophobicContact CB-CB 4.32Å; Q84-H117 PolarHBondContact N-O 2.89Å; Q84-H117 PolarHBondContact O-N 3.39Å; I115-H117 VanDerWaalsContact CG2-CE1 3.49Å; I115-H117 WeakPolarHBondContact CG2-CE1 3.37Å; H117-R124 HydrophobicContact CB-CG 4.48Å; H117-R124 PolarHBondContact CD2-NH2 3.15Å; H117-R124 PolarHBondContact CE1-NH2 3.15Å; H117-R124 PolarHBondContact ND1-NE 2.88Å; H117-R124 PolarHBondContact ND1-NH2 3.17Å; H117-R124 PolarHBondContact NE2-NH2 3.43Å; H117-S125 WeakPolarHBondContact CA-O 3.26Å; H117-S126 WeakPolarHBondContact ND1-CB 3.36Å
118	A	92	Very high	89.6	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	114.9	-178.1	0	0	0	0	0	109.3	D78 A80 Y83 H120 R124 S125	D78-A118 HydrophobicContact CB-CB 3.9Å; A80-A118 HydrophobicContact CB-CB 3.68Å; Y83-A118 HydrophobicContact CD1-CB 4.22Å; Y83-A118 HydrophobicContact CE1-CB 4.3Å; A118-H120 PolarHBondContact O-ND1 3.42Å; A118-H120 VanDerWaalsContact O-ND1 3.16Å; A118-R124 WeakPolarHBondContact O-CA 3.4Å; A118-S125 PolarHBondContact N-O 2.81Å; A118-S125 VanDerWaalsContact N-O 3.08Å; A118-S125 PolarHBondContact O-N 2.9Å; A118-S125 PolarHBondContact O-OG 3.45Å
119	V	90.4	Very high	89.5	Confident	57 Å²	57	53.9 Å²	53.9	35%	0.345	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	111	-175.2	-173.8	0	0	0	0	110.2	A80 V81 F82 R124	A80-V119 WeakPolarHBondContact CB-O 3.35Å; V81-V119 PolarHBondContact N-O 3.18Å; F82-V119 HydrophobicContact CB-CB 4.32Å; F82-V119 PolarHBondContact N-O 2.78Å; F82-V119 PolarHBondContact O-N 3.05Å; V119-R124 HydrophobicContact CG2-CB 4.32Å; V119-R124 HydrophobicContact CG2-CG 4.21Å
120	H	87.7	Confident	89.6	Confident	56 Å²	56	45.1 Å²	45.1	26%	0.259	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	164.3	178.8	-51.3	77.2	0	0	0	109.2	D79 A118 Y122 G123 S125	D79-H120 PolarHBondContact O-CD2 3.03Å; D79-H120 PolarHBondContact O-NE2 3.44Å; A118-H120 PolarHBondContact O-ND1 3.42Å; A118-H120 VanDerWaalsContact O-ND1 3.16Å; H120-Y122 PolarHBondContact O-N 3.05Å; H120-G123 PolarHBondContact N-O 3.49Å; H120-G123 PolarHBondContact O-N 2.96Å; H120-S125 PolarHBondContact CE1-OG 2.65Å
121	G	83.9	Confident	89.6	Confident	79 Å²	79	43.3 Å²	43.3	81%	0.814	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-11.5	175.6	0	0	0	0	0	115.3
122	Y	83.3	Confident	89.6	Confident	239 Å²	239	42.6 Å²	42.6	94%	0.937	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-5.3	178.9	-56.1	-77.1	0	0	0	114	H120	H120-Y122 PolarHBondContact O-N 3.05Å
123	G	86.1	Confident	89.6	Confident	40 Å²	40	40.9 Å²	40.9	41%	0.412	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	145.5	-175.1	-178.1	0	0	0	0	0	114.9	H120	H120-G123 PolarHBondContact N-O 3.49Å; H120-G123 PolarHBondContact O-N 2.96Å
124	R	86.4	Confident	89.6	Confident	151 Å²	151	39.8 Å²	39.8	57%	0.57	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-104.4	123.4	-180	177.9	178.7	179.8	176.2	0.8	110.2	H117 A118 V119	H117-R124 HydrophobicContact CB-CG 4.48Å; H117-R124 PolarHBondContact CD2-NH2 3.15Å; H117-R124 PolarHBondContact CE1-NH2 3.15Å; H117-R124 PolarHBondContact ND1-NE 2.88Å; H117-R124 PolarHBondContact ND1-NH2 3.17Å; H117-R124 PolarHBondContact NE2-NH2 3.43Å; A118-R124 WeakPolarHBondContact O-CA 3.4Å; V119-R124 HydrophobicContact CG2-CB 4.32Å; V119-R124 HydrophobicContact CG2-CG 4.21Å
125	S	87.4	Confident	89.4	Confident	34 Å²	34	42.5 Å²	42.5	24%	0.238	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	170.1	162.4	61.6	0	0	0	0	110.6	D78 H117 A118 H120	D78-S125 VanDerWaalsContact OD2-CB 3.25Å; D78-S125 WeakPolarHBondContact OD2-CB 3.27Å; D78-S125 PolarHBondContact OD2-OG 3.24Å; H117-S125 WeakPolarHBondContact CA-O 3.26Å; A118-S125 PolarHBondContact N-O 2.81Å; A118-S125 VanDerWaalsContact N-O 3.08Å; A118-S125 PolarHBondContact O-N 2.9Å; A118-S125 PolarHBondContact O-OG 3.45Å; H120-S125 PolarHBondContact CE1-OG 2.65Å
126	S	88.8	Confident	89	Confident	62 Å²	62	43 Å²	43	43%	0.434	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	136.8	177.5	57.9	0	0	0	0	112	C116 H117	C116-S126 CarbonylContact O-C 3.51Å; C116-S126 VanDerWaalsContact O-CA 3.24Å; C116-S126 WeakPolarHBondContact O-CA 3.39Å; H117-S126 WeakPolarHBondContact ND1-CB 3.36Å
127	V	88.2	Confident	88.5	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.03	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	125.4	-177.7	-177.2	0	0	0	0	109.6	T60 P77 I115 C116 M129	T60-V127 WeakPolarHBondContact O-CG1 3.26Å; P77-V127 HydrophobicContact CG-CB 4.4Å; P77-V127 HydrophobicContact CG-CG1 4.06Å; P77-V127 HydrophobicContact CG-CG2 3.85Å; I115-V127 WeakPolarHBondContact CA-O 3.48Å; C116-V127 PolarHBondContact N-O 2.82Å; C116-V127 PolarHBondContact O-N 2.76Å; V127-M129 HydrophobicContact CB-CE 4.15Å; V127-M129 HydrophobicContact CG1-CE 3.78Å; V127-M129 HydrophobicContact CG1-CG 4.32Å
128	E	89.5	Confident	88.2	Confident	36 Å²	36	48.6 Å²	48.6	17%	0.168	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	126.7	178.1	-173	-170.4	165.7	0	0	110	R61 L62 V88 R113	R61-E128 IonicContact NE-OE2 3.8Å; R61-E128 IonicContact NH2-OE2 3.43Å; L62-E128 PolarHBondContact N-O 2.82Å; V88-E128 HydrophobicContact CG2-CG 4.43Å; R113-E128 WeakPolarHBondContact CD-OE1 3.32Å; R113-E128 IonicContact CZ-OE1 3.37Å; R113-E128 IonicContact NE-OE1 3.82Å; R113-E128 IonicContact NH1-OE1 3.19Å; R113-E128 PolarHBondContact NH1-OE1 2.93Å
129	M	89	Confident	87.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	115.3	-178.8	-52.1	-170.2	-166.2	0	0	109.8	L62 Y64 L74 K75 W85 Y114 C116 V127	L62-M129 HydrophobicContact CB-CB 4.47Å; L62-M129 HydrophobicContact CB-CG 4.18Å; L62-M129 HydrophobicContact CD1-CE 4.2Å; L62-M129 HydrophobicContact CD1-CG 4.36Å; L62-M129 HydrophobicContact CD1-SD 4.2Å; L62-M129 CarbonylContact O-C 3.53Å; L62-M129 WeakPolarHBondContact O-CA 3.15Å; Y64-M129 HydrophobicContact CE2-CB 4.39Å; Y64-M129 HydrophobicContact CE2-SD 4.48Å; L74-M129 HydrophobicContact CB-SD 4.24Å; L74-M129 HydrophobicContact CD1-SD 4.49Å; K75-M129 WeakPolarHBondContact O-CE 3.48Å; W85-M129 HydrophobicContact CH2-CE 3.64Å; W85-M129 HydrophobicContact CH2-SD 3.65Å; W85-M129 HydrophobicContact CZ3-CE 4.01Å; W85-M129 HydrophobicContact CZ3-SD 3.76Å; Y114-M129 PolarHBondContact N-O 3.45Å; Y114-M129 PolarHBondContact O-N 2.67Å; C116-M129 HydrophobicContact CB-CE 4.26Å; V127-M129 HydrophobicContact CB-CE 4.15Å; V127-M129 HydrophobicContact CG1-CE 3.78Å; V127-M129 HydrophobicContact CG1-CG 4.32Å
130	S	91.4	Very high	87.7	Confident	5 Å²	5	54.3 Å²	54.3	4%	0.035	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	118.6	178.3	-66.9	0	0	0	0	110.2	L62 G63 Y64 L162	L62-S130 PolarHBondContact O-N 2.84Å; G63-S130 CarbonylContact C-O 3.56Å; G63-S130 VanDerWaalsContact CA-O 3.3Å; G63-S130 WeakPolarHBondContact CA-O 3.46Å; Y64-S130 PolarHBondContact N-O 2.62Å; S130-L162 WeakPolarHBondContact OG-CD2 3.47Å
131	V	91.9	Very high	87.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	133	172.2	-177.8	0	0	0	0	108.5	Y64 I66 L72 L74 I103 S111 N112 Y114 V133 L162	Y64-V131 HydrophobicContact CD2-CG2 4.29Å; Y64-V131 WeakPolarHBondContact O-CA 3.47Å; I66-V131 HydrophobicContact CD1-CG1 4.07Å; I66-V131 HydrophobicContact CG1-CG1 4.35Å; L72-V131 HydrophobicContact CD2-CG1 3.87Å; L72-V131 HydrophobicContact CD2-CG2 3.93Å; L74-V131 HydrophobicContact CD1-CG2 4.01Å; L74-V131 HydrophobicContact CD2-CG2 3.97Å; I103-V131 HydrophobicContact CD1-CB 4.45Å; I103-V131 HydrophobicContact CD1-CG1 4.04Å; I103-V131 HydrophobicContact CD1-CG2 4.18Å; S111-V131 CarbonylContact C-O 3.6Å; S111-V131 VanDerWaalsContact CA-O 3.24Å; S111-V131 WeakPolarHBondContact CA-O 3.24Å; N112-V131 PolarHBondContact N-O 2.97Å; N112-V131 PolarHBondContact O-N 3.49Å; Y114-V131 HydrophobicContact CD2-CB 4.17Å; Y114-V131 HydrophobicContact CD2-CG2 3.78Å; Y114-V131 HydrophobicContact CE2-CB 3.91Å; Y114-V131 HydrophobicContact CE2-CG2 3.91Å; V131-V133 HydrophobicContact CG1-CG2 4.37Å; V131-L162 VanDerWaalsContact O-CD1 3.29Å; V131-L162 WeakPolarHBondContact O-CD1 3.45Å
132	R	92.4	Very high	87.6	Confident	13 Å²	13	51.4 Å²	51.4	5%	0.049	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	125.7	172.1	177.7	63.4	-173.6	-152.9	-5.6	109	Y64 L65 I66 I134 E144 F161 L162 S164 V187	Y64-R132 PolarHBondContact O-N 3.44Å; L65-R132 WeakPolarHBondContact CA-O 3.29Å; L65-R132 HydrophobicContact CD1-CB 3.84Å; L65-R132 HydrophobicContact CD1-CG 3.59Å; I66-R132 PolarHBondContact N-O 2.86Å; R132-I134 HydrophobicContact CG-CG2 4.04Å; R132-E144 IonicContact CZ-OE2 3.96Å; R132-E144 IonicContact NH1-OE2 2.78Å; R132-E144 IonicContact NH2-OE2 3.48Å; R132-E144 PolarHBondContact NH2-OE2 3.34Å; R132-F161 WeakPolarHBondContact CD-O 3.37Å; R132-F161 PolarHBondContact NE-O 3.25Å; R132-F161 PolarHBondContact NH1-O 3.39Å; R132-L162 HydrophobicContact CB-CD1 4.21Å; R132-L162 VanDerWaalsContact CD-O 3.29Å; R132-L162 WeakPolarHBondContact CD-O 3.19Å; R132-L162 PolarHBondContact NH1-O 3.08Å; R132-S164 PolarHBondContact NH1-OG 2.75Å; R132-S164 PolarHBondContact NH2-OG 3.26Å; R132-S164 VanDerWaalsContact NH2-OG 3.16Å; R132-V187 HydrophobicContact CB-CG2 3.42Å; R132-V187 VanDerWaalsContact CB-CG2 3.42Å; R132-V187 HydrophobicContact CG-CG2 4.23Å
133	V	92.4	Very high	87.7	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	125.8	174.6	-168	0	0	0	0	108.3	I66 V68 A106 T107 L108 D110 S111 V131	I66-V133 HydrophobicContact CD1-CG2 4.02Å; I66-V133 HydrophobicContact CG1-CB 4.37Å; I66-V133 HydrophobicContact CG1-CG1 4.35Å; I66-V133 HydrophobicContact CG1-CG2 3.87Å; I66-V133 WeakPolarHBondContact O-CA 3.33Å; V68-V133 HydrophobicContact CB-CG1 4.49Å; V68-V133 HydrophobicContact CG2-CG1 3.88Å; A106-V133 HydrophobicContact CB-CG1 4.03Å; A106-V133 HydrophobicContact CB-CG2 4.02Å; T107-V133 WeakPolarHBondContact O-CB 3.08Å; T107-V133 WeakPolarHBondContact O-CG1 3.43Å; T107-V133 VanDerWaalsContact O-CG2 3.31Å; T107-V133 WeakPolarHBondContact O-CG2 3.26Å; L108-V133 WeakPolarHBondContact CD2-O 3.29Å; D110-V133 HydrophobicContact CB-CG2 4.05Å; S111-V133 PolarHBondContact OG-N 3.01Å; S111-V133 PolarHBondContact OG-O 3.4Å; V131-V133 HydrophobicContact CG1-CG2 4.37Å
134	I	90.3	Very high	87.9	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.01	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	142.3	178.9	50.6	167.2	0	0	0	112.7	L65 I66 R67 V68 R132 F136 V154	L65-I134 HydrophobicContact CD1-CD1 3.77Å; L65-I134 HydrophobicContact CD1-CG1 3.82Å; L65-I134 HydrophobicContact CD1-CG2 4.26Å; L65-I134 HydrophobicContact CD2-CD1 4.07Å; L65-I134 HydrophobicContact CG-CD1 4.05Å; L65-I134 HydrophobicContact CG-CG1 4.33Å; I66-I134 PolarHBondContact O-N 2.85Å; R67-I134 WeakPolarHBondContact CA-O 3.27Å; V68-I134 PolarHBondContact N-O 2.79Å; V68-I134 VanDerWaalsContact N-O 3.16Å; R132-I134 HydrophobicContact CG-CG2 4.04Å; I134-F136 HydrophobicContact CD1-CD2 3.77Å; I134-F136 HydrophobicContact CD1-CE1 4.19Å; I134-F136 HydrophobicContact CD1-CE2 3.21Å; I134-F136 HydrophobicContact CD1-CG 4.47Å; I134-F136 HydrophobicContact CD1-CZ 3.45Å; I134-F136 VanDerWaalsContact CD1-CZ 3.45Å; I134-F136 HydrophobicContact CG1-CD2 3.91Å; I134-F136 HydrophobicContact CG1-CE2 3.52Å; I134-F136 HydrophobicContact CG1-CZ 4.25Å; I134-V154 HydrophobicContact CD1-CG1 4.14Å
135	D	89.7	Confident	88.1	Confident	64 Å²	64	38.9 Å²	38.9	34%	0.342	22%	0.217	S	C	.	.			trans	-91.9	113.2	160.6	-172.3	-20	0	0	0	108.1	V68 S137 S138 A141	V68-D135 HydrophobicContact CG2-CB 4.13Å; D135-S137 VanDerWaalsContact CG-OG 3.26Å; D135-S137 PolarHBondContact O-N 2.82Å; D135-S137 WeakPolarHBondContact OD1-CB 3.43Å; D135-S137 PolarHBondContact OD1-N 2.86Å; D135-S137 PolarHBondContact OD1-OG 3.07Å; D135-S137 PolarHBondContact OD2-OG 3.32Å; D135-S138 WeakPolarHBondContact O-CB 3.44Å; D135-S138 PolarHBondContact O-N 2.64Å; D135-S138 VanDerWaalsContact O-N 3.16Å; D135-A141 VanDerWaalsContact O-CB 3.25Å; D135-A141 WeakPolarHBondContact O-CB 3.49Å
136	F	83.1	Confident	88.2	Confident	40 Å²	40	37.4 Å²	37.4	18%	0.175	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-12.6	179.8	-80.3	-109.8	0	0	0	113.3	R67 I134 V154 T156	R67-F136 HydrophobicContact CG-CD2 3.73Å; R67-F136 HydrophobicContact CG-CE2 3.51Å; R67-F136 VanDerWaalsContact CZ-CE2 3.47Å; R67-F136 VanDerWaalsContact NH1-CD2 3.29Å; R67-F136 VanDerWaalsContact NH2-CE1 3.3Å; R67-F136 VanDerWaalsContact NH2-CZ 3.34Å; I134-F136 HydrophobicContact CD1-CD2 3.77Å; I134-F136 HydrophobicContact CD1-CE1 4.19Å; I134-F136 HydrophobicContact CD1-CE2 3.21Å; I134-F136 HydrophobicContact CD1-CG 4.47Å; I134-F136 HydrophobicContact CD1-CZ 3.45Å; I134-F136 VanDerWaalsContact CD1-CZ 3.45Å; I134-F136 HydrophobicContact CG1-CD2 3.91Å; I134-F136 HydrophobicContact CG1-CE2 3.52Å; I134-F136 HydrophobicContact CG1-CZ 4.25Å; F136-V154 HydrophobicContact CD1-CB 3.79Å; F136-V154 HydrophobicContact CD1-CG1 4.11Å; F136-V154 HydrophobicContact CE1-CB 3.88Å; F136-V154 HydrophobicContact CE1-CG1 3.73Å; F136-V154 HydrophobicContact CZ-CG1 4.33Å; F136-T156 HydrophobicContact CE1-CG2 3.81Å; F136-T156 HydrophobicContact CZ-CG2 3.84Å
137	S	82.9	Confident	88.1	Confident	96 Å²	96	38.7 Å²	38.7	67%	0.671	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-12.2	173.9	72.8	0	0	0	0	113.5	D135	D135-S137 VanDerWaalsContact CG-OG 3.26Å; D135-S137 PolarHBondContact O-N 2.82Å; D135-S137 WeakPolarHBondContact OD1-CB 3.43Å; D135-S137 PolarHBondContact OD1-N 2.86Å; D135-S137 PolarHBondContact OD1-OG 3.07Å; D135-S137 PolarHBondContact OD2-OG 3.32Å
138	S	86.6	Confident	87.8	Confident	41 Å²	41	40.2 Å²	40.2	29%	0.287	22%	0.216	S	C	.	.			trans	-78.5	133	-179.6	-180	0	0	0	0	112.3	D135 T140 A141 Q142	D135-S138 WeakPolarHBondContact O-CB 3.44Å; D135-S138 PolarHBondContact O-N 2.64Å; D135-S138 VanDerWaalsContact O-N 3.16Å; S138-T140 PolarHBondContact O-N 3.48Å; S138-T140 WeakPolarHBondContact OG-CB 3.37Å; S138-T140 PolarHBondContact OG-N 3.27Å; S138-T140 PolarHBondContact OG-OG1 2.87Å; S138-A141 WeakPolarHBondContact O-CB 3.33Å; S138-A141 PolarHBondContact O-N 2.97Å; S138-Q142 PolarHBondContact O-N 2.94Å
139	I	85.7	Confident	87.4	Confident	110 Å²	110	44.1 Å²	44.1	56%	0.564	25%	0.247	S	C	*	.	H	α-helix	trans	-58.3	-31.1	171.3	-165.1	168.1	0	0	0	112.1	A141 Q142 H143	I139-A141 VanDerWaalsContact C-N 3.29Å; I139-A141 PolarHBondContact O-N 3.08Å; I139-Q142 WeakPolarHBondContact O-CB 3.4Å; I139-Q142 PolarHBondContact O-N 3.1Å; I139-Q142 VanDerWaalsContact O-N 3.13Å; I139-H143 PolarHBondContact O-CD2 3.09Å; I139-H143 VanDerWaalsContact O-CD2 3.23Å; I139-H143 PolarHBondContact O-N 3.29Å
140	T	85.6	Confident	87.1	Confident	67 Å²	67	52.2 Å²	52.2	41%	0.411	28%	0.282	S	S	.	.	H	α-helix	trans	-60.3	-39.4	174.1	-49.1	0	0	0	0	111.5	S138 Q142 H143 E144	S138-T140 PolarHBondContact O-N 3.48Å; S138-T140 WeakPolarHBondContact OG-CB 3.37Å; S138-T140 PolarHBondContact OG-N 3.27Å; S138-T140 PolarHBondContact OG-OG1 2.87Å; T140-Q142 VanDerWaalsContact C-N 3.29Å; T140-Q142 PolarHBondContact O-N 3.31Å; T140-H143 PolarHBondContact O-N 2.94Å; T140-E144 HydrophobicContact CG2-CG 4.28Å; T140-E144 WeakPolarHBondContact O-CB 3.37Å; T140-E144 WeakPolarHBondContact O-CG 3.31Å; T140-E144 PolarHBondContact O-N 2.9Å
141	A	85.4	Confident	86.7	Confident	3 Å²	3	55.9 Å²	55.9	3%	0.025	31%	0.305	C	S	.	.	H	α-helix	trans	-68.5	-28.7	178	0	0	0	0	0	112.4	D135 S138 I139 H143 C145 V154	D135-A141 VanDerWaalsContact O-CB 3.25Å; D135-A141 WeakPolarHBondContact O-CB 3.49Å; S138-A141 WeakPolarHBondContact O-CB 3.33Å; S138-A141 PolarHBondContact O-N 2.97Å; I139-A141 VanDerWaalsContact C-N 3.29Å; I139-A141 PolarHBondContact O-N 3.08Å; A141-H143 VanDerWaalsContact C-N 3.33Å; A141-C145 VanDerWaalsContact O-CB 3.25Å; A141-C145 WeakPolarHBondContact O-CB 3.41Å; A141-C145 PolarHBondContact O-N 3.48Å; A141-V154 HydrophobicContact CB-CG2 4.12Å; A141-V154 WeakPolarHBondContact O-CG2 3.46Å
142	Q	83.1	Confident	86.1	Confident	72 Å²	72	57.9 Å²	57.9	34%	0.336	33%	0.326	S	S	.	.	H	α-helix	trans	-70	-29.3	174.5	-60.1	178.4	-3.2	0	0	112.4	S138 I139 T140 I147	S138-Q142 PolarHBondContact O-N 2.94Å; I139-Q142 WeakPolarHBondContact O-CB 3.4Å; I139-Q142 PolarHBondContact O-N 3.1Å; I139-Q142 VanDerWaalsContact O-N 3.13Å; T140-Q142 VanDerWaalsContact C-N 3.29Å; T140-Q142 PolarHBondContact O-N 3.31Å; Q142-I147 WeakPolarHBondContact O-CD1 3.29Å
143	H	85.4	Confident	85.7	Confident	144 Å²	144	61.6 Å²	61.6	67%	0.667	35%	0.346	S	S	*	.	H	α-helix	trans	-86.4	-26.8	175	-67.8	-65.1	0	0	0	113.7	I139 T140 A141	I139-H143 PolarHBondContact O-CD2 3.09Å; I139-H143 VanDerWaalsContact O-CD2 3.23Å; I139-H143 PolarHBondContact O-N 3.29Å; T140-H143 PolarHBondContact O-N 2.94Å; A141-H143 VanDerWaalsContact C-N 3.33Å
144	E	90.5	Very high	85.2	Confident	18 Å²	18	62 Å²	62	8%	0.084	35%	0.349	C	S	.	.	H	α-helix	trans	-100.2	-8.4	-174.7	-66.5	-176.4	157.9	0	0	114.9	R132 T140 C160 F161 S164	R132-E144 IonicContact CZ-OE2 3.96Å; R132-E144 IonicContact NH1-OE2 2.78Å; R132-E144 IonicContact NH2-OE2 3.48Å; R132-E144 PolarHBondContact NH2-OE2 3.34Å; T140-E144 HydrophobicContact CG2-CG 4.28Å; T140-E144 WeakPolarHBondContact O-CB 3.37Å; T140-E144 WeakPolarHBondContact O-CG 3.31Å; T140-E144 PolarHBondContact O-N 2.9Å; E144-C160 WeakPolarHBondContact O-CA 3.35Å; E144-F161 HydrophobicContact CB-CD2 4.33Å; E144-F161 WeakPolarHBondContact O-CD2 3.42Å; E144-F161 PolarHBondContact O-N 2.84Å; E144-S164 VanDerWaalsContact CD-OG 3.28Å; E144-S164 WeakPolarHBondContact OE1-CA 3.45Å; E144-S164 WeakPolarHBondContact OE1-CB 3.41Å; E144-S164 PolarHBondContact OE1-OG 3.06Å; E144-S164 WeakPolarHBondContact OE2-CB 3.02Å; E144-S164 PolarHBondContact OE2-OG 3.19Å
145	C	91.6	Very high	84.8	Confident	4 Å²	4	63.6 Å²	63.6	3%	0.027	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-124.6	155.6	177	-62.5	0	0	0	0	112.1	A141 I147 V154 P159 C160	A141-C145 VanDerWaalsContact O-CB 3.25Å; A141-C145 WeakPolarHBondContact O-CB 3.41Å; A141-C145 PolarHBondContact O-N 3.48Å; C145-I147 PolarHBondContact O-N 2.87Å; C145-V154 HydrophobicContact CB-CB 4.38Å; C145-V154 HydrophobicContact CB-CG1 3.47Å; C145-V154 VanDerWaalsContact CB-CG1 3.47Å; C145-V154 HydrophobicContact CB-CG2 4.1Å; C145-P159 WeakPolarHBondContact CA-O 3.29Å; C145-C160 HydrophobicContact CB-CB 4.04Å; C145-C160 WeakPolarHBondContact CB-SG 3.5Å; C145-C160 WeakPolarHBondContact SG-CB 3.27Å; C145-C160 CovalentContact SG-SG 2.03Å; C145-C160 PolarHBondContact SG-SG 2.89Å
146	A	89.8	Confident	84.2	Confident	4 Å²	4	63.1 Å²	63.1	3%	0.033	36%	0.357	C	S	.	.			trans	-64.6	132.7	174.2	0	0	0	0	0	110.5	N155 P159 P315 I317	A146-N155 VanDerWaalsContact O-CB 3.31Å; A146-N155 WeakPolarHBondContact O-CB 3.36Å; A146-N155 PolarHBondContact O-N 2.92Å; A146-P159 HydrophobicContact CB-CG 4.28Å; A146-P159 PolarHBondContact N-O 2.9Å; A146-P315 HydrophobicContact CB-CB 3.83Å; A146-I317 HydrophobicContact CB-CG2 3.95Å
147	I	86.4	Confident	84	Confident	88 Å²	88	66.1 Å²	66.1	45%	0.451	38%	0.375	S	S	.	.	B	Isolated β-bridge	trans	-87.7	140.8	177.5	-58	177.9	0	0	0	109.4	Q142 C145 S149 G152 N153	Q142-I147 WeakPolarHBondContact O-CD1 3.29Å; C145-I147 PolarHBondContact O-N 2.87Å; I147-S149 PolarHBondContact O-N 3.3Å; I147-G152 VanDerWaalsContact CG2-C 3.48Å; I147-G152 WeakPolarHBondContact CG2-O 3.38Å; I147-N153 WeakPolarHBondContact CA-O 3.38Å
148	D	82.2	Confident	84	Confident	38 Å²	38	61.5 Å²	61.5	20%	0.203	34%	0.343	C	S	.	.			trans	-76	114.6	166.7	165.5	33	0	0	0	110.2	K150 T151 G152 N153 N155	D148-K150 PolarHBondContact O-N 3.17Å; D148-K150 PolarHBondContact OD1-N 3.09Å; D148-T151 PolarHBondContact O-N 3.23Å; D148-T151 VanDerWaalsContact O-N 3.12Å; D148-T151 WeakPolarHBondContact OD2-CB 3.48Å; D148-T151 VanDerWaalsContact OD2-CG2 3.27Å; D148-T151 WeakPolarHBondContact OD2-CG2 3.35Å; D148-T151 PolarHBondContact OD2-N 2.87Å; D148-T151 PolarHBondContact OD2-OG1 3.12Å; D148-G152 PolarHBondContact O-N 3.03Å; D148-N153 PolarHBondContact N-O 3.35Å; D148-N155 HydrophobicContact CB-CB 4.03Å
149	S	80.7	Confident	84.2	Confident	118 Å²	118	59.6 Å²	59.6	83%	0.825	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.4	-25.6	173.4	59.2	0	0	0	0	116.2	I147	I147-S149 PolarHBondContact O-N 3.3Å
150	K	81.2	Confident	84.5	Confident	169 Å²	169	54.3 Å²	54.3	74%	0.735	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-30.5	-177.8	-63.3	178.4	-179.9	176.2	0	114	D148	D148-K150 PolarHBondContact O-N 3.17Å; D148-K150 PolarHBondContact OD1-N 3.09Å
151	T	83	Confident	84.9	Confident	82 Å²	82	51.3 Å²	51.3	50%	0.503	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-13.6	-171.5	59.9	0	0	0	0	114.1	D148 N153	D148-T151 PolarHBondContact O-N 3.23Å; D148-T151 VanDerWaalsContact O-N 3.12Å; D148-T151 WeakPolarHBondContact OD2-CB 3.48Å; D148-T151 VanDerWaalsContact OD2-CG2 3.27Å; D148-T151 WeakPolarHBondContact OD2-CG2 3.35Å; D148-T151 PolarHBondContact OD2-N 2.87Å; D148-T151 PolarHBondContact OD2-OG1 3.12Å; T151-N153 PolarHBondContact O-N 2.92Å; T151-N153 VanDerWaalsContact O-N 3.16Å; T151-N153 PolarHBondContact O-ND2 3.03Å
152	G	80.5	Confident	85.1	Confident	43 Å²	43	51.4 Å²	51.4	44%	0.443	28%	0.284	S	S	.	.	S	Bend	trans	69.9	1.2	-175.1	0	0	0	0	0	114.2	I147 D148	I147-G152 VanDerWaalsContact CG2-C 3.48Å; I147-G152 WeakPolarHBondContact CG2-O 3.38Å; D148-G152 PolarHBondContact O-N 3.03Å
153	N	82.9	Confident	85.5	Confident	90 Å²	90	50 Å²	50	48%	0.481	28%	0.28	S	S	.	.	S	Bend	trans	-93.5	163.8	178.8	-66	-64	0	0	0	111.3	I147 D148 T151 N155	I147-N153 WeakPolarHBondContact CA-O 3.38Å; D148-N153 PolarHBondContact N-O 3.35Å; T151-N153 PolarHBondContact O-N 2.92Å; T151-N153 VanDerWaalsContact O-N 3.16Å; T151-N153 PolarHBondContact O-ND2 3.03Å; N153-N155 PolarHBondContact O-N 3.13Å
154	V	82.6	Confident	85.7	Confident	9 Å²	9	46.1 Å²	46.1	6%	0.055	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-57.7	120.3	171.5	172.5	0	0	0	0	110.3	I134 F136 A141 C145 T156	I134-V154 HydrophobicContact CD1-CG1 4.14Å; F136-V154 HydrophobicContact CD1-CB 3.79Å; F136-V154 HydrophobicContact CD1-CG1 4.11Å; F136-V154 HydrophobicContact CE1-CB 3.88Å; F136-V154 HydrophobicContact CE1-CG1 3.73Å; F136-V154 HydrophobicContact CZ-CG1 4.33Å; A141-V154 HydrophobicContact CB-CG2 4.12Å; A141-V154 WeakPolarHBondContact O-CG2 3.46Å; C145-V154 HydrophobicContact CB-CB 4.38Å; C145-V154 HydrophobicContact CB-CG1 3.47Å; C145-V154 VanDerWaalsContact CB-CG1 3.47Å; C145-V154 HydrophobicContact CB-CG2 4.1Å; V154-T156 PolarHBondContact O-N 2.89Å
155	N	82.5	Confident	85.7	Confident	35 Å²	35	47 Å²	47	19%	0.187	27%	0.274	C	S	.	.			trans	-72.8	112.4	175.9	-178.8	-6.2	0	0	0	109.2	A146 D148 N153 N157 G158	A146-N155 VanDerWaalsContact O-CB 3.31Å; A146-N155 WeakPolarHBondContact O-CB 3.36Å; A146-N155 PolarHBondContact O-N 2.92Å; D148-N155 HydrophobicContact CB-CB 4.03Å; N153-N155 PolarHBondContact O-N 3.13Å; N155-N157 PolarHBondContact O-N 2.93Å; N155-N157 PolarHBondContact OD1-N 2.74Å; N155-G158 PolarHBondContact O-N 2.85Å; N155-G158 PolarHBondContact OD1-N 3.49Å
156	T	76.6	Confident	85.6	Confident	54 Å²	54	50.6 Å²	50.6	33%	0.331	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-38.3	178	48.9	0	0	0	0	112.4	F136 V154 G158 T189	F136-T156 HydrophobicContact CE1-CG2 3.81Å; F136-T156 HydrophobicContact CZ-CG2 3.84Å; V154-T156 PolarHBondContact O-N 2.89Å; T156-G158 VanDerWaalsContact C-N 3.27Å; T156-G158 PolarHBondContact O-N 3.06Å; T156-T189 VanDerWaalsContact O-CG2 3.3Å; T156-T189 WeakPolarHBondContact O-CG2 3.46Å; T156-T189 PolarHBondContact O-OG1 3.33Å
157	N	78.4	Confident	85.6	Confident	103 Å²	103	56.5 Å²	56.5	55%	0.551	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-0.8	-173.9	-53.4	1.8	0	0	0	112.2	N155	N155-N157 PolarHBondContact O-N 2.93Å; N155-N157 PolarHBondContact OD1-N 2.74Å
158	G	83.7	Confident	85.8	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	35%	0.345	C	S	.	.	S	Bend	trans	-88.9	172.1	176	0	0	0	0	0	112.9	N155 T156	N155-G158 PolarHBondContact O-N 2.85Å; N155-G158 PolarHBondContact OD1-N 3.49Å; T156-G158 VanDerWaalsContact C-N 3.27Å; T156-G158 PolarHBondContact O-N 3.06Å
159	P	90.5	Very high	86.2	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	36%	0.357	C	S	.	.			trans	-74.5	145.8	171.1	30.9	-32.3	0	0	0	111.5	C145 A146 V187 L198 V290 I317	C145-P159 WeakPolarHBondContact CA-O 3.29Å; A146-P159 HydrophobicContact CB-CG 4.28Å; A146-P159 PolarHBondContact N-O 2.9Å; P159-V187 CarbonylContact C-O 3.56Å; P159-V187 WeakPolarHBondContact CA-O 3.16Å; P159-L198 HydrophobicContact CB-CD2 4.01Å; P159-V290 HydrophobicContact CB-CG1 4.43Å; P159-I317 HydrophobicContact CB-CD1 3.88Å; P159-I317 HydrophobicContact CB-CG1 4.16Å; P159-I317 HydrophobicContact CG-CD1 4.2Å; P159-I317 HydrophobicContact CG-CG1 3.96Å; P159-I317 HydrophobicContact CG-CG2 4.34Å
160	C	92	Very high	86.8	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	140.5	165.5	-72.5	0	0	0	0	109.2	L65 E144 C145 A186 V187	L65-C160 HydrophobicContact CD1-CB 3.91Å; L65-C160 HydrophobicContact CD2-CB 4.31Å; L65-C160 WeakPolarHBondContact CD2-SG 3.38Å; E144-C160 WeakPolarHBondContact O-CA 3.35Å; C145-C160 HydrophobicContact CB-CB 4.04Å; C145-C160 WeakPolarHBondContact CB-SG 3.5Å; C145-C160 WeakPolarHBondContact SG-CB 3.27Å; C145-C160 CovalentContact SG-SG 2.03Å; C145-C160 PolarHBondContact SG-SG 2.89Å; C160-A186 CarbonylContact O-C 3.56Å; C160-A186 WeakPolarHBondContact O-CA 3.49Å; C160-A186 VanDerWaalsContact O-CB 3.27Å; C160-A186 WeakPolarHBondContact O-CB 3.41Å; C160-V187 PolarHBondContact N-O 3.13Å; C160-V187 PolarHBondContact O-N 3.48Å
161	F	93.3	Very high	87.5	Confident	3 Å²	3	57.4 Å²	57.4	1%	0.013	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	140.1	169.5	-64.7	-59.7	0	0	0	111.1	R132 E144 C184 A186 V290 I317 R319	R132-F161 WeakPolarHBondContact CD-O 3.37Å; R132-F161 PolarHBondContact NE-O 3.25Å; R132-F161 PolarHBondContact NH1-O 3.39Å; E144-F161 HydrophobicContact CB-CD2 4.33Å; E144-F161 WeakPolarHBondContact O-CD2 3.42Å; E144-F161 PolarHBondContact O-N 2.84Å; F161-C184 VanDerWaalsContact CE1-SG 3.55Å; F161-A186 HydrophobicContact CD1-CB 4.44Å; F161-V290 HydrophobicContact CE1-CG2 3.89Å; F161-I317 HydrophobicContact CD1-CD1 3.59Å; F161-I317 HydrophobicContact CD1-CG1 4.39Å; F161-I317 HydrophobicContact CD2-CD1 3.91Å; F161-I317 HydrophobicContact CE1-CB 4.48Å; F161-I317 HydrophobicContact CE1-CD1 3.46Å; F161-I317 VanDerWaalsContact CE1-CD1 3.46Å; F161-I317 HydrophobicContact CE1-CG1 3.75Å; F161-I317 HydrophobicContact CE2-CB 3.89Å; F161-I317 HydrophobicContact CE2-CD1 3.81Å; F161-I317 HydrophobicContact CE2-CG1 4.02Å; F161-I317 HydrophobicContact CG-CD1 3.79Å; F161-I317 HydrophobicContact CZ-CB 3.76Å; F161-I317 HydrophobicContact CZ-CD1 3.57Å; F161-I317 HydrophobicContact CZ-CG1 3.53Å; F161-R319 VanDerWaalsContact CB-NH2 3.27Å; F161-R319 HydrophobicContact CE1-CB 4.03Å; F161-R319 HydrophobicContact CE2-CB 4.03Å; F161-R319 HydrophobicContact CZ-CB 3.56Å
162	L	91.1	Very high	88	Confident	6 Å²	6	54.2 Å²	54.2	3%	0.031	29%	0.293	C	S	.	.	S	Bend	trans	-72.5	-47.8	179.5	179.2	59.7	0	0	0	110.8	R113 S130 V131 R132 D185 V187	R113-L162 HydrophobicContact CG-CD2 3.79Å; S130-L162 WeakPolarHBondContact OG-CD2 3.47Å; V131-L162 VanDerWaalsContact O-CD1 3.29Å; V131-L162 WeakPolarHBondContact O-CD1 3.45Å; R132-L162 HydrophobicContact CB-CD1 4.21Å; R132-L162 VanDerWaalsContact CD-O 3.29Å; R132-L162 WeakPolarHBondContact CD-O 3.19Å; R132-L162 PolarHBondContact NH1-O 3.08Å; L162-D185 HydrophobicContact CB-CB 4.33Å; L162-D185 WeakPolarHBondContact CB-O 3.34Å; L162-D185 HydrophobicContact CD2-CB 4.26Å; L162-D185 PolarHBondContact N-O 3.47Å; L162-V187 HydrophobicContact CD1-CG1 4.27Å
163	T	90.2	Very high	88.6	Confident	41 Å²	41	56 Å²	56	25%	0.252	30%	0.295	S	S	.	.	S	Bend	trans	-93.9	138.4	176.3	50	0	0	0	0	111.1	D183 R319	T163-D183 WeakPolarHBondContact CB-OD2 3.41Å; T163-D183 WeakPolarHBondContact CG2-OD2 3.49Å; T163-D183 PolarHBondContact OG1-OD2 2.8Å; T163-R319 PolarHBondContact O-NH2 2.93Å; T163-R319 PolarHBondContact OG1-NH1 2.82Å
164	S	89.2	Confident	89.1	Confident	64 Å²	64	54.5 Å²	54.5	45%	0.448	28%	0.284	S	S	.	.			trans	-90.8	134.7	162.9	-60.3	0	0	0	0	108.7	R132 E144	R132-S164 PolarHBondContact NH1-OG 2.75Å; R132-S164 PolarHBondContact NH2-OG 3.26Å; R132-S164 VanDerWaalsContact NH2-OG 3.16Å; E144-S164 VanDerWaalsContact CD-OG 3.28Å; E144-S164 WeakPolarHBondContact OE1-CA 3.45Å; E144-S164 WeakPolarHBondContact OE1-CB 3.41Å; E144-S164 PolarHBondContact OE1-OG 3.06Å; E144-S164 WeakPolarHBondContact OE2-CB 3.02Å; E144-S164 PolarHBondContact OE2-OG 3.19Å
165	L	90.4	Very high	89.5	Confident	37 Å²	37	56.8 Å²	56.8	19%	0.194	30%	0.301	C	S	.	.			trans	-119.5	140.7	-175.1	-62.1	-176.4	0	0	0	110.8	E169 L170 F321	L165-E169 HydrophobicContact CB-CB 4.21Å; L165-E169 HydrophobicContact CD2-CB 4.33Å; L165-L170 HydrophobicContact CB-CD2 4.08Å; L165-L170 HydrophobicContact CB-CG 4.18Å; L165-L170 HydrophobicContact CD1-CD2 3.94Å; L165-F321 HydrophobicContact CD1-CE1 3.72Å; L165-F321 HydrophobicContact CD1-CZ 4.18Å
166	T	90.4	Very high	89.7	Confident	79 Å²	79	59.2 Å²	59.2	49%	0.485	31%	0.307	S	S	.	.			trans	-79.4	161	173.4	64.8	0	0	0	0	111.7	R168 E169 L170	T166-R168 PolarHBondContact O-N 2.84Å; T166-E169 VanDerWaalsContact CB-OE2 3.32Å; T166-E169 WeakPolarHBondContact CB-OE2 3.37Å; T166-E169 WeakPolarHBondContact CG2-OE2 3.23Å; T166-E169 PolarHBondContact N-OE2 3.02Å; T166-E169 PolarHBondContact O-N 2.87Å; T166-E169 PolarHBondContact OG1-OE2 2.92Å; T166-L170 PolarHBondContact O-N 2.8Å
167	D	89.4	Confident	90.1	Very high	128 Å²	128	58.4 Å²	58.4	68%	0.684	31%	0.31	S	S	*	.	H	α-helix	trans	-54.1	-28.9	175.4	-61.4	-48.8	0	0	0	113.2	N171	D167-N171 VanDerWaalsContact O-CB 3.3Å; D167-N171 WeakPolarHBondContact O-CB 3.43Å; D167-N171 PolarHBondContact O-N 3.23Å; D167-N171 PolarHBondContact O-ND2 3.2Å
168	R	90.7	Very high	90.7	Very high	216 Å²	216	56.3 Å²	56.3	82%	0.815	30%	0.299	S	S	*	.	H	α-helix	trans	-72.3	-29.9	176.7	-176.2	178.4	176.4	-168	-2.2	113	T166 N171	T166-R168 PolarHBondContact O-N 2.84Å; R168-N171 CarbonylContact O-C 3.59Å
169	E	92	Very high	91.1	Very high	99 Å²	99	61.5 Å²	61.5	46%	0.463	32%	0.323	S	S	.	.	H	α-helix	trans	-84.7	-27.3	176.3	-68.1	157.8	128.2	0	0	111.4	L165 T166	L165-E169 HydrophobicContact CB-CB 4.21Å; L165-E169 HydrophobicContact CD2-CB 4.33Å; T166-E169 VanDerWaalsContact CB-OE2 3.32Å; T166-E169 WeakPolarHBondContact CB-OE2 3.37Å; T166-E169 WeakPolarHBondContact CG2-OE2 3.23Å; T166-E169 PolarHBondContact N-OE2 3.02Å; T166-E169 PolarHBondContact O-N 2.87Å; T166-E169 PolarHBondContact OG1-OE2 2.92Å
170	L	93.3	Very high	91.2	Very high	41 Å²	41	62.1 Å²	62.1	22%	0.215	33%	0.326	C	S	.	.	H	α-helix	trans	-77.9	-26.8	169	-60.9	174.4	0	0	0	112.8	L165 T166 P172 R319 F321 R322	L165-L170 HydrophobicContact CB-CD2 4.08Å; L165-L170 HydrophobicContact CB-CG 4.18Å; L165-L170 HydrophobicContact CD1-CD2 3.94Å; T166-L170 PolarHBondContact O-N 2.8Å; L170-P172 WeakPolarHBondContact O-CD 3.41Å; L170-R319 HydrophobicContact CD2-CG 4.01Å; L170-F321 HydrophobicContact CD2-CD1 4.16Å; L170-F321 HydrophobicContact CD2-CE1 4.14Å; L170-F321 CarbonylContact O-C 3.54Å; L170-F321 VanDerWaalsContact O-CA 3.25Å; L170-F321 WeakPolarHBondContact O-CA 3.43Å; L170-R322 PolarHBondContact O-N 3Å
171	N	95	Very high	91.3	Very high	76 Å²	76	66.2 Å²	66.2	41%	0.406	35%	0.347	S	S	.	.	S	Bend	trans	-115.6	59.4	175.8	-61.3	-95.4	0	0	0	112	D167 R168 T173 R322	D167-N171 VanDerWaalsContact O-CB 3.3Å; D167-N171 WeakPolarHBondContact O-CB 3.43Å; D167-N171 PolarHBondContact O-N 3.23Å; D167-N171 PolarHBondContact O-ND2 3.2Å; R168-N171 CarbonylContact O-C 3.59Å; N171-T173 PolarHBondContact O-N 2.89Å; N171-R322 CarbonylContact C-O 3.58Å; N171-R322 WeakPolarHBondContact CA-O 3.39Å; N171-R322 WeakPolarHBondContact OD1-CB 3.46Å
172	P	94	Very high	91.3	Very high	14 Å²	14	66.2 Å²	66.2	9%	0.091	35%	0.347	C	S	.	.			trans	-69.6	129.5	-173.8	29.2	-34.4	0	0	0	111.4	L170 I180 F182 R322 L323 T324	L170-P172 WeakPolarHBondContact O-CD 3.41Å; P172-I180 HydrophobicContact CB-CD1 3.65Å; P172-I180 HydrophobicContact CG-CD1 3.52Å; P172-F182 HydrophobicContact CG-CE1 4.01Å; P172-R322 WeakPolarHBondContact CD-O 3.44Å; P172-L323 HydrophobicContact CG-CD1 4.25Å; P172-T324 PolarHBondContact O-N 3Å
173	T	93.4	Very high	91.4	Very high	81 Å²	81	67 Å²	67	50%	0.497	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	127.4	168.2	-54.3	0	0	0	0	109.9	N171 T324 K326	N171-T173 PolarHBondContact O-N 2.89Å; T173-T324 CarbonylContact C-O 3.59Å; T173-T324 VanDerWaalsContact CA-O 3.3Å; T173-T324 WeakPolarHBondContact CA-O 3.36Å; T173-T324 HydrophobicContact CG2-CG2 4.32Å; T173-K326 HydrophobicContact CG2-CD 4.33Å; T173-K326 HydrophobicContact CG2-CG 4.11Å
174	K	93.4	Very high	91.5	Very high	58 Å²	58	65 Å²	65	25%	0.252	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	161.5	-176.6	-72.5	-73.5	-174.3	152.1	0	110.9	D178 H179 I180 L278 L323 T324 V325 K326	K174-D178 HydrophobicContact CB-CB 4.18Å; K174-D178 HydrophobicContact CD-CB 3.97Å; K174-D178 WeakPolarHBondContact CD-OD2 3.43Å; K174-H179 WeakPolarHBondContact CE-O 2.98Å; K174-H179 PolarHBondContact NZ-O 3.43Å; K174-I180 HydrophobicContact CG-CD1 4.25Å; K174-L278 HydrophobicContact CB-CD1 3.6Å; K174-L278 HydrophobicContact CG-CD1 3.8Å; K174-L323 HydrophobicContact CB-CD1 4.36Å; K174-L323 HydrophobicContact CG-CD1 4.19Å; K174-T324 PolarHBondContact N-O 2.8Å; K174-V325 WeakPolarHBondContact O-CA 3.43Å; K174-K326 PolarHBondContact O-N 3.37Å
175	S	89.6	Confident	91.6	Very high	58 Å²	58	62.2 Å²	62.2	41%	0.406	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	157.6	170.6	-57.6	0	0	0	0	110.8	G177 D178	S175-G177 PolarHBondContact O-N 2.8Å; S175-D178 PolarHBondContact N-OD2 2.94Å; S175-D178 WeakPolarHBondContact O-CB 3.31Å; S175-D178 PolarHBondContact O-N 3.47Å
176	W	86.8	Confident	91.6	Very high	85 Å²	85	60.5 Å²	60.5	32%	0.322	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	137	162.6	-174	101.9	0	0	0	110.2	D178 L278 T279 K326 R328 E360	W176-D178 VanDerWaalsContact C-N 3.28Å; W176-D178 PolarHBondContact O-N 3.3Å; W176-L278 CarbonylContact C-O 3.53Å; W176-L278 WeakPolarHBondContact CA-O 3.44Å; W176-T279 HydrophobicContact CZ2-CG2 4.43Å; W176-K326 WeakPolarHBondContact CB-O 3.45Å; W176-K326 PolarHBondContact N-O 3.19Å; W176-R328 HydrophobicContact CB-CB 4.37Å; W176-R328 HydrophobicContact CD2-CB 4.48Å; W176-R328 HydrophobicContact CG-CB 4.2Å; W176-E360 HydrophobicContact CZ2-CG 4.14Å
177	G	85.2	Confident	91.6	Very high	37 Å²	37	56.8 Å²	56.8	38%	0.381	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	-10	-179.6	0	0	0	0	0	115.8	S175 L278	S175-G177 PolarHBondContact O-N 2.8Å; G177-L278 PolarHBondContact N-O 3.42Å
178	D	91.4	Very high	91.4	Very high	59 Å²	59	51.8 Å²	51.8	32%	0.316	26%	0.26	S	S	.	.			trans	-62.7	169.3	172.2	-82.1	-18.2	0	0	0	111.9	K174 S175 W176 K277 L278	K174-D178 HydrophobicContact CB-CB 4.18Å; K174-D178 HydrophobicContact CD-CB 3.97Å; K174-D178 WeakPolarHBondContact CD-OD2 3.43Å; S175-D178 PolarHBondContact N-OD2 2.94Å; S175-D178 WeakPolarHBondContact O-CB 3.31Å; S175-D178 PolarHBondContact O-N 3.47Å; W176-D178 VanDerWaalsContact C-N 3.28Å; W176-D178 PolarHBondContact O-N 3.3Å; D178-K277 WeakPolarHBondContact O-CA 3.24Å; D178-K277 PolarHBondContact O-N 2.88Å; D178-L278 HydrophobicContact CB-CD1 4.26Å; D178-L278 WeakPolarHBondContact O-CG 3.47Å; D178-L278 PolarHBondContact O-N 2.88Å
179	H	91.9	Very high	90.5	Very high	109 Å²	109	44.1 Å²	44.1	51%	0.505	24%	0.238	S	C	.	.			trans	-112.3	159.1	163.3	64.5	-84.8	0	0	0	111.1	K174 I275	K174-H179 WeakPolarHBondContact CE-O 2.98Å; K174-H179 PolarHBondContact NZ-O 3.43Å; H179-I275 CarbonylContact C-O 3.15Å; H179-I275 WeakPolarHBondContact CA-O 3.32Å
180	I	93.6	Very high	89.2	Confident	13 Å²	13	40.5 Å²	40.5	7%	0.067	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	151.9	172.9	-166.7	163.9	0	0	0	111.4	P172 K174 F182 R274 I275 L278 L323	P172-I180 HydrophobicContact CB-CD1 3.65Å; P172-I180 HydrophobicContact CG-CD1 3.52Å; K174-I180 HydrophobicContact CG-CD1 4.25Å; I180-F182 HydrophobicContact CD1-CD1 4.21Å; I180-F182 HydrophobicContact CD1-CE1 3.63Å; I180-F182 HydrophobicContact CD1-CZ 4.03Å; I180-F182 HydrophobicContact CG1-CD1 4.47Å; I180-F182 HydrophobicContact CG1-CE1 4.26Å; I180-F182 HydrophobicContact CG2-CE2 4.14Å; I180-F182 HydrophobicContact CG2-CZ 4.14Å; I180-R274 WeakPolarHBondContact O-CA 3.04Å; I180-I275 HydrophobicContact CG2-CB 4.09Å; I180-I275 PolarHBondContact N-O 3.04Å; I180-I275 PolarHBondContact O-N 3.47Å; I180-L278 HydrophobicContact CB-CD1 4.18Å; I180-L278 HydrophobicContact CG2-CD1 3.96Å; I180-L278 HydrophobicContact CG2-CD2 4.05Å; I180-L278 HydrophobicContact CG2-CG 4.4Å; I180-L323 HydrophobicContact CD1-CD1 3.93Å; I180-L323 HydrophobicContact CG2-CD2 4.47Å
181	I	92.7	Very high	87.4	Confident	86 Å²	86	46.1 Å²	46.1	44%	0.441	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	122.1	170.3	-55.7	174.7	0	0	0	106.6	Q272 L273 R274	I181-Q272 HydrophobicContact CG2-CB 4.01Å; I181-L273 WeakPolarHBondContact CA-O 3.44Å; I181-R274 HydrophobicContact CG1-CB 4.17Å; I181-R274 HydrophobicContact CG1-CG 4.08Å
182	F	93.9	Very high	85.9	Confident	3 Å²	3	47 Å²	47	1%	0.013	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	114.3	171.9	-59.4	-66.2	0	0	0	109	P172 I180 W202 Q272 L273 I275 Y286 F321 L323	P172-F182 HydrophobicContact CG-CE1 4.01Å; I180-F182 HydrophobicContact CD1-CD1 4.21Å; I180-F182 HydrophobicContact CD1-CE1 3.63Å; I180-F182 HydrophobicContact CD1-CZ 4.03Å; I180-F182 HydrophobicContact CG1-CD1 4.47Å; I180-F182 HydrophobicContact CG1-CE1 4.26Å; I180-F182 HydrophobicContact CG2-CE2 4.14Å; I180-F182 HydrophobicContact CG2-CZ 4.14Å; F182-W202 HydrophobicContact CB-CH2 3.5Å; F182-W202 HydrophobicContact CB-CZ3 3.72Å; F182-W202 HydrophobicContact CD2-CZ3 4.49Å; F182-W202 HydrophobicContact CG-CZ3 4.38Å; F182-W202 WeakPolarHBondContact O-CH2 3.49Å; F182-Q272 VanDerWaalsContact O-CA 3.29Å; F182-Q272 WeakPolarHBondContact O-CA 3.43Å; F182-L273 HydrophobicContact CB-CB 4.35Å; F182-L273 HydrophobicContact CD2-CB 4.16Å; F182-L273 HydrophobicContact CD2-CD2 4.01Å; F182-L273 HydrophobicContact CD2-CG 4.05Å; F182-L273 HydrophobicContact CE2-CD2 4.44Å; F182-L273 PolarHBondContact N-O 2.92Å; F182-L273 PolarHBondContact O-N 3.02Å; F182-I275 HydrophobicContact CE2-CD1 3.92Å; F182-Y286 HydrophobicContact CD2-CG 4.49Å; F182-Y286 HydrophobicContact CE2-CD1 4.09Å; F182-Y286 AromaticContact CE2-CD2 3.87Å; F182-Y286 HydrophobicContact CE2-CD2 3.87Å; F182-Y286 HydrophobicContact CE2-CE1 4.35Å; F182-Y286 HydrophobicContact CE2-CE2 4.14Å; F182-Y286 AromaticContact CE2-CG 3.85Å; F182-Y286 HydrophobicContact CE2-CG 3.85Å; F182-Y286 AromaticContact CZ-CD2 3.74Å; F182-Y286 HydrophobicContact CZ-CD2 3.74Å; F182-Y286 HydrophobicContact CZ-CE2 4.07Å; F182-Y286 HydrophobicContact CZ-CG 4.12Å; F182-F321 HydrophobicContact CB-CD1 4.41Å; F182-F321 HydrophobicContact CB-CD2 4.03Å; F182-F321 HydrophobicContact CB-CE1 4.16Å; F182-F321 HydrophobicContact CB-CE2 3.78Å; F182-F321 HydrophobicContact CB-CG 4.32Å; F182-F321 HydrophobicContact CB-CZ 3.82Å; F182-F321 HydrophobicContact CD1-CB 3.67Å; F182-F321 AromaticContact CD1-CD1 3.54Å; F182-F321 HydrophobicContact CD1-CD1 3.54Å; F182-F321 AromaticContact CD1-CD2 3.99Å; F182-F321 HydrophobicContact CD1-CD2 3.99Å; F182-F321 HydrophobicContact CD1-CE1 4.06Å; F182-F321 HydrophobicContact CD1-CE2 4.47Å; F182-F321 AromaticContact CD1-CG 3.48Å; F182-F321 HydrophobicContact CD1-CG 3.48Å; F182-F321 VanDerWaalsContact CD1-CG 3.48Å; F182-F321 HydrophobicContact CD1-CZ 4.47Å; F182-F321 HydrophobicContact CE1-CB 3.65Å; F182-F321 HydrophobicContact CE1-CD1 4.25Å; F182-F321 HydrophobicContact CE1-CG 4.02Å; F182-F321 HydrophobicContact CG-CD1 4.38Å; F182-F321 HydrophobicContact CG-CD2 4.18Å; F182-F321 HydrophobicContact CG-CE2 4.42Å; F182-F321 HydrophobicContact CG-CG 4.14Å; F182-F321 HydrophobicContact CZ-CB 4.49Å; F182-L323 HydrophobicContact CZ-CB 4.06Å; F182-L323 HydrophobicContact CZ-CD2 4.04Å; F182-L323 HydrophobicContact CZ-CG 4.48Å
183	D	92.2	Very high	84.5	Confident	23 Å²	23	46.5 Å²	46.5	12%	0.123	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	116.7	-177.9	-177.7	31.5	0	0	0	112.2	R113 T163 D185 Q272 R319 F321	R113-D183 IonicContact NH2-OD1 2.74Å; T163-D183 WeakPolarHBondContact CB-OD2 3.41Å; T163-D183 WeakPolarHBondContact CG2-OD2 3.49Å; T163-D183 PolarHBondContact OG1-OD2 2.8Å; D183-D185 PolarHBondContact OD1-N 3.01Å; D183-Q272 VanDerWaalsContact CG-NE2 3.34Å; D183-Q272 PolarHBondContact OD1-NE2 3.29Å; D183-R319 WeakPolarHBondContact O-CD 3.28Å; D183-R319 PolarHBondContact O-NH1 3.27Å; D183-F321 WeakPolarHBondContact O-CZ 3.49Å
184	C	92.9	Very high	83.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.246	C	C	.	.			trans	-124.3	14.7	177.3	-160.4	0	0	0	0	112.5	F161 A186 Y200 W202 S271 C288	F161-C184 VanDerWaalsContact CE1-SG 3.55Å; C184-A186 PolarHBondContact O-N 2.86Å; C184-Y200 VanDerWaalsContact O-CE1 3.31Å; C184-Y200 WeakPolarHBondContact O-CE1 3.5Å; C184-W202 HydrophobicContact CB-CH2 3.77Å; C184-W202 HydrophobicContact CB-CZ2 3.47Å; C184-W202 VanDerWaalsContact CB-CZ2 3.47Å; C184-S271 CarbonylContact C-O 3.58Å; C184-S271 VanDerWaalsContact C-O 3.29Å; C184-S271 VanDerWaalsContact CA-O 3.3Å; C184-S271 WeakPolarHBondContact CA-O 3.38Å; C184-S271 VanDerWaalsContact CB-O 3.31Å; C184-S271 WeakPolarHBondContact CB-O 3.33Å; C184-S271 PolarHBondContact N-O 2.82Å; C184-C288 HydrophobicContact CB-CB 3.77Å; C184-C288 WeakPolarHBondContact CB-SG 3.35Å; C184-C288 WeakPolarHBondContact SG-CB 3.26Å; C184-C288 CovalentContact SG-SG 2.02Å; C184-C288 PolarHBondContact SG-SG 3.44Å
185	D	91.1	Very high	82.7	Confident	5 Å²	5	41.5 Å²	41.5	3%	0.027	24%	0.239	C	C	.	.			trans	-55.5	139.2	177.4	-91.9	-68.5	0	0	0	111.9	R113 L162 D183 S271 Q272	R113-D185 IonicContact CZ-OD2 3.65Å; R113-D185 IonicContact NH1-OD2 2.69Å; R113-D185 PolarHBondContact NH1-OD2 2.97Å; R113-D185 IonicContact NH2-OD2 3.5Å; R113-D185 PolarHBondContact NH2-OD2 2.89Å; L162-D185 HydrophobicContact CB-CB 4.33Å; L162-D185 WeakPolarHBondContact CB-O 3.34Å; L162-D185 HydrophobicContact CD2-CB 4.26Å; L162-D185 PolarHBondContact N-O 3.47Å; D183-D185 PolarHBondContact OD1-N 3.01Å; D185-S271 PolarHBondContact N-O 3.47Å; D185-S271 WeakPolarHBondContact OD1-CB 3.49Å; D185-S271 PolarHBondContact OD1-OG 2.84Å; D185-S271 PolarHBondContact OD2-OG 3.04Å; D185-S271 VanDerWaalsContact OD2-OG 3.09Å; D185-Q272 VanDerWaalsContact OD2-CG 3.3Å; D185-Q272 WeakPolarHBondContact OD2-CG 3.29Å; D185-Q272 PolarHBondContact OD2-NE2 3.17Å
186	A	91.1	Very high	82	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.008	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	158.6	-175.5	0	0	0	0	0	111.4	C160 F161 C184 L198 Y200 V290 I317	C160-A186 CarbonylContact O-C 3.56Å; C160-A186 WeakPolarHBondContact O-CA 3.49Å; C160-A186 VanDerWaalsContact O-CB 3.27Å; C160-A186 WeakPolarHBondContact O-CB 3.41Å; F161-A186 HydrophobicContact CD1-CB 4.44Å; C184-A186 PolarHBondContact O-N 2.86Å; A186-L198 HydrophobicContact CB-CD1 4.08Å; A186-L198 VanDerWaalsContact O-CD1 3.23Å; A186-L198 WeakPolarHBondContact O-CD1 3.47Å; A186-Y200 HydrophobicContact CB-CE1 4.32Å; A186-Y200 PolarHBondContact N-OH 2.82Å; A186-Y200 PolarHBondContact O-OH 2.93Å; A186-V290 HydrophobicContact CB-CG1 4.11Å; A186-V290 HydrophobicContact CB-CG2 4.28Å; A186-I317 HydrophobicContact CB-CD1 4.12Å
187	V	89.9	Confident	81.8	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	164	174.1	-57.7	0	0	0	0	110.8	L65 R132 P159 C160 L162 L195	L65-V187 HydrophobicContact CB-CG2 4.27Å; L65-V187 HydrophobicContact CD1-CG2 4.29Å; R132-V187 HydrophobicContact CB-CG2 3.42Å; R132-V187 VanDerWaalsContact CB-CG2 3.42Å; R132-V187 HydrophobicContact CG-CG2 4.23Å; P159-V187 CarbonylContact C-O 3.56Å; P159-V187 WeakPolarHBondContact CA-O 3.16Å; C160-V187 PolarHBondContact N-O 3.13Å; C160-V187 PolarHBondContact O-N 3.48Å; L162-V187 HydrophobicContact CD1-CG1 4.27Å; V187-L195 HydrophobicContact CB-CD2 4.23Å; V187-L195 HydrophobicContact CG1-CD1 4.5Å; V187-L195 HydrophobicContact CG1-CD2 4.21Å
188	M	84.5	Confident	81.8	Confident	23 Å²	23	40.8 Å²	40.8	11%	0.113	23%	0.228	C	C	.	.			trans	-144.3	164	178.5	59.9	179	-68.4	0	0	109.8	G190 N197 L198 T292	M188-G190 VanDerWaalsContact C-N 3.33Å; M188-G190 PolarHBondContact O-N 2.72Å; M188-N197 HydrophobicContact CE-CB 4.37Å; M188-N197 HydrophobicContact SD-CB 3.77Å; M188-L198 HydrophobicContact CB-CD2 4.47Å; M188-L198 HydrophobicContact CG-CD2 4.21Å; M188-L198 HydrophobicContact SD-CD2 3.68Å; M188-L198 HydrophobicContact SD-CG 4.18Å; M188-T292 HydrophobicContact CE-CG2 3.95Å; M188-T292 HydrophobicContact SD-CG2 3.92Å
189	T	73.4	Confident	81.7	Confident	56 Å²	56	41.1 Å²	41.1	34%	0.344	23%	0.229	S	C	.	.			trans	-76.7	82.3	170.9	62.9	0	0	0	0	111.4	L65 T156	L65-T189 HydrophobicContact CB-CG2 3.97Å; L65-T189 HydrophobicContact CD2-CG2 4.24Å; L65-T189 HydrophobicContact CG-CG2 4.49Å; T156-T189 VanDerWaalsContact O-CG2 3.3Å; T156-T189 WeakPolarHBondContact O-CG2 3.46Å; T156-T189 PolarHBondContact O-OG1 3.33Å
190	G	63.7	Low	81.6	Confident	22 Å²	22	37 Å²	37	23%	0.227	21%	0.209	C	C	.	.			trans	-81	139	162	0	0	0	0	0	110.7	M188 D192 G193	M188-G190 VanDerWaalsContact C-N 3.33Å; M188-G190 PolarHBondContact O-N 2.72Å; G190-D192 PolarHBondContact O-N 2.79Å; G190-G193 PolarHBondContact O-N 2.85Å
191	T	55.7	Low	81.5	Confident	159 Å²	159	38.9 Å²	38.9	98%	0.975	22%	0.217	S	C	*	.	S	Bend	trans	-68.9	-21.9	172.5	46.7	0	0	0	0	112.9
192	D	63	Low	81.5	Confident	96 Å²	96	34.8 Å²	34.8	51%	0.513	20%	0.197	S	C	.	.	S	Bend	trans	-98.8	-9.2	172.6	58.7	-7	0	0	0	112.8	G190 S194	G190-D192 PolarHBondContact O-N 2.79Å; D192-S194 PolarHBondContact O-N 2.88Å; D192-S194 PolarHBondContact OD1-N 2.78Å; D192-S194 VanDerWaalsContact OD2-CB 3.32Å; D192-S194 WeakPolarHBondContact OD2-CB 3.48Å
193	G	64.3	Low	81.3	Confident	2 Å²	2	38.8 Å²	38.8	2%	0.021	22%	0.215	C	C	.	.			trans	66.9	11.5	-169	0	0	0	0	0	115	L62 G63 G190 L195	L62-G193 CarbonylContact C-O 3.54Å; L62-G193 VanDerWaalsContact CA-O 3.32Å; L62-G193 WeakPolarHBondContact CA-O 3.45Å; G63-G193 PolarHBondContact N-O 2.74Å; G63-G193 WeakPolarHBondContact O-CA 3.43Å; G190-G193 PolarHBondContact O-N 2.85Å; G193-L195 PolarHBondContact O-N 3.34Å
194	S	73.2	Confident	81.1	Confident	16 Å²	16	39.1 Å²	39.1	11%	0.112	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-73.6	125.4	-174.8	178.1	0	0	0	0	112.6	D192 D196	D192-S194 PolarHBondContact O-N 2.88Å; D192-S194 PolarHBondContact OD1-N 2.78Å; D192-S194 VanDerWaalsContact OD2-CB 3.32Å; D192-S194 WeakPolarHBondContact OD2-CB 3.48Å; S194-D196 VanDerWaalsContact C-N 3.29Å; S194-D196 WeakPolarHBondContact OG-CB 3.4Å; S194-D196 VanDerWaalsContact OG-CG 3.23Å; S194-D196 PolarHBondContact OG-N 3.05Å; S194-D196 VanDerWaalsContact OG-N 3.11Å; S194-D196 PolarHBondContact OG-OD2 3.01Å
195	L	76.8	Confident	80.6	Confident	19 Å²	19	42.1 Å²	42.1	10%	0.099	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-81.3	-2.3	173.4	-64.6	177.9	0	0	0	113.8	R61 V187 G193 N197 L198	R61-L195 HydrophobicContact CB-CB 4.46Å; R61-L195 HydrophobicContact CB-CD1 4.25Å; R61-L195 PolarHBondContact O-N 2.88Å; V187-L195 HydrophobicContact CB-CD2 4.23Å; V187-L195 HydrophobicContact CG1-CD1 4.5Å; V187-L195 HydrophobicContact CG1-CD2 4.21Å; G193-L195 PolarHBondContact O-N 3.34Å; L195-N197 PolarHBondContact O-N 3.09Å; L195-L198 HydrophobicContact CD2-CD1 3.87Å; L195-L198 PolarHBondContact O-N 3.15Å
196	D	75.9	Confident	79.5	Confident	120 Å²	120	43.2 Å²	43.2	64%	0.642	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-61	-17.1	177	-63.1	-45.9	0	0	0	113.6	S194 L198 R293	S194-D196 VanDerWaalsContact C-N 3.29Å; S194-D196 WeakPolarHBondContact OG-CB 3.4Å; S194-D196 VanDerWaalsContact OG-CG 3.23Å; S194-D196 PolarHBondContact OG-N 3.05Å; S194-D196 VanDerWaalsContact OG-N 3.11Å; S194-D196 PolarHBondContact OG-OD2 3.01Å; D196-L198 VanDerWaalsContact C-N 3.33Å; D196-R293 PolarHBondContact O-NE 3.16Å; D196-R293 PolarHBondContact O-NH1 3.13Å
197	N	81	Confident	77.8	Confident	34 Å²	34	49.6 Å²	49.6	18%	0.182	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-79.4	-11	176.5	-68.4	-61.2	0	0	0	113.6	M188 L195 T292 R293 T295	M188-N197 HydrophobicContact CE-CB 4.37Å; M188-N197 HydrophobicContact SD-CB 3.77Å; L195-N197 PolarHBondContact O-N 3.09Å; N197-T292 CarbonylContact O-C 3.59Å; N197-T292 WeakPolarHBondContact O-CA 3.19Å; N197-R293 PolarHBondContact O-N 3.15Å; N197-T295 WeakPolarHBondContact OD1-CG2 3.47Å
198	L	86.7	Confident	75.9	Confident	10 Å²	10	53.6 Å²	53.6	5%	0.052	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	143	176.4	-60.6	-176.5	0	0	0	111.7	P159 A186 M188 L195 D196 Y200 V290 T292	P159-L198 HydrophobicContact CB-CD2 4.01Å; A186-L198 HydrophobicContact CB-CD1 4.08Å; A186-L198 VanDerWaalsContact O-CD1 3.23Å; A186-L198 WeakPolarHBondContact O-CD1 3.47Å; M188-L198 HydrophobicContact CB-CD2 4.47Å; M188-L198 HydrophobicContact CG-CD2 4.21Å; M188-L198 HydrophobicContact SD-CD2 3.68Å; M188-L198 HydrophobicContact SD-CG 4.18Å; L195-L198 HydrophobicContact CD2-CD1 3.87Å; L195-L198 PolarHBondContact O-N 3.15Å; D196-L198 VanDerWaalsContact C-N 3.33Å; L198-Y200 HydrophobicContact CB-CE2 4.12Å; L198-Y200 WeakPolarHBondContact CD1-OH 3.44Å; L198-V290 HydrophobicContact CB-CG1 4.25Å; L198-V290 HydrophobicContact CD1-CG1 4.44Å; L198-V290 HydrophobicContact CD2-CG1 4.25Å; L198-T292 HydrophobicContact CD2-CG2 3.98Å
199	I	87.5	Confident	73.5	Confident	66 Å²	66	60.2 Å²	60.2	34%	0.338	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	117.2	171.8	-62.1	174.4	0	0	0	107.7	V290 R291 R293	I199-V290 WeakPolarHBondContact O-CA 3.14Å; I199-R291 PolarHBondContact N-O 3.2Å; I199-R291 PolarHBondContact O-N 3.45Å; I199-R293 HydrophobicContact CD1-CG 3.66Å; I199-R293 HydrophobicContact CG1-CG 3.98Å
200	Y	91	Very high	71.7	Confident	22 Å²	22	62.6 Å²	62.6	9%	0.086	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	142.9	170.3	-55	-89	0	0	0	109.4	C184 A186 L198 H269 T289 V290	C184-Y200 VanDerWaalsContact O-CE1 3.31Å; C184-Y200 WeakPolarHBondContact O-CE1 3.5Å; A186-Y200 HydrophobicContact CB-CE1 4.32Å; A186-Y200 PolarHBondContact N-OH 2.82Å; A186-Y200 PolarHBondContact O-OH 2.93Å; L198-Y200 HydrophobicContact CB-CE2 4.12Å; L198-Y200 WeakPolarHBondContact CD1-OH 3.44Å; Y200-H269 PolarHBondContact O-ND1 3.18Å; Y200-T289 CarbonylContact C-O 3.55Å; Y200-V290 HydrophobicContact CD1-CB 4.35Å; Y200-V290 HydrophobicContact CD1-CG1 3.99Å; Y200-V290 HydrophobicContact CD1-CG2 3.63Å; Y200-V290 HydrophobicContact CE1-CB 4.37Å; Y200-V290 HydrophobicContact CE1-CG1 3.74Å; Y200-V290 HydrophobicContact CE1-CG2 3.69Å
201	Q	91.3	Very high	70.1	Confident	53 Å²	53	68.7 Å²	68.7	25%	0.248	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	126.5	172.8	-177.7	-164.7	-23.3	0	0	108.1	C288 T289	Q201-C288 CarbonylContact O-C 3.49Å; Q201-C288 WeakPolarHBondContact O-CA 3.44Å; Q201-T289 PolarHBondContact N-O 3.35Å; Q201-T289 PolarHBondContact O-N 3.39Å
202	W	91.9	Very high	69.2	Low	1 Å²	1	66.9 Å²	66.9	0%	0.004	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	150.5	176.1	-66.8	80.6	0	0	0	111.9	F182 C184 L265 F268 E270 L273 Q287 C288 F321	F182-W202 HydrophobicContact CB-CH2 3.5Å; F182-W202 HydrophobicContact CB-CZ3 3.72Å; F182-W202 HydrophobicContact CD2-CZ3 4.49Å; F182-W202 HydrophobicContact CG-CZ3 4.38Å; F182-W202 WeakPolarHBondContact O-CH2 3.49Å; C184-W202 HydrophobicContact CB-CH2 3.77Å; C184-W202 HydrophobicContact CB-CZ2 3.47Å; C184-W202 VanDerWaalsContact CB-CZ2 3.47Å; W202-L265 HydrophobicContact CB-CB 4.16Å; W202-L265 HydrophobicContact CB-CD1 4.19Å; W202-L265 HydrophobicContact CB-CD2 4.38Å; W202-L265 HydrophobicContact CB-CG 4.49Å; W202-F268 HydrophobicContact CB-CD1 4.4Å; W202-F268 AromaticContact CD1-CD1 3.47Å; W202-F268 VanDerWaalsContact CD1-CD1 3.47Å; W202-F268 AromaticContact CG-CD1 3.93Å; W202-F268 HydrophobicContact CG-CD1 3.93Å; W202-F268 AromaticContact NE1-CD1 3.84Å; W202-F268 AromaticContact NE1-CE1 3.92Å; W202-E270 PolarHBondContact NE1-O 3.47Å; W202-L273 HydrophobicContact CD2-CB 3.89Å; W202-L273 HydrophobicContact CD2-CD2 4.23Å; W202-L273 HydrophobicContact CE3-CB 3.87Å; W202-L273 HydrophobicContact CE3-CD2 3.78Å; W202-L273 HydrophobicContact CH2-CB 3.81Å; W202-L273 HydrophobicContact CZ2-CB 3.82Å; W202-L273 HydrophobicContact CZ3-CB 3.83Å; W202-L273 HydrophobicContact CZ3-CD2 4.2Å; W202-Q287 CarbonylContact C-O 3.49Å; W202-Q287 WeakPolarHBondContact CA-O 3.45Å; W202-C288 HydrophobicContact CD2-CB 3.89Å; W202-C288 HydrophobicContact CE3-CB 3.79Å; W202-C288 HydrophobicContact CH2-CB 3.88Å; W202-C288 HydrophobicContact CZ2-CB 3.97Å; W202-C288 HydrophobicContact CZ3-CB 3.79Å; W202-F321 HydrophobicContact CH2-CD2 4.48Å; W202-F321 AromaticContact CH2-CE2 3.78Å; W202-F321 HydrophobicContact CH2-CE2 3.78Å; W202-F321 HydrophobicContact CH2-CZ 4.5Å; W202-F321 HydrophobicContact CZ3-CD2 4.04Å; W202-F321 AromaticContact CZ3-CE2 3.78Å; W202-F321 HydrophobicContact CZ3-CE2 3.78Å
203	E	90.4	Very high	67.7	Low	86 Å²	86	68.4 Å²	68.4	40%	0.402	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	135.8	-179.6	-171.1	164.7	164.2	0	0	109.7	Q287	E203-Q287 PolarHBondContact N-O 3.2Å; E203-Q287 PolarHBondContact O-N 3.11Å
204	F	88.6	Confident	66	Low	30 Å²	30	75.7 Å²	75.7	13%	0.132	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	106.1	176.6	178.7	-121.3	0	0	0	110.9	S206 L265 E285 Y286	F204-S206 PolarHBondContact O-N 2.82Å; F204-L265 HydrophobicContact CB-CD1 3.98Å; F204-E285 CarbonylContact C-O 3.56Å; F204-E285 WeakPolarHBondContact CD2-O 3.49Å; F204-Y286 AromaticContact CD2-CD1 3.91Å; F204-Y286 HydrophobicContact CD2-CD1 3.91Å; F204-Y286 HydrophobicContact CD2-CD2 4.16Å; F204-Y286 AromaticContact CD2-CE1 3.57Å; F204-Y286 HydrophobicContact CD2-CE1 3.57Å; F204-Y286 AromaticContact CD2-CE2 3.83Å; F204-Y286 HydrophobicContact CD2-CE2 3.83Å; F204-Y286 HydrophobicContact CD2-CG 4.19Å; F204-Y286 AromaticContact CD2-CZ 3.53Å; F204-Y286 HydrophobicContact CE2-CD2 4.31Å; F204-Y286 HydrophobicContact CE2-CE1 4.1Å; F204-Y286 AromaticContact CE2-CE2 3.67Å; F204-Y286 HydrophobicContact CE2-CE2 3.67Å; F204-Y286 AromaticContact CE2-CZ 3.55Å; F204-Y286 HydrophobicContact CG-CE1 4.3Å
205	I	82.7	Confident	64.2	Low	64 Å²	64	81.4 Å²	81.4	33%	0.328	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	85.1	176.6	-59.5	168.1	0	0	0	106.8	N207 E285 Q287	I205-N207 PolarHBondContact O-N 2.71Å; I205-E285 HydrophobicContact CB-CB 4.03Å; I205-E285 HydrophobicContact CB-CG 4.3Å; I205-E285 HydrophobicContact CD1-CG 4.43Å; I205-E285 WeakPolarHBondContact CD1-OE1 3.48Å; I205-E285 HydrophobicContact CG2-CB 4.45Å; I205-E285 PolarHBondContact N-O 2.03Å; I205-E285 PolarHBondContact O-N 3.43Å; I205-E285 VanDerWaalsContact O-N 3.11Å; I205-Q287 HydrophobicContact CD1-CB 4.12Å
206	S	66.3	Low	62	Low	28 Å²	28	88.2 Å²	88.2	20%	0.196	47%	0.467	C	S	.	.			trans	-64.9	118.8	176.5	55.2	0	0	0	0	110.4	F204 T208 K262	F204-S206 PolarHBondContact O-N 2.82Å; S206-T208 PolarHBondContact O-N 2.89Å; S206-T208 PolarHBondContact OG-OG1 2.86Å; S206-K262 PolarHBondContact OG-NZ 2.83Å
207	N	55.7	Low	59.8	Low	135 Å²	135	88.9 Å²	88.9	72%	0.722	47%	0.47	S	S	*	.			trans	-73.4	25.7	-177.1	-162.5	37.2	0	0	0	114.2	I205	I205-N207 PolarHBondContact O-N 2.71Å
208	T	50.3	Low	57.2	Low	83 Å²	83	98.9 Å²	98.9	51%	0.509	51%	0.505	S	S	.	.			trans	-82.8	114.6	172.3	49.3	0	0	0	0	109.2	S206 N210	S206-T208 PolarHBondContact O-N 2.89Å; S206-T208 PolarHBondContact OG-OG1 2.86Å; T208-N210 PolarHBondContact O-N 3.04Å
209	N	34.9	Very low	54.5	Low	163 Å²	163	103.5 Å²	103.5	87%	0.872	54%	0.538	S	S	*	.			trans	-65.9	81.2	173.4	-90.8	-22.2	0	0	0	110.8	N211	N209-N211 PolarHBondContact O-N 3.33Å
210	N	34.9	Very low	51.9	Low	105 Å²	105	106.7 Å²	106.7	56%	0.561	56%	0.561	S	S	*	*			trans	-74.2	94.3	178.6	-90.7	-2.2	0	0	0	110.1	T208 I212	T208-N210 PolarHBondContact O-N 3.04Å; N210-I212 HydrophobicContact CB-CD1 3.97Å; N210-I212 HydrophobicContact CB-CG1 4Å; N210-I212 PolarHBondContact O-N 2.91Å
211	N	29.7	Very low	49	Very low	150 Å²	150	114.9 Å²	114.9	80%	0.802	60%	0.597	S	S	*	*			trans	-64.6	58.4	154.8	-83.7	-21.5	0	0	0	110.6	N209 N213	N209-N211 PolarHBondContact O-N 3.33Å; N211-N213 VanDerWaalsContact C-N 3.3Å; N211-N213 PolarHBondContact O-N 2.78Å
212	I	36.5	Very low	46.2	Very low	121 Å²	121	121.3 Å²	121.3	62%	0.621	63%	0.626	S	S	*	*			trans	-74.5	92.7	164.4	-69	168.3	0	0	0	106	N210 N214	N210-I212 HydrophobicContact CB-CD1 3.97Å; N210-I212 HydrophobicContact CB-CG1 4Å; N210-I212 PolarHBondContact O-N 2.91Å; I212-N214 PolarHBondContact O-N 3.02Å; I212-N214 VanDerWaalsContact O-N 3.12Å
213	N	31.9	Very low	43.4	Very low	129 Å²	129	127.3 Å²	127.3	69%	0.69	66%	0.663	S	S	*	*			trans	-57.9	116	172.8	-75.5	-39	0	0	0	109.4	N211 N215	N211-N213 VanDerWaalsContact C-N 3.3Å; N211-N213 PolarHBondContact O-N 2.78Å; N213-N215 PolarHBondContact O-N 2.78Å
214	N	28.9	Very low	40.7	Very low	154 Å²	154	127.8 Å²	127.8	82%	0.824	68%	0.676	S	S	*	*	S	Bend	trans	-64.4	85.1	-178.8	-77.9	-46.2	0	0	0	111.8	I212	I212-N214 PolarHBondContact O-N 3.02Å; I212-N214 VanDerWaalsContact O-N 3.12Å
215	N	35	Very low	38	Very low	136 Å²	136	133.4 Å²	133.4	73%	0.727	71%	0.707	S	S	*	*			trans	-140	-18.1	178.2	-88.8	-47.8	0	0	0	116.2	N213	N213-N215 PolarHBondContact O-N 2.78Å
216	N	31.5	Very low	35.6	Very low	162 Å²	162	136.4 Å²	136.4	87%	0.866	73%	0.734	S	S	*	*			trans	-106.7	-1.3	-166.9	-79	-11.1	0	0	0	117.5	R218	N216-R218 PolarHBondContact O-N 3.41Å
217	L	29.5	Very low	33.9	Very low	134 Å²	134	139 Å²	139	70%	0.702	77%	0.765	S	S	*	*			trans	-87.4	85.2	169.4	-85.6	111	0	0	0	111.5	H236	L217-H236 WeakPolarHBondContact CD2-NE2 3.44Å
218	R	27	Very low	32.7	Very low	244 Å²	244	137.5 Å²	137.5	92%	0.921	77%	0.765	S	S	*	*			trans	-135.4	37.7	174.8	-147.5	-176	-172.1	-161.6	3.5	115.5	N216	N216-R218 PolarHBondContact O-N 3.41Å
219	S	28.1	Very low	31.9	Very low	107 Å²	107	140.2 Å²	140.2	75%	0.748	78%	0.776	S	S	*	*			trans	-158	140.6	160.8	-158.8	0	0	0	0	106.4
220	V	33.4	Very low	31.9	Very low	134 Å²	134	138.4 Å²	138.4	81%	0.812	77%	0.771	S	S	*	*			cis	-130	158.8	28.4	173.6	0	0	0	0	111.3
221	K	30.4	Very low	31.7	Very low	194 Å²	194	138.4 Å²	138.4	84%	0.843	78%	0.779	S	S	*	*			trans	-87.4	126.9	178	-68.8	177.4	176.7	177	0	114
222	Q	32.7	Very low	31.7	Very low	187 Å²	187	138.8 Å²	138.8	87%	0.874	78%	0.781	S	S	*	*			trans	-142	122.6	143.2	-69.4	-173.9	-35.5	0	0	105.2
223	V	32.8	Very low	31.5	Very low	128 Å²	128	138.9 Å²	138.9	78%	0.776	79%	0.788	S	S	*	*			cis	62.6	106.4	48.2	-169.7	0	0	0	0	109.7
224	S	32.8	Very low	31.3	Very low	95 Å²	95	140.4 Å²	140.4	66%	0.664	79%	0.794	S	S	*	*			cis	-163.4	157.1	10.3	49.2	0	0	0	0	115
225	N	32	Very low	31.4	Very low	149 Å²	149	139.2 Å²	139.2	80%	0.797	79%	0.786	S	S	*	*			trans	75.9	123.1	149.2	-68.5	5.9	0	0	0	123.2
226	S	32.7	Very low	31	Very low	126 Å²	126	138.5 Å²	138.5	88%	0.881	78%	0.779	S	S	*	*			trans	65	121.2	136.6	62.9	0	0	0	0	122
227	G	30.9	Very low	30.9	Very low	82 Å²	82	140.9 Å²	140.9	85%	0.845	78%	0.776	S	S	*	*			trans	145	118.2	165.4	0	0	0	0	0	111.1
228	S	31.5	Very low	30.9	Very low	105 Å²	105	142.6 Å²	142.6	73%	0.734	78%	0.78	S	S	*	*			trans	-86.9	149.2	171.8	62.5	0	0	0	0	109.5
229	D	31.9	Very low	30.9	Very low	139 Å²	139	140.7 Å²	140.7	74%	0.743	77%	0.773	S	S	*	*				-167.2	146.7	76.4	-84	-24.3	0	0	0	113.9
230	V	36.7	Very low	30.7	Very low	125 Å²	125	143.6 Å²	143.6	76%	0.758	78%	0.779	S	S	*	*			trans	42.4	102.6	141.6	-167.9	0	0	0	0	120
231	S	28.9	Very low	30.3	Very low	106 Å²	106	145 Å²	145	74%	0.741	78%	0.781	S	S	*	*			trans	53.4	105.2	138.6	-53.4	0	0	0	0	121.2
232	N	30.1	Very low	30.1	Very low	157 Å²	157	142.7 Å²	142.7	84%	0.84	78%	0.783	S	S	*	*				-155.5	167.1	119.2	-110.5	-40.9	0	0	0	112.1
233	T	32.2	Very low	29.8	Very low	124 Å²	124	144.9 Å²	144.9	76%	0.761	78%	0.783	S	S	*	*			trans	-57.7	135	-166.8	40.6	0	0	0	0	115	I235	T233-I235 PolarHBondContact O-N 3.03Å
234	I	27.6	Very low	29.5	Very low	160 Å²	160	144.4 Å²	144.4	82%	0.821	78%	0.781	S	S	*	*			trans	-80.4	88.9	-179.3	-54.7	176	0	0	0	110
235	I	31.4	Very low	29.4	Very low	129 Å²	129	145.6 Å²	145.6	66%	0.662	79%	0.786	S	S	*	*			trans	-79.1	135.3	155.2	-61.6	178.6	0	0	0	107.6	T233 R237	T233-I235 PolarHBondContact O-N 3.03Å; I235-R237 VanDerWaalsContact C-N 3.3Å; I235-R237 PolarHBondContact O-N 3.35Å
236	H	25.9	Very low	29	Very low	121 Å²	121	143.4 Å²	143.4	56%	0.56	78%	0.782	S	S	*	*			trans	-78.1	71.3	-164.5	-156.9	53.7	0	0	0	113.4	L217 Q238	L217-H236 WeakPolarHBondContact CD2-NE2 3.44Å; H236-Q238 PolarHBondContact O-N 3.34Å; H236-Q238 VanDerWaalsContact O-N 3.09Å
237	R	31.2	Very low	28.9	Very low	213 Å²	213	142.6 Å²	142.6	80%	0.804	77%	0.772	S	S	*	*			trans	-71	96.1	-179.6	-73.1	178.5	168.8	159.3	-1.2	112.4	I235	I235-R237 VanDerWaalsContact C-N 3.3Å; I235-R237 PolarHBondContact O-N 3.35Å
238	Q	28.7	Very low	28.7	Very low	170 Å²	170	144.6 Å²	144.6	79%	0.794	77%	0.767	S	S	*	*			trans	-71	128.9	155.9	-67.8	-173.9	-9	0	0	108.9	H236	H236-Q238 PolarHBondContact O-N 3.34Å; H236-Q238 VanDerWaalsContact O-N 3.09Å
239	R	26.8	Very low	28.7	Very low	204 Å²	204	143.1 Å²	143.1	77%	0.77	76%	0.757	S	S	*	*			trans	-141.9	83.2	-172.9	-164.8	-179.3	-166.4	-176.6	3.9	110.4
240	L	24.6	Very low	28.6	Very low	167 Å²	167	139.9 Å²	139.9	87%	0.874	74%	0.742	S	S	*	*			trans	-86.3	138.1	177.4	-90.3	153.6	0	0	0	111
241	L	24.1	Very low	28.7	Very low	165 Å²	165	136.4 Å²	136.4	86%	0.864	72%	0.721	S	S	*	*			trans	-107.6	104	-173.4	-76.2	162.2	0	0	0	110.7
242	V	27	Very low	28.9	Very low	144 Å²	144	134.6 Å²	134.6	87%	0.873	71%	0.708	S	S	*	*			trans	-135.9	159.9	171.9	-170.5	0	0	0	0	109.9
243	R	25.9	Very low	29.2	Very low	234 Å²	234	132.9 Å²	132.9	88%	0.883	70%	0.695	S	S	*	*			trans	-81.4	151.7	-169.3	-72.2	172.3	163.6	160	-7.7	114.5
244	T	25.6	Very low	29.2	Very low	118 Å²	118	133.9 Å²	133.9	72%	0.724	70%	0.696	S	S	*	*			trans	-40.1	153.1	151.4	50.1	0	0	0	0	113.6
245	P	31.9	Very low	29.3	Very low	119 Å²	119	133.2 Å²	133.2	77%	0.773	69%	0.694	S	S	*	*			cis	-147.3	-178.4	44.8	43.6	-24.2	0	0	0	118.6
246	S	23.8	Very low	29.2	Very low	103 Å²	103	136.6 Å²	136.6	72%	0.72	70%	0.7	S	S	*	*			trans	-20.4	135.6	166.2	57.3	0	0	0	0	119.6
247	V	30.2	Very low	29.3	Very low	109 Å²	109	137.6 Å²	137.6	66%	0.661	71%	0.71	S	S	*	*				-171.2	144.1	122.1	140	0	0	0	0	108.5	S249	V247-S249 PolarHBondContact O-N 3.32Å; V247-S249 PolarHBondContact O-OG 3.49Å
248	V	27.6	Very low	29.1	Very low	125 Å²	125	133.6 Å²	133.6	76%	0.758	70%	0.704	S	S	*	*			trans	-48.4	111.1	179.8	178.1	0	0	0	0	110.7
249	S	30.4	Very low	29.3	Very low	74 Å²	74	132 Å²	132	52%	0.517	71%	0.706	S	S	.	*			trans	-121	91.4	-172	-66	0	0	0	0	110.9	V247 V251	V247-S249 PolarHBondContact O-N 3.32Å; V247-S249 PolarHBondContact O-OG 3.49Å; S249-V251 PolarHBondContact O-N 3.09Å
250	T	30.3	Very low	29.7	Very low	71 Å²	71	129.5 Å²	129.5	44%	0.436	71%	0.708	S	S	.	*			trans	-60.2	120.5	164.8	45.4	0	0	0	0	109.4	S252	T250-S252 VanDerWaalsContact C-N 3.3Å; T250-S252 PolarHBondContact O-N 2.73Å
251	V	38.4	Very low	30.2	Very low	52 Å²	52	128.2 Å²	128.2	32%	0.315	70%	0.702	S	S	.	*	B	Isolated β-bridge	trans	-74.3	85.9	174.6	-173.5	0	0	0	0	108.9	S249 F263	S249-V251 PolarHBondContact O-N 3.09Å; V251-F263 HydrophobicContact CB-CE2 4.49Å; V251-F263 HydrophobicContact CG1-CE2 3.65Å; V251-F263 HydrophobicContact CG1-CZ 4.07Å
252	S	32	Very low	31.4	Very low	67 Å²	67	126.4 Å²	126.4	47%	0.469	69%	0.687	S	S	.	*			trans	-101	129.1	176.8	53.7	0	0	0	0	110.8	T250 N254	T250-S252 VanDerWaalsContact C-N 3.3Å; T250-S252 PolarHBondContact O-N 2.73Å; S252-N254 VanDerWaalsContact C-N 3.25Å; S252-N254 PolarHBondContact O-N 3.42Å
253	H	38.3	Very low	32.8	Very low	122 Å²	122	121.6 Å²	121.6	57%	0.565	65%	0.654	S	S	*	*			trans	-69.8	77.9	176.9	-85.5	-122.1	0	0	0	111.5
254	N	32.1	Very low	34.4	Very low	144 Å²	144	114.8 Å²	114.8	77%	0.77	64%	0.635	S	S	*	*			trans	-110.8	5.6	175.4	-80.2	3.2	0	0	0	113.3	S252	S252-N254 VanDerWaalsContact C-N 3.25Å; S252-N254 PolarHBondContact O-N 3.42Å
255	N	29.5	Very low	36.5	Very low	147 Å²	147	109.5 Å²	109.5	79%	0.786	60%	0.603	S	S	*	*			trans	-111.4	64.3	177.9	-155.2	22.4	0	0	0	111.5	D257	N255-D257 VanDerWaalsContact C-N 3.31Å; N255-D257 PolarHBondContact O-N 3.31Å
256	Y	28.4	Very low	37.7	Very low	199 Å²	199	107.3 Å²	107.3	78%	0.78	59%	0.59	S	S	*	*			trans	-64.5	90.1	163	-103.2	-109.1	0	0	0	108.5
257	D	27.6	Very low	39.3	Very low	143 Å²	143	109.6 Å²	109.6	77%	0.765	59%	0.589	S	S	*	*			trans	174.2	63.8	152.5	-93.6	-18.7	0	0	0	111.9	N255	N255-D257 VanDerWaalsContact C-N 3.31Å; N255-D257 PolarHBondContact O-N 3.31Å
258	N	28.7	Very low	41.2	Very low	129 Å²	129	105.7 Å²	105.7	69%	0.69	56%	0.563	S	S	*	*			trans	-171.7	119.5	141.8	-113.3	-83.3	0	0	0	112.4	N260	N258-N260 PolarHBondContact O-N 2.9Å
259	V	31.7	Very low	43.3	Very low	136 Å²	136	104.9 Å²	104.9	82%	0.824	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	95.4	169.5	-179.5	0	0	0	0	108.6
260	N	34.8	Very low	45.8	Very low	152 Å²	152	104.7 Å²	104.7	81%	0.813	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	161	-6.9	157.3	-87.9	-42.8	0	0	0	113.8	N258 K262	N258-N260 PolarHBondContact O-N 2.9Å; N260-K262 PolarHBondContact O-N 3.26Å
261	N	36	Very low	48.5	Very low	140 Å²	140	101.7 Å²	101.7	75%	0.749	52%	0.524	S	S	*	.			trans	-73.5	82.8	-174.6	-78	-10.7	0	0	0	113.1
262	K	49.2	Very low	50.9	Low	126 Å²	126	102.3 Å²	102.3	55%	0.548	52%	0.523	S	S	.	.			trans	-53.1	137.1	168.1	-175	-177.6	-176.8	-176.6	0	110.7	S206 N260 D264	S206-K262 PolarHBondContact OG-NZ 2.83Å; N260-K262 PolarHBondContact O-N 3.26Å; K262-D264 PolarHBondContact O-N 3.39Å
263	F	56.9	Low	53.8	Low	43 Å²	43	99.1 Å²	99.1	19%	0.189	50%	0.501	C	S	.	.			trans	-47.6	100.6	-179.7	-161.3	-100.4	0	0	0	113.1	V251 L265 I275 H282 Y286	V251-F263 HydrophobicContact CB-CE2 4.49Å; V251-F263 HydrophobicContact CG1-CE2 3.65Å; V251-F263 HydrophobicContact CG1-CZ 4.07Å; F263-L265 HydrophobicContact CD1-CD1 4.25Å; F263-L265 HydrophobicContact CD1-CD2 4.19Å; F263-L265 HydrophobicContact CD1-CG 3.82Å; F263-L265 HydrophobicContact CE1-CD1 4.13Å; F263-L265 HydrophobicContact CE1-CD2 3.67Å; F263-L265 HydrophobicContact CE1-CG 3.78Å; F263-L265 PolarHBondContact O-N 3.2Å; F263-I275 HydrophobicContact CE1-CD1 4.26Å; F263-I275 HydrophobicContact CZ-CD1 4.03Å; F263-I275 HydrophobicContact CZ-CG1 4.25Å; F263-H282 AromaticContact CE2-NE2 3.85Å; F263-Y286 HydrophobicContact CE1-CE1 4.29Å
264	D	58.2	Low	56.3	Low	91 Å²	91	98.7 Å²	98.7	49%	0.487	49%	0.494	S	S	.	.			trans	-88.9	94.4	-175.5	179	25.3	0	0	0	112.2	K262 S266 Q267	K262-D264 PolarHBondContact O-N 3.39Å; D264-S266 VanDerWaalsContact C-N 3.3Å; D264-S266 VanDerWaalsContact CG-OG 3.31Å; D264-S266 WeakPolarHBondContact OD1-CB 3.39Å; D264-S266 PolarHBondContact OD1-N 3.48Å; D264-S266 PolarHBondContact OD1-OG 2.96Å; D264-S266 PolarHBondContact OD2-OG 3.02Å; D264-Q267 PolarHBondContact OD2-NE2 3.06Å
265	L	69.6	Low	59	Low	8 Å²	8	91.9 Å²	91.9	4%	0.042	46%	0.458	C	S	.	.	G	3₁₀ helix	trans	-79.1	-4.9	172.9	-76.1	176.9	0	0	0	114.6	W202 F204 F263 Q267 F268 L273 Y286	W202-L265 HydrophobicContact CB-CB 4.16Å; W202-L265 HydrophobicContact CB-CD1 4.19Å; W202-L265 HydrophobicContact CB-CD2 4.38Å; W202-L265 HydrophobicContact CB-CG 4.49Å; F204-L265 HydrophobicContact CB-CD1 3.98Å; F263-L265 HydrophobicContact CD1-CD1 4.25Å; F263-L265 HydrophobicContact CD1-CD2 4.19Å; F263-L265 HydrophobicContact CD1-CG 3.82Å; F263-L265 HydrophobicContact CE1-CD1 4.13Å; F263-L265 HydrophobicContact CE1-CD2 3.67Å; F263-L265 HydrophobicContact CE1-CG 3.78Å; F263-L265 PolarHBondContact O-N 3.2Å; L265-Q267 PolarHBondContact O-N 3.14Å; L265-F268 HydrophobicContact CD2-CB 3.98Å; L265-F268 HydrophobicContact CD2-CD1 4.48Å; L265-F268 HydrophobicContact CD2-CG 4.32Å; L265-F268 WeakPolarHBondContact O-CB 3.34Å; L265-F268 PolarHBondContact O-N 2.96Å; L265-L273 HydrophobicContact CD1-CD2 3.69Å; L265-L273 HydrophobicContact CD2-CD1 3.72Å; L265-L273 HydrophobicContact CD2-CD2 3.74Å; L265-L273 HydrophobicContact CD2-CG 4.4Å; L265-L273 HydrophobicContact CG-CD2 4.4Å; L265-Y286 HydrophobicContact CD1-CD1 3.72Å; L265-Y286 HydrophobicContact CD1-CE1 4.01Å
266	S	58.7	Low	61.9	Low	73 Å²	73	86.9 Å²	86.9	51%	0.51	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-63.3	-21.1	-172.5	70.8	0	0	0	0	114	D264	D264-S266 VanDerWaalsContact C-N 3.3Å; D264-S266 VanDerWaalsContact CG-OG 3.31Å; D264-S266 WeakPolarHBondContact OD1-CB 3.39Å; D264-S266 PolarHBondContact OD1-N 3.48Å; D264-S266 PolarHBondContact OD1-OG 2.96Å; D264-S266 PolarHBondContact OD2-OG 3.02Å
267	Q	57.5	Low	64.6	Low	150 Å²	150	85.3 Å²	85.3	70%	0.701	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-94.4	-7.7	178.6	-57.7	175.6	61.5	0	0	112.9	D264 L265 H269	D264-Q267 PolarHBondContact OD2-NE2 3.06Å; L265-Q267 PolarHBondContact O-N 3.14Å; Q267-H269 PolarHBondContact O-CD2 2.76Å; Q267-H269 PolarHBondContact O-N 3.38Å
268	F	69.2	Low	67.5	Low	27 Å²	27	78.5 Å²	78.5	12%	0.118	39%	0.392	C	S	.	.			trans	-88.1	111.2	-173.5	-164.8	-102.8	0	0	0	111.6	W202 L265 E270 Q272 L273	W202-F268 HydrophobicContact CB-CD1 4.4Å; W202-F268 AromaticContact CD1-CD1 3.47Å; W202-F268 VanDerWaalsContact CD1-CD1 3.47Å; W202-F268 AromaticContact CG-CD1 3.93Å; W202-F268 HydrophobicContact CG-CD1 3.93Å; W202-F268 AromaticContact NE1-CD1 3.84Å; W202-F268 AromaticContact NE1-CE1 3.92Å; L265-F268 HydrophobicContact CD2-CB 3.98Å; L265-F268 HydrophobicContact CD2-CD1 4.48Å; L265-F268 HydrophobicContact CD2-CG 4.32Å; L265-F268 WeakPolarHBondContact O-CB 3.34Å; L265-F268 PolarHBondContact O-N 2.96Å; F268-E270 HydrophobicContact CE1-CB 3.96Å; F268-E270 HydrophobicContact CE2-CB 4.21Å; F268-E270 HydrophobicContact CE2-CG 4.06Å; F268-E270 HydrophobicContact CZ-CB 3.63Å; F268-E270 HydrophobicContact CZ-CG 4Å; F268-Q272 WeakPolarHBondContact CE1-O 3.29Å; F268-Q272 WeakPolarHBondContact CZ-O 3.4Å; F268-L273 HydrophobicContact CD1-CB 4.36Å; F268-L273 HydrophobicContact CD1-CD1 3.97Å; F268-L273 HydrophobicContact CE1-CB 3.86Å; F268-L273 HydrophobicContact CE1-CD1 3.82Å; F268-L273 HydrophobicContact CE1-CG 4.44Å; F268-L273 HydrophobicContact CG-CD1 4.46Å; F268-L273 HydrophobicContact CZ-CD1 4.17Å
269	H	72.2	Confident	70.2	Confident	108 Å²	108	73.2 Å²	73.2	50%	0.5	37%	0.365	S	S	.	.			trans	-120.1	12.6	-172.8	-67	-56.9	0	0	0	113.9	Y200 Q267	Y200-H269 PolarHBondContact O-ND1 3.18Å; Q267-H269 PolarHBondContact O-CD2 2.76Å; Q267-H269 PolarHBondContact O-N 3.38Å
270	E	81.7	Confident	72.6	Confident	71 Å²	71	67.1 Å²	67.1	33%	0.332	33%	0.327	S	S	.	.	S	Bend	trans	-81	159.6	172.7	-52.4	-165.9	156.9	0	0	111.3	W202 F268 Q272	W202-E270 PolarHBondContact NE1-O 3.47Å; F268-E270 HydrophobicContact CE1-CB 3.96Å; F268-E270 HydrophobicContact CE2-CB 4.21Å; F268-E270 HydrophobicContact CE2-CG 4.06Å; F268-E270 HydrophobicContact CZ-CB 3.63Å; F268-E270 HydrophobicContact CZ-CG 4Å; E270-Q272 VanDerWaalsContact C-N 3.33Å; E270-Q272 PolarHBondContact O-N 3.07Å
271	S	87.4	Confident	74.8	Confident	7 Å²	7	63.3 Å²	63.3	5%	0.049	31%	0.307	C	S	.	.	S	Bend	trans	-78.6	-13.6	-176.1	52.2	0	0	0	0	114.7	R61 C184 D185	R61-S271 PolarHBondContact NH1-OG 2.99Å; C184-S271 CarbonylContact C-O 3.58Å; C184-S271 VanDerWaalsContact C-O 3.29Å; C184-S271 VanDerWaalsContact CA-O 3.3Å; C184-S271 WeakPolarHBondContact CA-O 3.38Å; C184-S271 VanDerWaalsContact CB-O 3.31Å; C184-S271 WeakPolarHBondContact CB-O 3.33Å; C184-S271 PolarHBondContact N-O 2.82Å; D185-S271 PolarHBondContact N-O 3.47Å; D185-S271 WeakPolarHBondContact OD1-CB 3.49Å; D185-S271 PolarHBondContact OD1-OG 2.84Å; D185-S271 PolarHBondContact OD2-OG 3.04Å; D185-S271 VanDerWaalsContact OD2-OG 3.09Å
272	Q	90.1	Very high	77.2	Confident	65 Å²	65	56.9 Å²	56.9	30%	0.304	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	127.3	176.6	-55.3	-166.8	-35.8	0	0	110.1	R113 I181 F182 D183 D185 F268 E270	R113-Q272 VanDerWaalsContact NH2-NE2 3.12Å; I181-Q272 HydrophobicContact CG2-CB 4.01Å; F182-Q272 VanDerWaalsContact O-CA 3.29Å; F182-Q272 WeakPolarHBondContact O-CA 3.43Å; D183-Q272 VanDerWaalsContact CG-NE2 3.34Å; D183-Q272 PolarHBondContact OD1-NE2 3.29Å; D185-Q272 VanDerWaalsContact OD2-CG 3.3Å; D185-Q272 WeakPolarHBondContact OD2-CG 3.29Å; D185-Q272 PolarHBondContact OD2-NE2 3.17Å; F268-Q272 WeakPolarHBondContact CE1-O 3.29Å; F268-Q272 WeakPolarHBondContact CZ-O 3.4Å; E270-Q272 VanDerWaalsContact C-N 3.33Å; E270-Q272 PolarHBondContact O-N 3.07Å
273	L	91.5	Very high	79	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	109.5	174.8	173.3	59	0	0	0	109.6	I181 F182 W202 L265 F268 I275 Y286	I181-L273 WeakPolarHBondContact CA-O 3.44Å; F182-L273 HydrophobicContact CB-CB 4.35Å; F182-L273 HydrophobicContact CD2-CB 4.16Å; F182-L273 HydrophobicContact CD2-CD2 4.01Å; F182-L273 HydrophobicContact CD2-CG 4.05Å; F182-L273 HydrophobicContact CE2-CD2 4.44Å; F182-L273 PolarHBondContact N-O 2.92Å; F182-L273 PolarHBondContact O-N 3.02Å; W202-L273 HydrophobicContact CD2-CB 3.89Å; W202-L273 HydrophobicContact CD2-CD2 4.23Å; W202-L273 HydrophobicContact CE3-CB 3.87Å; W202-L273 HydrophobicContact CE3-CD2 3.78Å; W202-L273 HydrophobicContact CH2-CB 3.81Å; W202-L273 HydrophobicContact CZ2-CB 3.82Å; W202-L273 HydrophobicContact CZ3-CB 3.83Å; W202-L273 HydrophobicContact CZ3-CD2 4.2Å; L265-L273 HydrophobicContact CD1-CD2 3.69Å; L265-L273 HydrophobicContact CD2-CD1 3.72Å; L265-L273 HydrophobicContact CD2-CD2 3.74Å; L265-L273 HydrophobicContact CD2-CG 4.4Å; L265-L273 HydrophobicContact CG-CD2 4.4Å; F268-L273 HydrophobicContact CD1-CB 4.36Å; F268-L273 HydrophobicContact CD1-CD1 3.97Å; F268-L273 HydrophobicContact CE1-CB 3.86Å; F268-L273 HydrophobicContact CE1-CD1 3.82Å; F268-L273 HydrophobicContact CE1-CG 4.44Å; F268-L273 HydrophobicContact CG-CD1 4.46Å; F268-L273 HydrophobicContact CZ-CD1 4.17Å; L273-I275 HydrophobicContact CD1-CG1 4.37Å; L273-I275 HydrophobicContact CD2-CD1 4.44Å; L273-I275 HydrophobicContact CG-CD1 4.46Å; L273-I275 HydrophobicContact CG-CG1 4.21Å; L273-Y286 HydrophobicContact CD2-CD1 3.73Å; L273-Y286 HydrophobicContact CD2-CE1 4.16Å
274	R	90.6	Very high	80.6	Confident	113 Å²	113	50.9 Å²	50.9	43%	0.426	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	132	173.3	175.9	174	172.1	169.7	1.1	110.7	I180 I181 D276	I180-R274 WeakPolarHBondContact O-CA 3.04Å; I181-R274 HydrophobicContact CG1-CB 4.17Å; I181-R274 HydrophobicContact CG1-CG 4.08Å; R274-D276 IonicContact CZ-OD1 3.69Å; R274-D276 VanDerWaalsContact CZ-OD1 3.3Å; R274-D276 IonicContact CZ-OD2 2.84Å; R274-D276 VanDerWaalsContact NE-CG 3.3Å; R274-D276 IonicContact NE-OD1 2.85Å; R274-D276 PolarHBondContact NE-OD1 3.22Å; R274-D276 IonicContact NE-OD2 3.73Å; R274-D276 PolarHBondContact NE-OD2 3.27Å; R274-D276 IonicContact NH2-OD1 2.7Å; R274-D276 PolarHBondContact NH2-OD1 3.19Å; R274-D276 IonicContact NH2-OD2 3.73Å; R274-D276 PolarHBondContact NH2-OD2 2.98Å
275	I	90.3	Very high	82.3	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	122.6	172.9	-48.3	-176	0	0	0	108.4	H179 I180 F182 F263 L273 L278 H282 Y286	H179-I275 CarbonylContact C-O 3.15Å; H179-I275 WeakPolarHBondContact CA-O 3.32Å; I180-I275 HydrophobicContact CG2-CB 4.09Å; I180-I275 PolarHBondContact N-O 3.04Å; I180-I275 PolarHBondContact O-N 3.47Å; F182-I275 HydrophobicContact CE2-CD1 3.92Å; F263-I275 HydrophobicContact CE1-CD1 4.26Å; F263-I275 HydrophobicContact CZ-CD1 4.03Å; F263-I275 HydrophobicContact CZ-CG1 4.25Å; L273-I275 HydrophobicContact CD1-CG1 4.37Å; L273-I275 HydrophobicContact CD2-CD1 4.44Å; L273-I275 HydrophobicContact CG-CD1 4.46Å; L273-I275 HydrophobicContact CG-CG1 4.21Å; I275-L278 HydrophobicContact CB-CD2 4.14Å; I275-L278 HydrophobicContact CG2-CD2 3.72Å; I275-H282 WeakPolarHBondContact CG2-NE2 3.21Å; I275-Y286 HydrophobicContact CD1-CE1 3.81Å
276	D	88.7	Confident	83.4	Confident	41 Å²	41	48.4 Å²	48.4	22%	0.219	24%	0.235	C	C	.	.			trans	-105.9	140.2	177.3	-67.1	-63.3	0	0	0	109.9	R274	R274-D276 IonicContact CZ-OD1 3.69Å; R274-D276 VanDerWaalsContact CZ-OD1 3.3Å; R274-D276 IonicContact CZ-OD2 2.84Å; R274-D276 VanDerWaalsContact NE-CG 3.3Å; R274-D276 IonicContact NE-OD1 2.85Å; R274-D276 PolarHBondContact NE-OD1 3.22Å; R274-D276 IonicContact NE-OD2 3.73Å; R274-D276 PolarHBondContact NE-OD2 3.27Å; R274-D276 IonicContact NH2-OD1 2.7Å; R274-D276 PolarHBondContact NH2-OD1 3.19Å; R274-D276 IonicContact NH2-OD2 3.73Å; R274-D276 PolarHBondContact NH2-OD2 2.98Å
277	K	86.7	Confident	85.1	Confident	167 Å²	167	47.2 Å²	47.2	73%	0.726	22%	0.222	S	C	*	.	S	Bend	trans	61.1	69.6	-176.9	-55.4	179.3	179.5	179.1	0	113.9	D178 T279	D178-K277 WeakPolarHBondContact O-CA 3.24Å; D178-K277 PolarHBondContact O-N 2.88Å; K277-T279 PolarHBondContact O-N 3.09Å
278	L	88.9	Confident	86.8	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.189	C	C	.	.			trans	-62.7	126	178.4	-70.8	175.2	0	0	0	113.5	K174 W176 G177 D178 I180 I275 H282 L323 V325	K174-L278 HydrophobicContact CB-CD1 3.6Å; K174-L278 HydrophobicContact CG-CD1 3.8Å; W176-L278 CarbonylContact C-O 3.53Å; W176-L278 WeakPolarHBondContact CA-O 3.44Å; G177-L278 PolarHBondContact N-O 3.42Å; D178-L278 HydrophobicContact CB-CD1 4.26Å; D178-L278 WeakPolarHBondContact O-CG 3.47Å; D178-L278 PolarHBondContact O-N 2.88Å; I180-L278 HydrophobicContact CB-CD1 4.18Å; I180-L278 HydrophobicContact CG2-CD1 3.96Å; I180-L278 HydrophobicContact CG2-CD2 4.05Å; I180-L278 HydrophobicContact CG2-CG 4.4Å; I275-L278 HydrophobicContact CB-CD2 4.14Å; I275-L278 HydrophobicContact CG2-CD2 3.72Å; L278-H282 HydrophobicContact CD2-CB 4.02Å; L278-L323 HydrophobicContact CD1-CD1 4.37Å; L278-L323 HydrophobicContact CD1-CD2 4.37Å; L278-L323 HydrophobicContact CD2-CD2 3.77Å; L278-V325 HydrophobicContact CB-CG1 4.07Å; L278-V325 HydrophobicContact CB-CG2 4.13Å; L278-V325 HydrophobicContact CD1-CG2 4.39Å; L278-V325 HydrophobicContact CD2-CG2 4.45Å
279	T	84.3	Confident	87.9	Confident	18 Å²	18	39.2 Å²	39.2	11%	0.11	19%	0.185	C	C	.	.			trans	-115.1	171.4	174.9	39.7	0	0	0	0	111.2	W176 K277 D281 H282 E359	W176-T279 HydrophobicContact CZ2-CG2 4.43Å; K277-T279 PolarHBondContact O-N 3.09Å; T279-D281 VanDerWaalsContact C-OD1 3.28Å; T279-D281 WeakPolarHBondContact CB-OD1 3.41Å; T279-D281 PolarHBondContact O-N 2.96Å; T279-D281 PolarHBondContact OG1-OD1 2.99Å; T279-H282 WeakPolarHBondContact O-CB 3.38Å; T279-H282 PolarHBondContact O-N 3.4Å; T279-H282 PolarHBondContact OG1-CE1 3.44Å; T279-H282 PolarHBondContact OG1-ND1 2.82Å; T279-E359 HydrophobicContact CG2-CB 4.41Å
280	L	82	Confident	88.9	Confident	7 Å²	7	34 Å²	34	4%	0.037	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-10.3	-171.1	-76	-173.5	0	0	0	116	N283 V325 E359 E360 R362	L280-N283 WeakPolarHBondContact CD2-ND2 3.47Å; L280-N283 WeakPolarHBondContact O-CB 3.22Å; L280-N283 PolarHBondContact O-ND2 3.01Å; L280-V325 HydrophobicContact CD2-CB 4.47Å; L280-V325 HydrophobicContact CD2-CG1 4.48Å; L280-V325 VanDerWaalsContact CD2-O 3.24Å; L280-V325 WeakPolarHBondContact CD2-O 3.4Å; L280-E359 WeakPolarHBondContact CB-O 3.48Å; L280-E359 PolarHBondContact N-O 3.39Å; L280-E360 VanDerWaalsContact CD1-O 3.24Å; L280-E360 WeakPolarHBondContact CD1-O 3.48Å; L280-R362 HydrophobicContact CD1-CG 4.09Å; L280-R362 PolarHBondContact O-NH2 2.77Å
281	D	81.2	Confident	89.2	Confident	72 Å²	72	33.6 Å²	33.6	39%	0.385	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-31	172.7	65.2	-37.6	0	0	0	112.8	T279 N283	T279-D281 VanDerWaalsContact C-OD1 3.28Å; T279-D281 WeakPolarHBondContact CB-OD1 3.41Å; T279-D281 PolarHBondContact O-N 2.96Å; T279-D281 PolarHBondContact OG1-OD1 2.99Å; D281-N283 PolarHBondContact O-N 3.03Å; D281-N283 VanDerWaalsContact O-N 3.12Å
282	H	86.7	Confident	89.1	Confident	6 Å²	6	33.9 Å²	33.9	3%	0.028	16%	0.158	C	C	.	.	S	Bend	trans	-68.2	-3.9	174.3	-65.7	81.7	0	0	0	113.4	F263 I275 L278 T279 G284 Y286 L323 V325	F263-H282 AromaticContact CE2-NE2 3.85Å; I275-H282 WeakPolarHBondContact CG2-NE2 3.21Å; L278-H282 HydrophobicContact CD2-CB 4.02Å; T279-H282 WeakPolarHBondContact O-CB 3.38Å; T279-H282 PolarHBondContact O-N 3.4Å; T279-H282 PolarHBondContact OG1-CE1 3.44Å; T279-H282 PolarHBondContact OG1-ND1 2.82Å; H282-G284 PolarHBondContact O-N 3.43Å; H282-Y286 PolarHBondContact O-OH 3.02Å; H282-L323 HydrophobicContact CB-CD2 4.26Å; H282-V325 HydrophobicContact CB-CG2 4.3Å
283	N	87.5	Confident	88.5	Confident	34 Å²	34	37 Å²	37	18%	0.182	17%	0.167	C	C	.	.			trans	-65.1	114.1	170.5	-84.9	-66.9	0	0	0	111	L280 D281 T324 V325	L280-N283 WeakPolarHBondContact CD2-ND2 3.47Å; L280-N283 WeakPolarHBondContact O-CB 3.22Å; L280-N283 PolarHBondContact O-ND2 3.01Å; D281-N283 PolarHBondContact O-N 3.03Å; D281-N283 VanDerWaalsContact O-N 3.12Å; N283-T324 WeakPolarHBondContact OD1-CA 3.38Å; N283-V325 PolarHBondContact ND2-O 2.93Å; N283-V325 PolarHBondContact OD1-N 2.99Å
284	G	89.5	Confident	87.2	Confident	9 Å²	9	42.3 Å²	42.3	9%	0.093	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.7	-162.3	178.2	0	0	0	0	0	112.9	H282 L323	H282-G284 PolarHBondContact O-N 3.43Å; G284-L323 PolarHBondContact N-O 3.12Å; G284-L323 PolarHBondContact O-N 3.04Å
285	E	93.3	Very high	85.4	Confident	44 Å²	44	41 Å²	41	21%	0.206	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	132.2	-178.9	176.3	173.8	119	0	0	110.5	F204 I205 Q320 F321	F204-E285 CarbonylContact C-O 3.56Å; F204-E285 WeakPolarHBondContact CD2-O 3.49Å; I205-E285 HydrophobicContact CB-CB 4.03Å; I205-E285 HydrophobicContact CB-CG 4.3Å; I205-E285 HydrophobicContact CD1-CG 4.43Å; I205-E285 WeakPolarHBondContact CD1-OE1 3.48Å; I205-E285 HydrophobicContact CG2-CB 4.45Å; I205-E285 PolarHBondContact N-O 2.03Å; I205-E285 PolarHBondContact O-N 3.43Å; I205-E285 VanDerWaalsContact O-N 3.11Å; E285-Q320 VanDerWaalsContact CD-CG 3.5Å; E285-Q320 HydrophobicContact CG-CG 3.73Å; E285-Q320 PolarHBondContact OE1-NE2 3.26Å; E285-Q320 VanDerWaalsContact OE1-NE2 3.07Å; E285-Q320 PolarHBondContact OE2-NE2 3.48Å; E285-F321 CarbonylContact C-O 3.56Å; E285-F321 VanDerWaalsContact CA-O 3.32Å; E285-F321 WeakPolarHBondContact CA-O 3.27Å
286	Y	94	Very high	83	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.008	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	114.2	179.2	-66	-97.3	0	0	0	108.2	F182 F204 F263 L265 L273 I275 H282 F321 L323	F182-Y286 HydrophobicContact CD2-CG 4.49Å; F182-Y286 HydrophobicContact CE2-CD1 4.09Å; F182-Y286 AromaticContact CE2-CD2 3.87Å; F182-Y286 HydrophobicContact CE2-CD2 3.87Å; F182-Y286 HydrophobicContact CE2-CE1 4.35Å; F182-Y286 HydrophobicContact CE2-CE2 4.14Å; F182-Y286 AromaticContact CE2-CG 3.85Å; F182-Y286 HydrophobicContact CE2-CG 3.85Å; F182-Y286 AromaticContact CZ-CD2 3.74Å; F182-Y286 HydrophobicContact CZ-CD2 3.74Å; F182-Y286 HydrophobicContact CZ-CE2 4.07Å; F182-Y286 HydrophobicContact CZ-CG 4.12Å; F204-Y286 AromaticContact CD2-CD1 3.91Å; F204-Y286 HydrophobicContact CD2-CD1 3.91Å; F204-Y286 HydrophobicContact CD2-CD2 4.16Å; F204-Y286 AromaticContact CD2-CE1 3.57Å; F204-Y286 HydrophobicContact CD2-CE1 3.57Å; F204-Y286 AromaticContact CD2-CE2 3.83Å; F204-Y286 HydrophobicContact CD2-CE2 3.83Å; F204-Y286 HydrophobicContact CD2-CG 4.19Å; F204-Y286 AromaticContact CD2-CZ 3.53Å; F204-Y286 HydrophobicContact CE2-CD2 4.31Å; F204-Y286 HydrophobicContact CE2-CE1 4.1Å; F204-Y286 AromaticContact CE2-CE2 3.67Å; F204-Y286 HydrophobicContact CE2-CE2 3.67Å; F204-Y286 AromaticContact CE2-CZ 3.55Å; F204-Y286 HydrophobicContact CG-CE1 4.3Å; F263-Y286 HydrophobicContact CE1-CE1 4.29Å; L265-Y286 HydrophobicContact CD1-CD1 3.72Å; L265-Y286 HydrophobicContact CD1-CE1 4.01Å; L273-Y286 HydrophobicContact CD2-CD1 3.73Å; L273-Y286 HydrophobicContact CD2-CE1 4.16Å; I275-Y286 HydrophobicContact CD1-CE1 3.81Å; H282-Y286 PolarHBondContact O-OH 3.02Å; Y286-F321 PolarHBondContact N-O 3.22Å; Y286-F321 PolarHBondContact O-N 3.12Å; Y286-L323 HydrophobicContact CD2-CB 4.24Å; Y286-L323 HydrophobicContact CE2-CB 3.96Å; Y286-L323 HydrophobicContact CE2-CD2 4.02Å
287	Q	93.6	Very high	80.6	Confident	49 Å²	49	49.9 Å²	49.9	23%	0.229	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	126.5	175	-172.8	174.1	95.3	0	0	110	W202 E203 I205 R319	W202-Q287 CarbonylContact C-O 3.49Å; W202-Q287 WeakPolarHBondContact CA-O 3.45Å; E203-Q287 PolarHBondContact N-O 3.2Å; E203-Q287 PolarHBondContact O-N 3.11Å; I205-Q287 HydrophobicContact CD1-CB 4.12Å; Q287-R319 WeakPolarHBondContact CA-O 3.42Å
288	C	94	Very high	78	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	133.8	165.7	170.5	0	0	0	0	109.2	C184 Q201 W202 T318 R319	C184-C288 HydrophobicContact CB-CB 3.77Å; C184-C288 WeakPolarHBondContact CB-SG 3.35Å; C184-C288 WeakPolarHBondContact SG-CB 3.26Å; C184-C288 CovalentContact SG-SG 2.02Å; C184-C288 PolarHBondContact SG-SG 3.44Å; Q201-C288 CarbonylContact O-C 3.49Å; Q201-C288 WeakPolarHBondContact O-CA 3.44Å; W202-C288 HydrophobicContact CD2-CB 3.89Å; W202-C288 HydrophobicContact CE3-CB 3.79Å; W202-C288 HydrophobicContact CH2-CB 3.88Å; W202-C288 HydrophobicContact CZ2-CB 3.97Å; W202-C288 HydrophobicContact CZ3-CB 3.79Å; C288-T318 CarbonylContact O-C 3.38Å; C288-T318 VanDerWaalsContact O-CA 3.27Å; C288-T318 WeakPolarHBondContact O-CA 3.19Å; C288-R319 PolarHBondContact N-O 3.08Å; C288-R319 PolarHBondContact O-N 2.87Å
289	T	92.5	Very high	75.3	Confident	8 Å²	8	49.8 Å²	49.8	5%	0.049	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	129	166.5	-53.6	0	0	0	0	109.8	Y200 Q201 R291 M316 I317 T318	Y200-T289 CarbonylContact C-O 3.55Å; Q201-T289 PolarHBondContact N-O 3.35Å; Q201-T289 PolarHBondContact O-N 3.39Å; T289-R291 HydrophobicContact CG2-CG 3.86Å; T289-M316 HydrophobicContact CG2-CB 4.42Å; T289-M316 HydrophobicContact CG2-SD 4.18Å; T289-I317 WeakPolarHBondContact CA-O 3.44Å; T289-T318 HydrophobicContact CG2-CG2 3.97Å
290	V	92	Very high	72.7	Confident	0 Å²	0	53 Å²	53	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.8	169.7	-163.3	0	0	0	0	109	P159 F161 A186 L198 I199 Y200 M316 I317	P159-V290 HydrophobicContact CB-CG1 4.43Å; F161-V290 HydrophobicContact CE1-CG2 3.89Å; A186-V290 HydrophobicContact CB-CG1 4.11Å; A186-V290 HydrophobicContact CB-CG2 4.28Å; L198-V290 HydrophobicContact CB-CG1 4.25Å; L198-V290 HydrophobicContact CD1-CG1 4.44Å; L198-V290 HydrophobicContact CD2-CG1 4.25Å; I199-V290 WeakPolarHBondContact O-CA 3.14Å; Y200-V290 HydrophobicContact CD1-CB 4.35Å; Y200-V290 HydrophobicContact CD1-CG1 3.99Å; Y200-V290 HydrophobicContact CD1-CG2 3.63Å; Y200-V290 HydrophobicContact CE1-CB 4.37Å; Y200-V290 HydrophobicContact CE1-CG1 3.74Å; Y200-V290 HydrophobicContact CE1-CG2 3.69Å; V290-M316 CarbonylContact O-C 3.55Å; V290-M316 WeakPolarHBondContact O-CA 3.42Å; V290-M316 VanDerWaalsContact O-CB 3.26Å; V290-M316 WeakPolarHBondContact O-CB 3.16Å; V290-I317 HydrophobicContact CB-CD1 4.36Å; V290-I317 HydrophobicContact CB-CG1 3.79Å; V290-I317 HydrophobicContact CG2-CD1 4.39Å; V290-I317 HydrophobicContact CG2-CG1 4.05Å; V290-I317 PolarHBondContact N-O 2.89Å; V290-I317 PolarHBondContact O-N 3.18Å
291	R	88.6	Confident	70.3	Confident	62 Å²	62	56.1 Å²	56.1	23%	0.234	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	146	175.9	-47.6	-160.1	-179.1	88.4	5.6	110.8	I199 T289 M316	I199-R291 PolarHBondContact N-O 3.2Å; I199-R291 PolarHBondContact O-N 3.45Å; T289-R291 HydrophobicContact CG2-CG 3.86Å; R291-M316 HydrophobicContact CB-CB 4.29Å; R291-M316 HydrophobicContact CG-CB 3.77Å; R291-M316 HydrophobicContact CG-SD 4.47Å
292	T	84.4	Confident	67.8	Low	13 Å²	13	57.3 Å²	57.3	8%	0.08	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	144.8	166.8	51.5	0	0	0	0	111.5	M188 N197 L198 P314 P315	M188-T292 HydrophobicContact CE-CG2 3.95Å; M188-T292 HydrophobicContact SD-CG2 3.92Å; N197-T292 CarbonylContact O-C 3.59Å; N197-T292 WeakPolarHBondContact O-CA 3.19Å; L198-T292 HydrophobicContact CD2-CG2 3.98Å; T292-P314 WeakPolarHBondContact O-CB 3.48Å; T292-P315 HydrophobicContact CG2-CG 4.46Å; T292-P315 PolarHBondContact N-O 2.84Å; T292-P315 WeakPolarHBondContact OG1-CD 3.42Å; T292-P315 WeakPolarHBondContact OG1-CG 3.33Å; T292-P315 PolarHBondContact OG1-O 2.74Å
293	R	78.4	Confident	65.1	Low	129 Å²	129	60.2 Å²	60.2	49%	0.487	44%	0.437	S	S	.	.			trans	-65.4	133.8	161.2	-67.1	178.6	-170.4	-176.7	6.8	109.1	D196 N197 I199 T295	D196-R293 PolarHBondContact O-NE 3.16Å; D196-R293 PolarHBondContact O-NH1 3.13Å; N197-R293 PolarHBondContact O-N 3.15Å; I199-R293 HydrophobicContact CD1-CG 3.66Å; I199-R293 HydrophobicContact CG1-CG 3.98Å; R293-T295 PolarHBondContact O-N 3.3Å
294	I	64.3	Low	62.2	Low	112 Å²	112	62.9 Å²	62.9	57%	0.574	47%	0.473	S	S	*	.			trans	-71.8	101.5	169.1	-56.9	175.8	0	0	0	107	T296 P314	I294-T296 HydrophobicContact CG2-CG2 4.15Å; I294-T296 PolarHBondContact O-N 3.48Å; I294-P314 HydrophobicContact CD1-CB 4.4Å; I294-P314 HydrophobicContact CD1-CG 4.4Å; I294-P314 HydrophobicContact CG1-CB 3.89Å; I294-P314 HydrophobicContact CG1-CG 4.3Å
295	T	52.1	Low	59.6	Low	87 Å²	87	67.2 Å²	67.2	53%	0.534	51%	0.507	S	S	.	.			trans	-72.8	94.7	172.8	41.6	0	0	0	0	109.3	N197 R293 S297	N197-T295 WeakPolarHBondContact OD1-CG2 3.47Å; R293-T295 PolarHBondContact O-N 3.3Å; T295-S297 PolarHBondContact O-N 3.07Å
296	T	40.6	Very low	56.8	Low	132 Å²	132	70.6 Å²	70.6	81%	0.81	53%	0.531	S	S	*	.			trans	-72.6	35.7	172.4	57.4	0	0	0	0	112.2	I294 G298	I294-T296 HydrophobicContact CG2-CG2 4.15Å; I294-T296 PolarHBondContact O-N 3.48Å; T296-G298 PolarHBondContact O-N 3.11Å
297	S	36.9	Very low	53.9	Low	97 Å²	97	79.8 Å²	79.8	68%	0.678	58%	0.577	S	S	*	*			trans	-89.1	30.3	-178.4	57.8	0	0	0	0	112.8	T295 G299	T295-S297 PolarHBondContact O-N 3.07Å; S297-G299 PolarHBondContact O-N 3.27Å
298	G	33.2	Very low	51.2	Low	88 Å²	88	84.1 Å²	84.1	91%	0.907	60%	0.601	S	S	*	*			trans	-77.5	57.8	161.7	0	0	0	0	0	110.7	T296	T296-G298 PolarHBondContact O-N 3.11Å
299	G	31.3	Very low	48.2	Very low	76 Å²	76	90.6 Å²	90.6	78%	0.784	64%	0.636	S	S	*	*			trans	-146.7	56.8	-164.5	0	0	0	0	0	113.3	S297	S297-G299 PolarHBondContact O-N 3.27Å
300	G	30.4	Very low	45.6	Very low	86 Å²	86	100.1 Å²	100.1	89%	0.887	67%	0.672	S	S	*	*	S	Bend	trans	-174.8	27.8	-174.9	0	0	0	0	0	115.9
301	G	31.9	Very low	43.4	Very low	73 Å²	73	108.4 Å²	108.4	75%	0.753	71%	0.711	S	S	*	*	S	Bend	trans	-172.4	127	179.1	0	0	0	0	0	111.6	G303	G301-G303 PolarHBondContact O-N 3.05Å
302	G	27.7	Very low	41.9	Very low	96 Å²	96	112.3 Å²	112.3	99%	0.99	73%	0.732	S	S	*	*			trans	-76.3	112.8	-175.6	0	0	0	0	0	112.7
303	G	30	Very low	41	Very low	67 Å²	67	118.3 Å²	118.3	69%	0.691	76%	0.762	S	S	*	*			trans	-172.2	123.8	172.7	0	0	0	0	0	109.6	G301 A305	G301-G303 PolarHBondContact O-N 3.05Å; G303-A305 PolarHBondContact O-N 3.11Å
304	G	27.1	Very low	40.7	Very low	91 Å²	91	113.9 Å²	113.9	94%	0.938	75%	0.75	S	S	*	*			trans	-71.3	98.5	-168	0	0	0	0	0	113.9
305	A	34.8	Very low	41.6	Very low	99 Å²	99	110.2 Å²	110.2	82%	0.818	73%	0.734	S	S	*	*			trans	-88.4	122.5	163.1	0	0	0	0	0	109.8	G303	G303-A305 PolarHBondContact O-N 3.11Å
306	T	34.7	Very low	43.3	Very low	116 Å²	116	110.3 Å²	110.3	71%	0.712	73%	0.729	S	S	*	*			trans	-70.3	143.6	-179.5	44.7	0	0	0	0	112.1	N308	T306-N308 VanDerWaalsContact C-N 3.26Å; T306-N308 PolarHBondContact O-N 3.34Å
307	M	34.3	Very low	45.8	Very low	195 Å²	195	104.5 Å²	104.5	96%	0.961	69%	0.693	S	S	*	*			trans	-71.4	76.9	173.4	-80.4	-167.3	169.6	0	0	111.8	N309	M307-N309 PolarHBondContact O-N 3.02Å
308	N	36.8	Very low	48.5	Very low	139 Å²	139	103.4 Å²	103.4	74%	0.743	68%	0.682	S	S	*	*			trans	-89.9	96.6	166.4	-78.1	5.1	0	0	0	109.3	T306 Y310	T306-N308 VanDerWaalsContact C-N 3.26Å; T306-N308 PolarHBondContact O-N 3.34Å; N308-Y310 PolarHBondContact O-N 3.22Å; N308-Y310 VanDerWaalsContact O-N 3.13Å
309	N	31.2	Very low	51.3	Low	136 Å²	136	99.9 Å²	99.9	73%	0.727	64%	0.642	S	S	*	*			trans	-70.5	101.9	-174.4	-174.2	9	0	0	0	112	M307	M307-N309 PolarHBondContact O-N 3.02Å
310	Y	36.8	Very low	54.3	Low	208 Å²	208	101.1 Å²	101.1	82%	0.816	63%	0.627	S	S	*	*			trans	-131.2	126.5	158.8	-102.7	-93	0	0	0	108.5	N308 Q312	N308-Y310 PolarHBondContact O-N 3.22Å; N308-Y310 VanDerWaalsContact O-N 3.13Å; Y310-Q312 VanDerWaalsContact C-N 3.27Å; Y310-Q312 PolarHBondContact O-N 3.07Å
311	H	45.9	Very low	57.4	Low	174 Å²	174	97.1 Å²	97.1	81%	0.806	59%	0.585	S	S	*	*			trans	-67.2	88.2	166.8	-87.3	42	0	0	0	109	I313	H311-I313 PolarHBondContact O-N 3.3Å; H311-I313 VanDerWaalsContact O-N 3.1Å
312	Q	56.5	Low	60.4	Low	144 Å²	144	100.6 Å²	100.6	67%	0.673	58%	0.576	S	S	*	*			trans	-66.1	111	170.6	-69.5	-175.7	9.4	0	0	108.4	Y310	Y310-Q312 VanDerWaalsContact C-N 3.27Å; Y310-Q312 PolarHBondContact O-N 3.07Å
313	I	65.7	Low	63.6	Low	140 Å²	140	96.2 Å²	96.2	72%	0.718	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-58.6	123.6	172.6	-60.1	172.7	0	0	0	106.7	H311	H311-I313 PolarHBondContact O-N 3.3Å; H311-I313 VanDerWaalsContact O-N 3.1Å
314	P	73.6	Confident	66.5	Low	36 Å²	36	96 Å²	96	23%	0.234	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-62.1	139.1	-177.1	23.3	-31.2	0	0	0	109.8	T292 I294 M316	T292-P314 WeakPolarHBondContact O-CB 3.48Å; I294-P314 HydrophobicContact CD1-CB 4.4Å; I294-P314 HydrophobicContact CD1-CG 4.4Å; I294-P314 HydrophobicContact CG1-CB 3.89Å; I294-P314 HydrophobicContact CG1-CG 4.3Å; P314-M316 PolarHBondContact O-N 2.8Å
315	P	82.2	Confident	69.5	Low	35 Å²	35	91.9 Å²	91.9	23%	0.227	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-58	131.6	-179	23.7	-33.1	0	0	0	110.3	A146 T292	A146-P315 HydrophobicContact CB-CB 3.83Å; T292-P315 HydrophobicContact CG2-CG 4.46Å; T292-P315 PolarHBondContact N-O 2.84Å; T292-P315 WeakPolarHBondContact OG1-CD 3.42Å; T292-P315 WeakPolarHBondContact OG1-CG 3.33Å; T292-P315 PolarHBondContact OG1-O 2.74Å
316	M	88.3	Confident	72	Confident	89 Å²	89	93.3 Å²	93.3	44%	0.438	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	153.6	-176.3	66.8	176.5	-169.4	0	0	111.2	T289 V290 R291 P314	T289-M316 HydrophobicContact CG2-CB 4.42Å; T289-M316 HydrophobicContact CG2-SD 4.18Å; V290-M316 CarbonylContact O-C 3.55Å; V290-M316 WeakPolarHBondContact O-CA 3.42Å; V290-M316 VanDerWaalsContact O-CB 3.26Å; V290-M316 WeakPolarHBondContact O-CB 3.16Å; R291-M316 HydrophobicContact CB-CB 4.29Å; R291-M316 HydrophobicContact CG-CB 3.77Å; R291-M316 HydrophobicContact CG-SD 4.47Å; P314-M316 PolarHBondContact O-N 2.8Å
317	I	92.4	Very high	74.2	Confident	9 Å²	9	89.3 Å²	89.3	5%	0.046	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	152.8	172.4	54.3	-177.1	0	0	0	109.6	A146 P159 F161 A186 T289 V290	A146-I317 HydrophobicContact CB-CG2 3.95Å; P159-I317 HydrophobicContact CB-CD1 3.88Å; P159-I317 HydrophobicContact CB-CG1 4.16Å; P159-I317 HydrophobicContact CG-CD1 4.2Å; P159-I317 HydrophobicContact CG-CG1 3.96Å; P159-I317 HydrophobicContact CG-CG2 4.34Å; F161-I317 HydrophobicContact CD1-CD1 3.59Å; F161-I317 HydrophobicContact CD1-CG1 4.39Å; F161-I317 HydrophobicContact CD2-CD1 3.91Å; F161-I317 HydrophobicContact CE1-CB 4.48Å; F161-I317 HydrophobicContact CE1-CD1 3.46Å; F161-I317 VanDerWaalsContact CE1-CD1 3.46Å; F161-I317 HydrophobicContact CE1-CG1 3.75Å; F161-I317 HydrophobicContact CE2-CB 3.89Å; F161-I317 HydrophobicContact CE2-CD1 3.81Å; F161-I317 HydrophobicContact CE2-CG1 4.02Å; F161-I317 HydrophobicContact CG-CD1 3.79Å; F161-I317 HydrophobicContact CZ-CB 3.76Å; F161-I317 HydrophobicContact CZ-CD1 3.57Å; F161-I317 HydrophobicContact CZ-CG1 3.53Å; A186-I317 HydrophobicContact CB-CD1 4.12Å; T289-I317 WeakPolarHBondContact CA-O 3.44Å; V290-I317 HydrophobicContact CB-CD1 4.36Å; V290-I317 HydrophobicContact CB-CG1 3.79Å; V290-I317 HydrophobicContact CG2-CD1 4.39Å; V290-I317 HydrophobicContact CG2-CG1 4.05Å; V290-I317 PolarHBondContact N-O 2.89Å; V290-I317 PolarHBondContact O-N 3.18Å
318	T	93.3	Very high	76.4	Confident	75 Å²	75	83.2 Å²	83.2	46%	0.46	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	136.3	-179.2	49.5	0	0	0	0	110.6	C288 T289	C288-T318 CarbonylContact O-C 3.38Å; C288-T318 VanDerWaalsContact O-CA 3.27Å; C288-T318 WeakPolarHBondContact O-CA 3.19Å; T289-T318 HydrophobicContact CG2-CG2 3.97Å
319	R	93.6	Very high	78.3	Confident	14 Å²	14	82.5 Å²	82.5	5%	0.053	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	135.1	175.6	179.7	171.5	-77.4	-170.6	-11.3	108.8	F161 T163 L170 D183 Q287 C288 F321	F161-R319 VanDerWaalsContact CB-NH2 3.27Å; F161-R319 HydrophobicContact CE1-CB 4.03Å; F161-R319 HydrophobicContact CE2-CB 4.03Å; F161-R319 HydrophobicContact CZ-CB 3.56Å; T163-R319 PolarHBondContact O-NH2 2.93Å; T163-R319 PolarHBondContact OG1-NH1 2.82Å; L170-R319 HydrophobicContact CD2-CG 4.01Å; D183-R319 WeakPolarHBondContact O-CD 3.28Å; D183-R319 PolarHBondContact O-NH1 3.27Å; Q287-R319 WeakPolarHBondContact CA-O 3.42Å; C288-R319 PolarHBondContact N-O 3.08Å; C288-R319 PolarHBondContact O-N 2.87Å; R319-F321 HydrophobicContact CB-CE2 4.44Å; R319-F321 HydrophobicContact CG-CD2 4.33Å; R319-F321 HydrophobicContact CG-CE1 4.32Å; R319-F321 HydrophobicContact CG-CE2 3.66Å; R319-F321 HydrophobicContact CG-CZ 3.67Å
320	Q	94.2	Very high	80.4	Confident	101 Å²	101	80 Å²	80	47%	0.472	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	123.9	-171.3	-178.2	179.7	-22.4	0	0	108.3	E285	E285-Q320 VanDerWaalsContact CD-CG 3.5Å; E285-Q320 HydrophobicContact CG-CG 3.73Å; E285-Q320 PolarHBondContact OE1-NE2 3.26Å; E285-Q320 VanDerWaalsContact OE1-NE2 3.07Å; E285-Q320 PolarHBondContact OE2-NE2 3.48Å
321	F	95	Very high	82.3	Confident	3 Å²	3	72 Å²	72	1%	0.013	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	133.7	178.7	-55.3	-94.3	0	0	0	110	L165 L170 F182 D183 W202 E285 Y286 R319	L165-F321 HydrophobicContact CD1-CE1 3.72Å; L165-F321 HydrophobicContact CD1-CZ 4.18Å; L170-F321 HydrophobicContact CD2-CD1 4.16Å; L170-F321 HydrophobicContact CD2-CE1 4.14Å; L170-F321 CarbonylContact O-C 3.54Å; L170-F321 VanDerWaalsContact O-CA 3.25Å; L170-F321 WeakPolarHBondContact O-CA 3.43Å; F182-F321 HydrophobicContact CB-CD1 4.41Å; F182-F321 HydrophobicContact CB-CD2 4.03Å; F182-F321 HydrophobicContact CB-CE1 4.16Å; F182-F321 HydrophobicContact CB-CE2 3.78Å; F182-F321 HydrophobicContact CB-CG 4.32Å; F182-F321 HydrophobicContact CB-CZ 3.82Å; F182-F321 HydrophobicContact CD1-CB 3.67Å; F182-F321 AromaticContact CD1-CD1 3.54Å; F182-F321 HydrophobicContact CD1-CD1 3.54Å; F182-F321 AromaticContact CD1-CD2 3.99Å; F182-F321 HydrophobicContact CD1-CD2 3.99Å; F182-F321 HydrophobicContact CD1-CE1 4.06Å; F182-F321 HydrophobicContact CD1-CE2 4.47Å; F182-F321 AromaticContact CD1-CG 3.48Å; F182-F321 HydrophobicContact CD1-CG 3.48Å; F182-F321 VanDerWaalsContact CD1-CG 3.48Å; F182-F321 HydrophobicContact CD1-CZ 4.47Å; F182-F321 HydrophobicContact CE1-CB 3.65Å; F182-F321 HydrophobicContact CE1-CD1 4.25Å; F182-F321 HydrophobicContact CE1-CG 4.02Å; F182-F321 HydrophobicContact CG-CD1 4.38Å; F182-F321 HydrophobicContact CG-CD2 4.18Å; F182-F321 HydrophobicContact CG-CE2 4.42Å; F182-F321 HydrophobicContact CG-CG 4.14Å; F182-F321 HydrophobicContact CZ-CB 4.49Å; D183-F321 WeakPolarHBondContact O-CZ 3.49Å; W202-F321 HydrophobicContact CH2-CD2 4.48Å; W202-F321 AromaticContact CH2-CE2 3.78Å; W202-F321 HydrophobicContact CH2-CE2 3.78Å; W202-F321 HydrophobicContact CH2-CZ 4.5Å; W202-F321 HydrophobicContact CZ3-CD2 4.04Å; W202-F321 AromaticContact CZ3-CE2 3.78Å; W202-F321 HydrophobicContact CZ3-CE2 3.78Å; E285-F321 CarbonylContact C-O 3.56Å; E285-F321 VanDerWaalsContact CA-O 3.32Å; E285-F321 WeakPolarHBondContact CA-O 3.27Å; Y286-F321 PolarHBondContact N-O 3.22Å; Y286-F321 PolarHBondContact O-N 3.12Å; R319-F321 HydrophobicContact CB-CE2 4.44Å; R319-F321 HydrophobicContact CG-CD2 4.33Å; R319-F321 HydrophobicContact CG-CE1 4.32Å; R319-F321 HydrophobicContact CG-CE2 3.66Å; R319-F321 HydrophobicContact CG-CZ 3.67Å
322	R	95	Very high	83.9	Confident	146 Å²	146	66.9 Å²	66.9	55%	0.551	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.8	94.7	178.5	-174.6	176.4	177.5	161.8	0.3	110.1	L170 N171 P172	L170-R322 PolarHBondContact O-N 3Å; N171-R322 CarbonylContact C-O 3.58Å; N171-R322 WeakPolarHBondContact CA-O 3.39Å; N171-R322 WeakPolarHBondContact OD1-CB 3.46Å; P172-R322 WeakPolarHBondContact CD-O 3.44Å
323	L	93.9	Very high	85.2	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.016	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	127.7	-177.8	178.7	57.7	0	0	0	111	P172 K174 I180 F182 L278 H282 G284 Y286 V325	P172-L323 HydrophobicContact CG-CD1 4.25Å; K174-L323 HydrophobicContact CB-CD1 4.36Å; K174-L323 HydrophobicContact CG-CD1 4.19Å; I180-L323 HydrophobicContact CD1-CD1 3.93Å; I180-L323 HydrophobicContact CG2-CD2 4.47Å; F182-L323 HydrophobicContact CZ-CB 4.06Å; F182-L323 HydrophobicContact CZ-CD2 4.04Å; F182-L323 HydrophobicContact CZ-CG 4.48Å; L278-L323 HydrophobicContact CD1-CD1 4.37Å; L278-L323 HydrophobicContact CD1-CD2 4.37Å; L278-L323 HydrophobicContact CD2-CD2 3.77Å; H282-L323 HydrophobicContact CB-CD2 4.26Å; G284-L323 PolarHBondContact N-O 3.12Å; G284-L323 PolarHBondContact O-N 3.04Å; Y286-L323 HydrophobicContact CD2-CB 4.24Å; Y286-L323 HydrophobicContact CE2-CB 3.96Å; Y286-L323 HydrophobicContact CE2-CD2 4.02Å; L323-V325 HydrophobicContact CD1-CG2 4.27Å; L323-V325 HydrophobicContact CD2-CG2 3.97Å; L323-V325 HydrophobicContact CG-CG2 3.89Å
324	T	91.8	Very high	86.2	Confident	62 Å²	62	53.5 Å²	53.5	38%	0.38	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	109.8	169.4	-54.7	0	0	0	0	109.8	P172 T173 K174 N283	P172-T324 PolarHBondContact O-N 3Å; T173-T324 CarbonylContact C-O 3.59Å; T173-T324 VanDerWaalsContact CA-O 3.3Å; T173-T324 WeakPolarHBondContact CA-O 3.36Å; T173-T324 HydrophobicContact CG2-CG2 4.32Å; K174-T324 PolarHBondContact N-O 2.8Å; N283-T324 WeakPolarHBondContact OD1-CA 3.38Å
325	V	89.5	Confident	86.8	Confident	6 Å²	6	55.1 Å²	55.1	4%	0.036	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	119.7	174.1	-171.2	0	0	0	0	108.8	K174 L278 L280 H282 N283 L323	K174-V325 WeakPolarHBondContact O-CA 3.43Å; L278-V325 HydrophobicContact CB-CG1 4.07Å; L278-V325 HydrophobicContact CB-CG2 4.13Å; L278-V325 HydrophobicContact CD1-CG2 4.39Å; L278-V325 HydrophobicContact CD2-CG2 4.45Å; L280-V325 HydrophobicContact CD2-CB 4.47Å; L280-V325 HydrophobicContact CD2-CG1 4.48Å; L280-V325 VanDerWaalsContact CD2-O 3.24Å; L280-V325 WeakPolarHBondContact CD2-O 3.4Å; H282-V325 HydrophobicContact CB-CG2 4.3Å; N283-V325 PolarHBondContact ND2-O 2.93Å; N283-V325 PolarHBondContact OD1-N 2.99Å; L323-V325 HydrophobicContact CD1-CG2 4.27Å; L323-V325 HydrophobicContact CD2-CG2 3.97Å; L323-V325 HydrophobicContact CG-CG2 3.89Å
326	K	87	Confident	87	Confident	128 Å²	128	56 Å²	56	56%	0.557	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	139	173.8	-64.5	176.2	175.2	179	0	110.5	T173 K174 W176	T173-K326 HydrophobicContact CG2-CD 4.33Å; T173-K326 HydrophobicContact CG2-CG 4.11Å; K174-K326 PolarHBondContact O-N 3.37Å; W176-K326 WeakPolarHBondContact CB-O 3.45Å; W176-K326 PolarHBondContact N-O 3.19Å
327	S	81.9	Confident	87.1	Confident	32 Å²	32	55.6 Å²	55.6	22%	0.224	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-61.7	156	175.7	56.9	0	0	0	0	112.9	T329 A494	S327-T329 PolarHBondContact O-N 2.94Å; S327-A494 WeakPolarHBondContact OG-CB 3.03Å
328	R	80.2	Confident	87	Confident	67 Å²	67	58.2 Å²	58.2	25%	0.253	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-63.7	131.7	178.7	-167.4	174.9	178.7	-180	-4.2	112	W176 D330 E360 H361 R496	W176-R328 HydrophobicContact CB-CB 4.37Å; W176-R328 HydrophobicContact CD2-CB 4.48Å; W176-R328 HydrophobicContact CG-CB 4.2Å; R328-D330 WeakPolarHBondContact CG-OD1 3.32Å; R328-D330 IonicContact CZ-OD1 3.4Å; R328-D330 IonicContact CZ-OD2 3.6Å; R328-D330 VanDerWaalsContact NE-CG 3.31Å; R328-D330 IonicContact NE-OD1 3.71Å; R328-D330 PolarHBondContact NE-OD1 3.25Å; R328-D330 IonicContact NE-OD2 3.7Å; R328-D330 PolarHBondContact NE-OD2 2.62Å; R328-D330 VanDerWaalsContact NE-OD2 3.16Å; R328-D330 IonicContact NH2-OD1 3.24Å; R328-D330 IonicContact NH2-OD2 3.78Å; R328-D330 PolarHBondContact NH2-OD2 3.35Å; R328-E360 WeakPolarHBondContact CD-OE1 3.41Å; R328-E360 IonicContact CZ-OE1 2.74Å; R328-E360 IonicContact NE-OE1 3.3Å; R328-E360 IonicContact NH1-OE1 2.67Å; R328-E360 PolarHBondContact NH1-OE1 3.08Å; R328-H361 PolarHBondContact O-CE1 2.93Å; R328-R496 PolarHBondContact O-NH1 3.43Å
329	T	76.7	Confident	86.9	Confident	124 Å²	124	60.1 Å²	60.1	76%	0.761	33%	0.331	S	S	*	.	S	Bend	trans	-91.1	-20.6	-177.3	47.9	0	0	0	0	113.9	S327 R496	S327-T329 PolarHBondContact O-N 2.94Å; T329-R496 VanDerWaalsContact C-NH1 3.3Å; T329-R496 PolarHBondContact O-NH1 2.84Å
330	D	75.5	Confident	86.9	Confident	84 Å²	84	61 Å²	61	45%	0.449	34%	0.336	S	S	.	.	S	Bend	trans	-105.5	-173.5	173.8	67.8	-54.7	0	0	0	111.2	R328 R496	R328-D330 WeakPolarHBondContact CG-OD1 3.32Å; R328-D330 IonicContact CZ-OD1 3.4Å; R328-D330 IonicContact CZ-OD2 3.6Å; R328-D330 VanDerWaalsContact NE-CG 3.31Å; R328-D330 IonicContact NE-OD1 3.71Å; R328-D330 PolarHBondContact NE-OD1 3.25Å; R328-D330 IonicContact NE-OD2 3.7Å; R328-D330 PolarHBondContact NE-OD2 2.62Å; R328-D330 VanDerWaalsContact NE-OD2 3.16Å; R328-D330 IonicContact NH2-OD1 3.24Å; R328-D330 IonicContact NH2-OD2 3.78Å; R328-D330 PolarHBondContact NH2-OD2 3.35Å; D330-R496 PolarHBondContact O-NH1 2.93Å
331	G	76.2	Confident	86.8	Confident	39 Å²	39	62 Å²	62	40%	0.402	35%	0.345	S	S	.	.	S	Bend	trans	77.9	163.8	179.5	0	0	0	0	0	115.2	R496	G331-R496 PolarHBondContact O-NH2 3.21Å
332	S	80.4	Confident	86.7	Confident	68 Å²	68	66.3 Å²	66.3	48%	0.476	37%	0.365	S	S	.	.			trans	-75.3	140.3	167.5	47.5	0	0	0	0	110.3	H338	S332-H338 VanDerWaalsContact CB-NE2 3.28Å; S332-H338 WeakPolarHBondContact CB-NE2 3.46Å
333	I	84	Confident	86.5	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.005	37%	0.369	C	S	.	.	S	Bend	trans	-87.7	-38.6	177.6	-55.8	174.9	0	0	0	109.6	V356 H361 V490 T492 R496 D498	I333-V356 HydrophobicContact CG2-CG1 3.67Å; I333-V356 HydrophobicContact CG2-CG2 4.23Å; I333-V356 WeakPolarHBondContact O-CA 3.17Å; I333-V356 WeakPolarHBondContact O-CG1 3.12Å; I333-H361 HydrophobicContact CG2-CB 4.1Å; I333-V490 HydrophobicContact CG2-CG1 3.83Å; I333-T492 HydrophobicContact CD1-CG2 3.77Å; I333-T492 HydrophobicContact CG1-CG2 4.49Å; I333-T492 HydrophobicContact CG2-CG2 3.75Å; I333-R496 HydrophobicContact CD1-CB 3.65Å; I333-D498 WeakPolarHBondContact CA-OD2 3.47Å; I333-D498 HydrophobicContact CB-CB 3.77Å; I333-D498 WeakPolarHBondContact CB-OD2 3.13Å; I333-D498 HydrophobicContact CD1-CB 3.97Å; I333-D498 HydrophobicContact CG1-CB 4.11Å; I333-D498 PolarHBondContact N-OD2 2.7Å
334	I	86.5	Confident	86.4	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.01	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-85	134.9	179.1	-56.9	169.8	0	0	0	110.5	Q355 V490 D498 K500	I334-Q355 WeakPolarHBondContact CA-O 3.47Å; I334-V490 HydrophobicContact CD1-CB 4.32Å; I334-V490 HydrophobicContact CD1-CG2 3.81Å; I334-V490 HydrophobicContact CG1-CB 4.15Å; I334-V490 HydrophobicContact CG1-CG2 3.59Å; I334-D498 HydrophobicContact CD1-CB 4.1Å; I334-D498 HydrophobicContact CG1-CB 4.11Å; I334-D498 PolarHBondContact N-OD2 3.5Å; I334-K500 HydrophobicContact CD1-CB 3.75Å; I334-K500 HydrophobicContact CG2-CB 3.97Å; I334-K500 HydrophobicContact CG2-CD 3.51Å; I334-K500 HydrophobicContact CG2-CG 4.41Å
335	E	86.1	Confident	86.3	Confident	69 Å²	69	67.9 Å²	67.9	32%	0.322	38%	0.382	S	S	.	.			trans	-78.9	140.3	178.2	-64.7	-177.9	175.7	0	0	113.1	Q355 N357 K500	E335-Q355 HydrophobicContact CB-CB 4.48Å; E335-Q355 PolarHBondContact N-O 3.36Å; E335-Q355 VanDerWaalsContact OE2-CD 3.31Å; E335-Q355 WeakPolarHBondContact OE2-CG 3.47Å; E335-Q355 PolarHBondContact OE2-NE2 3.21Å; E335-N357 HydrophobicContact CG-CB 4.4Å; E335-N357 WeakPolarHBondContact OE1-CA 3.26Å; E335-N357 WeakPolarHBondContact OE1-CB 3.4Å; E335-N357 PolarHBondContact OE1-N 3.16Å; E335-K500 PolarHBondContact O-NZ 3.02Å
336	G	85.9	Confident	86.2	Confident	55 Å²	55	69.3 Å²	69.3	57%	0.567	40%	0.395	S	S	*	.	S	Bend	trans	82.2	-158.9	176.6	0	0	0	0	0	114.1	H338	G336-H338 PolarHBondContact O-N 2.55Å
337	P	89.5	Confident	86.2	Confident	80 Å²	80	65.4 Å²	65.4	52%	0.519	39%	0.391	S	S	.	.			trans	-72.1	126.7	-175.7	27.3	-33.6	0	0	0	112.2	I339 I340 K500	P337-I339 PolarHBondContact O-N 3.39Å; P337-I340 HydrophobicContact CB-CG1 4.43Å; P337-I340 HydrophobicContact CG-CD1 4.16Å; P337-I340 HydrophobicContact CG-CG1 3.9Å; P337-K500 WeakPolarHBondContact O-CE 3.3Å
338	H	91	Very high	86.5	Confident	63 Å²	63	68.2 Å²	68.2	29%	0.292	40%	0.4	S	S	.	.	S	Bend	trans	-70	-13.4	175.1	-71.4	-104	0	0	0	114.2	S332 G336 D498 H499 K500 F501	S332-H338 VanDerWaalsContact CB-NE2 3.28Å; S332-H338 WeakPolarHBondContact CB-NE2 3.46Å; G336-H338 PolarHBondContact O-N 2.55Å; H338-D498 IonicContact CE1-OD1 2.84Å; H338-D498 PolarHBondContact CE1-OD1 2.98Å; H338-D498 IonicContact CE1-OD2 3.24Å; H338-D498 PolarHBondContact CE1-OD2 3.39Å; H338-D498 IonicContact ND1-OD1 3Å; H338-D498 PolarHBondContact ND1-OD1 3.38Å; H338-H499 PolarHBondContact ND1-O 3.32Å; H338-K500 CarbonylContact O-C 3.49Å; H338-K500 WeakPolarHBondContact O-CA 3.44Å; H338-F501 PolarHBondContact O-N 3.44Å
339	I	91.4	Very high	86.9	Confident	115 Å²	115	68 Å²	68	59%	0.59	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.2	121.8	176.6	-56.3	178.2	0	0	0	108.1	P337 F501	P337-I339 PolarHBondContact O-N 3.39Å; I339-F501 WeakPolarHBondContact CA-O 3.29Å; I339-F501 HydrophobicContact CG1-CD2 4.5Å
340	I	92.6	Very high	87.5	Confident	33 Å²	33	62.9 Å²	62.9	17%	0.169	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	131.2	177.5	-64.6	175.6	0	0	0	107.7	P337 E342 F501 V502 Q503	P337-I340 HydrophobicContact CB-CG1 4.43Å; P337-I340 HydrophobicContact CG-CD1 4.16Å; P337-I340 HydrophobicContact CG-CG1 3.9Å; I340-E342 HydrophobicContact CG2-CB 4.44Å; I340-E342 HydrophobicContact CG2-CG 3.45Å; I340-E342 VanDerWaalsContact CG2-CG 3.45Å; I340-F501 PolarHBondContact N-O 3.22Å; I340-V502 HydrophobicContact CB-CG1 4.33Å; I340-V502 HydrophobicContact CB-CG2 4.35Å; I340-V502 HydrophobicContact CG2-CG1 4.14Å; I340-V502 CarbonylContact O-C 3.53Å; I340-V502 WeakPolarHBondContact O-CA 3.34Å; I340-Q503 PolarHBondContact O-N 2.59Å
341	N	93.7	Very high	88.3	Confident	122 Å²	122	61.8 Å²	61.8	65%	0.652	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	113.3	176.9	-64.4	-32	0	0	0	108.2	Q503	N341-Q503 WeakPolarHBondContact OD1-CB 3.04Å
342	E	91.6	Very high	89.1	Confident	94 Å²	94	60.8 Å²	60.8	44%	0.439	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	144.8	-167.1	-78.3	-74.8	-170.9	0	0	112.9	I340 F352 Q503 S505	I340-E342 HydrophobicContact CG2-CB 4.44Å; I340-E342 HydrophobicContact CG2-CG 3.45Å; I340-E342 VanDerWaalsContact CG2-CG 3.45Å; E342-F352 HydrophobicContact CB-CE1 3.88Å; E342-F352 HydrophobicContact CB-CZ 4.32Å; E342-F352 HydrophobicContact CG-CE1 3.91Å; E342-Q503 PolarHBondContact N-O 3.19Å; E342-S505 PolarHBondContact O-N 3Å
343	T	91.8	Very high	89.6	Confident	103 Å²	103	62.2 Å²	62.2	63%	0.632	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	117.7	-177.7	54.2	0	0	0	0	110.5	S505	T343-S505 WeakPolarHBondContact CA-O 3.35Å
344	V	90.7	Very high	90	Very high	13 Å²	13	62.1 Å²	62.1	8%	0.079	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	131.2	-175.3	-175.4	0	0	0	0	109.1	Q348 A350 F352 A478 I504 S505 V506 V507	V344-Q348 HydrophobicContact CG1-CB 4.06Å; V344-A350 HydrophobicContact CG1-CB 4.05Å; V344-A350 HydrophobicContact CG2-CB 3.89Å; V344-F352 HydrophobicContact CG2-CZ 4.38Å; V344-A478 HydrophobicContact CB-CB 4.46Å; V344-A478 HydrophobicContact CG1-CB 3.69Å; V344-I504 HydrophobicContact CG2-CG2 4.12Å; V344-S505 PolarHBondContact N-O 3.16Å; V344-S505 VanDerWaalsContact N-O 3.1Å; V344-V506 CarbonylContact O-C 3.56Å; V344-V506 VanDerWaalsContact O-CA 3.26Å; V344-V506 WeakPolarHBondContact O-CA 3.34Å; V344-V507 PolarHBondContact O-N 3.29Å
345	E	90.2	Very high	90.2	Very high	127 Å²	127	65.6 Å²	65.6	59%	0.593	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	141.2	173.5	-63.8	-168.6	151	0	0	110.9	G347 Q348 V507	E345-G347 PolarHBondContact O-N 2.8Å; E345-Q348 HydrophobicContact CB-CG 3.86Å; E345-Q348 WeakPolarHBondContact O-CB 3.49Å; E345-Q348 WeakPolarHBondContact O-CG 3.24Å; E345-Q348 PolarHBondContact O-N 2.81Å; E345-V507 CarbonylContact C-O 3.49Å; E345-V507 WeakPolarHBondContact CA-O 3.41Å; E345-V507 HydrophobicContact CG-CG2 4.28Å
346	A	88	Confident	90.2	Very high	37 Å²	37	62.3 Å²	62.3	31%	0.306	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	129.7	-176.4	0	0	0	0	0	111.3	A478 V506 V507	A346-A478 CarbonylContact C-O 3.53Å; A346-A478 WeakPolarHBondContact CA-O 3.31Å; A346-V506 HydrophobicContact CB-CG1 3.95Å; A346-V507 PolarHBondContact N-O 2.77Å
347	G	86.3	Confident	89.9	Confident	45 Å²	45	61.2 Å²	61.2	46%	0.464	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	-4.1	-174.1	0	0	0	0	0	115.6	E345 A478	E345-G347 PolarHBondContact O-N 2.8Å; G347-A478 PolarHBondContact N-O 2.98Å
348	Q	87.8	Confident	89.1	Confident	91 Å²	91	60.4 Å²	60.4	43%	0.425	33%	0.328	S	S	.	.			trans	-77.9	154.7	167.5	-63.4	-66.1	-12.7	0	0	111.6	V344 E345 A478	V344-Q348 HydrophobicContact CG1-CB 4.06Å; E345-Q348 HydrophobicContact CB-CG 3.86Å; E345-Q348 WeakPolarHBondContact O-CB 3.49Å; E345-Q348 WeakPolarHBondContact O-CG 3.24Å; E345-Q348 PolarHBondContact O-N 2.81Å; Q348-A478 WeakPolarHBondContact O-CB 3.34Å; Q348-A478 PolarHBondContact O-N 2.83Å
349	D	88.7	Confident	88.1	Confident	64 Å²	64	61.9 Å²	61.9	34%	0.342	34%	0.335	S	S	.	.			trans	-92.1	142.7	166.6	-75.1	17.2	0	0	0	108.7	L475 R476 Q477	D349-L475 CarbonylContact C-O 3.58Å; D349-L475 VanDerWaalsContact CA-O 3.26Å; D349-L475 WeakPolarHBondContact CA-O 3.25Å; D349-R476 WeakPolarHBondContact OD1-CA 3.44Å; D349-R476 IonicContact OD2-CZ 3.67Å; D349-R476 IonicContact OD2-NE 3.03Å; D349-R476 PolarHBondContact OD2-NE 3.22Å; D349-R476 IonicContact OD2-NH2 3.36Å; D349-R476 PolarHBondContact OD2-NH2 3.23Å; D349-Q477 PolarHBondContact OD1-N 2.84Å
350	A	90.5	Very high	87.2	Confident	15 Å²	15	58 Å²	58	12%	0.124	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	145.4	-179.1	0	0	0	0	0	111.8	V344 F352 V474 L475	V344-A350 HydrophobicContact CG1-CB 4.05Å; V344-A350 HydrophobicContact CG2-CB 3.89Å; A350-F352 HydrophobicContact CB-CE2 3.99Å; A350-F352 HydrophobicContact CB-CZ 4.04Å; A350-V474 WeakPolarHBondContact O-CA 3.48Å; A350-L475 HydrophobicContact CB-CB 4.41Å; A350-L475 PolarHBondContact N-O 3.12Å; A350-L475 PolarHBondContact O-N 3.21Å
351	I	91.4	Very high	86.2	Confident	61 Å²	61	56.5 Å²	56.5	31%	0.313	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	130.6	-175	-54.3	-179.8	0	0	0	110.3	Q472 L473 V474	I351-Q472 HydrophobicContact CG2-CB 4.04Å; I351-L473 CarbonylContact C-O 3.5Å; I351-L473 WeakPolarHBondContact CA-O 3.48Å; I351-V474 HydrophobicContact CG1-CG1 4.43Å; I351-V474 HydrophobicContact CG1-CG2 4.38Å; I351-V474 HydrophobicContact CG2-CG2 4.45Å
352	F	92.9	Very high	85.2	Confident	18 Å²	18	55.6 Å²	55.6	8%	0.079	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131.1	177.6	-50.2	-82.5	0	0	0	110.9	E342 V344 A350 W368 Q472 L473 L475 V502 I504	E342-F352 HydrophobicContact CB-CE1 3.88Å; E342-F352 HydrophobicContact CB-CZ 4.32Å; E342-F352 HydrophobicContact CG-CE1 3.91Å; V344-F352 HydrophobicContact CG2-CZ 4.38Å; A350-F352 HydrophobicContact CB-CE2 3.99Å; A350-F352 HydrophobicContact CB-CZ 4.04Å; F352-W368 HydrophobicContact CB-CH2 4.17Å; F352-W368 WeakPolarHBondContact O-CZ2 3.44Å; F352-Q472 CarbonylContact O-C 3.56Å; F352-Q472 WeakPolarHBondContact O-CA 3.44Å; F352-L473 HydrophobicContact CB-CB 4.29Å; F352-L473 HydrophobicContact CD2-CB 4.43Å; F352-L473 HydrophobicContact CD2-CD2 4.02Å; F352-L473 HydrophobicContact CD2-CG 4.14Å; F352-L473 PolarHBondContact N-O 2.67Å; F352-L473 PolarHBondContact O-N 2.91Å; F352-L475 HydrophobicContact CE2-CD1 4.24Å; F352-V502 HydrophobicContact CB-CG2 4.29Å; F352-V502 HydrophobicContact CD1-CG1 3.71Å; F352-V502 HydrophobicContact CD2-CG1 4.29Å; F352-V502 HydrophobicContact CE1-CG1 3.97Å; F352-V502 HydrophobicContact CG-CG1 3.89Å; F352-V502 HydrophobicContact CZ-CG1 4.36Å; F352-I504 HydrophobicContact CD2-CD1 4.02Å; F352-I504 HydrophobicContact CE2-CD1 3.41Å; F352-I504 VanDerWaalsContact CE2-CD1 3.41Å; F352-I504 HydrophobicContact CE2-CG1 4.16Å; F352-I504 HydrophobicContact CZ-CD1 3.94Å; F352-I504 HydrophobicContact CZ-CG1 4.19Å
353	H	91.9	Very high	84	Confident	98 Å²	98	52.2 Å²	52.2	45%	0.454	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.9	-171.9	-63.9	-97.3	0	0	0	112.7	Q472 K500	H353-Q472 PolarHBondContact CE1-NE2 3.16Å; H353-K500 WeakPolarHBondContact O-CE 3.24Å; H353-K500 PolarHBondContact O-NZ 3.25Å
354	C	92.3	Very high	82.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	119.8	165.6	-168	0	0	0	0	108.2	W368 S470 S471 C488	C354-W368 HydrophobicContact CB-CH2 4.04Å; C354-W368 HydrophobicContact CB-CZ2 3.43Å; C354-W368 VanDerWaalsContact CB-CZ2 3.43Å; C354-S470 CarbonylContact O-C 3.55Å; C354-S470 VanDerWaalsContact O-CA 3.31Å; C354-S470 WeakPolarHBondContact O-CA 3.48Å; C354-S471 PolarHBondContact N-O 3Å; C354-S471 PolarHBondContact O-N 2.84Å; C354-C488 HydrophobicContact CB-CB 3.6Å; C354-C488 WeakPolarHBondContact CB-SG 3.43Å; C354-C488 WeakPolarHBondContact SG-CB 3.48Å; C354-C488 CovalentContact SG-SG 2.03Å; C354-C488 PolarHBondContact SG-SG 2.6Å
355	Q	89.6	Confident	82.7	Confident	74 Å²	74	52.7 Å²	52.7	35%	0.346	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	147.2	-174.8	-179.9	167.1	-51.8	0	0	108.1	I334 E335	I334-Q355 WeakPolarHBondContact CA-O 3.47Å; E335-Q355 HydrophobicContact CB-CB 4.48Å; E335-Q355 PolarHBondContact N-O 3.36Å; E335-Q355 VanDerWaalsContact OE2-CD 3.31Å; E335-Q355 WeakPolarHBondContact OE2-CG 3.47Å; E335-Q355 PolarHBondContact OE2-NE2 3.21Å
356	V	86.8	Confident	82.7	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-124.7	135.7	-178.9	172.7	0	0	0	0	108.6	I333 P358 H361 S363 I366 Q469 V490	I333-V356 HydrophobicContact CG2-CG1 3.67Å; I333-V356 HydrophobicContact CG2-CG2 4.23Å; I333-V356 WeakPolarHBondContact O-CA 3.17Å; I333-V356 WeakPolarHBondContact O-CG1 3.12Å; V356-P358 WeakPolarHBondContact O-CD 3.47Å; V356-H361 HydrophobicContact CG1-CB 3.82Å; V356-S363 WeakPolarHBondContact CG1-OG 2.97Å; V356-S363 WeakPolarHBondContact CG2-OG 3.46Å; V356-I366 HydrophobicContact CG2-CD1 3.87Å; V356-Q469 HydrophobicContact CB-CB 4.19Å; V356-Q469 PolarHBondContact N-O 2.79Å; V356-Q469 VanDerWaalsContact N-O 3.11Å; V356-V490 HydrophobicContact CG2-CB 4.33Å; V356-V490 HydrophobicContact CG2-CG1 3.76Å; V356-V490 HydrophobicContact CG2-CG2 3.68Å
357	N	79	Confident	82.9	Confident	33 Å²	33	49.1 Å²	49.1	18%	0.176	26%	0.26	C	S	.	.			trans	-66.5	112.5	179.6	-177.1	-6.1	0	0	0	110.5	E335 E359 E360 H361	E335-N357 HydrophobicContact CG-CB 4.4Å; E335-N357 WeakPolarHBondContact OE1-CA 3.26Å; E335-N357 WeakPolarHBondContact OE1-CB 3.4Å; E335-N357 PolarHBondContact OE1-N 3.16Å; N357-E359 PolarHBondContact O-N 3.21Å; N357-E359 WeakPolarHBondContact OD1-CB 3.25Å; N357-E359 PolarHBondContact OD1-N 3.18Å; N357-E360 HydrophobicContact CB-CB 4.4Å; N357-E360 WeakPolarHBondContact ND2-CG 3.5Å; N357-E360 PolarHBondContact ND2-OE2 3.48Å; N357-E360 PolarHBondContact O-N 3.14Å; N357-H361 PolarHBondContact O-N 3.28Å
358	P	73.9	Confident	83.3	Confident	63 Å²	63	47 Å²	47	41%	0.409	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-15.6	-176.3	32.1	-36.8	0	0	0	114	V356 H361	V356-P358 WeakPolarHBondContact O-CD 3.47Å; P358-H361 WeakPolarHBondContact CA-O 3.27Å
359	E	69.4	Low	83.6	Confident	93 Å²	93	42.7 Å²	42.7	44%	0.435	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-29.3	178.7	-57.5	-176.2	172.3	0	0	112.3	T279 L280 N357	T279-E359 HydrophobicContact CG2-CB 4.41Å; L280-E359 WeakPolarHBondContact CB-O 3.48Å; L280-E359 PolarHBondContact N-O 3.39Å; N357-E359 PolarHBondContact O-N 3.21Å; N357-E359 WeakPolarHBondContact OD1-CB 3.25Å; N357-E359 PolarHBondContact OD1-N 3.18Å
360	E	71.7	Confident	83.9	Confident	33 Å²	33	41.1 Å²	41.1	15%	0.154	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-32.6	-179.3	-67.5	-175.7	108.1	0	0	112.8	W176 L280 R328 N357	W176-E360 HydrophobicContact CZ2-CG 4.14Å; L280-E360 VanDerWaalsContact CD1-O 3.24Å; L280-E360 WeakPolarHBondContact CD1-O 3.48Å; R328-E360 WeakPolarHBondContact CD-OE1 3.41Å; R328-E360 IonicContact CZ-OE1 2.74Å; R328-E360 IonicContact NE-OE1 3.3Å; R328-E360 IonicContact NH1-OE1 2.67Å; R328-E360 PolarHBondContact NH1-OE1 3.08Å; N357-E360 HydrophobicContact CB-CB 4.4Å; N357-E360 WeakPolarHBondContact ND2-CG 3.5Å; N357-E360 PolarHBondContact ND2-OE2 3.48Å; N357-E360 PolarHBondContact O-N 3.14Å
361	H	72.8	Confident	84	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.009	22%	0.217	C	C	.	.			trans	-136.6	142.8	-173.5	-59.8	-60.4	0	0	0	113.4	R328 I333 V356 N357 P358 Q469 T492	R328-H361 PolarHBondContact O-CE1 2.93Å; I333-H361 HydrophobicContact CG2-CB 4.1Å; V356-H361 HydrophobicContact CG1-CB 3.82Å; N357-H361 PolarHBondContact O-N 3.28Å; P358-H361 WeakPolarHBondContact CA-O 3.27Å; H361-Q469 PolarHBondContact O-NE2 3.05Å; H361-Q469 PolarHBondContact O-OE1 3.11Å; H361-T492 HydrophobicContact CB-CG2 4.1Å
362	R	73.1	Confident	84	Confident	103 Å²	103	40.2 Å²	40.2	39%	0.389	21%	0.205	S	C	.	.			trans	-105.1	106.2	161.6	-70	177.1	-176.2	-149.4	1.2	107.8	L280 T492 E493	L280-R362 HydrophobicContact CD1-CG 4.09Å; L280-R362 PolarHBondContact O-NH2 2.77Å; R362-T492 CarbonylContact O-C 3.59Å; R362-T492 WeakPolarHBondContact O-CA 3.4Å; R362-T492 WeakPolarHBondContact O-CB 3.43Å; R362-E493 HydrophobicContact CB-CB 4.49Å; R362-E493 HydrophobicContact CB-CG 4.03Å; R362-E493 WeakPolarHBondContact CB-OE2 3.46Å; R362-E493 WeakPolarHBondContact CD-OE2 3.4Å; R362-E493 PolarHBondContact O-N 3.36Å
363	S	66.4	Low	83.8	Confident	24 Å²	24	44.9 Å²	44.9	17%	0.168	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	127.7	169.8	-72.5	0	0	0	0	110.3	V356 Q469 V490 L491	V356-S363 WeakPolarHBondContact CG1-OG 2.97Å; V356-S363 WeakPolarHBondContact CG2-OG 3.46Å; S363-Q469 VanDerWaalsContact CB-OE1 3.23Å; S363-Q469 PolarHBondContact OG-OE1 3.12Å; S363-V490 VanDerWaalsContact OG-CG1 3.29Å; S363-V490 WeakPolarHBondContact OG-CG1 3.38Å; S363-L491 CarbonylContact C-O 3.29Å; S363-L491 WeakPolarHBondContact CA-O 3.02Å
364	S	67.8	Low	83.4	Confident	61 Å²	61	46 Å²	46	43%	0.427	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	-33.9	167.8	57.6	0	0	0	0	111	L491 T492	S364-L491 PolarHBondContact N-O 3.16Å; S364-L491 PolarHBondContact OG-O 3.07Å; S364-L491 VanDerWaalsContact OG-O 3.07Å; S364-T492 PolarHBondContact OG-O 3.46Å
365	T	86.6	Confident	83.1	Confident	64 Å²	64	53.2 Å²	53.2	39%	0.393	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	151.4	172.1	56.4	0	0	0	0	112.4	L491	T365-L491 PolarHBondContact N-O 3.04Å; T365-L491 PolarHBondContact O-N 3.07Å
366	I	90.2	Very high	82.8	Confident	11 Å²	11	53.7 Å²	53.7	6%	0.056	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	129.6	162.5	-50.2	-172.7	0	0	0	106.5	V356 V465 Q469 C488 V490	V356-I366 HydrophobicContact CG2-CD1 3.87Å; I366-V465 HydrophobicContact CB-CG2 3.83Å; I366-V465 HydrophobicContact CD1-CG1 3.99Å; I366-V465 HydrophobicContact CG1-CG1 4.16Å; I366-V465 HydrophobicContact CG1-CG2 4.31Å; I366-Q469 VanDerWaalsContact CD1-O 3.24Å; I366-Q469 WeakPolarHBondContact CD1-O 3.38Å; I366-C488 WeakPolarHBondContact CG2-SG 3.48Å; I366-V490 HydrophobicContact CB-CG2 4.45Å; I366-V490 HydrophobicContact CD1-CG2 4.33Å; I366-V490 HydrophobicContact CG1-CG2 4.04Å; I366-V490 HydrophobicContact CG2-CG2 4.03Å
367	R	92.5	Very high	82.8	Confident	78 Å²	78	57.5 Å²	57.5	29%	0.294	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	152.8	178	-69.9	-174.4	172.4	-163	-0.1	110.6	E386 W390 C488 S489	R367-E386 IonicContact CZ-OE1 3.33Å; R367-E386 IonicContact CZ-OE2 2.76Å; R367-E386 IonicContact NH1-OE1 2.79Å; R367-E386 PolarHBondContact NH1-OE1 3.42Å; R367-E386 IonicContact NH1-OE2 3.18Å; R367-E386 PolarHBondContact NH1-OE2 2.87Å; R367-E386 IonicContact NH2-OE1 2.72Å; R367-W390 HydrophobicContact CB-CH2 3.75Å; R367-W390 HydrophobicContact CB-CZ2 4.05Å; R367-C488 CarbonylContact O-C 3.56Å; R367-C488 WeakPolarHBondContact O-CA 3.46Å; R367-S489 PolarHBondContact N-O 2.77Å; R367-S489 PolarHBondContact O-N 3.39Å
368	W	94.3	Very high	83.1	Confident	2 Å²	2	62 Å²	62	1%	0.008	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	149.1	170.7	-67.7	87.4	0	0	0	111.1	F352 C354 L398 A462 S471 L473 V487 C488 V502	F352-W368 HydrophobicContact CB-CH2 4.17Å; F352-W368 WeakPolarHBondContact O-CZ2 3.44Å; C354-W368 HydrophobicContact CB-CH2 4.04Å; C354-W368 HydrophobicContact CB-CZ2 3.43Å; C354-W368 VanDerWaalsContact CB-CZ2 3.43Å; W368-L398 HydrophobicContact CB-CB 4.47Å; W368-L398 HydrophobicContact CB-CD1 4.17Å; W368-L398 PolarHBondContact O-N 2.88Å; W368-A462 HydrophobicContact CB-CB 4.06Å; W368-A462 HydrophobicContact CG-CB 4.18Å; W368-S471 PolarHBondContact NE1-OG 2.74Å; W368-L473 HydrophobicContact CD2-CB 3.76Å; W368-L473 HydrophobicContact CE3-CB 3.76Å; W368-L473 HydrophobicContact CE3-CD2 3.93Å; W368-L473 HydrophobicContact CE3-CG 4.38Å; W368-L473 HydrophobicContact CG-CB 4.44Å; W368-L473 HydrophobicContact CH2-CB 3.74Å; W368-L473 HydrophobicContact CZ2-CB 3.74Å; W368-L473 HydrophobicContact CZ3-CB 3.76Å; W368-L473 HydrophobicContact CZ3-CD2 3.87Å; W368-L473 HydrophobicContact CZ3-CG 4.46Å; W368-V487 CarbonylContact C-O 3.58Å; W368-V487 VanDerWaalsContact CA-O 3.27Å; W368-V487 WeakPolarHBondContact CA-O 3.41Å; W368-C488 HydrophobicContact CD2-CB 3.89Å; W368-C488 HydrophobicContact CE3-CB 3.77Å; W368-C488 HydrophobicContact CH2-CB 4Å; W368-C488 HydrophobicContact CZ2-CB 4.09Å; W368-C488 HydrophobicContact CZ3-CB 3.82Å; W368-V502 HydrophobicContact CH2-CG2 4.34Å; W368-V502 HydrophobicContact CZ3-CG2 3.99Å
369	G	93.9	Very high	83.7	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	162.1	169.2	0	0	0	0	0	113	V396 Y486 V487	G369-V396 CarbonylContact C-O 3.51Å; G369-V396 WeakPolarHBondContact CA-O 3.42Å; G369-Y486 CarbonylContact O-C 3.48Å; G369-Y486 VanDerWaalsContact O-CA 3.29Å; G369-Y486 WeakPolarHBondContact O-CA 3.37Å; G369-V487 PolarHBondContact N-O 3.13Å; G369-V487 PolarHBondContact O-N 3.1Å
370	K	94	Very high	84.5	Confident	31 Å²	31	59 Å²	59	14%	0.135	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	135.3	174	-172	-177.3	-174.5	170.8	0	109.8	I372 F395 V396 L398 S481 S483 Y486	K370-I372 PolarHBondContact O-N 2.76Å; K370-F395 VanDerWaalsContact C-CD1 3.44Å; K370-F395 CarbonylContact O-C 3.57Å; K370-F395 VanDerWaalsContact O-CA 3.23Å; K370-F395 WeakPolarHBondContact O-CA 3.3Å; K370-V396 HydrophobicContact CB-CG1 4.1Å; K370-V396 PolarHBondContact N-O 2.9Å; K370-V396 PolarHBondContact O-N 3.03Å; K370-L398 HydrophobicContact CB-CD2 4.38Å; K370-S481 PolarHBondContact NZ-O 2.9Å; K370-S483 WeakPolarHBondContact CE-O 3.45Å; K370-S483 PolarHBondContact NZ-O 3.11Å; K370-Y486 HydrophobicContact CB-CD1 3.94Å; K370-Y486 HydrophobicContact CB-CE1 3.77Å; K370-Y486 HydrophobicContact CD-CE1 3.89Å; K370-Y486 HydrophobicContact CD-CE2 4.33Å; K370-Y486 WeakPolarHBondContact CD-OH 3.32Å; K370-Y486 WeakPolarHBondContact CE-OH 3.44Å; K370-Y486 HydrophobicContact CG-CD1 4.13Å; K370-Y486 HydrophobicContact CG-CE1 3.76Å; K370-Y486 HydrophobicContact CG-CE2 4.19Å; K370-Y486 PolarHBondContact NZ-OH 2.85Å
371	S	93.4	Very high	85.1	Confident	44 Å²	44	60.9 Å²	60.9	31%	0.308	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	132.8	176.9	62.3	0	0	0	0	110.3	F395 R485	S371-F395 VanDerWaalsContact N-CD1 3.29Å; S371-R485 WeakPolarHBondContact CB-O 3.32Å; S371-R485 PolarHBondContact N-O 2.98Å; S371-R485 PolarHBondContact OG-N 3.4Å; S371-R485 PolarHBondContact OG-O 3.22Å; S371-R485 VanDerWaalsContact OG-O 3.08Å
372	I	91.6	Very high	85.7	Confident	12 Å²	12	65 Å²	65	6%	0.062	35%	0.35	C	S	.	.			trans	-125	148.7	174.8	61.6	173.3	0	0	0	109.9	K370 E376 R377 Y380 V387 T394 V396	K370-I372 PolarHBondContact O-N 2.76Å; I372-E376 HydrophobicContact CB-CB 4.43Å; I372-R377 HydrophobicContact CD1-CB 4.32Å; I372-Y380 HydrophobicContact CB-CD2 4.33Å; I372-Y380 HydrophobicContact CB-CE2 4.11Å; I372-Y380 HydrophobicContact CD1-CD2 3.8Å; I372-Y380 HydrophobicContact CD1-CE2 4.42Å; I372-Y380 HydrophobicContact CD1-CG 4.16Å; I372-Y380 HydrophobicContact CG2-CD2 3.95Å; I372-Y380 HydrophobicContact CG2-CE1 4.4Å; I372-Y380 HydrophobicContact CG2-CE2 3.49Å; I372-Y380 VanDerWaalsContact CG2-CE2 3.49Å; I372-V387 HydrophobicContact CD1-CG1 3.93Å; I372-V387 HydrophobicContact CD1-CG2 3.94Å; I372-T394 HydrophobicContact CD1-CG2 4.05Å; I372-T394 HydrophobicContact CG1-CG2 3.79Å; I372-T394 PolarHBondContact N-O 2.82Å; I372-V396 HydrophobicContact CD1-CB 4.43Å; I372-V396 HydrophobicContact CG2-CB 4.12Å; I372-V396 HydrophobicContact CG2-CG1 3.75Å
373	D	88.1	Confident	86.2	Confident	116 Å²	116	65.9 Å²	65.9	62%	0.62	36%	0.358	S	S	*	.			trans	-73.9	151.9	174.8	-84.1	-33.4	0	0	0	110.8	N375 E376 R377	D373-N375 PolarHBondContact O-N 2.79Å; D373-E376 HydrophobicContact CB-CG 4.23Å; D373-E376 PolarHBondContact N-OE2 2.85Å; D373-E376 VanDerWaalsContact N-OE2 3.13Å; D373-E376 WeakPolarHBondContact O-CB 3.34Å; D373-E376 PolarHBondContact O-N 3.34Å; D373-R377 PolarHBondContact O-N 2.89Å
374	N	84.3	Confident	87.1	Confident	122 Å²	122	68 Å²	68	65%	0.652	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-24.3	179.2	-75.5	-18.9	0	0	0	113.4	T394	N374-T394 PolarHBondContact OD1-OG1 2.81Å
375	N	85.3	Confident	88	Confident	151 Å²	151	70.7 Å²	70.7	81%	0.807	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-31.8	174.7	-63.6	-22.9	0	0	0	112.6	D373	D373-N375 PolarHBondContact O-N 2.79Å
376	E	84.3	Confident	88.1	Confident	84 Å²	84	71.4 Å²	71.4	39%	0.393	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-27.9	-179.1	-56.8	-176.1	124.8	0	0	112	I372 D373 L378 A379 Y380	I372-E376 HydrophobicContact CB-CB 4.43Å; D373-E376 HydrophobicContact CB-CG 4.23Å; D373-E376 PolarHBondContact N-OE2 2.85Å; D373-E376 VanDerWaalsContact N-OE2 3.13Å; D373-E376 WeakPolarHBondContact O-CB 3.34Å; D373-E376 PolarHBondContact O-N 3.34Å; E376-L378 PolarHBondContact O-N 3.25Å; E376-L378 VanDerWaalsContact O-N 3.09Å; E376-A379 WeakPolarHBondContact O-CA 3.33Å; E376-A379 WeakPolarHBondContact O-CB 3.42Å; E376-A379 PolarHBondContact O-N 3.24Å; E376-Y380 HydrophobicContact CB-CD2 3.91Å; E376-Y380 HydrophobicContact CB-CE2 3.79Å; E376-Y380 WeakPolarHBondContact O-CD2 3.5Å; E376-Y380 PolarHBondContact O-N 2.96Å; E376-Y380 VanDerWaalsContact O-N 3.17Å
377	R	86.1	Confident	88.1	Confident	80 Å²	80	72 Å²	72	30%	0.302	39%	0.388	S	S	.	.	H	α-helix	trans	-42.5	-48.3	-178.5	173.9	173.2	179.5	155.4	11.8	113.3	I372 D373 A379 Y380 E381 V387	I372-R377 HydrophobicContact CD1-CB 4.32Å; D373-R377 PolarHBondContact O-N 2.89Å; R377-A379 VanDerWaalsContact C-N 3.28Å; R377-A379 PolarHBondContact O-N 3.21Å; R377-Y380 PolarHBondContact O-N 2.76Å; R377-E381 HydrophobicContact CG-CG 4.26Å; R377-E381 WeakPolarHBondContact CG-OE2 3.45Å; R377-E381 IonicContact CZ-OE1 2.71Å; R377-E381 VanDerWaalsContact NE-CD 3.33Å; R377-E381 IonicContact NE-OE1 3.37Å; R377-E381 PolarHBondContact NE-OE1 2.78Å; R377-E381 IonicContact NE-OE2 3.94Å; R377-E381 PolarHBondContact NE-OE2 2.94Å; R377-E381 IonicContact NH2-OE1 3.35Å; R377-E381 PolarHBondContact NH2-OE1 2.82Å; R377-E381 WeakPolarHBondContact O-CB 3.3Å; R377-E381 WeakPolarHBondContact O-CG 3.38Å; R377-E381 PolarHBondContact O-N 3.31Å; R377-V387 HydrophobicContact CG-CG1 4.29Å
378	L	84.8	Confident	87.9	Confident	129 Å²	129	70.2 Å²	70.2	68%	0.675	38%	0.384	S	S	*	.	H	α-helix	trans	-64.5	-29.5	-178.6	-67.4	173.8	0	0	0	113.3	E376 A382	E376-L378 PolarHBondContact O-N 3.25Å; E376-L378 VanDerWaalsContact O-N 3.09Å; L378-A382 WeakPolarHBondContact O-CB 3.15Å; L378-A382 PolarHBondContact O-N 3.05Å; L378-A382 VanDerWaalsContact O-N 3.09Å
379	A	86.3	Confident	87.7	Confident	52 Å²	52	76.2 Å²	76.2	43%	0.43	41%	0.412	S	S	.	.	H	α-helix	trans	-74.2	-47.1	174.6	0	0	0	0	0	111.1	E376 R377 E381 A382 E383	E376-A379 WeakPolarHBondContact O-CA 3.33Å; E376-A379 WeakPolarHBondContact O-CB 3.42Å; E376-A379 PolarHBondContact O-N 3.24Å; R377-A379 VanDerWaalsContact C-N 3.28Å; R377-A379 PolarHBondContact O-N 3.21Å; A379-E381 PolarHBondContact O-N 2.97Å; A379-A382 PolarHBondContact O-N 3.46Å; A379-E383 WeakPolarHBondContact O-CG 3.44Å; A379-E383 PolarHBondContact O-N 3.33Å
380	Y	86.2	Confident	87.4	Confident	39 Å²	39	77.7 Å²	77.7	15%	0.153	42%	0.418	C	S	.	.	H	α-helix	trans	-60.7	-42.6	176.5	-76.2	-84.3	0	0	0	112.2	I372 E376 R377 E383 G384 R385 V396	I372-Y380 HydrophobicContact CB-CD2 4.33Å; I372-Y380 HydrophobicContact CB-CE2 4.11Å; I372-Y380 HydrophobicContact CD1-CD2 3.8Å; I372-Y380 HydrophobicContact CD1-CE2 4.42Å; I372-Y380 HydrophobicContact CD1-CG 4.16Å; I372-Y380 HydrophobicContact CG2-CD2 3.95Å; I372-Y380 HydrophobicContact CG2-CE1 4.4Å; I372-Y380 HydrophobicContact CG2-CE2 3.49Å; I372-Y380 VanDerWaalsContact CG2-CE2 3.49Å; E376-Y380 HydrophobicContact CB-CD2 3.91Å; E376-Y380 HydrophobicContact CB-CE2 3.79Å; E376-Y380 WeakPolarHBondContact O-CD2 3.5Å; E376-Y380 PolarHBondContact O-N 2.96Å; E376-Y380 VanDerWaalsContact O-N 3.17Å; R377-Y380 PolarHBondContact O-N 2.76Å; Y380-E383 PolarHBondContact O-N 3.01Å; Y380-G384 PolarHBondContact O-N 2.67Å; Y380-R385 HydrophobicContact CD1-CB 4.46Å; Y380-R385 VanDerWaalsContact CD1-CZ 3.44Å; Y380-R385 VanDerWaalsContact CE1-NH2 3.35Å; Y380-R385 WeakPolarHBondContact O-CB 3.33Å; Y380-R385 PolarHBondContact O-N 3.38Å; Y380-V396 HydrophobicContact CD1-CB 3.92Å; Y380-V396 HydrophobicContact CD1-CG1 4.15Å; Y380-V396 HydrophobicContact CD1-CG2 3.64Å; Y380-V396 HydrophobicContact CE1-CB 4.16Å; Y380-V396 HydrophobicContact CE1-CG1 3.85Å; Y380-V396 HydrophobicContact CE1-CG2 4.11Å; Y380-V396 HydrophobicContact CG-CB 4.42Å; Y380-V396 HydrophobicContact CG-CG2 4.38Å
381	E	86.2	Confident	86.9	Confident	74 Å²	74	79.2 Å²	79.2	35%	0.346	44%	0.436	S	S	.	.	H	α-helix	trans	-67.1	-38.4	175.7	-71.8	176.3	154.7	0	0	112.1	R377 A379 E383 G384 V387	R377-E381 HydrophobicContact CG-CG 4.26Å; R377-E381 WeakPolarHBondContact CG-OE2 3.45Å; R377-E381 IonicContact CZ-OE1 2.71Å; R377-E381 VanDerWaalsContact NE-CD 3.33Å; R377-E381 IonicContact NE-OE1 3.37Å; R377-E381 PolarHBondContact NE-OE1 2.78Å; R377-E381 IonicContact NE-OE2 3.94Å; R377-E381 PolarHBondContact NE-OE2 2.94Å; R377-E381 IonicContact NH2-OE1 3.35Å; R377-E381 PolarHBondContact NH2-OE1 2.82Å; R377-E381 WeakPolarHBondContact O-CB 3.3Å; R377-E381 WeakPolarHBondContact O-CG 3.38Å; R377-E381 PolarHBondContact O-N 3.31Å; A379-E381 PolarHBondContact O-N 2.97Å; E381-E383 VanDerWaalsContact C-N 3.34Å; E381-E383 PolarHBondContact O-N 3.4Å; E381-G384 PolarHBondContact O-N 2.95Å; E381-V387 HydrophobicContact CG-CB 4.16Å; E381-V387 HydrophobicContact CG-CG2 3.96Å
382	A	83.5	Confident	86.5	Confident	89 Å²	89	81.1 Å²	81.1	74%	0.736	46%	0.462	S	S	*	.	H	α-helix	trans	-69.9	-27.4	176.6	0	0	0	0	0	113.7	L378 A379 G384	L378-A382 WeakPolarHBondContact O-CB 3.15Å; L378-A382 PolarHBondContact O-N 3.05Å; L378-A382 VanDerWaalsContact O-N 3.09Å; A379-A382 PolarHBondContact O-N 3.46Å; A382-G384 PolarHBondContact O-N 3.16Å
383	E	85.1	Confident	86.3	Confident	120 Å²	120	81.8 Å²	81.8	56%	0.561	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-3.2	169.3	-70.3	171	169.2	0	0	113.1	A379 Y380 E381 R385	A379-E383 WeakPolarHBondContact O-CG 3.44Å; A379-E383 PolarHBondContact O-N 3.33Å; Y380-E383 PolarHBondContact O-N 3.01Å; E381-E383 VanDerWaalsContact C-N 3.34Å; E381-E383 PolarHBondContact O-N 3.4Å; E383-R385 VanDerWaalsContact C-N 3.35Å; E383-R385 HydrophobicContact CB-CG 4.27Å; E383-R385 IonicContact OE1-NH2 3.9Å; E383-R385 IonicContact OE2-CZ 3.82Å; E383-R385 IonicContact OE2-NE 2.65Å; E383-R385 PolarHBondContact OE2-NE 2.76Å; E383-R385 IonicContact OE2-NH2 3.1Å; E383-R385 PolarHBondContact OE2-NH2 2.91Å
384	G	84.3	Confident	86.5	Confident	69 Å²	69	77 Å²	77	71%	0.711	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	18.6	-177.6	0	0	0	0	0	114.4	Y380 E381 A382	Y380-G384 PolarHBondContact O-N 2.67Å; E381-G384 PolarHBondContact O-N 2.95Å; A382-G384 PolarHBondContact O-N 3.16Å
385	R	86.1	Confident	86.9	Confident	117 Å²	117	71.5 Å²	71.5	44%	0.442	42%	0.418	S	S	.	.			trans	-82.3	136	175.4	-58.8	-159.7	-101	176.9	-2.9	110.2	Y380 E383 V387 V396	Y380-R385 HydrophobicContact CD1-CB 4.46Å; Y380-R385 VanDerWaalsContact CD1-CZ 3.44Å; Y380-R385 VanDerWaalsContact CE1-NH2 3.35Å; Y380-R385 WeakPolarHBondContact O-CB 3.33Å; Y380-R385 PolarHBondContact O-N 3.38Å; E383-R385 VanDerWaalsContact C-N 3.35Å; E383-R385 HydrophobicContact CB-CG 4.27Å; E383-R385 IonicContact OE1-NH2 3.9Å; E383-R385 IonicContact OE2-CZ 3.82Å; E383-R385 IonicContact OE2-NE 2.65Å; E383-R385 PolarHBondContact OE2-NE 2.76Å; E383-R385 IonicContact OE2-NH2 3.1Å; E383-R385 PolarHBondContact OE2-NH2 2.91Å; R385-V387 PolarHBondContact O-N 3.46Å; R385-V396 HydrophobicContact CB-CG2 3.88Å
386	E	89.9	Confident	87.3	Confident	79 Å²	79	64.6 Å²	64.6	37%	0.369	38%	0.381	S	S	.	.			trans	-68.2	122.5	-179.4	-172.3	-176.1	-152.4	0	0	110.1	R367 I388 V397	R367-E386 IonicContact CZ-OE1 3.33Å; R367-E386 IonicContact CZ-OE2 2.76Å; R367-E386 IonicContact NH1-OE1 2.79Å; R367-E386 PolarHBondContact NH1-OE1 3.42Å; R367-E386 IonicContact NH1-OE2 3.18Å; R367-E386 PolarHBondContact NH1-OE2 2.87Å; R367-E386 IonicContact NH2-OE1 2.72Å; E386-I388 HydrophobicContact CG-CD1 4.14Å; E386-I388 HydrophobicContact CG-CG1 4.09Å; E386-V397 HydrophobicContact CB-CB 4.17Å; E386-V397 HydrophobicContact CB-CG2 4.11Å; E386-V397 HydrophobicContact CG-CB 4.44Å; E386-V397 HydrophobicContact CG-CG2 3.9Å; E386-V397 PolarHBondContact O-N 3.45Å; E386-V397 WeakPolarHBondContact OE2-CG2 3.19Å
387	V	89.8	Confident	87.6	Confident	23 Å²	23	61.6 Å²	61.6	14%	0.139	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	124.8	177.8	176.8	0	0	0	0	109.4	I372 R377 E381 R385 T394 F395	I372-V387 HydrophobicContact CD1-CG1 3.93Å; I372-V387 HydrophobicContact CD1-CG2 3.94Å; R377-V387 HydrophobicContact CG-CG1 4.29Å; E381-V387 HydrophobicContact CG-CB 4.16Å; E381-V387 HydrophobicContact CG-CG2 3.96Å; R385-V387 PolarHBondContact O-N 3.46Å; V387-T394 HydrophobicContact CG1-CG2 3.52Å; V387-F395 CarbonylContact C-O 3.55Å; V387-F395 WeakPolarHBondContact CA-O 3.3Å
388	I	89.4	Confident	87.9	Confident	42 Å²	42	58.9 Å²	58.9	22%	0.215	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	152.6	-175.3	-58.3	-177.4	0	0	0	109.8	E386 W390 F395 V397	E386-I388 HydrophobicContact CG-CD1 4.14Å; E386-I388 HydrophobicContact CG-CG1 4.09Å; I388-W390 HydrophobicContact CB-CD2 4.43Å; I388-W390 HydrophobicContact CB-CZ2 4.33Å; I388-W390 HydrophobicContact CD1-CH2 4.29Å; I388-W390 HydrophobicContact CD1-CZ2 3.84Å; I388-W390 HydrophobicContact CG2-CD2 4.02Å; I388-W390 HydrophobicContact CG2-CG 4.18Å; I388-W390 HydrophobicContact CG2-CZ2 4.11Å; I388-F395 PolarHBondContact N-O 3.17Å; I388-F395 PolarHBondContact O-N 2.81Å; I388-V397 HydrophobicContact CB-CG2 4.37Å; I388-V397 HydrophobicContact CD1-CG2 3.53Å; I388-V397 HydrophobicContact CG1-CG2 3.75Å
389	Q	89	Confident	88	Confident	127 Å²	127	56.3 Å²	56.3	59%	0.593	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	121.9	167.7	-70.3	-178	-28.1	0	0	110.4	G393	Q389-G393 VanDerWaalsContact CA-O 3.29Å; Q389-G393 WeakPolarHBondContact CA-O 3.42Å
390	W	88.2	Confident	88	Confident	32 Å²	32	57.3 Å²	57.3	12%	0.121	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	139.1	177.1	-72.2	-40.7	0	0	0	108.8	R367 I388 G392 G393 F395 V397 V487 S489	R367-W390 HydrophobicContact CB-CH2 3.75Å; R367-W390 HydrophobicContact CB-CZ2 4.05Å; I388-W390 HydrophobicContact CB-CD2 4.43Å; I388-W390 HydrophobicContact CB-CZ2 4.33Å; I388-W390 HydrophobicContact CD1-CH2 4.29Å; I388-W390 HydrophobicContact CD1-CZ2 3.84Å; I388-W390 HydrophobicContact CG2-CD2 4.02Å; I388-W390 HydrophobicContact CG2-CG 4.18Å; I388-W390 HydrophobicContact CG2-CZ2 4.11Å; W390-G392 PolarHBondContact O-N 3.25Å; W390-G393 PolarHBondContact N-O 3.4Å; W390-G393 PolarHBondContact O-N 3.34Å; W390-F395 HydrophobicContact CB-CD2 4.09Å; W390-F395 HydrophobicContact CB-CE2 4.33Å; W390-F395 HydrophobicContact CE3-CB 3.98Å; W390-F395 HydrophobicContact CE3-CD2 4.48Å; W390-F395 HydrophobicContact CE3-CG 4.25Å; W390-F395 HydrophobicContact CZ3-CB 4.4Å; W390-F395 WeakPolarHBondContact O-CE2 3.47Å; W390-V397 HydrophobicContact CH2-CG2 3.89Å; W390-V397 HydrophobicContact CZ3-CG2 4.35Å; W390-V487 HydrophobicContact CD2-CG1 4.49Å; W390-V487 HydrophobicContact CE3-CG1 3.59Å; W390-V487 HydrophobicContact CZ3-CG1 4.19Å; W390-S489 PolarHBondContact NE1-OG 2.85Å
391	A	83.4	Confident	87.9	Confident	63 Å²	63	56.8 Å²	56.8	52%	0.521	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.7	26.3	-176.1	0	0	0	0	0	116.1	G393 H499 F501	A391-G393 VanDerWaalsContact C-N 3.29Å; A391-G393 PolarHBondContact O-N 2.85Å; A391-H499 PolarHBondContact N-NE2 3.3Å; A391-H499 VanDerWaalsContact N-NE2 3.19Å; A391-F501 HydrophobicContact CB-CE1 4.2Å; A391-F501 HydrophobicContact CB-CZ 3.58Å
392	G	84.2	Confident	87.5	Confident	83 Å²	83	55.3 Å²	55.3	86%	0.856	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	1.8	-174.4	0	0	0	0	0	116	W390	W390-G392 PolarHBondContact O-N 3.25Å
393	G	87.9	Confident	86.9	Confident	27 Å²	27	52.7 Å²	52.7	28%	0.278	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	159	170.7	0	0	0	0	0	112.7	Q389 W390 A391 F395	Q389-G393 VanDerWaalsContact CA-O 3.29Å; Q389-G393 WeakPolarHBondContact CA-O 3.42Å; W390-G393 PolarHBondContact N-O 3.4Å; W390-G393 PolarHBondContact O-N 3.34Å; A391-G393 VanDerWaalsContact C-N 3.29Å; A391-G393 PolarHBondContact O-N 2.85Å; G393-F395 WeakPolarHBondContact O-CD2 3.31Å
394	T	92	Very high	85.9	Confident	14 Å²	14	51 Å²	51	9%	0.086	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	127.8	173.8	-52.7	0	0	0	0	109.8	I372 N374 V387	I372-T394 HydrophobicContact CD1-CG2 4.05Å; I372-T394 HydrophobicContact CG1-CG2 3.79Å; I372-T394 PolarHBondContact N-O 2.82Å; N374-T394 PolarHBondContact OD1-OG1 2.81Å; V387-T394 HydrophobicContact CG1-CG2 3.52Å
395	F	93	Very high	84.7	Confident	8 Å²	8	51.7 Å²	51.7	4%	0.035	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	136.9	-177.7	-66.3	-97	0	0	0	111.5	K370 S371 V387 I388 W390 G393 V487 F501	K370-F395 VanDerWaalsContact C-CD1 3.44Å; K370-F395 CarbonylContact O-C 3.57Å; K370-F395 VanDerWaalsContact O-CA 3.23Å; K370-F395 WeakPolarHBondContact O-CA 3.3Å; S371-F395 VanDerWaalsContact N-CD1 3.29Å; V387-F395 CarbonylContact C-O 3.55Å; V387-F395 WeakPolarHBondContact CA-O 3.3Å; I388-F395 PolarHBondContact N-O 3.17Å; I388-F395 PolarHBondContact O-N 2.81Å; W390-F395 HydrophobicContact CB-CD2 4.09Å; W390-F395 HydrophobicContact CB-CE2 4.33Å; W390-F395 HydrophobicContact CE3-CB 3.98Å; W390-F395 HydrophobicContact CE3-CD2 4.48Å; W390-F395 HydrophobicContact CE3-CG 4.25Å; W390-F395 HydrophobicContact CZ3-CB 4.4Å; W390-F395 WeakPolarHBondContact O-CE2 3.47Å; G393-F395 WeakPolarHBondContact O-CD2 3.31Å; F395-V487 HydrophobicContact CD1-CB 4.19Å; F395-V487 HydrophobicContact CD1-CG1 3.39Å; F395-V487 HydrophobicContact CD2-CG1 4.16Å; F395-V487 HydrophobicContact CE1-CB 3.73Å; F395-V487 HydrophobicContact CE1-CG1 3.43Å; F395-V487 VanDerWaalsContact CE1-CG1 3.43Å; F395-V487 HydrophobicContact CE2-CG1 4.18Å; F395-V487 HydrophobicContact CG-CG1 3.8Å; F395-V487 HydrophobicContact CZ-CB 4.04Å; F395-V487 HydrophobicContact CZ-CG1 3.85Å; F395-F501 HydrophobicContact CZ-CE1 4.27Å
396	V	92.9	Very high	83.4	Confident	5 Å²	5	46.8 Å²	46.8	3%	0.03	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	131.6	161.9	64	0	0	0	0	108.9	G369 K370 I372 Y380 R385	G369-V396 CarbonylContact C-O 3.51Å; G369-V396 WeakPolarHBondContact CA-O 3.42Å; K370-V396 HydrophobicContact CB-CG1 4.1Å; K370-V396 PolarHBondContact N-O 2.9Å; K370-V396 PolarHBondContact O-N 3.03Å; I372-V396 HydrophobicContact CD1-CB 4.43Å; I372-V396 HydrophobicContact CG2-CB 4.12Å; I372-V396 HydrophobicContact CG2-CG1 3.75Å; Y380-V396 HydrophobicContact CD1-CB 3.92Å; Y380-V396 HydrophobicContact CD1-CG1 4.15Å; Y380-V396 HydrophobicContact CD1-CG2 3.64Å; Y380-V396 HydrophobicContact CE1-CB 4.16Å; Y380-V396 HydrophobicContact CE1-CG1 3.85Å; Y380-V396 HydrophobicContact CE1-CG2 4.11Å; Y380-V396 HydrophobicContact CG-CB 4.42Å; Y380-V396 HydrophobicContact CG-CG2 4.38Å; R385-V396 HydrophobicContact CB-CG2 3.88Å
397	V	92.1	Very high	81.6	Confident	22 Å²	22	47.1 Å²	47.1	13%	0.133	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	134.4	177	-174.7	0	0	0	0	109.5	E386 I388 W390	E386-V397 HydrophobicContact CB-CB 4.17Å; E386-V397 HydrophobicContact CB-CG2 4.11Å; E386-V397 HydrophobicContact CG-CB 4.44Å; E386-V397 HydrophobicContact CG-CG2 3.9Å; E386-V397 PolarHBondContact O-N 3.45Å; E386-V397 WeakPolarHBondContact OE2-CG2 3.19Å; I388-V397 HydrophobicContact CB-CG2 4.37Å; I388-V397 HydrophobicContact CD1-CG2 3.53Å; I388-V397 HydrophobicContact CG1-CG2 3.75Å; W390-V397 HydrophobicContact CH2-CG2 3.89Å; W390-V397 HydrophobicContact CZ3-CG2 4.35Å
398	L	91.8	Very high	79.5	Confident	22 Å²	22	52.4 Å²	52.4	12%	0.115	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-83.3	143.1	177.3	-63.3	-179.4	0	0	0	111	W368 K370 S400 A460 A462 L473 Y486	W368-L398 HydrophobicContact CB-CB 4.47Å; W368-L398 HydrophobicContact CB-CD1 4.17Å; W368-L398 PolarHBondContact O-N 2.88Å; K370-L398 HydrophobicContact CB-CD2 4.38Å; L398-S400 PolarHBondContact O-N 2.02Å; L398-A460 HydrophobicContact CD1-CB 4.33Å; L398-A462 HydrophobicContact CB-CB 4.27Å; L398-L473 HydrophobicContact CD1-CD1 3.41Å; L398-L473 VanDerWaalsContact CD1-CD1 3.41Å; L398-Y486 HydrophobicContact CD1-CD1 3.92Å; L398-Y486 HydrophobicContact CD1-CE1 3.96Å
399	P	87.3	Confident	77.3	Confident	76 Å²	76	57.1 Å²	57.1	49%	0.494	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-63.7	136.9	175.6	27.4	-34	0	0	0	110.8	V461 A462	P399-V461 WeakPolarHBondContact O-CG1 3.36Å; P399-A462 PolarHBondContact O-N 2.81Å
400	S	85.1	Confident	75.3	Confident	73 Å²	73	54.9 Å²	54.9	51%	0.51	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	132.6	173.6	55.7	0	0	0	0	111.3	L398 A462	L398-S400 PolarHBondContact O-N 2.02Å; S400-A462 CarbonylContact C-O 3.59Å; S400-A462 VanDerWaalsContact CA-O 3.29Å; S400-A462 WeakPolarHBondContact CA-O 3.46Å
401	V	84.1	Confident	73.2	Confident	27 Å²	27	57.9 Å²	57.9	16%	0.164	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	147.5	170.8	-60.1	0	0	0	0	111.1	S403 L456 V461 A462 T463 E464	V401-S403 PolarHBondContact O-N 3.49Å; V401-L456 HydrophobicContact CB-CD2 4.19Å; V401-L456 HydrophobicContact CG1-CD2 4.04Å; V401-L456 HydrophobicContact CG2-CD2 3.92Å; V401-V461 HydrophobicContact CB-CG1 4.34Å; V401-V461 HydrophobicContact CG1-CG1 3.67Å; V401-V461 HydrophobicContact CG2-CG1 3.79Å; V401-A462 PolarHBondContact N-O 2.83Å; V401-T463 CarbonylContact O-C 3.54Å; V401-T463 VanDerWaalsContact O-CA 3.26Å; V401-T463 WeakPolarHBondContact O-CA 3.47Å; V401-E464 PolarHBondContact O-N 2.86Å
402	S	78.7	Confident	71	Confident	43 Å²	43	60.3 Å²	60.3	30%	0.301	37%	0.372	S	S	.	.			trans	-58.3	134.3	178.3	-50.6	0	0	0	0	112.2	S404 L405 E464	S402-S404 PolarHBondContact O-N 3.3Å; S402-L405 WeakPolarHBondContact O-CB 3.31Å; S402-L405 PolarHBondContact O-N 3.05Å; S402-E464 WeakPolarHBondContact CA-OE2 3.45Å; S402-E464 WeakPolarHBondContact CB-OE2 3.34Å; S402-E464 VanDerWaalsContact OG-CD 3.3Å; S402-E464 PolarHBondContact OG-OE1 3.02Å; S402-E464 PolarHBondContact OG-OE2 3Å
403	S	71.1	Confident	68.8	Low	35 Å²	35	62 Å²	62	25%	0.245	36%	0.359	C	S	.	.	H	α-helix	trans	-59.2	-23.9	-171.1	-31.6	0	0	0	0	113.3	V401 A406 L407	V401-S403 PolarHBondContact O-N 3.49Å; S403-A406 PolarHBondContact O-N 2.79Å; S403-L407 WeakPolarHBondContact O-CB 3.02Å; S403-L407 VanDerWaalsContact O-CG 3.31Å; S403-L407 WeakPolarHBondContact O-CG 3.3Å; S403-L407 PolarHBondContact O-N 2.83Å
404	S	63.3	Low	66.2	Low	85 Å²	85	65.4 Å²	65.4	59%	0.594	38%	0.376	S	S	*	.	H	α-helix	trans	-61.7	-37	171.8	51.2	0	0	0	0	113.4	S402 N408	S402-S404 PolarHBondContact O-N 3.3Å; S404-N408 VanDerWaalsContact O-CB 3.29Å; S404-N408 WeakPolarHBondContact O-CB 3.5Å; S404-N408 PolarHBondContact O-N 3.04Å
405	L	60.2	Low	63.4	Low	82 Å²	82	70.6 Å²	70.6	43%	0.429	41%	0.414	S	S	.	.	H	α-helix	trans	-71.3	-36.9	177	-65.2	171.4	0	0	0	111.6	S402 L456	S402-L405 WeakPolarHBondContact O-CB 3.31Å; S402-L405 PolarHBondContact O-N 3.05Å; L405-L456 HydrophobicContact CB-CD2 4.16Å
406	A	57.4	Low	60.6	Low	15 Å²	15	76.6 Å²	76.6	12%	0.124	45%	0.446	C	S	.	.	H	α-helix	trans	-70.2	-42.2	176.3	0	0	0	0	0	112.5	S403 T463 V474	S403-A406 PolarHBondContact O-N 2.79Å; A406-T463 HydrophobicContact CB-CG2 3.82Å; A406-V474 HydrophobicContact CB-CG2 4.41Å
407	L	53.2	Low	57.8	Low	86 Å²	86	83.3 Å²	83.3	45%	0.45	48%	0.482	S	S	.	.	H	α-helix	trans	-78.7	-24	-174.4	-71.2	170	0	0	0	114.4	S403 Y409 N410	S403-L407 WeakPolarHBondContact O-CB 3.02Å; S403-L407 VanDerWaalsContact O-CG 3.31Å; S403-L407 WeakPolarHBondContact O-CG 3.3Å; S403-L407 PolarHBondContact O-N 2.83Å; L407-Y409 PolarHBondContact O-N 3.49Å; L407-N410 PolarHBondContact O-N 2.87Å
408	N	44.7	Very low	54.9	Low	134 Å²	134	89.3 Å²	89.3	72%	0.717	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	16.6	-174.4	-162.1	33.2	0	0	0	115	S404	S404-N408 VanDerWaalsContact O-CB 3.29Å; S404-N408 WeakPolarHBondContact O-CB 3.5Å; S404-N408 PolarHBondContact O-N 3.04Å
409	Y	44.1	Very low	52.1	Low	140 Å²	140	97.9 Å²	97.9	55%	0.549	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	-15.3	168.6	-151.7	-100.7	0	0	0	113.4	L407 S411 N412	L407-Y409 PolarHBondContact O-N 3.49Å; Y409-S411 PolarHBondContact O-N 2.85Å; Y409-N412 PolarHBondContact O-N 3.23Å; Y409-N412 VanDerWaalsContact O-N 3.14Å
410	N	47.5	Very low	49.5	Very low	80 Å²	80	100.2 Å²	100.2	43%	0.428	56%	0.564	S	S	.	*	G	3₁₀ helix	trans	-66.8	-17.8	-178.5	-75.9	-0.2	0	0	0	113.3	L407 N412 M413	L407-N410 PolarHBondContact O-N 2.87Å; N410-N412 PolarHBondContact O-N 3.23Å; N410-M413 PolarHBondContact O-N 2.82Å
411	S	42.4	Very low	47.1	Very low	96 Å²	96	101.8 Å²	101.8	67%	0.671	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-67.4	-10.6	173.4	50	0	0	0	0	114.5	Y409	Y409-S411 PolarHBondContact O-N 2.85Å
412	N	37.9	Very low	44.5	Very low	113 Å²	113	110.3 Å²	110.3	60%	0.604	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-107.5	4.9	-179.7	-71.8	-17.5	0	0	0	114.1	Y409 N410	Y409-N412 PolarHBondContact O-N 3.23Å; Y409-N412 VanDerWaalsContact O-N 3.14Å; N410-N412 PolarHBondContact O-N 3.23Å
413	M	38.3	Very low	42.4	Very low	118 Å²	118	116.1 Å²	116.1	58%	0.581	64%	0.637	S	S	*	*	S	Bend	trans	-87.6	121.1	175.1	-106	-65.9	-168.7	0	0	111	N410 S415	N410-M413 PolarHBondContact O-N 2.82Å; M413-S415 PolarHBondContact O-N 3.36Å; M413-S415 VanDerWaalsContact O-N 3.16Å
414	P	32.2	Very low	40.8	Very low	99 Å²	99	120 Å²	120	64%	0.643	66%	0.664	S	S	*	*			trans	-64.4	115.2	172.4	-18.2	31.7	0	0	0	110.2	D416	P414-D416 PolarHBondContact O-N 2.71Å
415	S	33.8	Very low	39.5	Very low	124 Å²	124	120.5 Å²	120.5	87%	0.867	67%	0.673	S	S	*	*			trans	-80.4	47.5	-176.1	-43.4	0	0	0	0	112.7	M413 N417	M413-S415 PolarHBondContact O-N 3.36Å; M413-S415 VanDerWaalsContact O-N 3.16Å; S415-N417 PolarHBondContact O-N 3.45Å
416	D	34.6	Very low	38.3	Very low	134 Å²	134	124.8 Å²	124.8	72%	0.717	70%	0.695	S	S	*	*			trans	-84.1	115.8	-177.4	-80.4	-36.4	0	0	0	111.7	P414	P414-D416 PolarHBondContact O-N 2.71Å
417	N	34.2	Very low	37.3	Very low	145 Å²	145	134.4 Å²	134.4	78%	0.775	73%	0.728	S	S	*	*	S	Bend	trans	105.9	129.2	164.2	-56.4	-72.6	0	0	0	118.4	S415	S415-N417 PolarHBondContact O-N 3.45Å
418	L	31.6	Very low	36.6	Very low	149 Å²	149	136.5 Å²	136.5	78%	0.78	75%	0.748	S	S	*	*			trans	70	62	159.2	-86.7	74.6	0	0	0	119.7
419	F	32.3	Very low	36.3	Very low	202 Å²	202	134.4 Å²	134.4	89%	0.886	74%	0.743	S	S	*	*				-136.3	112.5	123.8	-88.6	-75	0	0	0	110.3	S421	F419-S421 PolarHBondContact O-N 3.47Å
420	P	32.2	Very low	36.1	Very low	125 Å²	125	133.1 Å²	133.1	81%	0.812	76%	0.755	S	S	*	*			trans	-84.2	77.4	-176.2	33.5	-34.9	0	0	0	112.1	K422	P420-K422 PolarHBondContact O-N 3.31Å
421	S	34.7	Very low	35.8	Very low	106 Å²	106	134.4 Å²	134.4	74%	0.741	77%	0.77	S	S	*	*			trans	-64.8	120.9	172.8	-67	0	0	0	0	111.5	F419 L423	F419-S421 PolarHBondContact O-N 3.47Å; S421-L423 PolarHBondContact O-N 3.02Å
422	K	30	Very low	35.7	Very low	205 Å²	205	135.5 Å²	135.5	89%	0.891	78%	0.778	S	S	*	*			trans	-65.2	110.9	171.6	-76.6	178.9	176.4	173.7	0	110.4	P420	P420-K422 PolarHBondContact O-N 3.31Å
423	L	35.3	Very low	35.8	Very low	165 Å²	165	135.1 Å²	135.1	86%	0.864	78%	0.784	S	S	*	*			trans	-139.4	121.2	159.5	-115.9	104.4	0	0	0	110.5	S421	S421-L423 PolarHBondContact O-N 3.02Å
424	S	36	Very low	35.8	Very low	118 Å²	118	135.2 Å²	135.2	83%	0.825	80%	0.796	S	S	*	*			trans	-132.5	105.3	179.9	-67.4	0	0	0	0	110.7
425	A	36	Very low	36	Very low	94 Å²	94	134.9 Å²	134.9	78%	0.777	80%	0.802	S	S	*	*			trans	64.6	145.2	172	0	0	0	0	0	115.3
426	L	36.9	Very low	36.3	Very low	172 Å²	172	137 Å²	137	90%	0.901	80%	0.802	S	S	*	*			cis	-142.2	172.2	35.6	-85.7	162.5	0	0	0	114.5
427	R	35.7	Very low	36.5	Very low	217 Å²	217	135.1 Å²	135.1	82%	0.819	80%	0.8	S	S	*	*			trans	-75.7	162.4	178.8	-127.8	173.5	-173.8	151.7	-2	111.7
428	P	38.8	Very low	36.7	Very low	131 Å²	131	133.7 Å²	133.7	85%	0.851	80%	0.801	S	S	*	*				-141	-171	79.8	37.4	-20.1	0	0	0	115
429	S	38	Very low	37.1	Very low	90 Å²	90	132.8 Å²	132.8	63%	0.629	81%	0.807	S	S	*	*			trans	-139.8	-177.3	-167.9	52.1	0	0	0	0	112.1
430	S	40.8	Very low	37.4	Very low	112 Å²	112	128.8 Å²	128.8	78%	0.783	80%	0.804	S	S	*	*			trans	89.2	155.7	170.3	81.3	0	0	0	0	117.5
431	S	40.6	Very low	37.7	Very low	108 Å²	108	128.7 Å²	128.7	76%	0.755	81%	0.807	S	S	*	*				-177.9	123.8	-50.5	50.2	0	0	0	0	111.9
432	S	39.3	Very low	37.8	Very low	119 Å²	119	129.6 Å²	129.6	83%	0.832	81%	0.813	S	S	*	*			trans	179	172	159.7	46.8	0	0	0	0	111
433	S	40	Very low	38.1	Very low	104 Å²	104	124.9 Å²	124.9	73%	0.727	81%	0.806	S	S	*	*				176.6	157.6	-67.3	51.2	0	0	0	0	109.2
434	S	39.9	Very low	38.1	Very low	120 Å²	120	123.3 Å²	123.3	84%	0.839	81%	0.809	S	S	*	*			trans	69.2	130.4	-168.8	74.8	0	0	0	0	114.7
435	A	35.8	Very low	38.3	Very low	92 Å²	92	122.3 Å²	122.3	76%	0.76	80%	0.802	S	S	*	*			cis	89.9	118.9	8.7	0	0	0	0	0	118
436	L	40.1	Very low	38.2	Very low	168 Å²	168	124 Å²	124	88%	0.88	81%	0.808	S	S	*	*			trans	179.9	155.5	134.1	-98.7	161.7	0	0	0	113.2
437	S	38.5	Very low	38.2	Very low	95 Å²	95	120.9 Å²	120.9	66%	0.664	80%	0.8	S	S	*	*			trans	24.5	125.6	162.1	56.8	0	0	0	0	121.3
438	S	38.4	Very low	38	Very low	115 Å²	115	116.1 Å²	116.1	80%	0.804	80%	0.8	S	S	*	*			cis	78.7	93.1	39.6	84.9	0	0	0	0	116.8
439	S	39.9	Very low	37.9	Very low	130 Å²	130	115.1 Å²	115.1	91%	0.909	80%	0.796	S	S	*	*			trans	-160.8	148.1	147.5	57.7	0	0	0	0	110.9
440	S	38	Very low	37.7	Very low	118 Å²	118	115.9 Å²	115.9	83%	0.825	80%	0.802	S	S	*	*			trans	-109.3	136.1	-173	55.4	0	0	0	0	112.7
441	S	39.3	Very low	37.3	Very low	124 Å²	124	115.7 Å²	115.7	87%	0.867	80%	0.8	S	S	*	*			trans	-158.6	138.3	152	52.6	0	0	0	0	111.1
442	S	36.3	Very low	36.9	Very low	124 Å²	124	116.7 Å²	116.7	87%	0.867	80%	0.802	S	S	*	*			trans	-89.6	130.3	-176.9	52.7	0	0	0	0	112.8
443	S	36.7	Very low	36.6	Very low	107 Å²	107	115.2 Å²	115.2	75%	0.748	80%	0.797	S	S	*	*			trans	-147.3	110.6	159.4	58.5	0	0	0	0	110.4	S445	S443-S445 PolarHBondContact O-N 3.26Å
444	S	36.2	Very low	36.6	Very low	131 Å²	131	113.1 Å²	113.1	92%	0.916	79%	0.786	S	S	*	*			trans	-78.1	109.1	177.3	51.9	0	0	0	0	111.1
445	S	39.5	Very low	37	Very low	97 Å²	97	112 Å²	112	68%	0.678	78%	0.784	S	S	*	*			trans	-128.2	102.2	168.9	58.2	0	0	0	0	109.9	S443 S447	S443-S445 PolarHBondContact O-N 3.26Å; S445-S447 VanDerWaalsContact C-N 3.33Å; S445-S447 PolarHBondContact O-N 2.95Å
446	S	33.4	Very low	37.9	Very low	129 Å²	129	109 Å²	109	90%	0.902	76%	0.755	S	S	*	*			trans	-74.4	80.7	178.5	53	0	0	0	0	111.3	S448	S446-S448 PolarHBondContact O-N 3.24Å
447	S	37.2	Very low	38.9	Very low	107 Å²	107	104.3 Å²	104.3	75%	0.748	74%	0.735	S	S	*	*			trans	-77.5	103.9	171.6	56	0	0	0	0	110.2	S445 S449	S445-S447 VanDerWaalsContact C-N 3.33Å; S445-S447 PolarHBondContact O-N 2.95Å; S447-S449 PolarHBondContact O-N 3.38Å
448	S	32	Very low	40.1	Very low	117 Å²	117	106.5 Å²	106.5	82%	0.818	74%	0.738	S	S	*	*			trans	-64.6	108.2	-178.4	52.2	0	0	0	0	112.7	S446 S450	S446-S448 PolarHBondContact O-N 3.24Å; S448-S450 PolarHBondContact O-N 2.96Å
449	S	35.4	Very low	41.9	Very low	110 Å²	110	101.4 Å²	101.4	77%	0.769	70%	0.704	S	S	*	*			trans	-77.1	113.3	160.2	43.8	0	0	0	0	109.1	S447 S451	S447-S449 PolarHBondContact O-N 3.38Å; S449-S451 PolarHBondContact O-N 3.41Å
450	S	34.5	Very low	44	Very low	107 Å²	107	96 Å²	96	75%	0.748	67%	0.667	S	S	*	*			trans	-74.1	84.9	-177.9	56	0	0	0	0	111.4	S448 V452	S448-S450 PolarHBondContact O-N 2.96Å; S450-V452 PolarHBondContact O-N 2.85Å
451	S	32.2	Very low	46.5	Very low	107 Å²	107	90.8 Å²	90.8	75%	0.748	63%	0.631	S	S	*	*			trans	-69.7	90.5	172.5	57.7	0	0	0	0	110.4	S449 A453	S449-S451 PolarHBondContact O-N 3.41Å; S451-A453 PolarHBondContact O-N 2.99Å
452	V	33.1	Very low	48.9	Very low	129 Å²	129	85.1 Å²	85.1	78%	0.782	59%	0.591	S	S	*	*			trans	-74.9	64.6	168.6	-169.4	0	0	0	0	109.1	S450 A454	S450-V452 PolarHBondContact O-N 2.85Å; V452-A454 PolarHBondContact O-N 2.87Å
453	A	32.2	Very low	51.4	Low	88 Å²	88	79.4 Å²	79.4	73%	0.727	55%	0.551	S	S	*	*			trans	-73.3	78	165.6	0	0	0	0	0	107.6	S451 A455	S451-A453 PolarHBondContact O-N 2.99Å; A453-A455 PolarHBondContact O-N 2.89Å
454	A	41	Very low	53.7	Low	60 Å²	60	78.4 Å²	78.4	50%	0.496	53%	0.534	S	S	.	.			trans	-57.6	112.9	175.7	0	0	0	0	0	108.7	V452 L456	V452-A454 PolarHBondContact O-N 2.87Å; A454-L456 PolarHBondContact O-N 3.41Å
455	A	47.3	Very low	55.9	Low	98 Å²	98	75.4 Å²	75.4	81%	0.81	51%	0.51	S	S	*	.			trans	-66.4	104.7	178.7	0	0	0	0	0	108.9	A453	A453-A455 PolarHBondContact O-N 2.89Å
456	L	54.1	Low	57.8	Low	29 Å²	29	72.5 Å²	72.5	15%	0.152	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-52.4	141.4	167.2	-72.7	172.5	0	0	0	109.2	V401 L405 A454	V401-L456 HydrophobicContact CB-CD2 4.19Å; V401-L456 HydrophobicContact CG1-CD2 4.04Å; V401-L456 HydrophobicContact CG2-CD2 3.92Å; L405-L456 HydrophobicContact CB-CD2 4.16Å; A454-L456 PolarHBondContact O-N 3.41Å
457	P	61.3	Low	59.6	Low	69 Å²	69	72.8 Å²	72.8	45%	0.448	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-52.3	142.9	174.3	-25.1	33.7	0	0	0	111.8	V461	P457-V461 HydrophobicContact CB-CG2 4.06Å; P457-V461 HydrophobicContact CG-CG2 4.26Å
458	L	64	Low	61.3	Low	140 Å²	140	70.5 Å²	70.5	73%	0.733	48%	0.476	S	S	*	.	S	Bend	trans	-71.6	146.6	166.2	-75.4	80.8	0	0	0	109.3
459	G	76.4	Confident	63.7	Low	9 Å²	9	66.4 Å²	66.4	9%	0.093	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	96.8	-154.2	-174.7	0	0	0	0	0	113.4	R476 D482	G459-R476 PolarHBondContact N-O 3.02Å; G459-R476 PolarHBondContact O-N 3.41Å; G459-D482 WeakPolarHBondContact CA-OD1 3.29Å
460	A	85.1	Confident	66.2	Low	17 Å²	17	62 Å²	62	14%	0.14	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	127.4	-175.3	0	0	0	0	0	114.3	L398 L473 L475 D482 Y486	L398-A460 HydrophobicContact CD1-CB 4.33Å; A460-L473 HydrophobicContact CB-CD1 4.22Å; A460-L475 HydrophobicContact CB-CD1 3.79Å; A460-L475 HydrophobicContact CB-CG 3.96Å; A460-D482 PolarHBondContact N-OD1 3.34Å; A460-Y486 HydrophobicContact CB-CE1 3.67Å
461	V	89.3	Confident	68.8	Low	8 Å²	8	57 Å²	57	5%	0.048	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	147	-178.6	-176.9	0	0	0	0	109.7	P399 V401 P457 V474	P399-V461 WeakPolarHBondContact O-CG1 3.36Å; V401-V461 HydrophobicContact CB-CG1 4.34Å; V401-V461 HydrophobicContact CG1-CG1 3.67Å; V401-V461 HydrophobicContact CG2-CG1 3.79Å; P457-V461 HydrophobicContact CB-CG2 4.06Å; P457-V461 HydrophobicContact CG-CG2 4.26Å; V461-V474 PolarHBondContact N-O 2.83Å; V461-V474 PolarHBondContact O-N 2.81Å
462	A	90.7	Very high	71.7	Confident	4 Å²	4	53.4 Å²	53.4	3%	0.033	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	152.2	175.4	0	0	0	0	0	111.6	W368 L398 P399 S400 V401 Q472	W368-A462 HydrophobicContact CB-CB 4.06Å; W368-A462 HydrophobicContact CG-CB 4.18Å; L398-A462 HydrophobicContact CB-CB 4.27Å; P399-A462 PolarHBondContact O-N 2.81Å; S400-A462 CarbonylContact C-O 3.59Å; S400-A462 VanDerWaalsContact CA-O 3.29Å; S400-A462 WeakPolarHBondContact CA-O 3.46Å; V401-A462 PolarHBondContact N-O 2.83Å; A462-Q472 CarbonylContact C-O 3.58Å; A462-Q472 WeakPolarHBondContact CA-O 3.44Å
463	T	88.2	Confident	74.6	Confident	5 Å²	5	47.2 Å²	47.2	3%	0.031	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	149.1	164	74.4	0	0	0	0	111.2	V401 A406 S471 Q472 V474	V401-T463 CarbonylContact O-C 3.54Å; V401-T463 VanDerWaalsContact O-CA 3.26Å; V401-T463 WeakPolarHBondContact O-CA 3.47Å; A406-T463 HydrophobicContact CB-CG2 3.82Å; T463-S471 PolarHBondContact O-OG 3.03Å; T463-Q472 HydrophobicContact CG2-CB 3.88Å; T463-Q472 PolarHBondContact N-O 3.35Å; T463-Q472 PolarHBondContact OG1-N 2.84Å; T463-V474 HydrophobicContact CG2-CG2 4.28Å
464	E	85.1	Confident	77.4	Confident	86 Å²	86	43.8 Å²	43.8	40%	0.402	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-52.4	154.9	160.4	-70.2	173.7	168.2	0	0	111.2	V401 S402 S466	V401-E464 PolarHBondContact O-N 2.86Å; S402-E464 WeakPolarHBondContact CA-OE2 3.45Å; S402-E464 WeakPolarHBondContact CB-OE2 3.34Å; S402-E464 VanDerWaalsContact OG-CD 3.3Å; S402-E464 PolarHBondContact OG-OE1 3.02Å; S402-E464 PolarHBondContact OG-OE2 3Å; E464-S466 PolarHBondContact O-N 3.39Å
465	V	81.9	Confident	79.8	Confident	68 Å²	68	41 Å²	41	41%	0.412	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-74.7	125.1	-178.2	-169	0	0	0	0	109.5	I366	I366-V465 HydrophobicContact CB-CG2 3.83Å; I366-V465 HydrophobicContact CD1-CG1 3.99Å; I366-V465 HydrophobicContact CG1-CG1 4.16Å; I366-V465 HydrophobicContact CG1-CG2 4.31Å
466	S	78.9	Confident	81.7	Confident	35 Å²	35	39.2 Å²	39.2	25%	0.245	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-71.1	165.1	177.7	74	0	0	0	0	112.2	E464 S468 Q469 S470	E464-S466 PolarHBondContact O-N 3.39Å; S466-S468 PolarHBondContact O-N 3.31Å; S466-S468 VanDerWaalsContact O-N 3.15Å; S466-S468 PolarHBondContact OG-N 3.47Å; S466-S468 PolarHBondContact OG-OG 3.05Å; S466-S468 VanDerWaalsContact OG-OG 3.06Å; S466-Q469 PolarHBondContact O-N 2.98Å; S466-Q469 VanDerWaalsContact O-N 3.09Å; S466-S470 WeakPolarHBondContact CB-O 3.27Å; S466-S470 PolarHBondContact N-O 3.24Å; S466-S470 PolarHBondContact OG-N 2.86Å; S466-S470 PolarHBondContact OG-O 2.9Å; S466-S470 PolarHBondContact OG-OG 2.67Å
467	S	72.5	Confident	83.2	Confident	135 Å²	135	43.4 Å²	43.4	94%	0.944	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-14.7	169.2	51.2	0	0	0	0	113.8
468	S	72	Confident	84.4	Confident	60 Å²	60	40.2 Å²	40.2	42%	0.42	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	26.5	173.6	78.2	0	0	0	0	112.6	S466 S470	S466-S468 PolarHBondContact O-N 3.31Å; S466-S468 VanDerWaalsContact O-N 3.15Å; S466-S468 PolarHBondContact OG-N 3.47Å; S466-S468 PolarHBondContact OG-OG 3.05Å; S466-S468 VanDerWaalsContact OG-OG 3.06Å; S468-S470 VanDerWaalsContact C-N 3.27Å; S468-S470 PolarHBondContact O-N 2.91Å; S468-S470 PolarHBondContact OG-OG 3.45Å
469	Q	83.2	Confident	85.6	Confident	31 Å²	31	35.4 Å²	35.4	15%	0.145	21%	0.207	C	C	.	.	S	Bend	trans	50	42.8	-179.9	-54.8	-169.8	48.2	0	0	113.7	V356 H361 S363 I366 S466	V356-Q469 HydrophobicContact CB-CB 4.19Å; V356-Q469 PolarHBondContact N-O 2.79Å; V356-Q469 VanDerWaalsContact N-O 3.11Å; H361-Q469 PolarHBondContact O-NE2 3.05Å; H361-Q469 PolarHBondContact O-OE1 3.11Å; S363-Q469 VanDerWaalsContact CB-OE1 3.23Å; S363-Q469 PolarHBondContact OG-OE1 3.12Å; I366-Q469 VanDerWaalsContact CD1-O 3.24Å; I366-Q469 WeakPolarHBondContact CD1-O 3.38Å; S466-Q469 PolarHBondContact O-N 2.98Å; S466-Q469 VanDerWaalsContact O-N 3.09Å
470	S	86.6	Confident	86.2	Confident	16 Å²	16	40 Å²	40	11%	0.112	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	142.5	178.4	66.5	0	0	0	0	113	C354 S466 S468	C354-S470 CarbonylContact O-C 3.55Å; C354-S470 VanDerWaalsContact O-CA 3.31Å; C354-S470 WeakPolarHBondContact O-CA 3.48Å; S466-S470 WeakPolarHBondContact CB-O 3.27Å; S466-S470 PolarHBondContact N-O 3.24Å; S466-S470 PolarHBondContact OG-N 2.86Å; S466-S470 PolarHBondContact OG-O 2.9Å; S466-S470 PolarHBondContact OG-OG 2.67Å; S468-S470 VanDerWaalsContact C-N 3.27Å; S468-S470 PolarHBondContact O-N 2.91Å; S468-S470 PolarHBondContact OG-OG 3.45Å
471	S	90.4	Very high	86.2	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.014	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	145.3	175.1	172.6	0	0	0	0	109.4	C354 W368 T463	C354-S471 PolarHBondContact N-O 3Å; C354-S471 PolarHBondContact O-N 2.84Å; W368-S471 PolarHBondContact NE1-OG 2.74Å; T463-S471 PolarHBondContact O-OG 3.03Å
472	Q	92.1	Very high	86.3	Confident	32 Å²	32	43.8 Å²	43.8	15%	0.15	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	135	-175	-51.9	178.4	6.2	0	0	110.1	I351 F352 H353 A462 T463 V474	I351-Q472 HydrophobicContact CG2-CB 4.04Å; F352-Q472 CarbonylContact O-C 3.56Å; F352-Q472 WeakPolarHBondContact O-CA 3.44Å; H353-Q472 PolarHBondContact CE1-NE2 3.16Å; A462-Q472 CarbonylContact C-O 3.58Å; A462-Q472 WeakPolarHBondContact CA-O 3.44Å; T463-Q472 HydrophobicContact CG2-CB 3.88Å; T463-Q472 PolarHBondContact N-O 3.35Å; T463-Q472 PolarHBondContact OG1-N 2.84Å; Q472-V474 HydrophobicContact CB-CG2 4.44Å
473	L	93.2	Very high	86.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	118.5	164.9	170.6	61.8	0	0	0	107.9	I351 F352 W368 L398 A460 L475 Y486 I504	I351-L473 CarbonylContact C-O 3.5Å; I351-L473 WeakPolarHBondContact CA-O 3.48Å; F352-L473 HydrophobicContact CB-CB 4.29Å; F352-L473 HydrophobicContact CD2-CB 4.43Å; F352-L473 HydrophobicContact CD2-CD2 4.02Å; F352-L473 HydrophobicContact CD2-CG 4.14Å; F352-L473 PolarHBondContact N-O 2.67Å; F352-L473 PolarHBondContact O-N 2.91Å; W368-L473 HydrophobicContact CD2-CB 3.76Å; W368-L473 HydrophobicContact CE3-CB 3.76Å; W368-L473 HydrophobicContact CE3-CD2 3.93Å; W368-L473 HydrophobicContact CE3-CG 4.38Å; W368-L473 HydrophobicContact CG-CB 4.44Å; W368-L473 HydrophobicContact CH2-CB 3.74Å; W368-L473 HydrophobicContact CZ2-CB 3.74Å; W368-L473 HydrophobicContact CZ3-CB 3.76Å; W368-L473 HydrophobicContact CZ3-CD2 3.87Å; W368-L473 HydrophobicContact CZ3-CG 4.46Å; L398-L473 HydrophobicContact CD1-CD1 3.41Å; L398-L473 VanDerWaalsContact CD1-CD1 3.41Å; A460-L473 HydrophobicContact CB-CD1 4.22Å; L473-L475 HydrophobicContact CD1-CD1 3.88Å; L473-L475 HydrophobicContact CD2-CD1 4.1Å; L473-L475 HydrophobicContact CG-CD1 3.72Å; L473-Y486 HydrophobicContact CD1-CD1 4.15Å; L473-Y486 HydrophobicContact CD1-CE1 4.35Å; L473-Y486 HydrophobicContact CD2-CD1 3.66Å; L473-Y486 HydrophobicContact CD2-CD2 4.48Å; L473-Y486 HydrophobicContact CD2-CE1 4.37Å; L473-Y486 HydrophobicContact CD2-CG 3.71Å; L473-I504 HydrophobicContact CD2-CD1 4.24Å
474	V	92.2	Very high	86.5	Confident	16 Å²	16	45.8 Å²	45.8	10%	0.097	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	118.8	179.2	-176.8	0	0	0	0	108.7	A350 I351 A406 V461 T463 Q472 R476	A350-V474 WeakPolarHBondContact O-CA 3.48Å; I351-V474 HydrophobicContact CG1-CG1 4.43Å; I351-V474 HydrophobicContact CG1-CG2 4.38Å; I351-V474 HydrophobicContact CG2-CG2 4.45Å; A406-V474 HydrophobicContact CB-CG2 4.41Å; V461-V474 PolarHBondContact N-O 2.83Å; V461-V474 PolarHBondContact O-N 2.81Å; T463-V474 HydrophobicContact CG2-CG2 4.28Å; Q472-V474 HydrophobicContact CB-CG2 4.44Å; V474-R476 HydrophobicContact CG1-CG 3.94Å
475	L	91.1	Very high	87	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	129.8	167.4	-84.9	65.5	0	0	0	108.2	D349 A350 F352 A460 L473 D482 I504	D349-L475 CarbonylContact C-O 3.58Å; D349-L475 VanDerWaalsContact CA-O 3.26Å; D349-L475 WeakPolarHBondContact CA-O 3.25Å; A350-L475 HydrophobicContact CB-CB 4.41Å; A350-L475 PolarHBondContact N-O 3.12Å; A350-L475 PolarHBondContact O-N 3.21Å; F352-L475 HydrophobicContact CE2-CD1 4.24Å; A460-L475 HydrophobicContact CB-CD1 3.79Å; A460-L475 HydrophobicContact CB-CG 3.96Å; L473-L475 HydrophobicContact CD1-CD1 3.88Å; L473-L475 HydrophobicContact CD2-CD1 4.1Å; L473-L475 HydrophobicContact CG-CD1 3.72Å; L475-D482 HydrophobicContact CD2-CB 3.92Å; L475-I504 HydrophobicContact CD1-CD1 3.81Å; L475-I504 HydrophobicContact CD2-CD1 3.65Å; L475-I504 HydrophobicContact CD2-CG2 4.01Å; L475-I504 HydrophobicContact CG-CD1 4.41Å
476	R	86.7	Confident	87.6	Confident	62 Å²	62	44.3 Å²	44.3	23%	0.234	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	128.8	176	-57.1	-156.3	71.3	-159.9	2.7	111.7	D349 G459 V474	D349-R476 WeakPolarHBondContact OD1-CA 3.44Å; D349-R476 IonicContact OD2-CZ 3.67Å; D349-R476 IonicContact OD2-NE 3.03Å; D349-R476 PolarHBondContact OD2-NE 3.22Å; D349-R476 IonicContact OD2-NH2 3.36Å; D349-R476 PolarHBondContact OD2-NH2 3.23Å; G459-R476 PolarHBondContact N-O 3.02Å; G459-R476 PolarHBondContact O-N 3.41Å; V474-R476 HydrophobicContact CG1-CG 3.94Å
477	Q	85.4	Confident	88.4	Confident	117 Å²	117	42.6 Å²	42.6	55%	0.547	24%	0.239	S	C	.	.	S	Bend	trans	48.4	57.7	-175.4	-62.7	-177.1	-8.4	0	0	112.1	D349 S479	D349-Q477 PolarHBondContact OD1-N 2.84Å; Q477-S479 PolarHBondContact O-N 3.19Å; Q477-S479 VanDerWaalsContact O-N 3.15Å
478	A	88.2	Confident	89.4	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.008	19%	0.194	C	C	.	.			trans	-43.3	117.6	-168.3	0	0	0	0	0	112.8	V344 A346 G347 Q348 V506	V344-A478 HydrophobicContact CB-CB 4.46Å; V344-A478 HydrophobicContact CG1-CB 3.69Å; A346-A478 CarbonylContact C-O 3.53Å; A346-A478 WeakPolarHBondContact CA-O 3.31Å; G347-A478 PolarHBondContact N-O 2.98Å; Q348-A478 WeakPolarHBondContact O-CB 3.34Å; Q348-A478 PolarHBondContact O-N 2.83Å; A478-V506 HydrophobicContact CB-CG1 4.15Å; A478-V506 HydrophobicContact CB-CG2 4.12Å
479	S	89	Confident	90.4	Very high	40 Å²	40	33.9 Å²	33.9	28%	0.28	18%	0.178	S	C	.	.			trans	-94.7	162.3	179.9	72.2	0	0	0	0	110.9	Q477 S481 D482 V506	Q477-S479 PolarHBondContact O-N 3.19Å; Q477-S479 VanDerWaalsContact O-N 3.15Å; S479-S481 WeakPolarHBondContact CB-OG 3.37Å; S479-S481 PolarHBondContact O-N 3.5Å; S479-S481 VanDerWaalsContact O-N 3.15Å; S479-S481 PolarHBondContact OG-N 3.3Å; S479-S481 PolarHBondContact OG-OG 2.9Å; S479-D482 VanDerWaalsContact CB-OD2 3.32Å; S479-D482 WeakPolarHBondContact CB-OD2 3.49Å; S479-D482 PolarHBondContact N-OD2 2.89Å; S479-D482 WeakPolarHBondContact O-CB 3.27Å; S479-D482 PolarHBondContact O-N 2.75Å; S479-D482 PolarHBondContact OG-N 3.21Å; S479-D482 PolarHBondContact OG-OD2 3.05Å; S479-V506 WeakPolarHBondContact O-CB 2.99Å; S479-V506 WeakPolarHBondContact O-CG2 3.45Å
480	Q	87.6	Confident	90.8	Very high	106 Å²	106	32.4 Å²	32.4	50%	0.495	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-56.9	-34.1	174.1	-166.1	65.9	76.3	0	0	111.5	D482 S483 V506	Q480-D482 VanDerWaalsContact C-N 3.28Å; Q480-D482 PolarHBondContact O-N 3Å; Q480-S483 PolarHBondContact NE2-OG 2.99Å; Q480-S483 VanDerWaalsContact NE2-OG 3.15Å; Q480-S483 VanDerWaalsContact O-CB 3.27Å; Q480-S483 WeakPolarHBondContact O-CB 3.37Å; Q480-S483 PolarHBondContact O-N 2.84Å; Q480-S483 VanDerWaalsContact O-N 3.17Å; Q480-S483 PolarHBondContact O-OG 3.39Å; Q480-V506 PolarHBondContact NE2-O 3.19Å
481	S	86.7	Confident	90.9	Very high	90 Å²	90	35 Å²	35	63%	0.629	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-64.3	-20.2	172.9	23.1	0	0	0	0	114.8	K370 S479 S483	K370-S481 PolarHBondContact NZ-O 2.9Å; S479-S481 WeakPolarHBondContact CB-OG 3.37Å; S479-S481 PolarHBondContact O-N 3.5Å; S479-S481 VanDerWaalsContact O-N 3.15Å; S479-S481 PolarHBondContact OG-N 3.3Å; S479-S481 PolarHBondContact OG-OG 2.9Å; S481-S483 VanDerWaalsContact C-N 3.25Å; S481-S483 PolarHBondContact O-N 3.06Å
482	D	90.4	Very high	90.7	Very high	14 Å²	14	35.1 Å²	35.1	8%	0.075	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-81.3	-2.3	173	-63.9	-65.2	0	0	0	113.2	G459 A460 L475 S479 Q480 Y486 V506	G459-D482 WeakPolarHBondContact CA-OD1 3.29Å; A460-D482 PolarHBondContact N-OD1 3.34Å; L475-D482 HydrophobicContact CD2-CB 3.92Å; S479-D482 VanDerWaalsContact CB-OD2 3.32Å; S479-D482 WeakPolarHBondContact CB-OD2 3.49Å; S479-D482 PolarHBondContact N-OD2 2.89Å; S479-D482 WeakPolarHBondContact O-CB 3.27Å; S479-D482 PolarHBondContact O-N 2.75Å; S479-D482 PolarHBondContact OG-N 3.21Å; S479-D482 PolarHBondContact OG-OD2 3.05Å; Q480-D482 VanDerWaalsContact C-N 3.28Å; Q480-D482 PolarHBondContact O-N 3Å; D482-Y486 WeakPolarHBondContact O-CE2 3.23Å; D482-Y486 PolarHBondContact O-OH 3.2Å; D482-Y486 VanDerWaalsContact O-OH 3.07Å; D482-V506 HydrophobicContact CB-CG2 4.36Å
483	S	91.4	Very high	90	Very high	33 Å²	33	40 Å²	40	23%	0.231	21%	0.207	C	C	.	.			trans	-64.1	148.2	166.8	-52	0	0	0	0	110.5	K370 Q480 S481 I504 V506	K370-S483 WeakPolarHBondContact CE-O 3.45Å; K370-S483 PolarHBondContact NZ-O 3.11Å; Q480-S483 PolarHBondContact NE2-OG 2.99Å; Q480-S483 VanDerWaalsContact NE2-OG 3.15Å; Q480-S483 VanDerWaalsContact O-CB 3.27Å; Q480-S483 WeakPolarHBondContact O-CB 3.37Å; Q480-S483 PolarHBondContact O-N 2.84Å; Q480-S483 VanDerWaalsContact O-N 3.17Å; Q480-S483 PolarHBondContact O-OG 3.39Å; S481-S483 VanDerWaalsContact C-N 3.25Å; S481-S483 PolarHBondContact O-N 3.06Å; S483-I504 WeakPolarHBondContact CA-O 3.15Å; S483-V506 WeakPolarHBondContact OG-CB 3.42Å; S483-V506 PolarHBondContact OG-N 3.04Å; S483-V506 VanDerWaalsContact OG-N 3.08Å
484	G	92.8	Very high	89.3	Confident	18 Å²	18	42.8 Å²	42.8	19%	0.186	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.8	-173.8	177.6	0	0	0	0	0	113.4	Q503 I504	G484-Q503 VanDerWaalsContact C-NE2 3.34Å; G484-Q503 PolarHBondContact O-NE2 3.44Å; G484-I504 PolarHBondContact N-O 2.81Å; G484-I504 PolarHBondContact O-N 2.83Å
485	R	94.2	Very high	88.7	Confident	122 Å²	122	44.7 Å²	44.7	46%	0.46	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	130.1	170.6	-172.1	176.5	-63.4	174.8	1.8	109.6	S371 F501 Q503	S371-R485 WeakPolarHBondContact CB-O 3.32Å; S371-R485 PolarHBondContact N-O 2.98Å; S371-R485 PolarHBondContact OG-N 3.4Å; S371-R485 PolarHBondContact OG-O 3.22Å; S371-R485 VanDerWaalsContact OG-O 3.08Å; R485-F501 HydrophobicContact CG-CD1 4.35Å; R485-Q503 VanDerWaalsContact NE-OE1 3.11Å
486	Y	95	Very high	88.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	153.3	171.4	-65.8	-102.1	0	0	0	108.9	G369 K370 L398 A460 L473 D482 F501 V502 I504	G369-Y486 CarbonylContact O-C 3.48Å; G369-Y486 VanDerWaalsContact O-CA 3.29Å; G369-Y486 WeakPolarHBondContact O-CA 3.37Å; K370-Y486 HydrophobicContact CB-CD1 3.94Å; K370-Y486 HydrophobicContact CB-CE1 3.77Å; K370-Y486 HydrophobicContact CD-CE1 3.89Å; K370-Y486 HydrophobicContact CD-CE2 4.33Å; K370-Y486 WeakPolarHBondContact CD-OH 3.32Å; K370-Y486 WeakPolarHBondContact CE-OH 3.44Å; K370-Y486 HydrophobicContact CG-CD1 4.13Å; K370-Y486 HydrophobicContact CG-CE1 3.76Å; K370-Y486 HydrophobicContact CG-CE2 4.19Å; K370-Y486 PolarHBondContact NZ-OH 2.85Å; L398-Y486 HydrophobicContact CD1-CD1 3.92Å; L398-Y486 HydrophobicContact CD1-CE1 3.96Å; A460-Y486 HydrophobicContact CB-CE1 3.67Å; L473-Y486 HydrophobicContact CD1-CD1 4.15Å; L473-Y486 HydrophobicContact CD1-CE1 4.35Å; L473-Y486 HydrophobicContact CD2-CD1 3.66Å; L473-Y486 HydrophobicContact CD2-CD2 4.48Å; L473-Y486 HydrophobicContact CD2-CE1 4.37Å; L473-Y486 HydrophobicContact CD2-CG 3.71Å; D482-Y486 WeakPolarHBondContact O-CE2 3.23Å; D482-Y486 PolarHBondContact O-OH 3.2Å; D482-Y486 VanDerWaalsContact O-OH 3.07Å; Y486-F501 CarbonylContact O-C 3.55Å; Y486-F501 WeakPolarHBondContact O-CA 3.5Å; Y486-V502 PolarHBondContact N-O 2.03Å; Y486-V502 PolarHBondContact O-N 2.85Å; Y486-I504 HydrophobicContact CD2-CB 4.38Å; Y486-I504 HydrophobicContact CD2-CD1 3.63Å; Y486-I504 HydrophobicContact CD2-CG1 3.92Å; Y486-I504 HydrophobicContact CE2-CB 4.27Å; Y486-I504 HydrophobicContact CE2-CD1 3.73Å; Y486-I504 HydrophobicContact CE2-CG1 4.18Å; Y486-I504 HydrophobicContact CG-CD1 4.33Å
487	V	94.9	Very high	88.5	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	134.2	172.9	70.2	0	0	0	0	109.2	W368 G369 W390 F395 H499 K500 F501	W368-V487 CarbonylContact C-O 3.58Å; W368-V487 VanDerWaalsContact CA-O 3.27Å; W368-V487 WeakPolarHBondContact CA-O 3.41Å; G369-V487 PolarHBondContact N-O 3.13Å; G369-V487 PolarHBondContact O-N 3.1Å; W390-V487 HydrophobicContact CD2-CG1 4.49Å; W390-V487 HydrophobicContact CE3-CG1 3.59Å; W390-V487 HydrophobicContact CZ3-CG1 4.19Å; F395-V487 HydrophobicContact CD1-CB 4.19Å; F395-V487 HydrophobicContact CD1-CG1 3.39Å; F395-V487 HydrophobicContact CD2-CG1 4.16Å; F395-V487 HydrophobicContact CE1-CB 3.73Å; F395-V487 HydrophobicContact CE1-CG1 3.43Å; F395-V487 VanDerWaalsContact CE1-CG1 3.43Å; F395-V487 HydrophobicContact CE2-CG1 4.18Å; F395-V487 HydrophobicContact CG-CG1 3.8Å; F395-V487 HydrophobicContact CZ-CB 4.04Å; F395-V487 HydrophobicContact CZ-CG1 3.85Å; V487-H499 HydrophobicContact CG2-CB 4.14Å; V487-K500 CarbonylContact C-O 3.44Å; V487-K500 WeakPolarHBondContact CA-O 3.32Å; V487-F501 HydrophobicContact CB-CD1 3.92Å; V487-F501 HydrophobicContact CB-CE1 3.98Å; V487-F501 HydrophobicContact CG2-CD1 3.72Å; V487-F501 HydrophobicContact CG2-CE1 3.5Å; V487-F501 HydrophobicContact CG2-CZ 4.15Å
488	C	94.4	Very high	88.7	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	124.5	155.1	177.3	0	0	0	0	107.7	C354 I366 R367 W368 H499 K500	C354-C488 HydrophobicContact CB-CB 3.6Å; C354-C488 WeakPolarHBondContact CB-SG 3.43Å; C354-C488 WeakPolarHBondContact SG-CB 3.48Å; C354-C488 CovalentContact SG-SG 2.03Å; C354-C488 PolarHBondContact SG-SG 2.6Å; I366-C488 WeakPolarHBondContact CG2-SG 3.48Å; R367-C488 CarbonylContact O-C 3.56Å; R367-C488 WeakPolarHBondContact O-CA 3.46Å; W368-C488 HydrophobicContact CD2-CB 3.89Å; W368-C488 HydrophobicContact CE3-CB 3.77Å; W368-C488 HydrophobicContact CH2-CB 4Å; W368-C488 HydrophobicContact CZ2-CB 4.09Å; W368-C488 HydrophobicContact CZ3-CB 3.82Å; C488-H499 WeakPolarHBondContact O-CA 3.13Å; C488-K500 HydrophobicContact CB-CB 4.34Å; C488-K500 PolarHBondContact N-O 3.38Å; C488-K500 PolarHBondContact O-N 3.4Å
489	S	93.2	Very high	88.9	Confident	11 Å²	11	46.7 Å²	46.7	8%	0.077	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	128.3	170.5	-170	0	0	0	0	109.3	R367 W390 H499	R367-S489 PolarHBondContact N-O 2.77Å; R367-S489 PolarHBondContact O-N 3.39Å; W390-S489 PolarHBondContact NE1-OG 2.85Å; S489-H499 PolarHBondContact OG-CE1 3.47Å; S489-H499 PolarHBondContact OG-ND1 3.13Å
490	V	91.6	Very high	89.1	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	139.6	172.2	175.6	0	0	0	0	108.9	I333 I334 V356 S363 I366 D497 D498	I333-V490 HydrophobicContact CG2-CG1 3.83Å; I334-V490 HydrophobicContact CD1-CB 4.32Å; I334-V490 HydrophobicContact CD1-CG2 3.81Å; I334-V490 HydrophobicContact CG1-CB 4.15Å; I334-V490 HydrophobicContact CG1-CG2 3.59Å; V356-V490 HydrophobicContact CG2-CB 4.33Å; V356-V490 HydrophobicContact CG2-CG1 3.76Å; V356-V490 HydrophobicContact CG2-CG2 3.68Å; S363-V490 VanDerWaalsContact OG-CG1 3.29Å; S363-V490 WeakPolarHBondContact OG-CG1 3.38Å; I366-V490 HydrophobicContact CB-CG2 4.45Å; I366-V490 HydrophobicContact CD1-CG2 4.33Å; I366-V490 HydrophobicContact CG1-CG2 4.04Å; I366-V490 HydrophobicContact CG2-CG2 4.03Å; V490-D497 WeakPolarHBondContact O-CA 3.25Å; V490-D498 PolarHBondContact N-O 2.67Å; V490-D498 PolarHBondContact O-N 3.24Å
491	L	88.5	Confident	89.5	Confident	70 Å²	70	42.6 Å²	42.6	37%	0.366	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	137.4	164.4	-173.9	67.1	0	0	0	108.8	S363 S364 T365 D497	S363-L491 CarbonylContact C-O 3.29Å; S363-L491 WeakPolarHBondContact CA-O 3.02Å; S364-L491 PolarHBondContact N-O 3.16Å; S364-L491 PolarHBondContact OG-O 3.07Å; S364-L491 VanDerWaalsContact OG-O 3.07Å; T365-L491 PolarHBondContact N-O 3.04Å; T365-L491 PolarHBondContact O-N 3.07Å; L491-D497 HydrophobicContact CD1-CB 4.19Å
492	T	86	Confident	89.9	Confident	5 Å²	5	38.3 Å²	38.3	3%	0.031	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	160.7	177.3	57.1	0	0	0	0	112.4	I333 H361 R362 S364 A494 G495 R496	I333-T492 HydrophobicContact CD1-CG2 3.77Å; I333-T492 HydrophobicContact CG1-CG2 4.49Å; I333-T492 HydrophobicContact CG2-CG2 3.75Å; H361-T492 HydrophobicContact CB-CG2 4.1Å; R362-T492 CarbonylContact O-C 3.59Å; R362-T492 WeakPolarHBondContact O-CA 3.4Å; R362-T492 WeakPolarHBondContact O-CB 3.43Å; S364-T492 PolarHBondContact OG-O 3.46Å; T492-A494 PolarHBondContact O-N 3.22Å; T492-G495 PolarHBondContact O-N 2.78Å; T492-R496 PolarHBondContact N-O 3.09Å; T492-R496 WeakPolarHBondContact OG1-CB 3.47Å; T492-R496 PolarHBondContact OG1-N 2.94Å; T492-R496 VanDerWaalsContact OG1-N 3.08Å; T492-R496 PolarHBondContact OG1-O 3.39Å
493	E	78.5	Confident	90.1	Very high	135 Å²	135	40.4 Å²	40.4	63%	0.631	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-26.6	169.3	-66.8	-174.5	143.2	0	0	112.2	R362 G495	R362-E493 HydrophobicContact CB-CB 4.49Å; R362-E493 HydrophobicContact CB-CG 4.03Å; R362-E493 WeakPolarHBondContact CB-OE2 3.46Å; R362-E493 WeakPolarHBondContact CD-OE2 3.4Å; R362-E493 PolarHBondContact O-N 3.36Å; E493-G495 PolarHBondContact O-N 3.38Å
494	A	76.6	Confident	90.3	Very high	59 Å²	59	38.9 Å²	38.9	49%	0.488	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	1.3	176.1	0	0	0	0	0	114.3	S327 T492 R496	S327-A494 WeakPolarHBondContact OG-CB 3.03Å; T492-A494 PolarHBondContact O-N 3.22Å; A494-R496 VanDerWaalsContact C-N 3.26Å; A494-R496 PolarHBondContact O-N 2.81Å
495	G	81.2	Confident	90.3	Very high	55 Å²	55	40.6 Å²	40.6	57%	0.567	22%	0.219	S	C	*	.	S	Bend	trans	74.9	6.9	-179.4	0	0	0	0	0	115.1	T492 E493	T492-G495 PolarHBondContact O-N 2.78Å; E493-G495 PolarHBondContact O-N 3.38Å
496	R	84.6	Confident	90.2	Very high	65 Å²	65	35 Å²	35	25%	0.245	20%	0.199	C	C	.	.			trans	-78.4	132.5	167.6	-64	-178.6	60.1	-161.9	-4.6	110.1	R328 T329 D330 G331 I333 T492 A494	R328-R496 PolarHBondContact O-NH1 3.43Å; T329-R496 VanDerWaalsContact C-NH1 3.3Å; T329-R496 PolarHBondContact O-NH1 2.84Å; D330-R496 PolarHBondContact O-NH1 2.93Å; G331-R496 PolarHBondContact O-NH2 3.21Å; I333-R496 HydrophobicContact CD1-CB 3.65Å; T492-R496 PolarHBondContact N-O 3.09Å; T492-R496 WeakPolarHBondContact OG1-CB 3.47Å; T492-R496 PolarHBondContact OG1-N 2.94Å; T492-R496 VanDerWaalsContact OG1-N 3.08Å; T492-R496 PolarHBondContact OG1-O 3.39Å; A494-R496 VanDerWaalsContact C-N 3.26Å; A494-R496 PolarHBondContact O-N 2.81Å
497	D	87.8	Confident	89.9	Confident	103 Å²	103	38.4 Å²	38.4	55%	0.551	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-99.7	155.7	171.2	57.9	-37.9	0	0	0	112.1	V490 L491	V490-D497 WeakPolarHBondContact O-CA 3.25Å; L491-D497 HydrophobicContact CD1-CB 4.19Å
498	D	89.9	Confident	88.9	Confident	26 Å²	26	41.8 Å²	41.8	14%	0.139	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	156	173.4	-165	2.5	0	0	0	110.9	I333 I334 H338 V490	I333-D498 WeakPolarHBondContact CA-OD2 3.47Å; I333-D498 HydrophobicContact CB-CB 3.77Å; I333-D498 WeakPolarHBondContact CB-OD2 3.13Å; I333-D498 HydrophobicContact CD1-CB 3.97Å; I333-D498 HydrophobicContact CG1-CB 4.11Å; I333-D498 PolarHBondContact N-OD2 2.7Å; I334-D498 HydrophobicContact CD1-CB 4.1Å; I334-D498 HydrophobicContact CG1-CB 4.11Å; I334-D498 PolarHBondContact N-OD2 3.5Å; H338-D498 IonicContact CE1-OD1 2.84Å; H338-D498 PolarHBondContact CE1-OD1 2.98Å; H338-D498 IonicContact CE1-OD2 3.24Å; H338-D498 PolarHBondContact CE1-OD2 3.39Å; H338-D498 IonicContact ND1-OD1 3Å; H338-D498 PolarHBondContact ND1-OD1 3.38Å; V490-D498 PolarHBondContact N-O 2.67Å; V490-D498 PolarHBondContact O-N 3.24Å
499	H	92.6	Very high	87.1	Confident	29 Å²	29	44.2 Å²	44.2	13%	0.134	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	134.7	-171.1	-61.2	-37.9	0	0	0	112.6	H338 A391 V487 C488 S489 F501	H338-H499 PolarHBondContact ND1-O 3.32Å; A391-H499 PolarHBondContact N-NE2 3.3Å; A391-H499 VanDerWaalsContact N-NE2 3.19Å; V487-H499 HydrophobicContact CG2-CB 4.14Å; C488-H499 WeakPolarHBondContact O-CA 3.13Å; S489-H499 PolarHBondContact OG-CE1 3.47Å; S489-H499 PolarHBondContact OG-ND1 3.13Å; H499-F501 HydrophobicContact CB-CE2 4.09Å; H499-F501 HydrophobicContact CB-CZ 4Å
500	K	93.6	Very high	84.8	Confident	13 Å²	13	48.7 Å²	48.7	6%	0.057	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	120.5	173.6	173.2	170.3	-178.9	175.6	0	110.1	I334 E335 P337 H338 H353 V487 C488	I334-K500 HydrophobicContact CD1-CB 3.75Å; I334-K500 HydrophobicContact CG2-CB 3.97Å; I334-K500 HydrophobicContact CG2-CD 3.51Å; I334-K500 HydrophobicContact CG2-CG 4.41Å; E335-K500 PolarHBondContact O-NZ 3.02Å; P337-K500 WeakPolarHBondContact O-CE 3.3Å; H338-K500 CarbonylContact O-C 3.49Å; H338-K500 WeakPolarHBondContact O-CA 3.44Å; H353-K500 WeakPolarHBondContact O-CE 3.24Å; H353-K500 PolarHBondContact O-NZ 3.25Å; V487-K500 CarbonylContact C-O 3.44Å; V487-K500 WeakPolarHBondContact CA-O 3.32Å; C488-K500 HydrophobicContact CB-CB 4.34Å; C488-K500 PolarHBondContact N-O 3.38Å; C488-K500 PolarHBondContact O-N 3.4Å
501	F	94.7	Very high	82.3	Confident	46 Å²	46	53.8 Å²	53.8	20%	0.202	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	138.9	-176.3	-57.8	-79.7	0	0	0	112	H338 I339 I340 A391 F395 R485 Y486 V487 H499	H338-F501 PolarHBondContact O-N 3.44Å; I339-F501 WeakPolarHBondContact CA-O 3.29Å; I339-F501 HydrophobicContact CG1-CD2 4.5Å; I340-F501 PolarHBondContact N-O 3.22Å; A391-F501 HydrophobicContact CB-CE1 4.2Å; A391-F501 HydrophobicContact CB-CZ 3.58Å; F395-F501 HydrophobicContact CZ-CE1 4.27Å; R485-F501 HydrophobicContact CG-CD1 4.35Å; Y486-F501 CarbonylContact O-C 3.55Å; Y486-F501 WeakPolarHBondContact O-CA 3.5Å; V487-F501 HydrophobicContact CB-CD1 3.92Å; V487-F501 HydrophobicContact CB-CE1 3.98Å; V487-F501 HydrophobicContact CG2-CD1 3.72Å; V487-F501 HydrophobicContact CG2-CE1 3.5Å; V487-F501 HydrophobicContact CG2-CZ 4.15Å; H499-F501 HydrophobicContact CB-CE2 4.09Å; H499-F501 HydrophobicContact CB-CZ 4Å
502	V	95.4	Very high	80.3	Confident	1 Å²	1	58 Å²	58	1%	0.006	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	111.5	172.8	-171.6	0	0	0	0	108.3	I340 F352 W368 Y486 I504	I340-V502 HydrophobicContact CB-CG1 4.33Å; I340-V502 HydrophobicContact CB-CG2 4.35Å; I340-V502 HydrophobicContact CG2-CG1 4.14Å; I340-V502 CarbonylContact O-C 3.53Å; I340-V502 WeakPolarHBondContact O-CA 3.34Å; F352-V502 HydrophobicContact CB-CG2 4.29Å; F352-V502 HydrophobicContact CD1-CG1 3.71Å; F352-V502 HydrophobicContact CD2-CG1 4.29Å; F352-V502 HydrophobicContact CE1-CG1 3.97Å; F352-V502 HydrophobicContact CG-CG1 3.89Å; F352-V502 HydrophobicContact CZ-CG1 4.36Å; W368-V502 HydrophobicContact CH2-CG2 4.34Å; W368-V502 HydrophobicContact CZ3-CG2 3.99Å; Y486-V502 PolarHBondContact N-O 2.03Å; Y486-V502 PolarHBondContact O-N 2.85Å; V502-I504 HydrophobicContact CG1-CD1 4.25Å; V502-I504 HydrophobicContact CG1-CG1 3.79Å
503	Q	95.4	Very high	78	Confident	57 Å²	57	67.1 Å²	67.1	27%	0.266	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	106.8	175.5	-172.2	70.2	58.5	0	0	108.6	I340 N341 E342 G484 R485	I340-Q503 PolarHBondContact O-N 2.59Å; N341-Q503 WeakPolarHBondContact OD1-CB 3.04Å; E342-Q503 PolarHBondContact N-O 3.19Å; G484-Q503 VanDerWaalsContact C-NE2 3.34Å; G484-Q503 PolarHBondContact O-NE2 3.44Å; R485-Q503 VanDerWaalsContact NE-OE1 3.11Å
504	I	94.7	Very high	75.9	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.005	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	127.9	-177.1	-54.9	-178.7	0	0	0	109.2	V344 F352 L473 L475 S483 G484 Y486 V502 V506	V344-I504 HydrophobicContact CG2-CG2 4.12Å; F352-I504 HydrophobicContact CD2-CD1 4.02Å; F352-I504 HydrophobicContact CE2-CD1 3.41Å; F352-I504 VanDerWaalsContact CE2-CD1 3.41Å; F352-I504 HydrophobicContact CE2-CG1 4.16Å; F352-I504 HydrophobicContact CZ-CD1 3.94Å; F352-I504 HydrophobicContact CZ-CG1 4.19Å; L473-I504 HydrophobicContact CD2-CD1 4.24Å; L475-I504 HydrophobicContact CD1-CD1 3.81Å; L475-I504 HydrophobicContact CD2-CD1 3.65Å; L475-I504 HydrophobicContact CD2-CG2 4.01Å; L475-I504 HydrophobicContact CG-CD1 4.41Å; S483-I504 WeakPolarHBondContact CA-O 3.15Å; G484-I504 PolarHBondContact N-O 2.81Å; G484-I504 PolarHBondContact O-N 2.83Å; Y486-I504 HydrophobicContact CD2-CB 4.38Å; Y486-I504 HydrophobicContact CD2-CD1 3.63Å; Y486-I504 HydrophobicContact CD2-CG1 3.92Å; Y486-I504 HydrophobicContact CE2-CB 4.27Å; Y486-I504 HydrophobicContact CE2-CD1 3.73Å; Y486-I504 HydrophobicContact CE2-CG1 4.18Å; Y486-I504 HydrophobicContact CG-CD1 4.33Å; V502-I504 HydrophobicContact CG1-CD1 4.25Å; V502-I504 HydrophobicContact CG1-CG1 3.79Å; I504-V506 HydrophobicContact CG2-CG2 4.13Å
505	S	93.7	Very high	74.1	Confident	54 Å²	54	68.5 Å²	68.5	38%	0.378	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	107	173.8	-56.8	0	0	0	0	109.7	E342 T343 V344	E342-S505 PolarHBondContact O-N 3Å; T343-S505 WeakPolarHBondContact CA-O 3.35Å; V344-S505 PolarHBondContact N-O 3.16Å; V344-S505 VanDerWaalsContact N-O 3.1Å
506	V	91.9	Very high	71.7	Confident	5 Å²	5	75.6 Å²	75.6	3%	0.03	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	134.5	179.3	-175.7	0	0	0	0	110	V344 A346 A478 S479 Q480 D482 S483 I504	V344-V506 CarbonylContact O-C 3.56Å; V344-V506 VanDerWaalsContact O-CA 3.26Å; V344-V506 WeakPolarHBondContact O-CA 3.34Å; A346-V506 HydrophobicContact CB-CG1 3.95Å; A478-V506 HydrophobicContact CB-CG1 4.15Å; A478-V506 HydrophobicContact CB-CG2 4.12Å; S479-V506 WeakPolarHBondContact O-CB 2.99Å; S479-V506 WeakPolarHBondContact O-CG2 3.45Å; Q480-V506 PolarHBondContact NE2-O 3.19Å; D482-V506 HydrophobicContact CB-CG2 4.36Å; S483-V506 WeakPolarHBondContact OG-CB 3.42Å; S483-V506 PolarHBondContact OG-N 3.04Å; S483-V506 VanDerWaalsContact OG-N 3.08Å; I504-V506 HydrophobicContact CG2-CG2 4.13Å
507	V	89.4	Confident	69.5	Low	72 Å²	72	78 Å²	78	44%	0.436	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.2	-175.9	-66.1	0	0	0	0	112.1	V344 E345 A346	V344-V507 PolarHBondContact O-N 3.29Å; E345-V507 CarbonylContact C-O 3.49Å; E345-V507 WeakPolarHBondContact CA-O 3.41Å; E345-V507 HydrophobicContact CG-CG2 4.28Å; A346-V507 PolarHBondContact N-O 2.77Å
508	G	72.4	Confident	67.2	Low	71 Å²	71	78.6 Å²	78.6	73%	0.732	46%	0.455	S	S	*	.			trans	97.6	27.7	167.8	0	0	0	0	0	117.9
509	G	58.3	Low	64.9	Low	51 Å²	51	80.5 Å²	80.5	53%	0.526	48%	0.482	S	S	.	.			trans	-98.1	46.1	-177.5	0	0	0	0	0	116.9
510	S	43.7	Very low	62.6	Low	104 Å²	104	82.9 Å²	82.9	73%	0.727	50%	0.501	S	S	*	.			trans	-134.6	132.3	-179.7	-161.8	0	0	0	0	112.9
511	L	40.6	Very low	60.5	Low	107 Å²	107	84.2 Å²	84.2	56%	0.56	51%	0.513	S	S	*	.			trans	65.6	147	-150	-65.9	68.3	0	0	0	110.5
512	I	45.8	Very low	58.5	Low	158 Å²	158	84.9 Å²	84.9	81%	0.81	53%	0.532	S	S	*	.			cis	-129.3	117.7	19.8	-57.2	162.9	0	0	0	111.5
513	Q	38.1	Very low	56.5	Low	198 Å²	198	89.7 Å²	89.7	93%	0.925	56%	0.562	S	S	*	*	S	Bend	trans	-138.4	113.7	141.6	-165.6	166.4	8.2	0	0	108.9
514	G	34.4	Very low	54.5	Low	71 Å²	71	92.2 Å²	92.2	73%	0.732	57%	0.573	S	S	*	*	S	Bend	trans	82.2	11.9	161	0	0	0	0	0	119.9
515	H	37.8	Very low	53	Low	151 Å²	151	99.3 Å²	99.3	70%	0.699	60%	0.6	S	S	*	*			trans	-145	126.6	163.5	-128.6	-89.5	0	0	0	116.8	L517	H515-L517 PolarHBondContact O-N 2.92Å
516	K	30	Very low	52	Low	205 Å²	205	102.1 Å²	102.1	89%	0.891	61%	0.61	S	S	*	*			trans	-83.2	77.9	-178.3	178.9	-172.2	171.5	179.3	0	111.2
517	L	40.2	Very low	51.2	Low	116 Å²	116	106 Å²	106	61%	0.607	63%	0.634	S	S	*	*			trans	-149.2	97.5	171.3	-88.6	-179.2	0	0	0	114.2	H515 G519	H515-L517 PolarHBondContact O-N 2.92Å; L517-G519 PolarHBondContact O-N 2.62Å
518	T	38.6	Very low	50.8	Low	114 Å²	114	107.1 Å²	107.1	70%	0.699	64%	0.637	S	S	*	*			trans	39.6	75.4	142.5	59.4	0	0	0	0	118.4	S520	T518-S520 PolarHBondContact O-N 2.69Å
519	G	41	Very low	51.3	Low	67 Å²	67	112.5 Å²	112.5	69%	0.691	64%	0.636	S	S	*	*	S	Bend	trans	-78.9	24.1	-176.1	0	0	0	0	0	118.7	L517 S521	L517-G519 PolarHBondContact O-N 2.62Å; G519-S521 PolarHBondContact O-N 2.93Å
520	S	45.8	Very low	52.6	Low	78 Å²	78	114.9 Å²	114.9	55%	0.545	64%	0.636	S	S	.	*			trans	-86.8	11.5	169.7	-164.1	0	0	0	0	112.2	T518 G522 H524	T518-S520 PolarHBondContact O-N 2.69Å; S520-G522 PolarHBondContact O-N 3.4Å; S520-H524 WeakPolarHBondContact O-CB 3.3Å; S520-H524 PolarHBondContact O-CD2 2.84Å; S520-H524 PolarHBondContact OG-CD2 3.35Å; S520-H524 VanDerWaalsContact OG-CD2 3.23Å
521	S	49.1	Very low	54.4	Low	42 Å²	42	111.7 Å²	111.7	29%	0.294	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.3	10.2	-149.6	56.8	0	0	0	0	116.5	G519 R525	G519-S521 PolarHBondContact O-N 2.93Å; S521-R525 WeakPolarHBondContact O-CB 3.32Å; S521-R525 VanDerWaalsContact O-CD 3.27Å; S521-R525 WeakPolarHBondContact O-CD 3.35Å; S521-R525 WeakPolarHBondContact O-CG 3.36Å; S521-R525 PolarHBondContact O-N 2.92Å
522	G	52.1	Low	56.7	Low	60 Å²	60	110.8 Å²	110.8	62%	0.619	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-76.1	171.6	0	0	0	0	0	110.5	S520 H524 R525 L526	S520-G522 PolarHBondContact O-N 3.4Å; G522-H524 PolarHBondContact O-N 3.4Å; G522-R525 PolarHBondContact O-N 2.78Å; G522-L526 PolarHBondContact O-N 3.19Å
523	T	53.6	Low	58.9	Low	102 Å²	102	106.7 Å²	106.7	63%	0.626	60%	0.595	S	S	*	*	H	α-helix	trans	-59.1	-45.3	174.7	48.9	0	0	0	0	111.9	R525 L526 T527	T523-R525 VanDerWaalsContact C-N 3.3Å; T523-R525 PolarHBondContact O-N 2.82Å; T523-L526 PolarHBondContact O-N 2.9Å; T523-L526 VanDerWaalsContact O-N 3.13Å; T523-T527 PolarHBondContact O-N 2.84Å; T523-T527 PolarHBondContact O-OG1 3.18Å; T523-T527 VanDerWaalsContact O-OG1 3.08Å
524	H	53.8	Low	61.4	Low	110 Å²	110	100.4 Å²	100.4	51%	0.509	57%	0.57	S	S	.	*	H	α-helix	trans	-63.8	-29	179.3	-82.2	-93.6	0	0	0	114	S520 G522 L528	S520-H524 WeakPolarHBondContact O-CB 3.3Å; S520-H524 PolarHBondContact O-CD2 2.84Å; S520-H524 PolarHBondContact OG-CD2 3.35Å; S520-H524 VanDerWaalsContact OG-CD2 3.23Å; G522-H524 PolarHBondContact O-N 3.4Å; H524-L528 VanDerWaalsContact O-CB 3.29Å; H524-L528 WeakPolarHBondContact O-CB 3.4Å; H524-L528 WeakPolarHBondContact O-CG 3.29Å; H524-L528 PolarHBondContact O-N 2.97Å
525	R	62.4	Low	64	Low	150 Å²	150	100.7 Å²	100.7	57%	0.566	56%	0.557	S	S	*	*	H	α-helix	trans	-72.1	-43	171.7	-78.3	179.5	-179.4	-171.2	2.4	111.3	S521 G522 T523 T527 L528 Y529	S521-R525 WeakPolarHBondContact O-CB 3.32Å; S521-R525 VanDerWaalsContact O-CD 3.27Å; S521-R525 WeakPolarHBondContact O-CD 3.35Å; S521-R525 WeakPolarHBondContact O-CG 3.36Å; S521-R525 PolarHBondContact O-N 2.92Å; G522-R525 PolarHBondContact O-N 2.78Å; T523-R525 VanDerWaalsContact C-N 3.3Å; T523-R525 PolarHBondContact O-N 2.82Å; R525-T527 VanDerWaalsContact C-N 3.33Å; R525-T527 PolarHBondContact O-N 2.81Å; R525-L528 PolarHBondContact O-N 3.33Å; R525-Y529 HydrophobicContact CB-CD2 4.36Å; R525-Y529 HydrophobicContact CB-CE2 4.42Å; R525-Y529 WeakPolarHBondContact O-CB 3.43Å; R525-Y529 WeakPolarHBondContact O-CD2 3.38Å; R525-Y529 PolarHBondContact O-N 3.16Å
526	L	74	Confident	66.7	Low	113 Å²	113	98.1 Å²	98.1	59%	0.592	55%	0.548	S	S	*	.	H	α-helix	trans	-58.4	-47.3	174.3	-170.5	75.3	0	0	0	110.8	G522 T523 L528 Y529 I530	G522-L526 PolarHBondContact O-N 3.19Å; T523-L526 PolarHBondContact O-N 2.9Å; T523-L526 VanDerWaalsContact O-N 3.13Å; L526-L528 PolarHBondContact O-N 3.32Å; L526-Y529 PolarHBondContact O-N 2.92Å; L526-I530 HydrophobicContact CG-CD1 4.06Å; L526-I530 WeakPolarHBondContact O-CG1 3.43Å; L526-I530 PolarHBondContact O-N 2.65Å
527	T	75.2	Confident	69.6	Low	85 Å²	85	94.5 Å²	94.5	52%	0.521	53%	0.532	S	S	.	.	H	α-helix	trans	-61.7	-39.6	175.8	-55.9	0	0	0	0	111.9	T523 R525 I530 A531	T523-T527 PolarHBondContact O-N 2.84Å; T523-T527 PolarHBondContact O-OG1 3.18Å; T523-T527 VanDerWaalsContact O-OG1 3.08Å; R525-T527 VanDerWaalsContact C-N 3.33Å; R525-T527 PolarHBondContact O-N 2.81Å; T527-I530 PolarHBondContact O-N 3.25Å; T527-A531 WeakPolarHBondContact O-CA 3.33Å; T527-A531 WeakPolarHBondContact O-CB 3.24Å; T527-A531 PolarHBondContact O-N 2.93Å
528	L	80.3	Confident	72.1	Confident	96 Å²	96	95.5 Å²	95.5	50%	0.503	53%	0.532	S	S	.	.	H	α-helix	trans	-65.7	-44.1	173.3	-89.2	160	0	0	0	112.8	H524 R525 L526 I530 A531 I532	H524-L528 VanDerWaalsContact O-CB 3.29Å; H524-L528 WeakPolarHBondContact O-CB 3.4Å; H524-L528 WeakPolarHBondContact O-CG 3.29Å; H524-L528 PolarHBondContact O-N 2.97Å; R525-L528 PolarHBondContact O-N 3.33Å; L526-L528 PolarHBondContact O-N 3.32Å; L528-I530 PolarHBondContact O-N 3.16Å; L528-A531 PolarHBondContact O-N 2.93Å; L528-I532 HydrophobicContact CD2-CD1 3.94Å; L528-I532 HydrophobicContact CD2-CG1 4.29Å; L528-I532 WeakPolarHBondContact O-CB 3.25Å; L528-I532 WeakPolarHBondContact O-CG1 3.47Å; L528-I532 PolarHBondContact O-N 3.48Å
529	Y	83	Confident	74.7	Confident	184 Å²	184	95.1 Å²	95.1	72%	0.722	53%	0.525	S	S	*	.	H	α-helix	trans	-64.8	-23.4	177.4	-82.3	-62.9	0	0	0	113.2	R525 L526 P533	R525-Y529 HydrophobicContact CB-CD2 4.36Å; R525-Y529 HydrophobicContact CB-CE2 4.42Å; R525-Y529 WeakPolarHBondContact O-CB 3.43Å; R525-Y529 WeakPolarHBondContact O-CD2 3.38Å; R525-Y529 PolarHBondContact O-N 3.16Å; L526-Y529 PolarHBondContact O-N 2.92Å; Y529-P533 WeakPolarHBondContact O-CD 3.48Å; Y529-P533 VanDerWaalsContact O-CG 3.24Å; Y529-P533 WeakPolarHBondContact O-CG 3.37Å
530	I	85.6	Confident	77.3	Confident	101 Å²	101	95.4 Å²	95.4	52%	0.518	52%	0.515	S	S	.	.	H	α-helix	trans	-90.5	-39.9	172.6	-63.7	168.2	0	0	0	111.1	L526 T527 L528 T534	L526-I530 HydrophobicContact CG-CD1 4.06Å; L526-I530 WeakPolarHBondContact O-CG1 3.43Å; L526-I530 PolarHBondContact O-N 2.65Å; T527-I530 PolarHBondContact O-N 3.25Å; L528-I530 PolarHBondContact O-N 3.16Å; I530-T534 HydrophobicContact CG2-CG2 4.49Å; I530-T534 WeakPolarHBondContact O-CB 3.42Å; I530-T534 VanDerWaalsContact O-CG2 3.3Å; I530-T534 WeakPolarHBondContact O-CG2 3.38Å; I530-T534 PolarHBondContact O-N 3.29Å; I530-T534 PolarHBondContact O-OG1 3.24Å
531	A	82.1	Confident	79.6	Confident	37 Å²	37	95.3 Å²	95.3	31%	0.306	51%	0.508	S	S	.	.	H	α-helix	trans	-70.3	-37.7	-177.4	0	0	0	0	0	113.2	T527 L528 T534 T535	T527-A531 WeakPolarHBondContact O-CA 3.33Å; T527-A531 WeakPolarHBondContact O-CB 3.24Å; T527-A531 PolarHBondContact O-N 2.93Å; L528-A531 PolarHBondContact O-N 2.93Å; A531-T534 WeakPolarHBondContact CA-OG1 3.3Å; A531-T534 PolarHBondContact O-OG1 2.91Å; A531-T535 WeakPolarHBondContact O-CB 3.49Å; A531-T535 VanDerWaalsContact O-CG2 3.29Å; A531-T535 WeakPolarHBondContact O-CG2 3.49Å; A531-T535 PolarHBondContact O-N 3.33Å; A531-T535 PolarHBondContact O-OG1 3.35Å
532	I	88.1	Confident	81.7	Confident	88 Å²	88	97.2 Å²	97.2	45%	0.451	52%	0.521	S	S	.	.	H	α-helix	trans	-65.6	-52.1	-179.4	-69.4	167.5	0	0	0	111.2	L528 T534 T535 I536	L528-I532 HydrophobicContact CD2-CD1 3.94Å; L528-I532 HydrophobicContact CD2-CG1 4.29Å; L528-I532 WeakPolarHBondContact O-CB 3.25Å; L528-I532 WeakPolarHBondContact O-CG1 3.47Å; L528-I532 PolarHBondContact O-N 3.48Å; I532-T534 PolarHBondContact O-N 2.83Å; I532-T535 PolarHBondContact O-N 2.85Å; I532-T535 PolarHBondContact O-OG1 2.91Å; I532-T535 VanDerWaalsContact O-OG1 3.1Å; I532-I536 HydrophobicContact CG2-CD1 3.75Å; I532-I536 WeakPolarHBondContact O-CB 3.45Å; I532-I536 WeakPolarHBondContact O-CD1 3.24Å; I532-I536 VanDerWaalsContact O-CG1 3.25Å; I532-I536 WeakPolarHBondContact O-CG1 3.34Å; I532-I536 PolarHBondContact O-N 2.88Å
533	P	92	Very high	83.7	Confident	73 Å²	73	98.4 Å²	98.4	47%	0.474	52%	0.516	S	S	.	.	H	α-helix	trans	-63.1	-38.9	176.4	-24.2	35.9	0	0	0	113.4	Y529 F537	Y529-P533 WeakPolarHBondContact O-CD 3.48Å; Y529-P533 VanDerWaalsContact O-CG 3.24Å; Y529-P533 WeakPolarHBondContact O-CG 3.37Å; P533-F537 VanDerWaalsContact O-CB 3.28Å; P533-F537 WeakPolarHBondContact O-CB 3.43Å; P533-F537 PolarHBondContact O-N 3.18Å
534	T	89.8	Confident	85.6	Confident	65 Å²	65	97.4 Å²	97.4	40%	0.399	51%	0.509	S	S	.	.	H	α-helix	trans	-69.8	-40.7	179.9	52	0	0	0	0	112.5	I530 A531 I532 F537 F538	I530-T534 HydrophobicContact CG2-CG2 4.49Å; I530-T534 WeakPolarHBondContact O-CB 3.42Å; I530-T534 VanDerWaalsContact O-CG2 3.3Å; I530-T534 WeakPolarHBondContact O-CG2 3.38Å; I530-T534 PolarHBondContact O-N 3.29Å; I530-T534 PolarHBondContact O-OG1 3.24Å; A531-T534 WeakPolarHBondContact CA-OG1 3.3Å; A531-T534 PolarHBondContact O-OG1 2.91Å; I532-T534 PolarHBondContact O-N 2.83Å; T534-F537 PolarHBondContact O-N 2.96Å; T534-F538 VanDerWaalsContact O-CD2 3.3Å; T534-F538 WeakPolarHBondContact O-CD2 3.42Å; T534-F538 PolarHBondContact O-N 3.19Å
535	T	89.9	Confident	87.4	Confident	77 Å²	77	95.7 Å²	95.7	47%	0.472	51%	0.506	S	S	.	.	H	α-helix	trans	-66.2	-41.3	174.9	51.1	0	0	0	0	112.2	A531 I532 F537 F538 I539	A531-T535 WeakPolarHBondContact O-CB 3.49Å; A531-T535 VanDerWaalsContact O-CG2 3.29Å; A531-T535 WeakPolarHBondContact O-CG2 3.49Å; A531-T535 PolarHBondContact O-N 3.33Å; A531-T535 PolarHBondContact O-OG1 3.35Å; I532-T535 PolarHBondContact O-N 2.85Å; I532-T535 PolarHBondContact O-OG1 2.91Å; I532-T535 VanDerWaalsContact O-OG1 3.1Å; T535-F537 PolarHBondContact O-N 2.98Å; T535-F538 PolarHBondContact O-N 3Å; T535-I539 VanDerWaalsContact O-CG1 3.27Å; T535-I539 WeakPolarHBondContact O-CG1 3.07Å; T535-I539 PolarHBondContact O-N 3.01Å
536	I	94.1	Very high	88.8	Confident	98 Å²	98	96.1 Å²	96.1	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-59.8	-45.5	172.6	-68.7	167.9	0	0	0	110.8	I532 F538 I539 C540	I532-I536 HydrophobicContact CG2-CD1 3.75Å; I532-I536 WeakPolarHBondContact O-CB 3.45Å; I532-I536 WeakPolarHBondContact O-CD1 3.24Å; I532-I536 VanDerWaalsContact O-CG1 3.25Å; I532-I536 WeakPolarHBondContact O-CG1 3.34Å; I532-I536 PolarHBondContact O-N 2.88Å; I536-F538 PolarHBondContact O-N 2.83Å; I536-I539 PolarHBondContact O-N 3.45Å; I536-C540 PolarHBondContact O-N 3.47Å
537	F	92.1	Very high	89.6	Confident	129 Å²	129	93.9 Å²	93.9	57%	0.566	50%	0.502	S	S	*	.	H	α-helix	trans	-61.7	-43.2	177.3	-178.5	-105.1	0	0	0	112.4	P533 T534 T535 C540 L541	P533-F537 VanDerWaalsContact O-CB 3.28Å; P533-F537 WeakPolarHBondContact O-CB 3.43Å; P533-F537 PolarHBondContact O-N 3.18Å; T534-F537 PolarHBondContact O-N 2.96Å; T535-F537 PolarHBondContact O-N 2.98Å; F537-C540 PolarHBondContact O-N 3.12Å; F537-L541 HydrophobicContact CD1-CD1 3.93Å; F537-L541 HydrophobicContact CD1-CG 4.44Å; F537-L541 HydrophobicContact CE1-CD1 3.45Å; F537-L541 VanDerWaalsContact CE1-CD1 3.45Å; F537-L541 HydrophobicContact CE1-CG 4.14Å; F537-L541 HydrophobicContact CZ-CD1 3.9Å; F537-L541 HydrophobicContact CZ-CD2 4.46Å; F537-L541 HydrophobicContact CZ-CG 4.23Å; F537-L541 WeakPolarHBondContact O-CG 3.48Å; F537-L541 PolarHBondContact O-N 3.33Å
538	F	91.6	Very high	90.3	Very high	136 Å²	136	95 Å²	95	60%	0.596	51%	0.505	S	S	*	.	H	α-helix	trans	-62.9	-42.1	173.8	-90.3	-69.8	0	0	0	112.5	T534 T535 I536 C540 L541 C542	T534-F538 VanDerWaalsContact O-CD2 3.3Å; T534-F538 WeakPolarHBondContact O-CD2 3.42Å; T534-F538 PolarHBondContact O-N 3.19Å; T535-F538 PolarHBondContact O-N 3Å; I536-F538 PolarHBondContact O-N 2.83Å; F538-C540 PolarHBondContact O-N 2.84Å; F538-L541 PolarHBondContact O-N 3.34Å; F538-C542 WeakPolarHBondContact O-CB 3.48Å; F538-C542 PolarHBondContact O-N 3.4Å; F538-C542 PolarHBondContact O-SG 2.03Å; F538-C542 VanDerWaalsContact O-SG 3.34Å
539	I	94.3	Very high	90.5	Very high	106 Å²	106	95.2 Å²	95.2	54%	0.544	51%	0.505	S	S	.	.	H	α-helix	trans	-61	-44.8	175.3	-69.2	163.8	0	0	0	110.4	T535 I536 L541 C542 V543	T535-I539 VanDerWaalsContact O-CG1 3.27Å; T535-I539 WeakPolarHBondContact O-CG1 3.07Å; T535-I539 PolarHBondContact O-N 3.01Å; I536-I539 PolarHBondContact O-N 3.45Å; I539-L541 PolarHBondContact O-N 3.19Å; I539-C542 PolarHBondContact O-N 3.28Å; I539-V543 HydrophobicContact CG2-CG2 4.47Å; I539-V543 WeakPolarHBondContact O-CG2 3.42Å; I539-V543 PolarHBondContact O-N 3.25Å
540	C	93.8	Very high	90.6	Very high	73 Å²	73	88.3 Å²	88.3	49%	0.493	48%	0.484	S	S	.	.	H	α-helix	trans	-60	-45.1	173.9	-76.7	0	0	0	0	112.5	I536 F537 F538 C542 V543 V544	I536-C540 PolarHBondContact O-N 3.47Å; F537-C540 PolarHBondContact O-N 3.12Å; F538-C540 PolarHBondContact O-N 2.84Å; C540-C542 VanDerWaalsContact C-N 3.35Å; C540-C542 PolarHBondContact O-N 2.55Å; C540-V543 PolarHBondContact O-N 3.04Å; C540-V544 WeakPolarHBondContact O-CB 3.34Å; C540-V544 WeakPolarHBondContact O-CG2 3.48Å; C540-V544 PolarHBondContact O-N 2.86Å
541	L	94.3	Very high	90.3	Very high	77 Å²	77	93 Å²	93	40%	0.403	50%	0.495	S	S	.	.	H	α-helix	trans	-61.9	-40.9	175.1	-74.8	179.9	0	0	0	111.9	F537 F538 I539 T545	F537-L541 HydrophobicContact CD1-CD1 3.93Å; F537-L541 HydrophobicContact CD1-CG 4.44Å; F537-L541 HydrophobicContact CE1-CD1 3.45Å; F537-L541 VanDerWaalsContact CE1-CD1 3.45Å; F537-L541 HydrophobicContact CE1-CG 4.14Å; F537-L541 HydrophobicContact CZ-CD1 3.9Å; F537-L541 HydrophobicContact CZ-CD2 4.46Å; F537-L541 HydrophobicContact CZ-CG 4.23Å; F537-L541 WeakPolarHBondContact O-CG 3.48Å; F537-L541 PolarHBondContact O-N 3.33Å; F538-L541 PolarHBondContact O-N 3.34Å; I539-L541 PolarHBondContact O-N 3.19Å; L541-T545 WeakPolarHBondContact O-CB 3.4Å; L541-T545 PolarHBondContact O-N 3.37Å; L541-T545 PolarHBondContact O-OG1 3.05Å
542	C	92.9	Very high	89.8	Confident	82 Å²	82	100.6 Å²	100.6	55%	0.554	52%	0.516	S	S	*	.	H	α-helix	trans	-64.7	-44	176.4	-73.9	0	0	0	0	111.8	F538 I539 C540 T545 Y546	F538-C542 WeakPolarHBondContact O-CB 3.48Å; F538-C542 PolarHBondContact O-N 3.4Å; F538-C542 PolarHBondContact O-SG 2.03Å; F538-C542 VanDerWaalsContact O-SG 3.34Å; I539-C542 PolarHBondContact O-N 3.28Å; C540-C542 VanDerWaalsContact C-N 3.35Å; C540-C542 PolarHBondContact O-N 2.55Å; C542-T545 PolarHBondContact O-N 2.83Å; C542-Y546 VanDerWaalsContact O-CB 3.24Å; C542-Y546 WeakPolarHBondContact O-CB 3.36Å; C542-Y546 PolarHBondContact O-N 2.8Å
543	V	94.4	Very high	88.7	Confident	84 Å²	84	100 Å²	100	51%	0.509	52%	0.516	S	S	.	.	H	α-helix	trans	-64.8	-47.2	177	170.9	0	0	0	0	111.3	I539 C540 T545 Y546 C547	I539-V543 HydrophobicContact CG2-CG2 4.47Å; I539-V543 WeakPolarHBondContact O-CG2 3.42Å; I539-V543 PolarHBondContact O-N 3.25Å; C540-V543 PolarHBondContact O-N 3.04Å; V543-T545 PolarHBondContact O-N 3.16Å; V543-Y546 PolarHBondContact O-N 2.94Å; V543-C547 WeakPolarHBondContact O-CB 3.39Å; V543-C547 PolarHBondContact O-N 3.34Å; V543-C547 PolarHBondContact O-SG 3.08Å
544	V	93.9	Very high	87.1	Confident	82 Å²	82	99 Å²	99	50%	0.497	52%	0.515	S	S	.	.	H	α-helix	trans	-60.1	-46.6	175.3	169.7	0	0	0	0	110.7	C540 Y546 C547 L548	C540-V544 WeakPolarHBondContact O-CB 3.34Å; C540-V544 WeakPolarHBondContact O-CG2 3.48Å; C540-V544 PolarHBondContact O-N 2.86Å; V544-Y546 PolarHBondContact O-N 2.77Å; V544-C547 PolarHBondContact O-N 3.04Å; V544-L548 HydrophobicContact CG1-CD1 3.92Å; V544-L548 HydrophobicContact CG1-CG 4.44Å; V544-L548 WeakPolarHBondContact O-CB 3.23Å; V544-L548 VanDerWaalsContact O-CG 3.31Å; V544-L548 WeakPolarHBondContact O-CG 3.31Å; V544-L548 PolarHBondContact O-N 3.05Å
545	T	91.2	Very high	85.5	Confident	73 Å²	73	102.8 Å²	102.8	45%	0.448	53%	0.527	S	S	.	.	H	α-helix	trans	-60.1	-45.5	177.4	-55.1	0	0	0	0	111.4	L541 C542 V543 L548 I549	L541-T545 WeakPolarHBondContact O-CB 3.4Å; L541-T545 PolarHBondContact O-N 3.37Å; L541-T545 PolarHBondContact O-OG1 3.05Å; C542-T545 PolarHBondContact O-N 2.83Å; V543-T545 PolarHBondContact O-N 3.16Å; T545-L548 PolarHBondContact O-N 2.84Å; T545-I549 HydrophobicContact CG2-CD1 3.87Å; T545-I549 WeakPolarHBondContact O-CG1 3Å; T545-I549 PolarHBondContact O-N 3.39Å
546	Y	92.9	Very high	84	Confident	160 Å²	160	104.7 Å²	104.7	63%	0.627	54%	0.535	S	S	*	.	H	α-helix	trans	-62.5	-43.2	176.2	178.8	-96.2	0	0	0	112	C542 V543 V544 L548 I549 S550	C542-Y546 VanDerWaalsContact O-CB 3.24Å; C542-Y546 WeakPolarHBondContact O-CB 3.36Å; C542-Y546 PolarHBondContact O-N 2.8Å; V543-Y546 PolarHBondContact O-N 2.94Å; V544-Y546 PolarHBondContact O-N 2.77Å; Y546-L548 VanDerWaalsContact C-N 3.35Å; Y546-L548 PolarHBondContact O-N 2.92Å; Y546-I549 PolarHBondContact O-N 2.66Å; Y546-S550 WeakPolarHBondContact O-CB 3.35Å; Y546-S550 PolarHBondContact O-N 2.99Å; Y546-S550 PolarHBondContact O-OG 2.91Å; Y546-S550 VanDerWaalsContact O-OG 3.12Å
547	C	90.9	Very high	82	Confident	66 Å²	66	110 Å²	110	45%	0.446	55%	0.549	S	S	.	.	H	α-helix	trans	-64.5	-36.8	175.9	-73.4	0	0	0	0	112.4	V543 V544 R551	V543-C547 WeakPolarHBondContact O-CB 3.39Å; V543-C547 PolarHBondContact O-N 3.34Å; V543-C547 PolarHBondContact O-SG 3.08Å; V544-C547 PolarHBondContact O-N 3.04Å; C547-R551 VanDerWaalsContact O-CB 3.27Å; C547-R551 WeakPolarHBondContact O-CB 3.29Å; C547-R551 WeakPolarHBondContact O-CG 3.47Å; C547-R551 PolarHBondContact O-N 2.92Å
548	L	88.6	Confident	80.1	Confident	109 Å²	109	113.3 Å²	113.3	57%	0.571	56%	0.557	S	S	*	*	H	α-helix	trans	-68.9	-42.6	174.8	-71.9	170.4	0	0	0	112.2	V544 T545 Y546 R552	V544-L548 HydrophobicContact CG1-CD1 3.92Å; V544-L548 HydrophobicContact CG1-CG 4.44Å; V544-L548 WeakPolarHBondContact O-CB 3.23Å; V544-L548 VanDerWaalsContact O-CG 3.31Å; V544-L548 WeakPolarHBondContact O-CG 3.31Å; V544-L548 PolarHBondContact O-N 3.05Å; T545-L548 PolarHBondContact O-N 2.84Å; Y546-L548 VanDerWaalsContact C-N 3.35Å; Y546-L548 PolarHBondContact O-N 2.92Å; L548-R552 PolarHBondContact O-N 2.83Å
549	I	85.8	Confident	78.2	Confident	99 Å²	99	110.7 Å²	110.7	51%	0.508	56%	0.56	S	S	.	*	H	α-helix	trans	-65.3	-50.4	175.2	-68.7	169.1	0	0	0	110.4	T545 Y546 R551 R552 T553	T545-I549 HydrophobicContact CG2-CD1 3.87Å; T545-I549 WeakPolarHBondContact O-CG1 3Å; T545-I549 PolarHBondContact O-N 3.39Å; Y546-I549 PolarHBondContact O-N 2.66Å; I549-R551 VanDerWaalsContact C-N 3.32Å; I549-R551 PolarHBondContact O-N 2.84Å; I549-R552 CarbonylContact O-C 3.57Å; I549-R552 WeakPolarHBondContact O-CA 3.42Å; I549-R552 WeakPolarHBondContact O-CB 3.34Å; I549-R552 PolarHBondContact O-N 2.86Å; I549-T553 HydrophobicContact CG2-CG2 4.46Å; I549-T553 PolarHBondContact O-N 3.1Å; I549-T553 PolarHBondContact O-OG1 2.92Å
550	S	84.4	Confident	76.3	Confident	40 Å²	40	110.1 Å²	110.1	28%	0.28	57%	0.566	S	S	.	*	H	α-helix	trans	-59.6	-38.7	177.4	-71.3	0	0	0	0	112.4	Y546 T553 A554	Y546-S550 WeakPolarHBondContact O-CB 3.35Å; Y546-S550 PolarHBondContact O-N 2.99Å; Y546-S550 PolarHBondContact O-OG 2.91Å; Y546-S550 VanDerWaalsContact O-OG 3.12Å; S550-T553 WeakPolarHBondContact CA-OG1 3.33Å; S550-T553 PolarHBondContact O-OG1 2.86Å; S550-T553 VanDerWaalsContact O-OG1 3.08Å; S550-A554 VanDerWaalsContact O-CB 3.24Å; S550-A554 WeakPolarHBondContact O-CB 3.39Å; S550-A554 PolarHBondContact O-N 3.49Å
551	R	78.9	Confident	74.3	Confident	198 Å²	198	113.4 Å²	113.4	75%	0.747	58%	0.579	S	S	*	*	H	α-helix	trans	-62.3	-45.8	170.1	-86.6	-176	164.7	-175	-3.9	111.7	C547 I549 A554 H555	C547-R551 VanDerWaalsContact O-CB 3.27Å; C547-R551 WeakPolarHBondContact O-CB 3.29Å; C547-R551 WeakPolarHBondContact O-CG 3.47Å; C547-R551 PolarHBondContact O-N 2.92Å; I549-R551 VanDerWaalsContact C-N 3.32Å; I549-R551 PolarHBondContact O-N 2.84Å; R551-A554 PolarHBondContact O-N 3.08Å; R551-H555 WeakPolarHBondContact O-CB 3.38Å; R551-H555 PolarHBondContact O-N 3.15Å
552	R	72.8	Confident	72.3	Confident	197 Å²	197	115.3 Å²	115.3	74%	0.743	59%	0.593	S	S	*	*	H	α-helix	trans	-62.6	-42.9	176.7	-94.8	-177.6	165.9	170.4	-3.3	112.9	L548 I549 H555 N556	L548-R552 PolarHBondContact O-N 2.83Å; I549-R552 CarbonylContact O-C 3.57Å; I549-R552 WeakPolarHBondContact O-CA 3.42Å; I549-R552 WeakPolarHBondContact O-CB 3.34Å; I549-R552 PolarHBondContact O-N 2.86Å; R552-H555 PolarHBondContact O-N 2.88Å; R552-N556 WeakPolarHBondContact O-CB 3.2Å; R552-N556 PolarHBondContact O-N 3.02Å
553	T	64	Low	70.1	Confident	75 Å²	75	122.9 Å²	122.9	46%	0.46	61%	0.61	S	S	.	*	H	α-helix	trans	-68.8	-36.2	177.6	52.5	0	0	0	0	112.2	I549 S550 R557	I549-T553 HydrophobicContact CG2-CG2 4.46Å; I549-T553 PolarHBondContact O-N 3.1Å; I549-T553 PolarHBondContact O-OG1 2.92Å; S550-T553 WeakPolarHBondContact CA-OG1 3.33Å; S550-T553 PolarHBondContact O-OG1 2.86Å; S550-T553 VanDerWaalsContact O-OG1 3.08Å; T553-R557 WeakPolarHBondContact O-CB 3.48Å; T553-R557 WeakPolarHBondContact O-CG 3.19Å; T553-R557 PolarHBondContact O-N 2.95Å
554	A	58.2	Low	67.8	Low	54 Å²	54	127 Å²	127	45%	0.446	62%	0.624	S	S	.	*	H	α-helix	trans	-66.4	-39.3	173.1	0	0	0	0	0	112.3	S550 R551 R558	S550-A554 VanDerWaalsContact O-CB 3.24Å; S550-A554 WeakPolarHBondContact O-CB 3.39Å; S550-A554 PolarHBondContact O-N 3.49Å; R551-A554 PolarHBondContact O-N 3.08Å; A554-R558 PolarHBondContact O-N 2.87Å
555	H	57.6	Low	65.5	Low	143 Å²	143	131.3 Å²	131.3	66%	0.662	64%	0.638	S	S	*	*	H	α-helix	trans	-67.6	-45.7	177.3	-139.7	-79	0	0	0	111.7	R551 R552 R557 R558 A559	R551-H555 WeakPolarHBondContact O-CB 3.38Å; R551-H555 PolarHBondContact O-N 3.15Å; R552-H555 PolarHBondContact O-N 2.88Å; H555-R557 VanDerWaalsContact C-N 3.34Å; H555-R557 PolarHBondContact O-N 3.29Å; H555-R558 PolarHBondContact O-N 2.78Å; H555-R558 VanDerWaalsContact O-N 3.16Å; H555-A559 PolarHBondContact O-N 2.95Å; H555-A559 VanDerWaalsContact O-N 3.08Å
556	N	57.2	Low	63.1	Low	118 Å²	118	137.6 Å²	137.6	63%	0.631	65%	0.654	S	S	*	*	H	α-helix	trans	-67.4	-31.6	179.3	-74.6	4.9	0	0	0	112.8	R552 R558	R552-N556 WeakPolarHBondContact O-CB 3.2Å; R552-N556 PolarHBondContact O-N 3.02Å; N556-R558 VanDerWaalsContact C-N 3.33Å
557	R	53.1	Low	60.5	Low	209 Å²	209	137.9 Å²	137.9	79%	0.789	67%	0.666	S	S	*	*	H	α-helix	trans	-75.3	-14.6	173.3	-75.6	-172.9	175.4	-166.5	-0.7	114.5	T553 H555	T553-R557 WeakPolarHBondContact O-CB 3.48Å; T553-R557 WeakPolarHBondContact O-CG 3.19Å; T553-R557 PolarHBondContact O-N 2.95Å; H555-R557 VanDerWaalsContact C-N 3.34Å; H555-R557 PolarHBondContact O-N 3.29Å
558	R	50.9	Low	58.3	Low	199 Å²	199	143.9 Å²	143.9	75%	0.751	68%	0.681	S	S	*	*	H	α-helix	trans	-92.3	-28.5	171.6	-73.7	-177.9	174.2	175.6	-1.4	112.9	A554 H555 N556 S560	A554-R558 PolarHBondContact O-N 2.87Å; H555-R558 PolarHBondContact O-N 2.78Å; H555-R558 VanDerWaalsContact O-N 3.16Å; N556-R558 VanDerWaalsContact C-N 3.33Å; R558-S560 VanDerWaalsContact C-N 3.29Å; R558-S560 PolarHBondContact O-N 3.09Å
559	A	52.4	Low	56.1	Low	80 Å²	80	146.8 Å²	146.8	66%	0.661	69%	0.689	S	S	*	*	H	α-helix	trans	-66	-23.1	-179.5	0	0	0	0	0	114.8	H555	H555-A559 PolarHBondContact O-N 2.95Å; H555-A559 VanDerWaalsContact O-N 3.08Å
560	S	53.3	Low	53.9	Low	95 Å²	95	149.1 Å²	149.1	66%	0.664	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-2.9	-176.8	69.4	0	0	0	0	115.5	R558	R558-S560 VanDerWaalsContact C-N 3.29Å; R558-S560 PolarHBondContact O-N 3.09Å
561	N	52.9	Low	52	Low	142 Å²	142	151 Å²	151	76%	0.759	72%	0.721	S	S	*	*	S	Bend	trans	-127.1	1.5	-168.6	-108.6	-20.8	0	0	0	115.2
562	V	52.4	Low	50.3	Low	116 Å²	116	147.1 Å²	147.1	70%	0.703	72%	0.719	S	S	*	*			trans	-123.5	66.4	-177.5	-167	0	0	0	0	110.4
563	R	45.5	Very low	48.9	Very low	242 Å²	242	146 Å²	146	91%	0.913	72%	0.722	S	S	*	*	S	Bend	trans	-122.5	10.5	173.3	-138.6	179.5	-161.2	173.7	5.9	113.5
564	H	46.2	Very low	47.7	Very low	171 Å²	171	150.2 Å²	150.2	79%	0.792	74%	0.736	S	S	*	*	S	Bend	trans	-133.3	135	174.4	-74.7	-3.8	0	0	0	108.4
565	Q	45.7	Very low	47.1	Very low	172 Å²	172	152.4 Å²	152.4	80%	0.804	75%	0.749	S	S	*	*			trans	64.9	141.6	174.6	-61.8	-179.3	-7.3	0	0	116.3
566	R	41.7	Very low	46.4	Very low	204 Å²	204	153 Å²	153	77%	0.77	75%	0.751	S	S	*	*			cis	-165.5	115.5	-20.8	-165.5	176.7	-162.1	156.6	0.3	108
567	N	38.2	Very low	45.8	Very low	167 Å²	167	153.8 Å²	153.8	89%	0.893	76%	0.755	S	S	*	*			trans	-110.1	108.8	169.3	-90.7	-0.3	0	0	0	109.3
568	Y	44.4	Very low	45.2	Very low	191 Å²	191	151.7 Å²	151.7	75%	0.749	75%	0.751	S	S	*	*			trans	-143.3	120	176	-112.9	-108.6	0	0	0	108.6
569	F	42.1	Very low	44.7	Very low	171 Å²	171	147.5 Å²	147.5	75%	0.75	75%	0.752	S	S	*	*			trans	67.7	137.7	171	-72.6	-110.3	0	0	0	116.6
570	N	40.6	Very low	44.4	Very low	148 Å²	148	148.9 Å²	148.9	79%	0.791	76%	0.757	S	S	*	*			cis	75.3	138.9	31.4	-66.7	-14.7	0	0	0	114.4
571	A	43.2	Very low	43.8	Very low	80 Å²	80	149 Å²	149	66%	0.661	76%	0.758	S	S	*	*			cis	-168.3	161.3	-6.1	0	0	0	0	0	113.2
572	V	44.1	Very low	43.3	Very low	115 Å²	115	148.5 Å²	148.5	70%	0.697	76%	0.76	S	S	*	*			trans	55	119.1	140.4	174.1	0	0	0	0	121.7	Q574	V572-Q574 HydrophobicContact CG1-CG 4.27Å
573	Q	42.3	Very low	42.6	Very low	175 Å²	175	147 Å²	147	82%	0.818	76%	0.76	S	S	*	*				-161.9	117.5	114.8	-107.2	175.6	-24.4	0	0	107.4
574	Q	40.4	Very low	42.1	Very low	162 Å²	162	141.2 Å²	141.2	76%	0.757	76%	0.756	S	S	*	*				58.3	133.3	77.4	-69	-176.5	-9	0	0	113.2	V572	V572-Q574 HydrophobicContact CG1-CG 4.27Å
575	S	45	Very low	41.5	Very low	101 Å²	101	137.8 Å²	137.8	71%	0.706	75%	0.751	S	S	*	*			cis	-153.5	150.2	49.3	60.5	0	0	0	0	113.9
576	Q	42.1	Very low	41	Very low	154 Å²	154	134 Å²	134	72%	0.72	74%	0.744	S	S	*	*				67.5	130.2	113.7	-64.5	-75.3	-17.9	0	0	114.8
577	I	45.8	Very low	40.6	Very low	136 Å²	136	129.3 Å²	129.3	70%	0.697	74%	0.742	S	S	*	*			cis	-164.4	153.9	40.8	-111.1	142.4	0	0	0	105.8
578	K	39.9	Very low	40.4	Very low	164 Å²	164	128.9 Å²	128.9	71%	0.713	74%	0.738	S	S	*	*			cis	-150.2	159.8	-7.8	-102.1	168	179.7	176	0	106
579	S	39.8	Very low	39.7	Very low	111 Å²	111	122.8 Å²	122.8	78%	0.776	73%	0.734	S	S	*	*				69.9	135.5	57.6	-36.6	0	0	0	0	114.1
580	S	46.9	Very low	39.1	Very low	109 Å²	109	121.3 Å²	121.3	76%	0.762	74%	0.738	S	S	*	*			cis	-142.6	179.5	12.3	60.7	0	0	0	0	111.3
581	S	41.7	Very low	38.7	Very low	97 Å²	97	119.4 Å²	119.4	68%	0.678	74%	0.736	S	S	*	*			cis	-159.1	156.6	20.2	-24.3	0	0	0	0	112.8
582	V	41.3	Very low	38	Very low	133 Å²	133	126 Å²	126	81%	0.806	74%	0.744	S	S	*	*			trans	41.5	112.1	147.5	-174.2	0	0	0	0	118.2
583	A	37.4	Very low	37.3	Very low	85 Å²	85	127.9 Å²	127.9	70%	0.702	75%	0.75	S	S	*	*			cis	88	144.2	25.6	0	0	0	0	0	117.1
584	S	35.9	Very low	36.8	Very low	120 Å²	120	123.5 Å²	123.5	84%	0.839	75%	0.751	S	S	*	*			trans	71.7	148	172.5	-56.9	0	0	0	0	117.6
585	S	34	Very low	36.4	Very low	98 Å²	98	119.1 Å²	119.1	69%	0.685	75%	0.749	S	S	*	*			cis	-167.4	167.8	-19.5	53.1	0	0	0	0	111.6
586	S	35.1	Very low	36	Very low	93 Å²	93	122.2 Å²	122.2	65%	0.65	76%	0.756	S	S	*	*			trans	58.5	111	148.4	57.8	0	0	0	0	122.3
587	S	32.8	Very low	35.7	Very low	105 Å²	105	122.1 Å²	122.1	73%	0.734	76%	0.761	S	S	*	*				69.3	161.2	129.1	68.9	0	0	0	0	123.1
588	I	34.2	Very low	35.1	Very low	158 Å²	158	119 Å²	119	81%	0.81	76%	0.762	S	S	*	*			trans	71.6	103.9	165.9	-54.5	169.9	0	0	0	117.7
589	G	30	Very low	34.8	Very low	64 Å²	64	119.3 Å²	119.3	66%	0.66	77%	0.766	S	S	*	*				70.2	142	111	0	0	0	0	0	123.2
590	V	29.7	Very low	34.6	Very low	139 Å²	139	119 Å²	119	84%	0.842	76%	0.759	S	S	*	*			trans	75.1	157.2	152.4	-148.8	0	0	0	0	117.9
591	C	31.9	Very low	34.2	Very low	109 Å²	109	119.4 Å²	119.4	74%	0.736	76%	0.757	S	S	*	*			trans	71.7	137.2	173	-64.5	0	0	0	0	117.4
592	R	28.7	Very low	34.1	Very low	219 Å²	219	121.9 Å²	121.9	83%	0.826	76%	0.761	S	S	*	*			cis	94.2	121.6	24.7	-81.7	-172.1	156.8	-172.8	-4.2	115.9
593	N	29.1	Very low	33.9	Very low	154 Å²	154	121.6 Å²	121.6	82%	0.824	76%	0.762	S	S	*	*			trans	62.6	152.2	138.6	-64	23	0	0	0	120.8
594	G	31.1	Very low	33.7	Very low	82 Å²	82	121.2 Å²	121.2	85%	0.845	77%	0.766	S	S	*	*			trans	106.5	98	175	0	0	0	0	0	112.1
595	G	31.2	Very low	33.7	Very low	70 Å²	70	122.9 Å²	122.9	72%	0.722	77%	0.766	S	S	*	*			cis	116.1	91.1	2.4	0	0	0	0	0	111.3
596	I	37.2	Very low	33.8	Very low	166 Å²	166	124.4 Å²	124.4	85%	0.851	77%	0.766	S	S	*	*			trans	-122.5	108.8	170.6	-46.7	178.9	0	0	0	108.8
597	N	36.7	Very low	33.5	Very low	153 Å²	153	130.3 Å²	130.3	82%	0.818	77%	0.774	S	S	*	*			trans	-17.3	135.7	159.6	-39.4	-33.6	0	0	0	115.4
598	G	32.2	Very low	33.8	Very low	69 Å²	69	133.7 Å²	133.7	71%	0.711	78%	0.783	S	S	*	*			cis	127.9	112	-8	0	0	0	0	0	114.1
599	H	33.4	Very low	33.6	Very low	172 Å²	172	136.9 Å²	136.9	80%	0.796	79%	0.785	S	S	*	*			trans	-158.2	121.8	151.8	-129.6	-96	0	0	0	110.8
600	T	35.5	Very low	34	Very low	104 Å²	104	138.7 Å²	138.7	64%	0.638	79%	0.785	S	S	*	*			trans	38.6	142.2	138.1	62.6	0	0	0	0	121.4
601	T	39.5	Very low	34.1	Very low	117 Å²	117	137.4 Å²	137.4	72%	0.718	78%	0.782	S	S	*	*			cis	-179.1	157.8	-5	29.6	0	0	0	0	106.2
602	I	39.1	Very low	34.7	Very low	150 Å²	150	138.3 Å²	138.3	77%	0.769	79%	0.787	S	S	*	*			cis	-151.4	142.9	-6.4	-114.6	160.3	0	0	0	107.4
603	P	36.7	Very low	34.9	Very low	127 Å²	127	132.9 Å²	132.9	83%	0.825	79%	0.789	S	S	*	*			trans	-112.5	167.5	168.2	39.3	-31.1	0	0	0	112.7
604	G	33.3	Very low	35.1	Very low	76 Å²	76	128.9 Å²	128.9	78%	0.784	78%	0.784	S	S	*	*			trans	167	110.2	164.6	0	0	0	0	0	116.7
605	D	35.9	Very low	35.2	Very low	156 Å²	156	131.1 Å²	131.1	83%	0.834	78%	0.781	S	S	*	*			trans	-62.7	154.8	160.8	-71.1	-84.9	0	0	0	112.1
606	N	36	Very low	35.3	Very low	129 Å²	129	132.2 Å²	132.2	69%	0.69	78%	0.784	S	S	*	*				-169.2	137.2	118.6	-106.8	-76.9	0	0	0	113.7
607	R	30.3	Very low	35.1	Very low	217 Å²	217	132.2 Å²	132.2	82%	0.819	78%	0.784	S	S	*	*			trans	18.7	119.9	141.7	-58.8	168.9	165.1	152.4	-12.9	118.2
608	L	37.3	Very low	35.1	Very low	177 Å²	177	128.2 Å²	128.2	93%	0.927	78%	0.78	S	S	*	*				-175.4	156.5	99.9	-96.7	168.5	0	0	0	114.6
609	R	30.3	Very low	35	Very low	224 Å²	224	129.2 Å²	129.2	85%	0.845	78%	0.781	S	S	*	*			trans	-109.4	165.1	-174.1	178.5	-163.6	-179.7	-158.7	3.2	107.4
610	P	38.8	Very low	35.1	Very low	103 Å²	103	127.3 Å²	127.3	67%	0.669	78%	0.782	S	S	*	*			cis	-131.6	-163.5	-42.6	41.2	-23.9	0	0	0	112.6
611	S	32.2	Very low	34.9	Very low	112 Å²	112	126.5 Å²	126.5	78%	0.783	78%	0.78	S	S	*	*			trans	114.3	143.8	145.2	-66.2	0	0	0	0	119.4
612	P	43.9	Very low	34.4	Very low	127 Å²	127	128.1 Å²	128.1	83%	0.825	78%	0.783	S	S	*	*			trans	-107.2	159	172	40.4	-33.3	0	0	0	114.1
613	A	33.4	Very low	34	Very low	106 Å²	106	124.1 Å²	124.1	88%	0.876	78%	0.779	S	S	*	*			trans	176.4	164.2	151.3	0	0	0	0	0	111.6
614	G	32.5	Very low	33.5	Very low	69 Å²	69	127.9 Å²	127.9	71%	0.711	78%	0.778	S	S	*	*			trans	95.8	100.4	170.2	0	0	0	0	0	113.7
615	T	32.8	Very low	33.2	Very low	129 Å²	129	129.5 Å²	129.5	79%	0.791	78%	0.777	S	S	*	*			cis	92	89.8	22.5	-44.7	0	0	0	0	115.6	L617	T615-L617 HydrophobicContact CG2-CD1 4.32Å
616	A	34.9	Very low	32.9	Very low	94 Å²	94	127.8 Å²	127.8	78%	0.777	78%	0.777	S	S	*	*			trans	-163.2	129	145	0	0	0	0	0	107.2
617	L	32.3	Very low	32.7	Very low	165 Å²	165	127.7 Å²	127.7	86%	0.864	78%	0.782	S	S	*	*			cis	104.2	134	28	-74.1	170.1	0	0	0	113	T615	T615-L617 HydrophobicContact CG2-CD1 4.32Å
618	G	36	Very low	32.6	Very low	70 Å²	70	125.2 Å²	125.2	72%	0.722	79%	0.785	S	S	*	*			trans	115.4	91.2	-164.3	0	0	0	0	0	110.8
619	A	31.2	Very low	32.2	Very low	90 Å²	90	120 Å²	120	74%	0.744	77%	0.773	S	S	*	*			cis	64.3	133.8	32.5	0	0	0	0	0	112.1
620	T	35.4	Very low	32.2	Very low	131 Å²	131	114.9 Å²	114.9	80%	0.804	77%	0.767	S	S	*	*			cis	-168.3	159.6	12.1	14.5	0	0	0	0	108.7
621	S	30.5	Very low	31.8	Very low	87 Å²	87	117.4 Å²	117.4	61%	0.608	78%	0.775	S	S	*	*			cis	175.6	147.5	-18.6	52	0	0	0	0	111.7
622	I	29.3	Very low	31.8	Very low	152 Å²	152	118.1 Å²	118.1	78%	0.779	78%	0.78	S	S	*	*			trans	64.7	131.6	155	-59.3	156.6	0	0	0	118.4	Y624	I622-Y624 HydrophobicContact CG2-CD2 3.89Å; I622-Y624 HydrophobicContact CG2-CE2 3.94Å
623	G	30	Very low	31.3	Very low	66 Å²	66	120.5 Å²	120.5	68%	0.68	78%	0.782	S	S	*	*			trans	151.6	86.4	166	0	0	0	0	0	112.6
624	Y	27.4	Very low	31.2	Very low	205 Å²	205	123.5 Å²	123.5	80%	0.804	78%	0.783	S	S	*	*				56.3	116.1	83	-74.7	-68.5	0	0	0	115.9	I622	I622-Y624 HydrophobicContact CG2-CD2 3.89Å; I622-Y624 HydrophobicContact CG2-CE2 3.94Å
625	S	26.9	Very low	31.2	Very low	110 Å²	110	123.6 Å²	123.6	77%	0.769	79%	0.785	S	S	*	*			trans	57	144.2	137.1	-50.2	0	0	0	0	119.3
626	S	29.5	Very low	31.2	Very low	120 Å²	120	120.8 Å²	120.8	84%	0.839	78%	0.781	S	S	*	*			cis	-161.6	176.5	27.1	42.7	0	0	0	0	112.1
627	V	31.5	Very low	31.3	Very low	128 Å²	128	123.6 Å²	123.6	78%	0.776	78%	0.783	S	S	*	*			trans	-90.9	145.8	168.6	-166	0	0	0	0	110.3
628	N	29.1	Very low	31.6	Very low	165 Å²	165	121.3 Å²	121.3	88%	0.882	77%	0.772	S	S	*	*			trans	121.7	155.2	159.8	-69	-26.2	0	0	0	115.1
629	G	28.9	Very low	31.7	Very low	66 Å²	66	124 Å²	124	68%	0.68	77%	0.77	S	S	*	*			trans	135.2	65.1	151.1	0	0	0	0	0	118.4
630	T	30.1	Very low	32	Very low	118 Å²	118	127.2 Å²	127.2	72%	0.724	77%	0.774	S	S	*	*			trans	14.5	133.9	138	53.2	0	0	0	0	121.3
631	N	29.6	Very low	31.9	Very low	156 Å²	156	124.5 Å²	124.5	83%	0.834	77%	0.773	S	S	*	*			trans	53.5	113.8	133.5	-50.6	-8.4	0	0	0	120.4
632	S	33.1	Very low	32.5	Very low	127 Å²	127	126.4 Å²	126.4	89%	0.888	78%	0.783	S	S	*	*				-162.2	159.8	122.2	-166.1	0	0	0	0	111.9
633	M	32.7	Very low	32.8	Very low	177 Å²	177	127.4 Å²	127.4	87%	0.872	79%	0.788	S	S	*	*			trans	-87.9	166.5	169	-60	175.2	176.8	0	0	112.1
634	N	32.4	Very low	32.9	Very low	168 Å²	168	131.2 Å²	131.2	90%	0.898	79%	0.793	S	S	*	*			trans	106.8	136.2	131.5	-156.7	18.9	0	0	0	118.9
635	G	31.9	Very low	33.2	Very low	72 Å²	72	127.4 Å²	127.4	74%	0.742	79%	0.791	S	S	*	*			trans	77.3	132.6	170.6	0	0	0	0	0	115.6
636	G	32.2	Very low	33.3	Very low	70 Å²	70	130.6 Å²	130.6	72%	0.722	79%	0.794	S	S	*	*			cis	148	148.8	-5.3	0	0	0	0	0	111.6
637	N	36.7	Very low	33.5	Very low	152 Å²	152	133.5 Å²	133.5	81%	0.813	80%	0.799	S	S	*	*			trans	65.9	152.8	175.9	-70	-4.8	0	0	0	115.7
638	N	39.9	Very low	33.5	Very low	117 Å²	117	132.2 Å²	132.2	63%	0.626	80%	0.796	S	S	*	*			cis	-149.8	133.1	4.6	-117.4	-13	0	0	0	112.8
639	N	37.3	Very low	34.1	Very low	127 Å²	127	130 Å²	130	68%	0.679	79%	0.79	S	S	*	*			trans	55.1	137.6	132.3	-61.1	-10.6	0	0	0	124.9
640	N	38.2	Very low	34.5	Very low	157 Å²	157	132.3 Å²	132.3	84%	0.84	79%	0.794	S	S	*	*			trans	85.3	109.9	142.6	-63.9	-8	0	0	0	122.5
641	G	33.5	Very low	34.5	Very low	75 Å²	75	133.9 Å²	133.9	77%	0.773	80%	0.797	S	S	*	*				107.8	102.4	106.2	0	0	0	0	0	118.9
642	P	41.5	Very low	34.5	Very low	126 Å²	126	136.5 Å²	136.5	82%	0.818	80%	0.802	S	S	*	*			trans	-100.7	149.6	176.4	37.3	-32.5	0	0	0	114.2
643	I	36.7	Very low	34.3	Very low	173 Å²	173	139 Å²	139	89%	0.887	80%	0.799	S	S	*	*			trans	-137.5	149.5	165.9	-65.2	-173.8	0	0	0	110.4
644	N	31	Very low	34.4	Very low	146 Å²	146	137.4 Å²	137.4	78%	0.781	80%	0.8	S	S	*	*			trans	-99.5	-172.3	-169.8	-87.5	-36.4	0	0	0	114.6
645	T	34.3	Very low	34.1	Very low	126 Å²	126	136.1 Å²	136.1	77%	0.773	79%	0.793	S	S	*	*			trans	90.9	115.1	164.9	69.2	0	0	0	0	115.3
646	Q	28.4	Very low	33.9	Very low	177 Å²	177	139 Å²	139	83%	0.827	79%	0.79	S	S	*	*				72.6	118.6	58.7	-82.3	-163.6	-26.1	0	0	114.7
647	L	34.5	Very low	33.8	Very low	180 Å²	180	144.2 Å²	144.2	94%	0.942	80%	0.796	S	S	*	*			trans	-161.3	161.9	140.2	-105.2	157.2	0	0	0	109.2
648	S	31	Very low	33.3	Very low	102 Å²	102	140.5 Å²	140.5	71%	0.713	79%	0.793	S	S	*	*			trans	-121.8	162.3	-155.4	-61.5	0	0	0	0	114.5
649	P	42.3	Very low	32.9	Very low	118 Å²	118	141.6 Å²	141.6	77%	0.766	80%	0.804	S	S	*	*			trans	-93.8	-176.3	-172.9	39.6	-38	0	0	0	113.4
650	P	37.9	Very low	32.5	Very low	115 Å²	115	141.7 Å²	141.7	75%	0.747	81%	0.809	S	S	*	*			trans	-139.2	137	136.8	36.5	-23.2	0	0	0	116.3
651	N	29.2	Very low	32.3	Very low	150 Å²	150	139.8 Å²	139.8	80%	0.802	81%	0.805	S	S	*	*			trans	28.4	130.6	139.2	-56.6	-25.4	0	0	0	122.4
652	F	31	Very low	32.1	Very low	212 Å²	212	145 Å²	145	93%	0.93	81%	0.812	S	S	*	*				-148.4	148.5	123.9	-124.9	-85.7	0	0	0	110.5
653	Q	28	Very low	31.8	Very low	178 Å²	178	146.5 Å²	146.5	83%	0.832	81%	0.811	S	S	*	*			trans	-113.2	140.6	-178.6	-58.1	172.7	-85.6	0	0	111.5
654	V	33.9	Very low	31.6	Very low	145 Å²	145	144.2 Å²	144.2	88%	0.879	81%	0.807	S	S	*	*			trans	-147.1	125.5	135.8	-176.2	0	0	0	0	111.2
655	N	27.2	Very low	31.7	Very low	141 Å²	141	140.8 Å²	140.8	75%	0.754	81%	0.806	S	S	*	*			trans	-16.6	157.3	164.3	-116.4	-9.8	0	0	0	124.7
656	L	27.9	Very low	31.6	Very low	132 Å²	132	138.1 Å²	138.1	69%	0.691	80%	0.804	S	S	*	*			trans	69.8	92.7	144	-110.3	74	0	0	0	121.6
657	H	29.3	Very low	31.8	Very low	180 Å²	180	140.4 Å²	140.4	83%	0.833	81%	0.807	S	S	*	*				-169.4	148.8	96.6	-116.7	-113.6	0	0	0	110.7
658	G	25.8	Very low	31.7	Very low	73 Å²	73	137 Å²	137	75%	0.753	80%	0.796	S	S	*	*			trans	-97.9	139.2	-173.7	0	0	0	0	0	114.2
659	T	31.7	Very low	31.7	Very low	141 Å²	141	138.5 Å²	138.5	87%	0.865	80%	0.8	S	S	*	*			trans	-132	123.5	168.9	42.2	0	0	0	0	110.4
660	V	29	Very low	31.2	Very low	128 Å²	128	140.2 Å²	140.2	78%	0.776	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-96.7	134.4	173	177.5	0	0	0	0	107.8	M662	V660-M662 PolarHBondContact O-N 3.49Å
661	P	34.4	Very low	30.8	Very low	118 Å²	118	142.1 Å²	142.1	77%	0.766	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-65.9	128.2	176.6	27.1	-34	0	0	0	110.6
662	M	30	Very low	30.9	Very low	184 Å²	184	143.6 Å²	143.6	91%	0.906	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-81.9	144.1	-175	-67.3	-163	-67.9	0	0	113.1	V660	V660-M662 PolarHBondContact O-N 3.49Å
663	I	34.7	Very low	30.8	Very low	157 Å²	157	138.6 Å²	138.6	81%	0.805	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-101.3	124.2	170.8	-58.6	171.2	0	0	0	108
664	P	33.4	Very low	31.1	Very low	125 Å²	125	138.5 Å²	138.5	81%	0.812	80%	0.801	S	S	*	*	S	Bend	trans	-72.3	141	174.1	-18.3	32.4	0	0	0	113.2
665	G	32.3	Very low	30.9	Very low	74 Å²	74	135.3 Å²	135.3	76%	0.763	80%	0.798	S	S	*	*	S	Bend	trans	101.3	-13	154.5	0	0	0	0	0	119.2	Y667	G665-Y667 PolarHBondContact O-N 3.4Å
666	G	32.9	Very low	31	Very low	71 Å²	71	132.4 Å²	132.4	73%	0.732	80%	0.801	S	S	*	*			trans	-86.8	96.8	-175.5	0	0	0	0	0	115.1
667	Y	31.8	Very low	31.2	Very low	224 Å²	224	131.1 Å²	131.1	88%	0.878	80%	0.803	S	S	*	*			trans	-80.6	125.3	168.7	-78.9	-80.1	0	0	0	111.8	G665	G665-Y667 PolarHBondContact O-N 3.4Å
668	P	31.7	Very low	31.3	Very low	109 Å²	109	130.9 Å²	130.9	71%	0.708	80%	0.802	S	S	*	*			trans	-81.8	132.7	176.2	31.9	-33.2	0	0	0	111.9	L670	P668-L670 PolarHBondContact O-N 2.79Å
669	V	32.1	Very low	31.6	Very low	133 Å²	133	135.8 Å²	135.8	81%	0.806	81%	0.806	S	S	*	*			trans	-76.5	106.5	171.6	-179.8	0	0	0	0	109.5	I671	V669-I671 HydrophobicContact CG1-CG1 4.17Å; V669-I671 PolarHBondContact O-N 3.05Å
670	L	31.5	Very low	31.5	Very low	154 Å²	154	135 Å²	135	81%	0.806	80%	0.803	S	S	*	*			trans	-82.3	104.3	170.8	-82.3	167.7	0	0	0	110.5	P668	P668-L670 PolarHBondContact O-N 2.79Å
671	I	30.2	Very low	31.7	Very low	156 Å²	156	133.4 Å²	133.4	80%	0.8	80%	0.803	S	S	*	*			trans	-90	116	162.8	-56.5	178.1	0	0	0	107.5	V669	V669-I671 HydrophobicContact CG1-CG1 4.17Å; V669-I671 PolarHBondContact O-N 3.05Å
672	Q	31.1	Very low	31.8	Very low	181 Å²	181	132.6 Å²	132.6	85%	0.846	80%	0.8	S	S	*	*			trans	-135	125.8	172.6	-139.3	170.3	11.5	0	0	110.6
673	S	28.4	Very low	31.8	Very low	106 Å²	106	129 Å²	129	74%	0.741	79%	0.793	S	S	*	*			trans	-88	154.2	-163.8	62.8	0	0	0	0	114.6
674	I	33.3	Very low	32	Very low	176 Å²	176	126.2 Å²	126.2	90%	0.903	79%	0.785	S	S	*	*			trans	-136.1	125.7	148	-58.8	-177.2	0	0	0	110.2
675	G	29.3	Very low	31.7	Very low	79 Å²	79	129.1 Å²	129.1	81%	0.814	79%	0.786	S	S	*	*			trans	85.5	99.4	152.9	0	0	0	0	0	118.8
676	G	30.7	Very low	31.6	Very low	79 Å²	79	136.4 Å²	136.4	81%	0.814	79%	0.792	S	S	*	*			trans	176.7	76.3	172.7	0	0	0	0	0	114.3
677	S	30.9	Very low	31.3	Very low	105 Å²	105	137.8 Å²	137.8	73%	0.734	79%	0.79	S	S	*	*			trans	-41.4	149.4	-175.8	53.7	0	0	0	0	119.8
678	Q	32.7	Very low	31.4	Very low	176 Å²	176	133.6 Å²	133.6	82%	0.822	79%	0.787	S	S	*	*			trans	74.5	138.5	163.3	-64.9	170.5	11.8	0	0	116.7
679	Q	31.7	Very low	31.4	Very low	175 Å²	175	133.8 Å²	133.8	82%	0.818	79%	0.789	S	S	*	*			cis	-160.7	149.6	-12.2	-172.7	165.2	-20.2	0	0	109.4
680	P	29.8	Very low	31.4	Very low	125 Å²	125	135.9 Å²	135.9	81%	0.812	79%	0.79	S	S	*	*			trans	-112.9	150.3	-161.6	39.9	-32.9	0	0	0	118
681	A	33.6	Very low	31.4	Very low	95 Å²	95	132 Å²	132	79%	0.785	78%	0.78	S	S	*	*			trans	-166.7	149.4	160.5	0	0	0	0	0	107.3
682	S	34.9	Very low	31.3	Very low	100 Å²	100	135.4 Å²	135.4	70%	0.699	78%	0.783	S	S	*	*			cis	170.6	98.7	-21.4	48.7	0	0	0	0	106.3
683	S	31.4	Very low	31.4	Very low	108 Å²	108	132.3 Å²	132.3	76%	0.755	78%	0.781	S	S	*	*				19.2	162.3	128.8	56.5	0	0	0	0	121.6
684	P	37.3	Very low	31.4	Very low	99 Å²	99	135.2 Å²	135.2	64%	0.643	79%	0.787	S	S	*	*			cis	-149	-171.7	-23.7	39.3	-18.6	0	0	0	116.3
685	F	27.3	Very low	31.3	Very low	187 Å²	187	131.8 Å²	131.8	82%	0.82	78%	0.779	S	S	*	*			trans	55.1	128.4	149.3	-67.7	-54.9	0	0	0	122.3
686	Y	30.8	Very low	31.2	Very low	227 Å²	227	134 Å²	134	89%	0.89	78%	0.776	S	S	*	*				-153.8	152.8	110.5	-120	-81.2	0	0	0	111
687	S	26.9	Very low	31.2	Very low	99 Å²	99	141.7 Å²	141.7	69%	0.692	78%	0.783	S	S	*	*			trans	-140.5	146.6	177.8	56	0	0	0	0	111.2
688	V	34	Very low	31.2	Very low	136 Å²	136	139.9 Å²	139.9	82%	0.824	78%	0.781	S	S	*	*			trans	-136.8	126.7	179	-175.8	0	0	0	0	109.6
689	P	32	Very low	31	Very low	113 Å²	113	140.2 Å²	140.2	73%	0.734	78%	0.782	S	S	*	*			trans	-102.7	-165.7	178	40.7	-35.3	0	0	0	112.8
690	E	32.7	Very low	30.9	Very low	178 Å²	178	140 Å²	140	83%	0.832	79%	0.787	S	S	*	*			trans	83.7	136.2	162.1	-148.9	164.9	-152.2	0	0	116.8
691	A	30.7	Very low	30.9	Very low	72 Å²	72	139.7 Å²	139.7	60%	0.595	78%	0.782	S	S	*	*			cis	-166.9	164.4	-25.1	0	0	0	0	0	115.1
692	R	27.9	Very low	30.5	Very low	228 Å²	228	140 Å²	140	86%	0.86	78%	0.779	S	S	*	*			trans	59.5	103.9	143.3	-76	167.6	177.1	151.3	-1.1	122.5
693	S	33.1	Very low	30.3	Very low	116 Å²	116	140.7 Å²	140.7	81%	0.811	78%	0.781	S	S	*	*				-173.8	121.6	125.5	51.5	0	0	0	0	107.4
694	L	28.2	Very low	30	Very low	166 Å²	166	142.1 Å²	142.1	87%	0.869	79%	0.785	S	S	*	*				51.7	125.7	50.5	-104.8	71.8	0	0	0	112.9
695	S	31.2	Very low	29.7	Very low	104 Å²	104	143.6 Å²	143.6	73%	0.727	79%	0.792	S	S	*	*			cis	-147.7	138.4	14.2	50.4	0	0	0	0	110.8
696	T	27.6	Very low	29.7	Very low	125 Å²	125	141.1 Å²	141.1	77%	0.767	79%	0.793	S	S	*	*				67.2	95.3	78	-45.7	0	0	0	0	116.2
697	Y	30.6	Very low	29.7	Very low	241 Å²	241	133.8 Å²	133.8	95%	0.945	79%	0.786	S	S	*	*			trans	-167.9	144.8	149.1	-111.6	-82.6	0	0	0	106.4
698	G	30.2	Very low	29.8	Very low	67 Å²	67	136 Å²	136	69%	0.691	79%	0.79	S	S	*	*			cis	-156.6	168.6	-7.9	0	0	0	0	0	109.8
699	Q	28.7	Very low	29.8	Very low	183 Å²	183	136.3 Å²	136.3	86%	0.855	79%	0.787	S	S	*	*			trans	-79.7	156.8	-173	-65.1	172.6	-21.1	0	0	113.6
700	N	30.7	Very low	30	Very low	171 Å²	171	136 Å²	136	91%	0.914	79%	0.788	S	S	*	*			trans	-148	153.9	133.7	-126.9	-25.3	0	0	0	111.3
701	V	29.4	Very low	29.6	Very low	118 Å²	118	135 Å²	135	72%	0.715	78%	0.783	S	S	*	*			trans	-111.2	137.7	-159.8	178.3	0	0	0	0	112.4
702	S	24.4	Very low	29.6	Very low	102 Å²	102	141.3 Å²	141.3	71%	0.713	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-76.1	132.5	175.6	-51.2	0	0	0	0	112.5
703	P	31.1	Very low	29.6	Very low	115 Å²	115	136.6 Å²	136.6	75%	0.747	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-79	123.2	160.6	31.4	-30	0	0	0	109.9
704	V	25.6	Very low	29.5	Very low	138 Å²	138	140 Å²	140	84%	0.836	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-89.3	122.1	163.8	175	0	0	0	0	107.6
705	T	30.5	Very low	29.5	Very low	129 Å²	129	135.5 Å²	135.5	79%	0.791	79%	0.787	S	S	*	*			trans	-124	132.2	177.5	-46.2	0	0	0	0	109.9
706	T	27.5	Very low	29.3	Very low	136 Å²	136	138 Å²	138	83%	0.834	79%	0.793	S	S	*	*			trans	-94.8	146.7	-166.2	50	0	0	0	0	114.4
707	G	30.6	Very low	29.6	Very low	73 Å²	73	140.7 Å²	140.7	75%	0.753	80%	0.799	S	S	*	*			trans	155.8	150.1	157.3	0	0	0	0	0	113.4
708	N	29.9	Very low	29.6	Very low	144 Å²	144	136.3 Å²	136.3	77%	0.77	79%	0.791	S	S	*	*			cis	-162.9	169.3	-16.6	-152.4	5.7	0	0	0	109.5
709	N	33.9	Very low	29.5	Very low	143 Å²	143	138.1 Å²	138.1	77%	0.765	79%	0.789	S	S	*	*			trans	73.7	140.8	173.4	-36.8	-38	0	0	0	114.8
710	S	34.7	Very low	29.6	Very low	108 Å²	108	136.4 Å²	136.4	76%	0.755	79%	0.786	S	S	*	*			cis	-152.3	136	-8.4	50	0	0	0	0	110.7
711	E	26.3	Very low	29.6	Very low	155 Å²	155	135.6 Å²	135.6	72%	0.724	79%	0.787	S	S	*	*			trans	-75.2	152.7	178.7	-60.8	175.3	113.4	0	0	113.4	I713	E711-I713 WeakPolarHBondContact OE1-CD1 3.37Å
712	F	30.3	Very low	29.7	Very low	206 Å²	206	137.9 Å²	137.9	90%	0.904	79%	0.792	S	S	*	*			trans	-137	105.8	146.6	-94.8	-80.8	0	0	0	109.3
713	I	27.1	Very low	30	Very low	128 Å²	128	139.5 Å²	139.5	66%	0.656	79%	0.793	S	S	*	*			trans	-109.2	118.2	178.2	-63.2	175.1	0	0	0	109.4	E711	E711-I713 WeakPolarHBondContact OE1-CD1 3.37Å
714	M	30.2	Very low	30.1	Very low	187 Å²	187	141.8 Å²	141.8	92%	0.921	80%	0.799	S	S	*	*			trans	-167.8	126.7	159.6	-111	178.7	-71.3	0	0	108.8
715	G	29.3	Very low	30.3	Very low	72 Å²	72	139.9 Å²	139.9	74%	0.742	79%	0.791	S	S	*	*			cis	-169.9	140.6	-10.4	0	0	0	0	0	109.4
716	N	27.5	Very low	30.4	Very low	158 Å²	158	141.3 Å²	141.3	85%	0.845	79%	0.794	S	S	*	*			trans	-98.2	130.7	-174.9	-165.5	8	0	0	0	110.9
717	M	33.3	Very low	30.3	Very low	181 Å²	181	143 Å²	143	89%	0.892	80%	0.798	S	S	*	*			trans	-106	140.4	174	-76.3	-162.5	179.8	0	0	111.2
718	N	31.6	Very low	30.3	Very low	148 Å²	148	146.7 Å²	146.7	79%	0.791	80%	0.799	S	S	*	*			trans	-72.6	137.6	-165.6	-87.9	-19.6	0	0	0	115.1
719	T	27.5	Very low	30.1	Very low	105 Å²	105	143.8 Å²	143.8	64%	0.644	80%	0.796	S	S	*	*			trans	10	124.1	137.5	61.4	0	0	0	0	118.2
720	N	29.9	Very low	30	Very low	148 Å²	148	142.4 Å²	142.4	79%	0.791	80%	0.795	S	S	*	*				164.4	110.1	114.7	-84.1	-27.3	0	0	0	113
721	T	31.5	Very low	29.6	Very low	154 Å²	154	147.1 Å²	147.1	95%	0.945	80%	0.798	S	S	*	*				-170.8	168	126.4	12.6	0	0	0	0	111.5
722	M	31.4	Very low	30.1	Very low	166 Å²	166	145.6 Å²	145.6	82%	0.818	80%	0.802	S	S	*	*			trans	-101.3	157.7	-164.4	-80	179.2	161.8	0	0	114.8
723	N	31.2	Very low	30.1	Very low	135 Å²	135	143.8 Å²	143.8	72%	0.722	80%	0.801	S	S	*	*			trans	51.7	110	146.4	-56.2	-7.7	0	0	0	119.3
724	N	32.8	Very low	30.1	Very low	163 Å²	163	140.8 Å²	140.8	87%	0.872	80%	0.803	S	S	*	*				-163.2	159.2	87.3	-106.7	-23.1	0	0	0	112.9
725	S	28.8	Very low	30.2	Very low	98 Å²	98	138.3 Å²	138.3	69%	0.685	79%	0.792	S	S	*	*			trans	-86.4	142.6	-173.8	54.3	0	0	0	0	114.1
726	N	33.2	Very low	30.4	Very low	159 Å²	159	142.7 Å²	142.7	85%	0.85	80%	0.797	S	S	*	*			trans	-160.9	127.7	132.8	-97.4	-28.1	0	0	0	110.7
727	N	26.1	Very low	30.4	Very low	171 Å²	171	145 Å²	145	91%	0.914	80%	0.795	S	S	*	*			trans	-82.8	117.2	179.6	-89.5	-13.8	0	0	0	111.2
728	I	29.5	Very low	30.4	Very low	151 Å²	151	142.3 Å²	142.3	77%	0.774	79%	0.791	S	S	*	*			trans	-137.3	105.2	156.3	-57.7	-178	0	0	0	107.9
729	A	27.2	Very low	30.4	Very low	84 Å²	84	141.2 Å²	141.2	69%	0.694	79%	0.79	S	S	*	*			trans	-101.7	96.6	174.7	0	0	0	0	0	109.6	Y731	A729-Y731 HydrophobicContact CB-CE2 4.4Å
730	C	30.2	Very low	30.8	Very low	113 Å²	113	142 Å²	142	76%	0.764	80%	0.796	S	S	*	*			trans	-89.3	111.2	175.4	-69.7	0	0	0	0	110.6
731	Y	27.1	Very low	30.8	Very low	207 Å²	207	140.9 Å²	140.9	81%	0.812	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-96.3	127.9	167.1	-69.7	-89.3	0	0	0	110	A729	A729-Y731 HydrophobicContact CB-CE2 4.4Å
732	P	35.8	Very low	30.7	Very low	123 Å²	123	136.5 Å²	136.5	80%	0.799	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-77.7	143.8	163.8	-6	23.5	0	0	0	110.7
733	N	30.4	Very low	30.6	Very low	168 Å²	168	137.2 Å²	137.2	90%	0.898	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-90.9	153.4	173.3	-69.6	-54.5	0	0	0	111.4
734	G	29	Very low	30.4	Very low	66 Å²	66	138.8 Å²	138.8	68%	0.68	79%	0.794	S	S	*	*			trans	127	97.5	148.8	0	0	0	0	0	116.7
735	L	30.7	Very low	30.4	Very low	134 Å²	134	137.4 Å²	137.4	70%	0.702	79%	0.785	S	S	*	*			trans	-127.3	111.3	150.2	-81.5	172.9	0	0	0	108
736	I	33.7	Very low	30.4	Very low	165 Å²	165	140 Å²	140	85%	0.846	79%	0.791	S	S	*	*			trans	-101.1	131.1	177.3	-65.1	174.4	0	0	0	107.8
737	Y	27.4	Very low	30.2	Very low	205 Å²	205	137.2 Å²	137.2	80%	0.804	78%	0.784	S	S	*	*			trans	-67.5	139.5	175.6	-79	-95.1	0	0	0	111.2	V739	Y737-V739 PolarHBondContact O-N 3.13Å; Y737-V739 VanDerWaalsContact O-N 3.13Å
738	P	33.3	Very low	30.4	Very low	125 Å²	125	136 Å²	136	81%	0.812	78%	0.777	S	S	*	*			trans	-69.6	108.3	171.7	28.6	-33	0	0	0	110.3
739	V	32.8	Very low	30.5	Very low	126 Å²	126	134.9 Å²	134.9	76%	0.764	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-83	133.5	170	-174.8	0	0	0	0	108.8	Y737 S741	Y737-V739 PolarHBondContact O-N 3.13Å; Y737-V739 VanDerWaalsContact O-N 3.13Å; V739-S741 PolarHBondContact O-N 3.08Å
740	P	34.7	Very low	30.6	Very low	120 Å²	120	135.3 Å²	135.3	78%	0.779	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-64.8	123.3	177.6	-22.2	33.4	0	0	0	112.6
741	S	29.9	Very low	30.7	Very low	126 Å²	126	136.8 Å²	136.8	88%	0.881	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-61.9	143.8	164.3	-57.4	0	0	0	0	110.6	V739	V739-S741 PolarHBondContact O-N 3.08Å
742	G	29.9	Very low	30.9	Very low	62 Å²	62	134.8 Å²	134.8	64%	0.639	78%	0.778	S	S	*	*			cis	153.6	155.6	-5.3	0	0	0	0	0	111.1
743	H	30.1	Very low	30.5	Very low	181 Å²	181	133.1 Å²	133.1	84%	0.838	78%	0.775	S	S	*	*			trans	-160.9	117.2	161.8	-111	-71.6	0	0	0	110.2
744	I	25.6	Very low	30.6	Very low	168 Å²	168	130.7 Å²	130.7	86%	0.862	77%	0.771	S	S	*	*			trans	-137	130.2	169.5	-59.8	177.8	0	0	0	106.8
745	I	33.2	Very low	30.6	Very low	134 Å²	134	135.5 Å²	135.5	69%	0.687	78%	0.782	S	S	*	*			trans	-134.3	122.6	169.8	-64.5	-177.7	0	0	0	109
746	N	29.9	Very low	30.9	Very low	152 Å²	152	134.3 Å²	134.3	81%	0.813	78%	0.782	S	S	*	*			trans	43.6	115.4	163.4	-65.1	-3.8	0	0	0	120.8
747	S	27.6	Very low	30.8	Very low	100 Å²	100	134.2 Å²	134.2	70%	0.699	78%	0.78	S	S	*	*			trans	-66.7	145.6	147.8	51.1	0	0	0	0	112.6
748	N	29.6	Very low	31	Very low	146 Å²	146	134 Å²	134	78%	0.781	78%	0.783	S	S	*	*				179.4	160.6	125.7	-91.7	-18.8	0	0	0	112.8
749	T	31.8	Very low	30.8	Very low	128 Å²	128	133.2 Å²	133.2	79%	0.785	78%	0.781	S	S	*	*			trans	51.8	102	168	50.9	0	0	0	0	117.3
750	S	30.2	Very low	30.9	Very low	93 Å²	93	132.8 Å²	132.8	65%	0.65	78%	0.784	S	S	*	*				79.4	128.7	62.4	76	0	0	0	0	116.2
751	N	31.6	Very low	30.9	Very low	144 Å²	144	132.2 Å²	132.2	77%	0.77	78%	0.783	S	S	*	*			trans	101.9	128.7	151.9	-63.1	-15.9	0	0	0	121.4
752	L	31.9	Very low	31.8	Very low	164 Å²	164	132.2 Å²	132.2	86%	0.859	78%	0.78	S	S	*	*			trans	68.7	113.8	151.4	-87.8	72.6	0	0	0	121.3
753	A	28.2	Very low	32.1	Very low	89 Å²	89	136.6 Å²	136.6	74%	0.736	79%	0.788	S	S	*	*			trans	-75.1	166.4	164.9	0	0	0	0	0	113.5
754	S	31.6	Very low	32.4	Very low	116 Å²	116	133 Å²	133	81%	0.811	78%	0.784	S	S	*	*				162	100.1	122.1	-71.6	0	0	0	0	115.4
755	N	29	Very low	33	Very low	168 Å²	168	130 Å²	130	90%	0.898	78%	0.777	S	S	*	*			trans	55.4	165.7	136.6	-87.1	5.7	0	0	0	123.6
756	P	37.2	Very low	33.2	Very low	109 Å²	109	129.8 Å²	129.8	71%	0.708	78%	0.782	S	S	*	*			trans	-122.8	174.2	-151.1	44.4	-34.5	0	0	0	116.3
757	M	30.5	Very low	33.5	Very low	163 Å²	163	128.7 Å²	128.7	80%	0.803	79%	0.786	S	S	*	*			trans	-178.1	143.5	133.8	-102.1	-173.7	-166.2	0	0	111.5
758	F	31.9	Very low	33.9	Very low	200 Å²	200	127.3 Å²	127.3	88%	0.877	79%	0.788	S	S	*	*				164.7	164	119.4	-96.3	-72.5	0	0	0	112.5
759	S	29.9	Very low	34.3	Very low	109 Å²	109	127 Å²	127	76%	0.762	79%	0.786	S	S	*	*			trans	-143.4	156.5	-160.5	55.4	0	0	0	0	113.6
760	S	34.7	Very low	34.7	Very low	117 Å²	117	126.6 Å²	126.6	82%	0.818	78%	0.78	S	S	*	*			trans	-170.9	124.8	152.1	55.4	0	0	0	0	113.4
761	S	34.5	Very low	35.2	Very low	108 Å²	108	128.2 Å²	128.2	76%	0.755	78%	0.781	S	S	*	*			trans	-98.4	178	154.3	-57	0	0	0	0	109.5
762	P	47.9	Very low	35.7	Very low	126 Å²	126	128 Å²	128	82%	0.818	78%	0.78	S	S	*	*				-148.4	170.8	107.4	37.6	-21.1	0	0	0	116.4
763	D	36.2	Very low	36	Very low	154 Å²	154	127.3 Å²	127.3	82%	0.824	78%	0.777	S	S	*	*			trans	-99.8	174.8	-172.3	-39.4	-101.7	0	0	0	114.7
764	S	37.2	Very low	36.5	Very low	106 Å²	106	129 Å²	129	74%	0.741	78%	0.784	S	S	*	*			trans	-174.3	119.1	134	59.8	0	0	0	0	116.4
765	S	37.9	Very low	36.7	Very low	103 Å²	103	130.9 Å²	130.9	72%	0.72	78%	0.777	S	S	*	*			trans	58.1	147.3	135.2	63.8	0	0	0	0	123
766	T	37.6	Very low	37	Very low	130 Å²	130	129.5 Å²	129.5	80%	0.798	77%	0.768	S	S	*	*			cis	-172.2	151.4	-4	20	0	0	0	0	112.7
767	S	37	Very low	36.9	Very low	129 Å²	129	130.5 Å²	130.5	90%	0.902	76%	0.763	S	S	*	*			trans	61.3	145.6	151	-154.6	0	0	0	0	119.6
768	G	36.2	Very low	37.1	Very low	71 Å²	71	128.3 Å²	128.3	73%	0.732	76%	0.761	S	S	*	*			cis	151.1	166.5	3.9	0	0	0	0	0	109.5
769	N	36.9	Very low	37.3	Very low	139 Å²	139	125.4 Å²	125.4	74%	0.743	76%	0.76	S	S	*	*			cis	-169.3	173.2	-9.9	-172.6	21.8	0	0	0	109.8
770	N	40.6	Very low	37.5	Very low	121 Å²	121	128.6 Å²	128.6	65%	0.647	76%	0.763	S	S	*	*			trans	76.1	150.4	170.4	-51.3	-45.8	0	0	0	118.4
771	N	40	Very low	37.4	Very low	127 Å²	127	129.3 Å²	129.3	68%	0.679	76%	0.762	S	S	*	*			cis	-168.3	165.5	-24.2	-102.6	-18.2	0	0	0	113
772	N	41.9	Very low	37.3	Very low	139 Å²	139	131.1 Å²	131.1	74%	0.743	76%	0.762	S	S	*	*			trans	84	90.6	154.2	-63.9	-13.5	0	0	0	123.3
773	N	38.7	Very low	36.4	Very low	150 Å²	150	135 Å²	135	80%	0.802	76%	0.76	S	S	*	*				43.5	116.9	120.1	-63.9	-8.8	0	0	0	123.4
774	S	39.6	Very low	36.2	Very low	125 Å²	125	135.5 Å²	135.5	87%	0.874	76%	0.762	S	S	*	*				159.8	159.6	105.6	52.8	0	0	0	0	111.8
775	K	34.2	Very low	35.8	Very low	154 Å²	154	136.4 Å²	136.4	67%	0.67	76%	0.758	S	S	*	*			cis	-170.8	163.4	-37.4	-163.6	-144	167.4	-137.8	0	105.7	E777	K775-E777 WeakPolarHBondContact CE-OE2 3.29Å; K775-E777 IonicContact NZ-OE1 3.16Å; K775-E777 IonicContact NZ-OE2 2.95Å; K775-E777 PolarHBondContact NZ-OE2 3.46Å
776	I	35.8	Very low	35.5	Very low	139 Å²	139	140.5 Å²	140.5	71%	0.713	76%	0.763	S	S	*	*			trans	78.3	126.5	174.7	-45.8	-174.8	0	0	0	115
777	E	35.5	Very low	35.2	Very low	130 Å²	130	139.3 Å²	139.3	61%	0.607	76%	0.76	S	S	*	*			cis	-165.6	172.5	-38.4	-115.9	90.8	-92.1	0	0	105.5	K775	K775-E777 WeakPolarHBondContact CE-OE2 3.29Å; K775-E777 IonicContact NZ-OE1 3.16Å; K775-E777 IonicContact NZ-OE2 2.95Å; K775-E777 PolarHBondContact NZ-OE2 3.46Å
778	P	35.4	Very low	35	Very low	117 Å²	117	138.6 Å²	138.6	76%	0.76	76%	0.755	S	S	*	*			trans	-112.3	172.8	-150.1	41.9	-38.5	0	0	0	119.4
779	V	35.3	Very low	34.8	Very low	140 Å²	140	143.9 Å²	143.9	85%	0.848	76%	0.76	S	S	*	*			trans	-137.3	158	159.6	-177.5	0	0	0	0	110.6
780	E	34.6	Very low	35.1	Very low	176 Å²	176	143 Å²	143	82%	0.822	76%	0.762	S	S	*	*			trans	-66	155.4	-160	-61.6	168	104.1	0	0	118.3
781	V	32.2	Very low	34.9	Very low	131 Å²	131	145.7 Å²	145.7	79%	0.794	77%	0.77	S	S	*	*			trans	-124.5	114.3	166.3	174.2	0	0	0	0	109.4
782	I	33.7	Very low	35	Very low	147 Å²	147	144.8 Å²	144.8	75%	0.754	77%	0.771	S	S	*	*			trans	-89.1	113.4	171.3	-64.3	177.5	0	0	0	109.1
783	R	28.9	Very low	35.4	Very low	206 Å²	206	144 Å²	144	78%	0.777	77%	0.772	S	S	*	*			trans	-89.2	133.7	162.3	-80.1	-177.9	170.1	-179.1	-2.9	109.5
784	L	32.1	Very low	35.8	Very low	165 Å²	165	146.6 Å²	146.6	86%	0.864	80%	0.797	S	S	*	*			trans	-116.6	141.3	150.5	-72.6	175.3	0	0	0	109
785	L	28	Very low	35.7	Very low	126 Å²	126	147.7 Å²	147.7	66%	0.66	79%	0.793	S	S	*	*			trans	-110.9	-165.5	-174.3	-80.8	164.4	0	0	0	109.8
786	F	31.9	Very low	35.7	Very low	189 Å²	189	147.3 Å²	147.3	83%	0.829	80%	0.799	S	S	*	*			trans	83.1	130.9	168.9	-44.7	-65.6	0	0	0	115.8
787	S	30.7	Very low	35.7	Very low	105 Å²	105	147.8 Å²	147.8	73%	0.734	80%	0.804	S	S	*	*			cis	-158.1	134.1	-19.8	-153.7	0	0	0	0	110.6
788	S	32.2	Very low	35.8	Very low	114 Å²	114	148.8 Å²	148.8	80%	0.797	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-85.2	132.8	173.7	38.4	0	0	0	0	111.3
789	H	33.2	Very low	35.8	Very low	181 Å²	181	150.8 Å²	150.8	84%	0.838	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-77.3	139.6	173.9	-82.7	58.8	0	0	0	111.1
790	P	42.2	Very low	35.8	Very low	122 Å²	122	151.5 Å²	151.5	79%	0.792	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-77.7	142	170.7	32.5	-33.4	0	0	0	111
791	H	37	Very low	35.9	Very low	177 Å²	177	149.8 Å²	149.8	82%	0.819	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-95.4	127.2	176.1	-146	-62.9	0	0	0	109.6
792	P	43.1	Very low	36.2	Very low	107 Å²	107	151.2 Å²	151.2	70%	0.695	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-76.8	151.4	167.4	32	-33.1	0	0	0	110.8
793	T	49.1	Very low	36.4	Very low	123 Å²	123	151.6 Å²	151.6	76%	0.755	82%	0.824	S	S	*	*			trans	-140	159.2	165.3	50.8	0	0	0	0	108
794	P	48.5	Very low	37.1	Very low	204 Å²	204	146.6 Å²	146.6	100%	1.325	83%	0.828	S	S	*	*				-45.6	0	-117.6	30.1	-37.2	0	0	0	116.3

Retrieved 794 of 794 residues in 1396 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).