A0A3Q0KIU6_SCHMA Loading...

Metalloproteinase inhibitor 1

AlphaFold DB , UniProt , Accession A0A3Q0KIU6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 408 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	47.2	Very low	72.5	Confident	247 Å²	247	142.5 Å²	142.5	100%	1.217	74%	0.74	S	S	*	*				0	92.6	0	-77.5	176.1	163.7	0	0	106.4	A3	M1-A3 PolarHBondContact O-N 3.47Å
2	E	55.4	Low	73.9	Confident	192 Å²	192	137.8 Å²	137.8	90%	0.897	72%	0.715	S	S	*	*			trans	-76.6	120	-171.1	-70.8	171.6	157.4	0	0	109.5	S4	E2-S4 PolarHBondContact O-N 3.14Å; E2-S4 VanDerWaalsContact O-N 3.14Å
3	A	54.3	Low	75.2	Confident	100 Å²	100	134.4 Å²	134.4	83%	0.826	70%	0.697	S	S	*	*			trans	-64.9	109.6	175.6	0	0	0	0	0	108.9	M1	M1-A3 PolarHBondContact O-N 3.47Å
4	S	65.9	Low	76.4	Confident	108 Å²	108	131.8 Å²	131.8	76%	0.755	68%	0.684	S	S	*	*			trans	-63.7	137.4	171.4	47.6	0	0	0	0	109.7	E2	E2-S4 PolarHBondContact O-N 3.14Å; E2-S4 VanDerWaalsContact O-N 3.14Å
5	P	72.2	Confident	77.5	Confident	76 Å²	76	128.4 Å²	128.4	49%	0.494	67%	0.666	S	S	.	*			trans	-71.2	142.9	-169.6	-15.9	29.5	0	0	0	112.3	Y7 Y8	P5-Y7 HydrophobicContact CB-CD2 3.72Å; P5-Y7 HydrophobicContact CB-CE2 4.49Å; P5-Y7 PolarHBondContact O-N 3.33Å; P5-Y8 PolarHBondContact O-N 2.92Å
6	P	80.4	Confident	78.3	Confident	101 Å²	101	126.9 Å²	126.9	66%	0.656	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	-9.7	178.5	24.7	-34.6	0	0	0	114.5	Y8 L9 L10	P6-Y8 VanDerWaalsContact C-N 3.3Å; P6-Y8 PolarHBondContact O-N 3.31Å; P6-L9 PolarHBondContact O-N 2.98Å; P6-L10 PolarHBondContact O-N 3.39Å
7	Y	82.4	Confident	79.1	Confident	186 Å²	186	124.8 Å²	124.8	73%	0.729	65%	0.647	S	S	*	*	H	α-helix	trans	-64.6	-29.5	178.1	-62.3	-75.4	0	0	0	113.7	P5 L10 F11	P5-Y7 HydrophobicContact CB-CD2 3.72Å; P5-Y7 HydrophobicContact CB-CE2 4.49Å; P5-Y7 PolarHBondContact O-N 3.33Å; Y7-L10 PolarHBondContact O-N 3.42Å; Y7-F11 PolarHBondContact O-N 3.48Å
8	Y	81.4	Confident	79.6	Confident	181 Å²	181	122.6 Å²	122.6	71%	0.71	64%	0.64	S	S	*	*	H	α-helix	trans	-67.6	-39.8	-179.9	-119	-83.6	0	0	0	112.1	P5 P6 F11 I12	P5-Y8 PolarHBondContact O-N 2.92Å; P6-Y8 VanDerWaalsContact C-N 3.3Å; P6-Y8 PolarHBondContact O-N 3.31Å; Y8-F11 PolarHBondContact O-N 3.34Å; Y8-I12 HydrophobicContact CD1-CD1 4.42Å; Y8-I12 VanDerWaalsContact O-CG1 3.31Å; Y8-I12 WeakPolarHBondContact O-CG1 3.28Å; Y8-I12 PolarHBondContact O-N 3.05Å
9	L	84.1	Confident	80.1	Confident	124 Å²	124	121.7 Å²	121.7	65%	0.649	64%	0.636	S	S	*	*	H	α-helix	trans	-63.9	-42.2	175.7	-100.2	158.1	0	0	0	111.5	P6 F11 I12 I13	P6-L9 PolarHBondContact O-N 2.98Å; L9-F11 VanDerWaalsContact C-N 3.34Å; L9-F11 PolarHBondContact O-N 3.48Å; L9-I12 PolarHBondContact O-N 3.39Å; L9-I13 VanDerWaalsContact O-CG1 3.28Å; L9-I13 WeakPolarHBondContact O-CG1 3.33Å; L9-I13 PolarHBondContact O-N 3.46Å
10	L	87	Confident	80.3	Confident	114 Å²	114	123.9 Å²	123.9	60%	0.597	64%	0.636	S	S	*	*	H	α-helix	trans	-67.1	-37	-179.7	-152.5	127.9	0	0	0	111.9	P6 Y7 L14	P6-L10 PolarHBondContact O-N 3.39Å; Y7-L10 PolarHBondContact O-N 3.42Å; L10-L14 HydrophobicContact CD2-CD1 3.95Å; L10-L14 PolarHBondContact O-N 3.43Å
11	F	87.3	Confident	80.4	Confident	139 Å²	139	121.9 Å²	121.9	61%	0.61	63%	0.626	S	S	*	*	H	α-helix	trans	-66.6	-42.8	174.7	-164.5	-94.9	0	0	0	112	Y7 Y8 L9 L14 L15	Y7-F11 PolarHBondContact O-N 3.48Å; Y8-F11 PolarHBondContact O-N 3.34Å; L9-F11 VanDerWaalsContact C-N 3.34Å; L9-F11 PolarHBondContact O-N 3.48Å; F11-L14 PolarHBondContact O-N 3.03Å; F11-L15 HydrophobicContact CD1-CD1 4.2Å; F11-L15 HydrophobicContact CE1-CD1 3.69Å; F11-L15 WeakPolarHBondContact O-CB 3.31Å; F11-L15 PolarHBondContact O-N 3.28Å
12	I	89.1	Confident	81.9	Confident	86 Å²	86	115.1 Å²	115.1	44%	0.441	59%	0.591	S	S	.	*	H	α-helix	trans	-62.8	-43.6	176.4	-68.6	171.4	0	0	0	110.9	Y8 L9 L14 L15 I16	Y8-I12 HydrophobicContact CD1-CD1 4.42Å; Y8-I12 VanDerWaalsContact O-CG1 3.31Å; Y8-I12 WeakPolarHBondContact O-CG1 3.28Å; Y8-I12 PolarHBondContact O-N 3.05Å; L9-I12 PolarHBondContact O-N 3.39Å; I12-L14 PolarHBondContact O-N 2.98Å; I12-L15 PolarHBondContact O-N 3.45Å; I12-I16 HydrophobicContact CG2-CD1 3.85Å; I12-I16 HydrophobicContact CG2-CG1 4.46Å; I12-I16 VanDerWaalsContact O-CG1 3.31Å; I12-I16 WeakPolarHBondContact O-CG1 3.39Å; I12-I16 PolarHBondContact O-N 3.49Å
13	I	90.9	Very high	82.8	Confident	93 Å²	93	111.9 Å²	111.9	48%	0.477	58%	0.576	S	S	.	*	H	α-helix	trans	-62.1	-45.1	177.7	-68.6	165.9	0	0	0	110.9	L9 L15 I16 I17	L9-I13 VanDerWaalsContact O-CG1 3.28Å; L9-I13 WeakPolarHBondContact O-CG1 3.33Å; L9-I13 PolarHBondContact O-N 3.46Å; I13-L15 VanDerWaalsContact C-N 3.32Å; I13-L15 PolarHBondContact O-N 3.37Å; I13-I16 PolarHBondContact O-N 3.03Å; I13-I17 HydrophobicContact CG2-CD1 3.88Å; I13-I17 WeakPolarHBondContact O-CG1 3.31Å; I13-I17 PolarHBondContact O-N 3.35Å
14	L	92.1	Very high	83.6	Confident	98 Å²	98	109.5 Å²	109.5	51%	0.513	55%	0.551	S	S	.	*	H	α-helix	trans	-59.3	-44.3	176.4	-83.3	163.8	0	0	0	111.5	L10 F11 I12 I16 I17 T18	L10-L14 HydrophobicContact CD2-CD1 3.95Å; L10-L14 PolarHBondContact O-N 3.43Å; F11-L14 PolarHBondContact O-N 3.03Å; I12-L14 PolarHBondContact O-N 2.98Å; L14-I16 PolarHBondContact O-N 3.4Å; L14-I17 PolarHBondContact O-N 3.47Å; L14-T18 PolarHBondContact O-N 2.98Å; L14-T18 PolarHBondContact O-OG1 3.37Å
15	L	92.3	Very high	83.5	Confident	81 Å²	81	110.3 Å²	110.3	42%	0.424	54%	0.541	S	S	.	.	H	α-helix	trans	-64.9	-38.9	-179.2	-143.1	153.9	0	0	0	112.1	F11 I12 I13 T18 L19	F11-L15 HydrophobicContact CD1-CD1 4.2Å; F11-L15 HydrophobicContact CE1-CD1 3.69Å; F11-L15 WeakPolarHBondContact O-CB 3.31Å; F11-L15 PolarHBondContact O-N 3.28Å; I12-L15 PolarHBondContact O-N 3.45Å; I13-L15 VanDerWaalsContact C-N 3.32Å; I13-L15 PolarHBondContact O-N 3.37Å; L15-T18 PolarHBondContact O-N 3.21Å; L15-T18 PolarHBondContact O-OG1 2.8Å; L15-L19 HydrophobicContact CD2-CD1 3.67Å; L15-L19 HydrophobicContact CD2-CG 4.14Å; L15-L19 WeakPolarHBondContact O-CB 3.42Å; L15-L19 WeakPolarHBondContact O-CG 3.43Å; L15-L19 PolarHBondContact O-N 3.06Å
16	I	91.6	Very high	82.7	Confident	105 Å²	105	113.1 Å²	113.1	54%	0.538	55%	0.548	S	S	.	.	H	α-helix	trans	-64.3	-42.3	173.7	-67.5	168.8	0	0	0	110.9	I12 I13 L14 L19 Y20	I12-I16 HydrophobicContact CG2-CD1 3.85Å; I12-I16 HydrophobicContact CG2-CG1 4.46Å; I12-I16 VanDerWaalsContact O-CG1 3.31Å; I12-I16 WeakPolarHBondContact O-CG1 3.39Å; I12-I16 PolarHBondContact O-N 3.49Å; I13-I16 PolarHBondContact O-N 3.03Å; L14-I16 PolarHBondContact O-N 3.4Å; I16-L19 PolarHBondContact O-N 2.94Å; I16-Y20 WeakPolarHBondContact O-CB 3.47Å; I16-Y20 PolarHBondContact O-N 3.41Å
17	I	90.3	Very high	81.2	Confident	90 Å²	90	113.6 Å²	113.6	46%	0.462	55%	0.545	S	S	.	.	H	α-helix	trans	-64.2	-43.6	178	-67.6	167.5	0	0	0	110.9	I13 L14 Y20 I21	I13-I17 HydrophobicContact CG2-CD1 3.88Å; I13-I17 WeakPolarHBondContact O-CG1 3.31Å; I13-I17 PolarHBondContact O-N 3.35Å; L14-I17 PolarHBondContact O-N 3.47Å; I17-Y20 PolarHBondContact O-N 3.49Å; I17-I21 HydrophobicContact CG2-CD1 3.82Å; I17-I21 VanDerWaalsContact O-CG1 3.27Å; I17-I21 WeakPolarHBondContact O-CG1 3.27Å; I17-I21 PolarHBondContact O-N 2.99Å
18	T	89.3	Confident	79.5	Confident	86 Å²	86	111.7 Å²	111.7	53%	0.528	55%	0.546	S	S	.	.	H	α-helix	trans	-64.5	-41.8	176.8	8	0	0	0	0	112.3	L14 L15 Y20 I21 E22	L14-T18 PolarHBondContact O-N 2.98Å; L14-T18 PolarHBondContact O-OG1 3.37Å; L15-T18 PolarHBondContact O-N 3.21Å; L15-T18 PolarHBondContact O-OG1 2.8Å; T18-Y20 VanDerWaalsContact C-N 3.35Å; T18-I21 PolarHBondContact O-N 2.7Å; T18-E22 PolarHBondContact O-N 2.91Å
19	L	87.8	Confident	77.7	Confident	106 Å²	106	111.4 Å²	111.4	56%	0.555	55%	0.548	S	S	*	.	H	α-helix	trans	-63.4	-40.3	176.1	-74.7	171.4	0	0	0	111.9	L15 I16 I21 E22 Q23	L15-L19 HydrophobicContact CD2-CD1 3.67Å; L15-L19 HydrophobicContact CD2-CG 4.14Å; L15-L19 WeakPolarHBondContact O-CB 3.42Å; L15-L19 WeakPolarHBondContact O-CG 3.43Å; L15-L19 PolarHBondContact O-N 3.06Å; I16-L19 PolarHBondContact O-N 2.94Å; L19-I21 PolarHBondContact O-N 2.84Å; L19-E22 PolarHBondContact O-N 2.74Å; L19-Q23 WeakPolarHBondContact O-CB 3.32Å; L19-Q23 PolarHBondContact O-N 3.31Å
20	Y	85.7	Confident	75.3	Confident	164 Å²	164	110.2 Å²	110.2	64%	0.643	55%	0.546	S	S	*	.	H	α-helix	trans	-65.8	-37.6	176.8	-165.9	-97.3	0	0	0	112.3	I16 I17 T18 T24	I16-Y20 WeakPolarHBondContact O-CB 3.47Å; I16-Y20 PolarHBondContact O-N 3.41Å; I17-Y20 PolarHBondContact O-N 3.49Å; T18-Y20 VanDerWaalsContact C-N 3.35Å; Y20-T24 HydrophobicContact CD1-CG2 4.22Å; Y20-T24 HydrophobicContact CE1-CG2 3.95Å; Y20-T24 WeakPolarHBondContact O-CG2 3.33Å; Y20-T24 PolarHBondContact O-N 3.01Å; Y20-T24 PolarHBondContact O-OG1 3.06Å
21	I	82.3	Confident	72.7	Confident	83 Å²	83	113.2 Å²	113.2	43%	0.426	56%	0.557	S	S	.	*	H	α-helix	trans	-67.7	-37.9	175	-67.3	166.7	0	0	0	111.5	I17 T18 L19 T24 K25	I17-I21 HydrophobicContact CG2-CD1 3.82Å; I17-I21 VanDerWaalsContact O-CG1 3.27Å; I17-I21 WeakPolarHBondContact O-CG1 3.27Å; I17-I21 PolarHBondContact O-N 2.99Å; T18-I21 PolarHBondContact O-N 2.7Å; L19-I21 PolarHBondContact O-N 2.84Å; I21-T24 WeakPolarHBondContact CA-OG1 3.46Å; I21-T24 PolarHBondContact O-OG1 2.92Å; I21-T24 VanDerWaalsContact O-OG1 3.06Å; I21-K25 WeakPolarHBondContact O-CG 3.49Å; I21-K25 PolarHBondContact O-N 3.01Å
22	E	78.2	Confident	70.3	Confident	105 Å²	105	112.5 Å²	112.5	49%	0.491	56%	0.564	S	S	.	*	H	α-helix	trans	-67.2	-45.2	174.5	-79.7	-78.1	121	0	0	111.5	T18 L19 T24 K25 E26	T18-E22 PolarHBondContact O-N 2.91Å; L19-E22 PolarHBondContact O-N 2.74Å; E22-T24 PolarHBondContact O-N 2.93Å; E22-K25 WeakPolarHBondContact O-CB 3.12Å; E22-K25 PolarHBondContact O-N 3.31Å; E22-K25 IonicContact OE1-NZ 3.42Å; E22-K25 PolarHBondContact OE1-NZ 3.02Å; E22-E26 PolarHBondContact O-N 3.33Å
23	Q	75.2	Confident	67.6	Low	123 Å²	123	113.8 Å²	113.8	58%	0.575	58%	0.581	S	S	*	*	H	α-helix	trans	-64.1	-39.4	-180	-167.7	164.6	-7.9	0	0	112.2	L19 K25 E26 D27	L19-Q23 WeakPolarHBondContact O-CB 3.32Å; L19-Q23 PolarHBondContact O-N 3.31Å; Q23-K25 VanDerWaalsContact C-N 3.28Å; Q23-K25 PolarHBondContact O-N 3.35Å; Q23-E26 PolarHBondContact O-N 2.94Å; Q23-E26 VanDerWaalsContact O-N 3.15Å; Q23-D27 PolarHBondContact O-N 3.49Å
24	T	71.1	Confident	64.8	Low	50 Å²	50	115 Å²	115	31%	0.307	59%	0.592	S	S	.	*	H	α-helix	trans	-67.7	-24.2	174.3	52.3	0	0	0	0	113.3	Y20 I21 E22 I28	Y20-T24 HydrophobicContact CD1-CG2 4.22Å; Y20-T24 HydrophobicContact CE1-CG2 3.95Å; Y20-T24 WeakPolarHBondContact O-CG2 3.33Å; Y20-T24 PolarHBondContact O-N 3.01Å; Y20-T24 PolarHBondContact O-OG1 3.06Å; I21-T24 WeakPolarHBondContact CA-OG1 3.46Å; I21-T24 PolarHBondContact O-OG1 2.92Å; I21-T24 VanDerWaalsContact O-OG1 3.06Å; E22-T24 PolarHBondContact O-N 2.93Å; T24-I28 WeakPolarHBondContact O-CB 3.22Å; T24-I28 VanDerWaalsContact O-CD1 3.22Å; T24-I28 WeakPolarHBondContact O-CD1 3.39Å; T24-I28 WeakPolarHBondContact O-CG1 3.43Å; T24-I28 PolarHBondContact O-N 3.37Å
25	K	63.5	Low	61.9	Low	125 Å²	125	119.1 Å²	119.1	54%	0.543	61%	0.609	S	S	.	*	H	α-helix	trans	-72.9	-31.4	171.1	-75.5	174.8	-173.5	167.5	0	112.8	I21 E22 Q23	I21-K25 WeakPolarHBondContact O-CG 3.49Å; I21-K25 PolarHBondContact O-N 3.01Å; E22-K25 WeakPolarHBondContact O-CB 3.12Å; E22-K25 PolarHBondContact O-N 3.31Å; E22-K25 IonicContact OE1-NZ 3.42Å; E22-K25 PolarHBondContact OE1-NZ 3.02Å; Q23-K25 VanDerWaalsContact C-N 3.28Å; Q23-K25 PolarHBondContact O-N 3.35Å
26	E	55.1	Low	59	Low	135 Å²	135	121.5 Å²	121.5	63%	0.631	62%	0.62	S	S	*	*	H	α-helix	trans	-79.7	-37.9	177.3	-64.5	-156	149.2	0	0	112.1	E22 Q23 I28 K29	E22-E26 PolarHBondContact O-N 3.33Å; Q23-E26 PolarHBondContact O-N 2.94Å; Q23-E26 VanDerWaalsContact O-N 3.15Å; E26-I28 VanDerWaalsContact C-N 3.34Å; E26-I28 PolarHBondContact O-N 3.02Å; E26-K29 WeakPolarHBondContact O-CB 3.08Å; E26-K29 PolarHBondContact O-N 2.82Å
27	D	48.3	Very low	56	Low	111 Å²	111	127.6 Å²	127.6	59%	0.594	64%	0.636	S	S	*	*	H	α-helix	trans	-71.5	-26.5	177.3	-75.9	-27.4	0	0	0	113.1	Q23 K29	Q23-D27 PolarHBondContact O-N 3.49Å; D27-K29 PolarHBondContact O-N 3.02Å
28	I	47.6	Very low	53.2	Low	146 Å²	146	134.4 Å²	134.4	75%	0.749	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-10.8	171.6	-65.9	168.1	0	0	0	111.9	T24 E26 V30	T24-I28 WeakPolarHBondContact O-CB 3.22Å; T24-I28 VanDerWaalsContact O-CD1 3.22Å; T24-I28 WeakPolarHBondContact O-CD1 3.39Å; T24-I28 WeakPolarHBondContact O-CG1 3.43Å; T24-I28 PolarHBondContact O-N 3.37Å; E26-I28 VanDerWaalsContact C-N 3.34Å; E26-I28 PolarHBondContact O-N 3.02Å; I28-V30 VanDerWaalsContact C-N 3.29Å; I28-V30 PolarHBondContact O-N 2.9Å
29	K	41.7	Very low	50.6	Low	176 Å²	176	135.5 Å²	135.5	77%	0.765	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	0	-178.9	-121.6	173.3	-175.5	176.5	0	114.1	E26 D27	E26-K29 WeakPolarHBondContact O-CB 3.08Å; E26-K29 PolarHBondContact O-N 2.82Å; D27-K29 PolarHBondContact O-N 3.02Å
30	V	34.1	Very low	48	Very low	99 Å²	99	135.8 Å²	135.8	60%	0.6	68%	0.676	S	S	*	*	S	Bend	trans	-131.9	98	-174.1	-172.2	0	0	0	0	109.8	I28	I28-V30 VanDerWaalsContact C-N 3.29Å; I28-V30 PolarHBondContact O-N 2.9Å
31	H	32.5	Very low	45.9	Very low	177 Å²	177	132.9 Å²	132.9	82%	0.819	67%	0.672	S	S	*	*			trans	157.6	42	151	-83.1	-57.6	0	0	0	114.6
32	T	37.4	Very low	43.9	Very low	123 Å²	123	139.3 Å²	139.3	76%	0.755	69%	0.69	S	S	*	*			trans	-123.7	72.6	164.6	58.7	0	0	0	0	111.5	V34	T32-V34 VanDerWaalsContact C-N 3.35Å; T32-V34 PolarHBondContact O-N 2.88Å
33	S	31.5	Very low	42	Very low	114 Å²	114	139.5 Å²	139.5	80%	0.797	69%	0.691	S	S	*	*			trans	-89.2	72.9	162.1	51	0	0	0	0	109.6	Q35	S33-Q35 PolarHBondContact O-N 3.45Å
34	V	33.5	Very low	40.1	Very low	119 Å²	119	140.8 Å²	140.8	72%	0.721	69%	0.691	S	S	*	*			trans	-80.4	109.2	167.4	178.7	0	0	0	0	107.7	T32 I36	T32-V34 VanDerWaalsContact C-N 3.35Å; T32-V34 PolarHBondContact O-N 2.88Å; V34-I36 PolarHBondContact O-N 3.26Å
35	Q	30.4	Very low	38.8	Very low	184 Å²	184	145 Å²	145	86%	0.86	71%	0.71	S	S	*	*			trans	-60.2	101.9	170	-82	-172.4	-9.3	0	0	109.9	S33 R37	S33-Q35 PolarHBondContact O-N 3.45Å; Q35-R37 PolarHBondContact O-N 2.99Å; Q35-R37 VanDerWaalsContact O-N 3.09Å
36	I	31.7	Very low	37.8	Very low	130 Å²	130	145.2 Å²	145.2	67%	0.667	71%	0.713	S	S	*	*			trans	-76.1	95.9	172.1	-56.4	173.4	0	0	0	108	V34 R38	V34-I36 PolarHBondContact O-N 3.26Å; I36-R38 PolarHBondContact O-N 3.15Å; I36-R38 VanDerWaalsContact O-N 3.14Å
37	R	28.5	Very low	37	Very low	233 Å²	233	145.8 Å²	145.8	88%	0.879	71%	0.709	S	S	*	*			trans	-63.5	110.3	160.8	-92.4	-174.5	173.4	177.9	-1.1	108.2	Q35	Q35-R37 PolarHBondContact O-N 2.99Å; Q35-R37 VanDerWaalsContact O-N 3.09Å
38	R	31.1	Very low	36.6	Very low	234 Å²	234	144 Å²	144	88%	0.883	71%	0.71	S	S	*	*			trans	-60.9	127	173.5	-69.2	177.3	-178.5	156.9	0.9	109.8	I36	I36-R38 PolarHBondContact O-N 3.15Å; I36-R38 VanDerWaalsContact O-N 3.14Å
39	P	34.7	Very low	36.3	Very low	108 Å²	108	140.8 Å²	140.8	70%	0.701	70%	0.7	S	S	*	*			trans	-72.9	132.4	172.1	25.7	-27	0	0	0	110.4	N41	P39-N41 PolarHBondContact O-N 3.35Å
40	S	34.2	Very low	36.2	Very low	113 Å²	113	136.5 Å²	136.5	79%	0.79	69%	0.693	S	S	*	*	S	Bend	trans	-72.1	28.2	-171.4	67.9	0	0	0	0	115.7
41	N	40.9	Very low	36.4	Very low	103 Å²	103	136 Å²	136	55%	0.551	70%	0.699	S	S	*	*			trans	-104.2	24.2	-170.6	-82.7	-19.5	0	0	0	115.2	P39 H43 W44	P39-N41 PolarHBondContact O-N 3.35Å; N41-H43 PolarHBondContact O-N 3.47Å; N41-W44 PolarHBondContact OD1-NE1 3.42Å
42	R	41.5	Very low	36.7	Very low	217 Å²	217	138.5 Å²	138.5	82%	0.819	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-20.1	171	-93.6	-172.4	178.3	-173.3	-1.2	113.9	W44	R42-W44 VanDerWaalsContact C-N 3.27Å; R42-W44 PolarHBondContact O-N 3.41Å
43	H	37.4	Very low	36.6	Very low	109 Å²	109	140.3 Å²	140.3	51%	0.505	70%	0.701	S	S	.	*	H	α-helix	trans	-72.7	-14.7	-173.6	-143.9	-37.5	0	0	0	114.8	N41 R47	N41-H43 PolarHBondContact O-N 3.47Å; H43-R47 PolarHBondContact CD2-NH2 3.11Å; H43-R47 PolarHBondContact CE1-NE 3.48Å; H43-R47 PolarHBondContact CE1-NH2 3.06Å; H43-R47 PolarHBondContact ND1-NE 3.23Å; H43-R47 PolarHBondContact ND1-NH2 3.06Å; H43-R47 PolarHBondContact NE2-NH2 3.28Å
44	W	35.4	Very low	36.6	Very low	150 Å²	150	144.7 Å²	144.7	57%	0.568	71%	0.706	S	S	*	*	H	α-helix	trans	-87.5	-24.6	-173.1	-53.9	96.6	0	0	0	113.9	N41 R42	N41-W44 PolarHBondContact OD1-NE1 3.42Å; R42-W44 VanDerWaalsContact C-N 3.27Å; R42-W44 PolarHBondContact O-N 3.41Å
45	I	44.3	Very low	36.5	Very low	139 Å²	139	145.6 Å²	145.6	71%	0.713	71%	0.711	S	S	*	*	H	α-helix	trans	-88.4	-28.1	-176.9	-62.5	177.3	0	0	0	111.3	S49	I45-S49 PolarHBondContact O-OG 3.32Å
46	E	42.9	Very low	36.6	Very low	130 Å²	130	143.4 Å²	143.4	61%	0.607	71%	0.711	S	S	*	*	H	α-helix	trans	-82.7	-25.8	177.8	-71.9	173.2	175.3	0	0	113.6	S49 S50	E46-S49 WeakPolarHBondContact CA-OG 3.45Å; E46-S49 PolarHBondContact O-OG 3.19Å; E46-S49 VanDerWaalsContact O-OG 3.11Å; E46-S50 WeakPolarHBondContact O-CB 3.2Å; E46-S50 PolarHBondContact O-N 3.22Å; E46-S50 VanDerWaalsContact O-N 3.15Å
47	R	38.5	Very low	36.5	Very low	146 Å²	146	143.2 Å²	143.2	55%	0.551	72%	0.718	S	S	*	*	H	α-helix	trans	-76.4	-29.8	177.7	-116	-177.8	-91.9	159	-8.9	113.3	H43 A51	H43-R47 PolarHBondContact CD2-NH2 3.11Å; H43-R47 PolarHBondContact CE1-NE 3.48Å; H43-R47 PolarHBondContact CE1-NH2 3.06Å; H43-R47 PolarHBondContact ND1-NE 3.23Å; H43-R47 PolarHBondContact ND1-NH2 3.06Å; H43-R47 PolarHBondContact NE2-NH2 3.28Å; R47-A51 PolarHBondContact O-N 3.18Å
48	A	38.4	Very low	36.6	Very low	74 Å²	74	137.6 Å²	137.6	61%	0.612	72%	0.715	S	S	*	*	H	α-helix	trans	-79.2	-21.7	177.3	0	0	0	0	0	113.4
49	S	41.5	Very low	36.5	Very low	78 Å²	78	132.5 Å²	132.5	55%	0.545	71%	0.709	S	S	.	*	H	α-helix	trans	-89.4	-25.1	173.7	43.9	0	0	0	0	113.1	I45 E46	I45-S49 PolarHBondContact O-OG 3.32Å; E46-S49 WeakPolarHBondContact CA-OG 3.45Å; E46-S49 PolarHBondContact O-OG 3.19Å; E46-S49 VanDerWaalsContact O-OG 3.11Å
50	S	40.7	Very low	36.3	Very low	87 Å²	87	135.5 Å²	135.5	61%	0.608	72%	0.718	S	S	*	*	H	α-helix	trans	-79.6	-24	175.9	-166.1	0	0	0	0	114	E46 R52	E46-S50 WeakPolarHBondContact O-CB 3.2Å; E46-S50 PolarHBondContact O-N 3.22Å; E46-S50 VanDerWaalsContact O-N 3.15Å; S50-R52 PolarHBondContact O-N 3.47Å; S50-R52 VanDerWaalsContact O-N 3.14Å
51	A	38.6	Very low	36	Very low	87 Å²	87	135.6 Å²	135.6	72%	0.719	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	9.6	177.8	0	0	0	0	0	115.3	R47	R47-A51 PolarHBondContact O-N 3.18Å
52	R	38.1	Very low	35.5	Very low	230 Å²	230	137.4 Å²	137.4	87%	0.868	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.7	12	178.2	-84.7	-171.7	-173	-179.7	5.2	114.9	S50	S50-R52 PolarHBondContact O-N 3.47Å; S50-R52 VanDerWaalsContact O-N 3.14Å
53	Q	34.1	Very low	34.8	Very low	162 Å²	162	132.9 Å²	132.9	76%	0.757	73%	0.726	S	S	*	*			trans	-123.6	89.5	173.2	-76.7	-178.5	-13.5	0	0	110.3
54	K	32.4	Very low	34.5	Very low	205 Å²	205	134.9 Å²	134.9	89%	0.891	74%	0.739	S	S	*	*			trans	-177.7	149.6	148.3	-104.5	164	-177.3	-177.1	0	110.4
55	T	32.2	Very low	34.3	Very low	138 Å²	138	135 Å²	135	85%	0.847	75%	0.749	S	S	*	*			trans	78.4	75.3	173.6	63.5	0	0	0	0	118.3
56	T	31.7	Very low	33.6	Very low	138 Å²	138	133.6 Å²	133.6	85%	0.847	75%	0.749	S	S	*	*			trans	-73.9	137.6	134.2	12.3	0	0	0	0	108.9
57	P	29.6	Very low	33.2	Very low	126 Å²	126	135.6 Å²	135.6	82%	0.818	76%	0.764	S	S	*	*			trans	-90.8	118.8	-178.4	33.3	-27.2	0	0	0	110.3
58	S	31.2	Very low	32.8	Very low	115 Å²	115	138.6 Å²	138.6	80%	0.804	78%	0.775	S	S	*	*			trans	-101.7	113.9	162.3	58.2	0	0	0	0	109.1	L60	S58-L60 PolarHBondContact O-N 2.91Å
59	V	28.6	Very low	32.5	Very low	128 Å²	128	144.9 Å²	144.9	78%	0.776	79%	0.789	S	S	*	*			trans	-22.5	117.3	157.6	-179.6	0	0	0	0	112.9
60	L	31	Very low	31.8	Very low	170 Å²	170	146.7 Å²	146.7	89%	0.89	79%	0.791	S	S	*	*			trans	-161.8	129.5	139	-114.9	128.3	0	0	0	111.3	S58	S58-L60 PolarHBondContact O-N 2.91Å
61	T	26.1	Very low	31.4	Very low	115 Å²	115	153.2 Å²	153.2	71%	0.706	80%	0.804	S	S	*	*			trans	-62	128.9	-175.5	-38.7	0	0	0	0	112.2
62	T	31.6	Very low	31	Very low	141 Å²	141	156.6 Å²	156.6	87%	0.865	81%	0.809	S	S	*	*				-168.6	130.8	129.6	8.4	0	0	0	0	111.9
63	T	26.1	Very low	30.7	Very low	122 Å²	122	149.3 Å²	149.3	75%	0.748	81%	0.806	S	S	*	*			trans	-56.9	148	175.7	14.4	0	0	0	0	113.5
64	I	32.6	Very low	30.3	Very low	152 Å²	152	149.9 Å²	149.9	78%	0.779	81%	0.814	S	S	*	*				-176.7	107.2	116.6	-84.7	151.1	0	0	0	110.4
65	I	30	Very low	30.2	Very low	153 Å²	153	144.9 Å²	144.9	79%	0.785	81%	0.811	S	S	*	*			trans	65.4	123.4	134.9	-50.7	176.7	0	0	0	121
66	P	29.5	Very low	30	Very low	108 Å²	108	143.4 Å²	143.4	70%	0.701	81%	0.806	S	S	*	*			trans	-102.9	170.6	-175	41.7	-35.3	0	0	0	113.7
67	N	34.5	Very low	29.8	Very low	172 Å²	172	142 Å²	142	92%	0.92	80%	0.802	S	S	*	*			trans	-133.9	124.2	150.7	-100.5	-22	0	0	0	112.7
68	R	31	Very low	29.9	Very low	209 Å²	209	143.8 Å²	143.8	79%	0.789	80%	0.803	S	S	*	*			trans	-62.9	148	175.1	-99.2	168.1	164	172.3	-4.5	111.7
69	F	31	Very low	29.8	Very low	206 Å²	206	145.5 Å²	145.5	90%	0.904	80%	0.803	S	S	*	*				-150.7	117.6	118.3	-96.8	-75.8	0	0	0	109.2
70	I	27.7	Very low	30	Very low	116 Å²	116	147.1 Å²	147.1	60%	0.595	80%	0.804	S	S	*	*			trans	-103.3	133.4	168.6	-67	169.3	0	0	0	105.5	L72	I70-L72 HydrophobicContact CG2-CD1 3.72Å
71	Y	32.4	Very low	29.9	Very low	224 Å²	224	144.3 Å²	144.3	88%	0.878	80%	0.799	S	S	*	*			trans	-139	119.9	142.6	-102.3	-82.5	0	0	0	109.7
72	L	29.6	Very low	30.1	Very low	158 Å²	158	142.5 Å²	142.5	83%	0.827	79%	0.791	S	S	*	*			trans	-61.5	150.2	166.9	-92.9	75.5	0	0	0	110.8	I70	I70-L72 HydrophobicContact CG2-CD1 3.72Å
73	G	31	Very low	30.2	Very low	77 Å²	77	144 Å²	144	79%	0.794	79%	0.788	S	S	*	*			trans	-176.8	89.8	163.8	0	0	0	0	0	112.2
74	N	27.2	Very low	30.6	Very low	175 Å²	175	145.9 Å²	145.9	94%	0.936	79%	0.793	S	S	*	*			trans	-61.1	132.1	166.3	-78.6	-25.4	0	0	0	110.4
75	A	30.3	Very low	30.6	Very low	99 Å²	99	147.9 Å²	147.9	82%	0.818	80%	0.796	S	S	*	*			trans	-169.5	131	144	0	0	0	0	0	111
76	S	27.4	Very low	30.8	Very low	108 Å²	108	149 Å²	149	76%	0.755	80%	0.795	S	S	*	*			trans	-60.8	162.2	173	35.3	0	0	0	0	114.8
77	S	27.7	Very low	31.1	Very low	109 Å²	109	151.7 Å²	151.7	76%	0.762	80%	0.803	S	S	*	*			trans	65.8	98.7	159.6	64.4	0	0	0	0	118.7
78	I	32.5	Very low	31	Very low	163 Å²	163	149.3 Å²	149.3	84%	0.836	80%	0.801	S	S	*	*			trans	-140.1	121.2	145.2	-57.9	-176.9	0	0	0	110.2
79	N	28.4	Very low	31.2	Very low	150 Å²	150	146.8 Å²	146.8	80%	0.802	80%	0.801	S	S	*	*			trans	-67.6	127.4	167.8	-171.4	9.3	0	0	0	109.4
80	M	32.8	Very low	31.4	Very low	162 Å²	162	148.9 Å²	148.9	80%	0.798	80%	0.803	S	S	*	*			trans	-147.7	90.8	165.2	-113.2	177.7	124.5	0	0	111.5	S82	M80-S82 PolarHBondContact O-N 3.4Å
81	S	27.7	Very low	31.7	Very low	112 Å²	112	155.2 Å²	155.2	78%	0.783	82%	0.819	S	S	*	*			trans	-67.6	102.5	154	-173.3	0	0	0	0	108.6
82	S	31.4	Very low	31.8	Very low	77 Å²	77	154 Å²	154	54%	0.538	82%	0.818	S	S	.	*			trans	-171.3	78.3	162.5	65.1	0	0	0	0	112.9	M80	M80-S82 PolarHBondContact O-N 3.4Å
83	E	33.6	Very low	31.9	Very low	173 Å²	173	155.5 Å²	155.5	81%	0.808	82%	0.821	S	S	*	*			trans	-142.4	57.6	153.9	-91.8	-75.4	151.1	0	0	106.4
84	L	33.9	Very low	32.1	Very low	161 Å²	161	160.6 Å²	160.6	84%	0.843	83%	0.829	S	S	*	*			trans	-122.1	55.5	176.1	-128.4	167.4	0	0	0	106.9
85	K	32.2	Very low	32.3	Very low	194 Å²	194	161 Å²	161	84%	0.843	83%	0.826	S	S	*	*			trans	-167.8	62.7	-179.4	-115.6	175.7	-172	-177.3	0	111.8
86	K	35.9	Very low	32.5	Very low	176 Å²	176	163.8 Å²	163.8	77%	0.765	83%	0.827	S	S	*	*	S	Bend	trans	-165.9	127.3	158.1	-100.6	145.1	-171.6	-176.8	0	107.8
87	N	34.6	Very low	32.7	Very low	164 Å²	164	167.3 Å²	167.3	88%	0.877	83%	0.831	S	S	*	*			trans	107.3	20	178.4	-50.6	-14.3	0	0	0	117.5	I89	N87-I89 PolarHBondContact O-N 3.35Å
88	S	33	Very low	32.9	Very low	123 Å²	123	167.7 Å²	167.7	86%	0.86	83%	0.831	S	S	*	*			trans	-85.2	19.8	163.6	88.8	0	0	0	0	114.1
89	I	35.4	Very low	32.7	Very low	155 Å²	155	169 Å²	169	80%	0.795	83%	0.834	S	S	*	*			trans	-127.2	72.8	-172.4	-52.6	175.4	0	0	0	109.1	N87	N87-I89 PolarHBondContact O-N 3.35Å
90	R	34.4	Very low	32.9	Very low	251 Å²	251	170.2 Å²	170.2	95%	0.947	84%	0.839	S	S	*	*			trans	-167.8	25.3	153.1	-122.7	179.4	-172.2	-178.8	2.5	114.9
91	R	34.7	Very low	32.8	Very low	248 Å²	248	167.6 Å²	167.6	94%	0.936	84%	0.835	S	S	*	*			trans	-105.6	92	165.3	-87	-173.8	-175.8	163.5	1.1	108.5
92	K	33.6	Very low	32.8	Very low	198 Å²	198	169.6 Å²	169.6	86%	0.861	84%	0.836	S	S	*	*			trans	-171.8	111.2	160	-109.4	178.1	179.6	-173.1	0	106.9
93	E	33.1	Very low	32.8	Very low	190 Å²	190	172.6 Å²	172.6	89%	0.888	85%	0.852	S	S	*	*	S	Bend	trans	134.9	136.2	170.6	-79.9	174.2	161.8	0	0	109.2
94	L	34.2	Very low	32.7	Very low	184 Å²	184	171.3 Å²	171.3	96%	0.963	85%	0.85	S	S	*	*			trans	81.2	50.9	-159.1	-66.3	125.6	0	0	0	115.9
95	Q	31.1	Very low	32.3	Very low	185 Å²	185	168.4 Å²	168.4	86%	0.864	84%	0.843	S	S	*	*			trans	-103.5	113.4	134.4	-91	177.6	-24.8	0	0	105.5
96	D	34.8	Very low	32.5	Very low	156 Å²	156	165.1 Å²	165.1	83%	0.834	84%	0.842	S	S	*	*			trans	-168.7	113.4	147.9	-93.3	-28.3	0	0	0	110.7
97	Q	31.4	Very low	32.2	Very low	183 Å²	183	162.3 Å²	162.3	86%	0.855	84%	0.84	S	S	*	*			trans	65.5	152	150.4	-78.3	-175.4	-25.6	0	0	122.9
98	P	31.5	Very low	32	Very low	117 Å²	117	164.5 Å²	164.5	76%	0.76	84%	0.837	S	S	*	*			cis	-135.5	165.5	-36	32.5	-13.8	0	0	0	114.2
99	Q	28.3	Very low	32.1	Very low	191 Å²	191	164.1 Å²	164.1	89%	0.893	83%	0.825	S	S	*	*			trans	-69.9	147.8	176.8	-60.9	177.4	0	0	0	113.5
100	L	33.3	Very low	31.9	Very low	175 Å²	175	162.8 Å²	162.8	92%	0.916	82%	0.819	S	S	*	*			trans	-145.5	153.1	153.7	-94.8	144.6	0	0	0	109
101	P	30.7	Very low	31.7	Very low	107 Å²	107	160.1 Å²	160.1	70%	0.695	81%	0.811	S	S	*	*			trans	-104.3	167.8	-135.2	38.4	-36.1	0	0	0	116.5
102	N	27	Very low	31.7	Very low	154 Å²	154	157.2 Å²	157.2	82%	0.824	81%	0.808	S	S	*	*			trans	-39.7	135.4	169.4	-91.7	-21.5	0	0	0	114.8
103	T	32	Very low	31.8	Very low	140 Å²	140	150.9 Å²	150.9	86%	0.859	80%	0.799	S	S	*	*			trans	-138.3	123.1	148.7	-2.3	0	0	0	0	109.9
104	N	31.3	Very low	31.6	Very low	145 Å²	145	147.2 Å²	147.2	78%	0.775	79%	0.794	S	S	*	*			trans	-71.2	140.2	175.3	-64	-43	0	0	0	111.1
105	S	26.4	Very low	31.7	Very low	100 Å²	100	150.6 Å²	150.6	70%	0.699	79%	0.794	S	S	*	*			trans	44.8	145.2	146.9	-135.2	0	0	0	0	120.5	T107	S105-T107 PolarHBondContact OG-N 3.06Å
106	P	35.7	Very low	32	Very low	126 Å²	126	150.5 Å²	150.5	82%	0.818	79%	0.791	S	S	*	*				-141.5	140.8	78	32.1	-12.9	0	0	0	115.5
107	T	29.2	Very low	32	Very low	116 Å²	116	151.6 Å²	151.6	71%	0.712	79%	0.79	S	S	*	*			trans	-40	142.3	147.3	-30.3	0	0	0	0	113.4	S105	S105-T107 PolarHBondContact OG-N 3.06Å
108	Y	31.1	Very low	32.3	Very low	210 Å²	210	147.4 Å²	147.4	82%	0.824	78%	0.779	S	S	*	*			trans	-172.1	104.5	144.2	-125.8	-113	0	0	0	108.8
109	L	35.7	Very low	32.6	Very low	116 Å²	116	148.6 Å²	148.6	61%	0.607	78%	0.778	S	S	*	*				79.4	107.4	107.7	-81.9	160.2	0	0	0	113.5
110	D	31	Very low	33.1	Very low	127 Å²	127	146 Å²	146	68%	0.679	77%	0.77	S	S	*	*				89.2	135.6	50.3	-149.9	27.4	0	0	0	113.6
111	Y	30	Very low	33	Very low	195 Å²	195	145.5 Å²	145.5	77%	0.765	76%	0.763	S	S	*	*			trans	53.8	128.4	165.9	-88.4	-102.1	0	0	0	122.4
112	Q	34.7	Very low	33.3	Very low	186 Å²	186	151.7 Å²	151.7	87%	0.869	77%	0.774	S	S	*	*				168.7	134.5	110.2	-87.9	176	13	0	0	108.4
113	G	34.8	Very low	33.7	Very low	65 Å²	65	150.7 Å²	150.7	67%	0.67	77%	0.769	S	S	*	*			cis	93.9	83.8	33.4	0	0	0	0	0	109.8
114	S	29.7	Very low	34	Very low	114 Å²	114	153.5 Å²	153.5	80%	0.797	77%	0.772	S	S	*	*			trans	-11.5	129.2	169	-50.1	0	0	0	0	118.7
115	R	36.7	Very low	34	Very low	255 Å²	255	154.7 Å²	154.7	96%	0.962	77%	0.773	S	S	*	*				-176.4	148.6	128.1	-101.5	169.8	-157.4	-167.3	6.9	112.8
116	K	36	Very low	34.2	Very low	183 Å²	183	155.2 Å²	155.2	80%	0.796	78%	0.776	S	S	*	*			trans	-66.1	144.9	-177	-59.4	168	173.3	-179.6	0	113.2
117	H	36.6	Very low	34.1	Very low	178 Å²	178	156.3 Å²	156.3	82%	0.824	77%	0.774	S	S	*	*				173.1	159.4	106.9	-99.6	-80	0	0	0	111.4
118	P	37.1	Very low	34	Very low	96 Å²	96	158.6 Å²	158.6	62%	0.623	78%	0.781	S	S	*	*			trans	-118.3	-179.9	-158.8	40.2	-25.5	0	0	0	115
119	I	38	Very low	34	Very low	141 Å²	141	158 Å²	158	72%	0.723	78%	0.778	S	S	*	*			trans	104.3	140.6	154.1	-59.5	159.6	0	0	0	117.1
120	D	37.4	Very low	33.8	Very low	136 Å²	136	157.8 Å²	157.8	73%	0.727	78%	0.784	S	S	*	*			trans	85	97.9	171.2	-54.4	-31.2	0	0	0	117.8
121	E	32.8	Very low	34.1	Very low	166 Å²	166	159.2 Å²	159.2	78%	0.776	79%	0.786	S	S	*	*				69.7	99.3	66.6	-160.1	175.5	-137.7	0	0	112.6
122	Y	37.1	Very low	34.1	Very low	237 Å²	237	159.2 Å²	159.2	93%	0.929	79%	0.793	S	S	*	*			trans	-159	126.7	143.9	-114.5	-82	0	0	0	111
123	N	35.1	Very low	34.2	Very low	132 Å²	132	153.4 Å²	153.4	71%	0.706	78%	0.783	S	S	*	*			trans	-60.6	142.4	-174.4	-74.9	-54	0	0	0	115
124	Q	36.7	Very low	34.2	Very low	200 Å²	200	155.5 Å²	155.5	94%	0.935	78%	0.778	S	S	*	*			trans	-141.9	110.5	150	-139.6	161.8	9.2	0	0	110.3
125	H	31.8	Very low	34.5	Very low	170 Å²	170	154.5 Å²	154.5	79%	0.787	77%	0.772	S	S	*	*			trans	-65	138.1	174.8	-73.5	-80.9	0	0	0	111.1
126	S	30.9	Very low	34.6	Very low	110 Å²	110	146 Å²	146	77%	0.769	76%	0.756	S	S	*	*				164.8	146.5	114.4	48.1	0	0	0	0	113.7
127	I	34.6	Very low	34.7	Very low	150 Å²	150	144.9 Å²	144.9	77%	0.769	75%	0.751	S	S	*	*			trans	88.9	105.5	164.1	-41.1	-176.8	0	0	0	117	Y129	I127-Y129 HydrophobicContact CG2-CD2 4.14Å; I127-Y129 HydrophobicContact CG2-CE2 4.14Å
128	L	27	Very low	34.8	Very low	164 Å²	164	144.3 Å²	144.3	86%	0.859	75%	0.748	S	S	*	*			trans	-84.1	122.5	175.4	-155.4	89.1	0	0	0	109.8
129	Y	29.8	Very low	35	Very low	196 Å²	196	146.2 Å²	146.2	77%	0.769	75%	0.754	S	S	*	*			trans	-143	132.5	153	-83.6	-77.3	0	0	0	109	I127 H131	I127-Y129 HydrophobicContact CG2-CD2 4.14Å; I127-Y129 HydrophobicContact CG2-CE2 4.14Å; Y129-H131 PolarHBondContact O-N 3.41Å
130	P	32.1	Very low	35.3	Very low	113 Å²	113	143.4 Å²	143.4	73%	0.734	74%	0.74	S	S	*	*			trans	-82.2	105.5	177.3	31.5	-28	0	0	0	109.2	E132	P130-E132 PolarHBondContact O-N 3.49Å
131	H	36.8	Very low	35.2	Very low	156 Å²	156	139.7 Å²	139.7	72%	0.722	72%	0.723	S	S	*	*			trans	-97	62.6	170.5	-95.5	-55.3	0	0	0	111.2	Y129 G133	Y129-H131 PolarHBondContact O-N 3.41Å; H131-G133 PolarHBondContact O-N 2.96Å
132	E	31.3	Very low	35.3	Very low	196 Å²	196	136.3 Å²	136.3	92%	0.916	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	106.4	158.2	-72.6	-175.5	158.5	0	0	108.1	P130	P130-E132 PolarHBondContact O-N 3.49Å
133	G	34.8	Very low	35.3	Very low	64 Å²	64	132.2 Å²	132.2	66%	0.66	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	156.2	-11	172.5	0	0	0	0	0	117.7	H131	H131-G133 PolarHBondContact O-N 2.96Å
134	L	36.7	Very low	35.3	Very low	108 Å²	108	130.1 Å²	130.1	57%	0.565	68%	0.683	S	S	*	*			trans	-102.3	2	-172.3	-84.7	148.5	0	0	0	115.5
135	S	35.1	Very low	35.3	Very low	94 Å²	94	124.1 Å²	124.1	66%	0.657	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-8.3	-173.4	58.3	0	0	0	0	115.8
136	A	39.4	Very low	35.4	Very low	75 Å²	75	122.2 Å²	122.2	62%	0.62	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-20.8	-176.6	0	0	0	0	0	114.4
137	F	37	Very low	35.7	Very low	160 Å²	160	125.1 Å²	125.1	70%	0.702	65%	0.652	S	S	*	*	S	Bend	trans	-83.6	-19.1	-176	-72.7	-80.4	0	0	0	114.1
138	H	39.8	Very low	35.6	Very low	166 Å²	166	121.8 Å²	121.8	77%	0.769	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-6.7	-178	-68.9	-69.4	0	0	0	114.2
139	N	40.2	Very low	35.9	Very low	137 Å²	137	122.9 Å²	122.9	73%	0.733	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	8.1	-178.4	-71.1	-22.8	0	0	0	114.3
140	L	44.3	Very low	36.3	Very low	82 Å²	82	117.7 Å²	117.7	43%	0.429	60%	0.602	S	S	.	*	S	Bend	trans	-81.2	129.2	175.4	-71	163.4	0	0	0	109.6	S142 Y144	L140-S142 PolarHBondContact O-N 3.21Å; L140-Y144 HydrophobicContact CB-CD1 4.04Å; L140-Y144 HydrophobicContact CB-CG 4.38Å; L140-Y144 HydrophobicContact CD1-CD1 3.91Å; L140-Y144 HydrophobicContact CD1-CE1 3.98Å; L140-Y144 HydrophobicContact CD2-CD1 3.6Å; L140-Y144 HydrophobicContact CD2-CD2 4.42Å; L140-Y144 HydrophobicContact CD2-CE1 3.62Å; L140-Y144 HydrophobicContact CD2-CE2 4.45Å; L140-Y144 HydrophobicContact CD2-CG 4.02Å; L140-Y144 HydrophobicContact CG-CD1 4.05Å; L140-Y144 HydrophobicContact CG-CE1 4.32Å
141	P	35.4	Very low	36.4	Very low	58 Å²	58	121.8 Å²	121.8	38%	0.377	60%	0.604	S	S	.	*			trans	-51.6	141.8	177.5	-25.8	32.8	0	0	0	111.2	W143 Y144	P141-W143 HydrophobicContact CB-CD2 4.17Å; P141-W143 HydrophobicContact CB-CG 4Å; P141-W143 HydrophobicContact CB-CZ2 4.29Å; P141-W143 HydrophobicContact CG-CZ2 4.12Å; P141-W143 PolarHBondContact O-N 3.07Å; P141-Y144 WeakPolarHBondContact O-CA 3.03Å; P141-Y144 WeakPolarHBondContact O-CB 3.49Å; P141-Y144 PolarHBondContact O-N 2.84Å
142	S	34.6	Very low	36.3	Very low	94 Å²	94	118.2 Å²	118.2	66%	0.657	60%	0.595	S	S	*	*	H	α-helix	trans	-53.3	-31.4	-178.6	58.4	0	0	0	0	113.1	L140 Y144 S145 L146	L140-S142 PolarHBondContact O-N 3.21Å; S142-Y144 VanDerWaalsContact C-N 3.28Å; S142-Y144 PolarHBondContact O-N 2.87Å; S142-S145 PolarHBondContact O-N 3.44Å; S142-S145 PolarHBondContact O-OG 2.96Å; S142-L146 PolarHBondContact O-N 3.17Å
143	W	37.6	Very low	36.3	Very low	151 Å²	151	119.9 Å²	119.9	57%	0.572	59%	0.593	S	S	*	*	H	α-helix	trans	-66	-24.4	173.9	66.9	-102.3	0	0	0	114.3	P141 R147	P141-W143 HydrophobicContact CB-CD2 4.17Å; P141-W143 HydrophobicContact CB-CG 4Å; P141-W143 HydrophobicContact CB-CZ2 4.29Å; P141-W143 HydrophobicContact CG-CZ2 4.12Å; P141-W143 PolarHBondContact O-N 3.07Å; W143-R147 PolarHBondContact O-N 2.74Å
144	Y	35.2	Very low	36.3	Very low	89 Å²	89	125.4 Å²	125.4	35%	0.349	60%	0.602	S	S	.	*	H	α-helix	trans	-72.2	-43.7	175.7	-162.3	-89.7	0	0	0	110.6	L140 P141 S142 L146 R147 Y148	L140-Y144 HydrophobicContact CB-CD1 4.04Å; L140-Y144 HydrophobicContact CB-CG 4.38Å; L140-Y144 HydrophobicContact CD1-CD1 3.91Å; L140-Y144 HydrophobicContact CD1-CE1 3.98Å; L140-Y144 HydrophobicContact CD2-CD1 3.6Å; L140-Y144 HydrophobicContact CD2-CD2 4.42Å; L140-Y144 HydrophobicContact CD2-CE1 3.62Å; L140-Y144 HydrophobicContact CD2-CE2 4.45Å; L140-Y144 HydrophobicContact CD2-CG 4.02Å; L140-Y144 HydrophobicContact CG-CD1 4.05Å; L140-Y144 HydrophobicContact CG-CE1 4.32Å; P141-Y144 WeakPolarHBondContact O-CA 3.03Å; P141-Y144 WeakPolarHBondContact O-CB 3.49Å; P141-Y144 PolarHBondContact O-N 2.84Å; S142-Y144 VanDerWaalsContact C-N 3.28Å; S142-Y144 PolarHBondContact O-N 2.87Å; Y144-L146 VanDerWaalsContact C-N 3.34Å; Y144-L146 PolarHBondContact O-N 3.44Å; Y144-R147 PolarHBondContact O-N 3Å; Y144-Y148 HydrophobicContact CD1-CD2 4.12Å; Y144-Y148 HydrophobicContact CD2-CD2 4.21Å; Y144-Y148 AromaticContact CD2-CE2 3.93Å; Y144-Y148 HydrophobicContact CD2-CE2 3.93Å; Y144-Y148 HydrophobicContact CE1-CD2 4.11Å; Y144-Y148 HydrophobicContact CE1-CE2 4.4Å; Y144-Y148 HydrophobicContact CE2-CD2 4.19Å; Y144-Y148 AromaticContact CE2-CE2 3.71Å; Y144-Y148 HydrophobicContact CE2-CE2 3.71Å; Y144-Y148 HydrophobicContact CG-CD2 4.18Å; Y144-Y148 HydrophobicContact CG-CE2 4.37Å; Y144-Y148 AromaticContact CZ-CE2 3.97Å; Y144-Y148 WeakPolarHBondContact O-CD2 3.48Å; Y144-Y148 PolarHBondContact O-N 2.73Å
145	S	36.8	Very low	36.1	Very low	73 Å²	73	127.7 Å²	127.7	51%	0.51	61%	0.61	S	S	.	*	H	α-helix	trans	-66.7	-32.3	177.7	72.1	0	0	0	0	113.7	S142	S142-S145 PolarHBondContact O-N 3.44Å; S142-S145 PolarHBondContact O-OG 2.96Å
146	L	35	Very low	36.1	Very low	130 Å²	130	129.3 Å²	129.3	68%	0.681	62%	0.618	S	S	*	*	H	α-helix	trans	-79.1	-27.5	-179.2	-77.6	161.5	0	0	0	113.6	S142 Y144	S142-L146 PolarHBondContact O-N 3.17Å; Y144-L146 VanDerWaalsContact C-N 3.34Å; Y144-L146 PolarHBondContact O-N 3.44Å
147	R	36.3	Very low	36	Very low	171 Å²	171	132.8 Å²	132.8	65%	0.645	63%	0.626	S	S	*	*	H	α-helix	trans	-88.6	-25.6	179.7	-102.3	-177.8	-178.1	168	2.8	114.6	W143 Y144	W143-R147 PolarHBondContact O-N 2.74Å; Y144-R147 PolarHBondContact O-N 3Å
148	Y	32.3	Very low	36	Very low	81 Å²	81	132.6 Å²	132.6	32%	0.318	63%	0.627	S	S	.	*			trans	-101.2	17.8	-176.1	-74	-83.4	0	0	0	114.3	Y144 R150 I189	Y144-Y148 HydrophobicContact CD1-CD2 4.12Å; Y144-Y148 HydrophobicContact CD2-CD2 4.21Å; Y144-Y148 AromaticContact CD2-CE2 3.93Å; Y144-Y148 HydrophobicContact CD2-CE2 3.93Å; Y144-Y148 HydrophobicContact CE1-CD2 4.11Å; Y144-Y148 HydrophobicContact CE1-CE2 4.4Å; Y144-Y148 HydrophobicContact CE2-CD2 4.19Å; Y144-Y148 AromaticContact CE2-CE2 3.71Å; Y144-Y148 HydrophobicContact CE2-CE2 3.71Å; Y144-Y148 HydrophobicContact CG-CD2 4.18Å; Y144-Y148 HydrophobicContact CG-CE2 4.37Å; Y144-Y148 AromaticContact CZ-CE2 3.97Å; Y144-Y148 WeakPolarHBondContact O-CD2 3.48Å; Y144-Y148 PolarHBondContact O-N 2.73Å; Y148-R150 PolarHBondContact O-N 3.25Å; Y148-I189 HydrophobicContact CE1-CG2 3.96Å
149	R	32.7	Very low	36	Very low	187 Å²	187	129.1 Å²	129.1	71%	0.706	62%	0.619	S	S	*	*			trans	-69	71.8	164.6	-81.5	-170.1	-173.1	177.1	2.1	110.7	Y151	R149-Y151 PolarHBondContact O-N 3.1Å
150	R	39.3	Very low	35.9	Very low	87 Å²	87	132.7 Å²	132.7	33%	0.328	62%	0.624	S	S	.	*	S	Bend	trans	-64.8	92.3	143	-64.1	-177.7	-176.1	-168.6	-0.7	104.3	Y148 P152 R176 D311 C313	Y148-R150 PolarHBondContact O-N 3.25Å; R150-P152 VanDerWaalsContact O-N 3.09Å; R150-R176 PolarHBondContact O-NH1 3.16Å; R150-D311 IonicContact NH1-OD1 2.73Å; R150-D311 PolarHBondContact NH1-OD1 3.32Å; R150-D311 IonicContact NH1-OD2 2.92Å; R150-D311 PolarHBondContact NH1-OD2 3.1Å; R150-C313 VanDerWaalsContact NH1-CB 3.26Å
151	Y	34.3	Very low	35.8	Very low	198 Å²	198	135.8 Å²	135.8	78%	0.776	64%	0.641	S	S	*	*			trans	-21	107	-170.1	-77.2	-89	0	0	0	112.8	R149 R153	R149-Y151 PolarHBondContact O-N 3.1Å; Y151-R153 PolarHBondContact O-N 3.18Å
152	P	33.6	Very low	36.1	Very low	82 Å²	82	138.7 Å²	138.7	53%	0.532	65%	0.653	S	S	.	*			trans	-62.8	121.6	161.3	25.3	-28.1	0	0	0	106.3	R150 E154	R150-P152 VanDerWaalsContact O-N 3.09Å; P152-E154 PolarHBondContact O-N 2.78Å
153	R	33	Very low	36.3	Very low	230 Å²	230	142 Å²	142	87%	0.868	66%	0.664	S	S	*	*			trans	-67.7	129.8	162.8	-169.3	-176.1	-88.3	-157.1	-4.9	105.2	Y151 E155	Y151-R153 PolarHBondContact O-N 3.18Å; R153-E155 PolarHBondContact O-N 3.17Å
154	E	34.5	Very low	36.5	Very low	181 Å²	181	141.3 Å²	141.3	85%	0.846	67%	0.671	S	S	*	*			trans	-47.2	115.8	173	-68.7	169.5	178.7	0	0	108.3	P152	P152-E154 PolarHBondContact O-N 2.78Å
155	E	32.4	Very low	36.5	Very low	156 Å²	156	145 Å²	145	73%	0.729	70%	0.696	S	S	*	*			trans	-65.2	133.3	165.8	-72.4	-176	156.2	0	0	106.4	R153 N157	R153-E155 PolarHBondContact O-N 3.17Å; E155-N157 PolarHBondContact O-N 2.93Å
156	P	34.5	Very low	36.6	Very low	128 Å²	128	150 Å²	150	83%	0.831	71%	0.712	S	S	*	*			trans	-61.5	106.8	165.7	-7.6	21.5	0	0	0	106.5	H158	P156-H158 PolarHBondContact O-N 2.87Å
157	N	37.4	Very low	36.6	Very low	148 Å²	148	149.8 Å²	149.8	79%	0.791	71%	0.71	S	S	*	*			trans	-66.3	86.6	165.1	-75.9	-31.6	0	0	0	107.2	E155	E155-N157 PolarHBondContact O-N 2.93Å
158	H	37.1	Very low	36.7	Very low	155 Å²	155	146.4 Å²	146.4	72%	0.718	71%	0.71	S	S	*	*			trans	-159.3	114.4	148.4	-117.8	-70.7	0	0	0	111.2	P156	P156-H158 PolarHBondContact O-N 2.87Å
159	P	39	Very low	36.8	Very low	93 Å²	93	153.8 Å²	153.8	60%	0.604	74%	0.738	S	S	*	*	S	Bend	trans	-71.7	143.1	151.7	32.9	-25.8	0	0	0	106.4
160	Y	39.3	Very low	37	Very low	212 Å²	212	151.5 Å²	151.5	83%	0.831	74%	0.739	S	S	*	*			trans	76.3	78.9	-177.2	-45.9	-78.6	0	0	0	114.5
161	D	42	Very low	36.8	Very low	147 Å²	147	153.5 Å²	153.5	79%	0.786	75%	0.748	S	S	*	*			trans	-151.2	126.9	137.6	-123.6	-13.2	0	0	0	111.8
162	D	41.1	Very low	37.2	Very low	120 Å²	120	150.9 Å²	150.9	64%	0.642	74%	0.741	S	S	*	*			trans	58.8	90	161.5	-74	-21.3	0	0	0	121.1	N164	D162-N164 PolarHBondContact O-N 2.82Å
163	N	39.8	Very low	37.9	Very low	163 Å²	163	149 Å²	149	87%	0.872	73%	0.728	S	S	*	*				30.9	14.7	107.3	-74.8	-20.3	0	0	0	122.2
164	N	40	Very low	38.9	Very low	137 Å²	137	146.8 Å²	146.8	73%	0.733	73%	0.725	S	S	*	*			trans	-105.9	94	171.6	-85.8	-40.4	0	0	0	110.5	D162 Q166	D162-N164 PolarHBondContact O-N 2.82Å; N164-Q166 VanDerWaalsContact C-N 3.33Å; N164-Q166 PolarHBondContact O-N 2.73Å
165	L	36	Very low	40.1	Very low	166 Å²	166	139.7 Å²	139.7	87%	0.869	70%	0.695	S	S	*	*			trans	-48.7	90.2	164.7	-123.4	86.7	0	0	0	110.4
166	Q	38.6	Very low	41.4	Very low	179 Å²	179	139.2 Å²	139.2	84%	0.836	69%	0.687	S	S	*	*			trans	-95.4	111.3	160	-79.1	-171.8	9.4	0	0	108.5	N164	N164-Q166 VanDerWaalsContact C-N 3.33Å; N164-Q166 PolarHBondContact O-N 2.73Å
167	L	35.8	Very low	42.9	Very low	125 Å²	125	139.3 Å²	139.3	65%	0.654	69%	0.691	S	S	*	*			trans	-54.5	152.8	-177	-70.9	154.4	0	0	0	113	W169	L167-W169 VanDerWaalsContact C-N 3.26Å; L167-W169 PolarHBondContact O-N 2.92Å
168	P	38.7	Very low	44.6	Very low	100 Å²	100	134.9 Å²	134.9	65%	0.649	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-71.8	-6.5	-158	-15.6	30.5	0	0	0	116.3	N170	P168-N170 PolarHBondContact O-N 2.9Å
169	W	34	Very low	46.3	Very low	236 Å²	236	130.1 Å²	130.1	89%	0.894	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-78.9	-0	-168	-43.4	105	0	0	0	114.5	L167	L167-W169 VanDerWaalsContact C-N 3.26Å; L167-W169 PolarHBondContact O-N 2.92Å
170	N	35.5	Very low	48.1	Very low	138 Å²	138	132.5 Å²	132.5	74%	0.738	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-113.7	22.6	-178.3	-133.2	-5.8	0	0	0	113.5	P168 K172	P168-N170 PolarHBondContact O-N 2.9Å; N170-K172 PolarHBondContact O-N 2.95Å
171	Y	35.6	Very low	50.4	Low	130 Å²	130	123.1 Å²	123.1	51%	0.51	63%	0.625	S	S	.	*			trans	-70.5	113.6	177.8	-176.7	-100.3	0	0	0	111.1	P173 Y212	Y171-P173 HydrophobicContact CE1-CB 4.4Å; Y171-Y212 WeakPolarHBondContact CE1-O 3.49Å; Y171-Y212 PolarHBondContact OH-O 2.92Å
172	K	44.1	Very low	52.8	Low	142 Å²	142	116.6 Å²	116.6	62%	0.617	59%	0.59	S	S	*	*			trans	-93.3	120.8	166.5	-71.9	174.8	-177.7	169.6	0	106.9	N170 K174	N170-K172 PolarHBondContact O-N 2.95Å; K172-K174 PolarHBondContact O-N 3.04Å
173	P	46.8	Very low	55.4	Low	42 Å²	42	110.9 Å²	110.9	27%	0.273	56%	0.559	S	S	.	*			trans	-52.3	131.2	172.7	21.7	-31.6	0	0	0	108.1	Y171 C175	Y171-P173 HydrophobicContact CE1-CB 4.4Å; P173-C175 PolarHBondContact O-N 2.98Å
174	K	54.3	Low	58.1	Low	184 Å²	184	103.4 Å²	103.4	80%	0.8	52%	0.519	S	S	*	.			trans	-71.4	57.8	-178.9	-68.5	-175.9	-179.8	178.5	0	110.4	K172 R176	K172-K174 PolarHBondContact O-N 3.04Å; K174-R176 PolarHBondContact O-N 3.5Å
175	C	59.8	Low	60.6	Low	33 Å²	33	98.2 Å²	98.2	22%	0.223	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-66.9	131.1	173.8	-54.9	0	0	0	0	108.4	P173 S177 C284	P173-C175 PolarHBondContact O-N 2.98Å; C175-S177 PolarHBondContact O-N 2.91Å; C175-S177 VanDerWaalsContact O-N 3.16Å; C175-C284 HydrophobicContact CB-CB 3.85Å; C175-C284 VanDerWaalsContact SG-CA 3.52Å; C175-C284 VanDerWaalsContact SG-CB 3.53Å; C175-C284 PolarHBondContact SG-O 2.91Å
176	R	59	Low	63.4	Low	146 Å²	146	90.6 Å²	90.6	55%	0.551	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-62.6	121	172.1	-68.3	-173.2	-176.4	-170	6.7	108.5	R150 K174 C178	R150-R176 PolarHBondContact O-NH1 3.16Å; K174-R176 PolarHBondContact O-N 3.5Å; R176-C178 PolarHBondContact O-N 3.37Å
177	S	66.4	Low	66.1	Low	130 Å²	130	82.5 Å²	82.5	91%	0.909	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-70.8	120.1	166.4	-66.8	0	0	0	0	108	C175	C175-S177 PolarHBondContact O-N 2.91Å; C175-S177 VanDerWaalsContact O-N 3.16Å
178	C	73.7	Confident	68.8	Low	55 Å²	55	78.3 Å²	78.3	37%	0.372	40%	0.395	S	S	.	.			trans	-135	145.3	-178.9	46.7	0	0	0	0	109.6	R176 C313	R176-C178 PolarHBondContact O-N 3.37Å; C178-C313 HydrophobicContact CB-CB 3.81Å; C178-C313 WeakPolarHBondContact CB-SG 3.34Å; C178-C313 WeakPolarHBondContact SG-CA 3.39Å; C178-C313 WeakPolarHBondContact SG-CB 3.23Å; C178-C313 CovalentContact SG-SG 2.01Å; C178-C313 PolarHBondContact SG-SG 3.33Å
179	G	72.1	Confident	71.3	Confident	54 Å²	54	76.7 Å²	76.7	56%	0.557	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-65	138.5	166.8	0	0	0	0	0	109.2	P181	G179-P181 VanDerWaalsContact O-N 3.15Å
180	R	77.9	Confident	74.1	Confident	143 Å²	143	65.6 Å²	65.6	54%	0.54	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-50.8	121.3	172.1	-175.9	-178	179.4	112.8	10.4	109	K316 R345	R180-K316 PolarHBondContact NH2-O 3.48Å; R180-R345 PolarHBondContact O-NH2 3.15Å
181	P	87.3	Confident	76.8	Confident	16 Å²	16	60.9 Å²	60.9	10%	0.104	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-65.3	161	179.2	32.8	-40.5	0	0	0	110	G179 S186 C313 W315 R345	G179-P181 VanDerWaalsContact O-N 3.15Å; P181-S186 VanDerWaalsContact CB-OG 3.24Å; P181-S186 WeakPolarHBondContact CB-OG 3.39Å; P181-S186 VanDerWaalsContact CG-OG 3.22Å; P181-S186 WeakPolarHBondContact CG-OG 3.42Å; P181-C313 WeakPolarHBondContact CD-O 3.49Å; P181-C313 WeakPolarHBondContact CG-O 3.32Å; P181-W315 HydrophobicContact CG-CB 3.93Å; P181-W315 VanDerWaalsContact O-CD1 3.29Å; P181-R345 VanDerWaalsContact CA-NH2 3.25Å
182	L	92.9	Very high	79.5	Confident	9 Å²	9	54.7 Å²	54.7	5%	0.047	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-76.6	147.5	166.4	-65.8	179.3	0	0	0	108.1	Q184 D185 S186 L343 L362 D375 F391	L182-Q184 PolarHBondContact O-N 3.35Å; L182-D185 HydrophobicContact CB-CB 4.12Å; L182-D185 WeakPolarHBondContact O-CB 3.24Å; L182-D185 PolarHBondContact O-N 3.41Å; L182-S186 PolarHBondContact O-N 3.35Å; L182-S186 PolarHBondContact O-OG 2.98Å; L182-L343 HydrophobicContact CD1-CD2 3.64Å; L182-L362 HydrophobicContact CD1-CD1 4.09Å; L182-L362 HydrophobicContact CD1-CD2 3.65Å; L182-L362 HydrophobicContact CD1-CG 4.49Å; L182-L362 HydrophobicContact CD2-CD2 4.41Å; L182-L362 HydrophobicContact CG-CD2 3.84Å; L182-D375 WeakPolarHBondContact CA-OD1 3.44Å; L182-D375 HydrophobicContact CD2-CB 3.7Å; L182-F391 HydrophobicContact CD1-CE1 4.12Å; L182-F391 HydrophobicContact CD1-CZ 4.1Å
183	L	95.6	Very high	81.8	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-59.5	-38.9	178.1	178.8	56.8	0	0	0	111.1	D185 F187 L298 T300 W315 Q326 L330 Y334 D375	L183-D185 VanDerWaalsContact C-N 3.32Å; L183-D185 PolarHBondContact O-N 3.12Å; L183-F187 WeakPolarHBondContact O-CB 3.09Å; L183-F187 PolarHBondContact O-N 3.08Å; L183-L298 HydrophobicContact CD1-CD2 4.16Å; L183-L298 HydrophobicContact CD2-CD2 4.16Å; L183-T300 HydrophobicContact CD1-CG2 4.22Å; L183-W315 HydrophobicContact CB-CD2 4.16Å; L183-W315 HydrophobicContact CB-CG 4.33Å; L183-W315 HydrophobicContact CB-CZ2 4.04Å; L183-W315 HydrophobicContact CD1-CD2 3.59Å; L183-W315 HydrophobicContact CD1-CE3 3.65Å; L183-W315 HydrophobicContact CD1-CG 4.06Å; L183-W315 HydrophobicContact CD1-CH2 4.24Å; L183-W315 HydrophobicContact CD1-CZ2 4.19Å; L183-W315 HydrophobicContact CD1-CZ3 4.01Å; L183-W315 HydrophobicContact CD2-CH2 4.09Å; L183-W315 HydrophobicContact CD2-CZ2 3.96Å; L183-W315 HydrophobicContact CG-CD2 4.36Å; L183-W315 HydrophobicContact CG-CZ2 4.28Å; L183-Q326 HydrophobicContact CD2-CB 4.02Å; L183-Q326 HydrophobicContact CD2-CG 4.04Å; L183-L330 HydrophobicContact CD1-CD2 4.3Å; L183-L330 HydrophobicContact CD2-CD1 4.23Å; L183-L330 HydrophobicContact CD2-CD2 4.22Å; L183-L330 HydrophobicContact CD2-CG 4.25Å; L183-L330 HydrophobicContact CG-CD2 4.38Å; L183-Y334 HydrophobicContact CD2-CE2 3.89Å; L183-Y334 HydrophobicContact CG-CE2 3.78Å; L183-D375 PolarHBondContact N-OD1 2.82Å
184	Q	95.5	Very high	84.1	Confident	6 Å²	6	46 Å²	46	3%	0.028	25%	0.246	C	C	.	.	H	α-helix	trans	-60.2	-43.8	175	-178.3	175.4	1.4	0	0	112.1	L182 F187 C188 Y334 L343 C380	L182-Q184 PolarHBondContact O-N 3.35Å; Q184-F187 PolarHBondContact O-N 2.73Å; Q184-C188 PolarHBondContact O-N 3.36Å; Q184-C188 PolarHBondContact O-SG 3.3Å; Q184-C188 VanDerWaalsContact O-SG 3.33Å; Q184-Y334 HydrophobicContact CB-CD1 3.72Å; Q184-Y334 HydrophobicContact CB-CE1 3.53Å; Q184-Y334 HydrophobicContact CB-CG 4.47Å; Q184-Y334 HydrophobicContact CG-CD1 3.61Å; Q184-Y334 HydrophobicContact CG-CE1 3.92Å; Q184-Y334 HydrophobicContact CG-CG 4.37Å; Q184-L343 HydrophobicContact CG-CD1 3.97Å; Q184-C380 PolarHBondContact NE2-O 3.23Å
185	D	93.2	Very high	86	Confident	29 Å²	29	37.7 Å²	37.7	16%	0.155	21%	0.211	C	C	.	.	H	α-helix	trans	-63.2	-49.9	-178.7	-165.8	29.6	0	0	0	110	L182 L183 F187 C188 I189 L343	L182-D185 HydrophobicContact CB-CB 4.12Å; L182-D185 WeakPolarHBondContact O-CB 3.24Å; L182-D185 PolarHBondContact O-N 3.41Å; L183-D185 VanDerWaalsContact C-N 3.32Å; L183-D185 PolarHBondContact O-N 3.12Å; D185-F187 PolarHBondContact O-N 2.79Å; D185-C188 PolarHBondContact O-N 2.88Å; D185-C188 VanDerWaalsContact O-N 3.1Å; D185-I189 WeakPolarHBondContact O-CB 3.34Å; D185-I189 WeakPolarHBondContact O-CG1 3.36Å; D185-I189 PolarHBondContact O-N 3.04Å; D185-I189 WeakPolarHBondContact OD1-CD1 3.34Å; D185-L343 HydrophobicContact CB-CD1 4.5Å; D185-L343 HydrophobicContact CB-CD2 4.41Å
186	S	94.1	Very high	87.5	Confident	5 Å²	5	36.1 Å²	36.1	4%	0.035	20%	0.2	C	C	.	.	H	α-helix	trans	-61.9	-44.4	176.9	-42.3	0	0	0	0	111.5	P181 L182 C188 I189 D190 T300 W315	P181-S186 VanDerWaalsContact CB-OG 3.24Å; P181-S186 WeakPolarHBondContact CB-OG 3.39Å; P181-S186 VanDerWaalsContact CG-OG 3.22Å; P181-S186 WeakPolarHBondContact CG-OG 3.42Å; L182-S186 PolarHBondContact O-N 3.35Å; L182-S186 PolarHBondContact O-OG 2.98Å; S186-C188 PolarHBondContact O-N 2.81Å; S186-I189 PolarHBondContact O-N 2.73Å; S186-D190 WeakPolarHBondContact CB-OD2 3.42Å; S186-D190 WeakPolarHBondContact O-CB 3.49Å; S186-D190 PolarHBondContact O-N 2.82Å; S186-T300 WeakPolarHBondContact CB-OG1 3.41Å; S186-W315 WeakPolarHBondContact OG-CB 3.21Å
187	F	95.2	Very high	89.1	Confident	10 Å²	10	30.7 Å²	30.7	4%	0.044	18%	0.182	C	C	.	.	H	α-helix	trans	-58.3	-35.8	175.5	-175.9	-80.2	0	0	0	112.3	L183 Q184 D185 V193 K227 L330 Y334	L183-F187 WeakPolarHBondContact O-CB 3.09Å; L183-F187 PolarHBondContact O-N 3.08Å; Q184-F187 PolarHBondContact O-N 2.73Å; D185-F187 PolarHBondContact O-N 2.79Å; F187-V193 HydrophobicContact CB-CG2 4.47Å; F187-V193 HydrophobicContact CD2-CB 4.34Å; F187-V193 HydrophobicContact CD2-CG1 4.33Å; F187-V193 HydrophobicContact CD2-CG2 3.72Å; F187-V193 HydrophobicContact CE2-CG2 4.28Å; F187-V193 HydrophobicContact CG-CG2 4.32Å; F187-K227 HydrophobicContact CE1-CD 4.46Å; F187-K227 HydrophobicContact CE2-CB 4.27Å; F187-K227 HydrophobicContact CZ-CB 4.41Å; F187-K227 HydrophobicContact CZ-CD 4.47Å; F187-K227 WeakPolarHBondContact O-CD 3.4Å; F187-K227 WeakPolarHBondContact O-CE 3.48Å; F187-K227 PolarHBondContact O-NZ 3.3Å; F187-L330 HydrophobicContact CD2-CD2 3.63Å; F187-L330 HydrophobicContact CE2-CD2 4.06Å; F187-Y334 HydrophobicContact CB-CD2 4.08Å; F187-Y334 HydrophobicContact CB-CG 4.45Å; F187-Y334 HydrophobicContact CD1-CD2 4.47Å; F187-Y334 HydrophobicContact CD1-CG 4.35Å; F187-Y334 HydrophobicContact CD2-CD2 4.11Å; F187-Y334 AromaticContact CG-CD2 3.96Å; F187-Y334 HydrophobicContact CG-CD2 3.96Å; F187-Y334 HydrophobicContact CG-CG 4.27Å
188	C	92.9	Very high	90.1	Very high	36 Å²	36	24.6 Å²	24.6	24%	0.243	14%	0.139	C	C	.	.	H	α-helix	trans	-81.1	-34.6	179.4	-66.6	0	0	0	0	113.4	Q184 D185 S186 C338	Q184-C188 PolarHBondContact O-N 3.36Å; Q184-C188 PolarHBondContact O-SG 3.3Å; Q184-C188 VanDerWaalsContact O-SG 3.33Å; D185-C188 PolarHBondContact O-N 2.88Å; D185-C188 VanDerWaalsContact O-N 3.1Å; S186-C188 PolarHBondContact O-N 2.81Å; C188-C338 WeakPolarHBondContact CA-SG 3.36Å; C188-C338 HydrophobicContact CB-CB 3.88Å; C188-C338 WeakPolarHBondContact CB-SG 3.47Å; C188-C338 WeakPolarHBondContact SG-CA 3.2Å; C188-C338 WeakPolarHBondContact SG-CB 3.3Å; C188-C338 CovalentContact SG-SG 2.05Å; C188-C338 PolarHBondContact SG-SG 3.47Å
189	I	90.7	Very high	90.7	Very high	67 Å²	67	25.2 Å²	25.2	34%	0.344	14%	0.142	S	C	.	.	H	α-helix	trans	-90	-42.4	-173.8	-65.7	172	0	0	0	112.7	Y148 D185 S186	Y148-I189 HydrophobicContact CE1-CG2 3.96Å; D185-I189 WeakPolarHBondContact O-CB 3.34Å; D185-I189 WeakPolarHBondContact O-CG1 3.36Å; D185-I189 PolarHBondContact O-N 3.04Å; D185-I189 WeakPolarHBondContact OD1-CD1 3.34Å; S186-I189 PolarHBondContact O-N 2.73Å
190	D	93.3	Very high	91.3	Very high	3 Å²	3	28 Å²	28	2%	0.016	14%	0.14	C	C	.	.	S	Bend	trans	-76.6	150.5	-171.5	-66.9	-13	0	0	0	111.3	S186 K227 T300 G301	S186-D190 WeakPolarHBondContact CB-OD2 3.42Å; S186-D190 WeakPolarHBondContact O-CB 3.49Å; S186-D190 PolarHBondContact O-N 2.82Å; D190-K227 PolarHBondContact O-NZ 3.34Å; D190-T300 WeakPolarHBondContact OD2-CB 3.43Å; D190-T300 PolarHBondContact OD2-OG1 2.97Å; D190-G301 WeakPolarHBondContact CB-O 3.31Å
191	D	91.5	Very high	91.4	Very high	39 Å²	39	24.5 Å²	24.5	21%	0.209	13%	0.131	C	C	.	.	S	Bend	trans	-71.7	-37.1	-175.3	-60.5	-32.9	0	0	0	111.8	D229 G301 I302 Y303	D191-D229 PolarHBondContact O-N 3.37Å; D191-G301 PolarHBondContact N-O 3.19Å; D191-I302 VanDerWaalsContact OD2-CA 3.31Å; D191-I302 WeakPolarHBondContact OD2-CA 3.27Å; D191-I302 WeakPolarHBondContact OD2-CB 3.46Å; D191-Y303 HydrophobicContact CB-CD2 3.82Å; D191-Y303 HydrophobicContact CB-CE2 4.47Å; D191-Y303 PolarHBondContact OD2-N 3.07Å
192	F	92.5	Very high	91	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	152.3	-179.7	66	-101.5	0	0	0	113.3	L194 I299 T300 G301 I302 Y303 P308 V310	F192-L194 HydrophobicContact CB-CG 4.24Å; F192-L194 HydrophobicContact CD2-CB 4.37Å; F192-L194 HydrophobicContact CD2-CD1 3.62Å; F192-L194 HydrophobicContact CD2-CG 3.61Å; F192-L194 HydrophobicContact CE2-CD1 3.95Å; F192-L194 HydrophobicContact CE2-CG 4.31Å; F192-L194 HydrophobicContact CG-CD1 4.16Å; F192-L194 HydrophobicContact CG-CG 4.21Å; F192-I299 HydrophobicContact CE2-CD1 4.1Å; F192-I299 HydrophobicContact CE2-CG1 4.41Å; F192-T300 WeakPolarHBondContact O-CA 3.36Å; F192-G301 VanDerWaalsContact CD1-O 3.29Å; F192-G301 WeakPolarHBondContact CD1-O 3.46Å; F192-G301 VanDerWaalsContact CZ-CA 3.41Å; F192-G301 PolarHBondContact N-O 2.79Å; F192-G301 VanDerWaalsContact N-O 3.11Å; F192-G301 PolarHBondContact O-N 3.33Å; F192-I302 WeakPolarHBondContact CE1-O 3.11Å; F192-Y303 HydrophobicContact CB-CE2 3.85Å; F192-Y303 AromaticContact CD1-CD2 3.76Å; F192-Y303 HydrophobicContact CD1-CD2 3.76Å; F192-Y303 HydrophobicContact CD1-CE1 4.48Å; F192-Y303 AromaticContact CD1-CE2 3.57Å; F192-Y303 HydrophobicContact CD1-CE2 3.57Å; F192-Y303 HydrophobicContact CD1-CG 4.32Å; F192-Y303 AromaticContact CD1-CZ 3.94Å; F192-Y303 HydrophobicContact CG-CE2 4.14Å; F192-P308 HydrophobicContact CD1-CB 4.12Å; F192-P308 HydrophobicContact CE1-CB 3.43Å; F192-P308 VanDerWaalsContact CE1-CB 3.43Å; F192-P308 HydrophobicContact CZ-CB 3.74Å; F192-V310 HydrophobicContact CE2-CG2 4.16Å; F192-V310 HydrophobicContact CZ-CG2 3.87Å
193	V	94.2	Very high	89.9	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	110.4	166.8	-178.2	0	0	0	0	107.3	F187 L226 K227 L298 I299 T300 L330	F187-V193 HydrophobicContact CB-CG2 4.47Å; F187-V193 HydrophobicContact CD2-CB 4.34Å; F187-V193 HydrophobicContact CD2-CG1 4.33Å; F187-V193 HydrophobicContact CD2-CG2 3.72Å; F187-V193 HydrophobicContact CE2-CG2 4.28Å; F187-V193 HydrophobicContact CG-CG2 4.32Å; V193-L226 HydrophobicContact CB-CB 4.29Å; V193-L226 HydrophobicContact CG1-CB 4.11Å; V193-L226 HydrophobicContact CG1-CD1 4.07Å; V193-L226 PolarHBondContact O-N 3.35Å; V193-K227 HydrophobicContact CB-CB 3.88Å; V193-K227 HydrophobicContact CG2-CB 3.91Å; V193-K227 HydrophobicContact CG2-CD 4.16Å; V193-K227 PolarHBondContact N-O 2.72Å; V193-K227 PolarHBondContact O-N 2.77Å; V193-L298 HydrophobicContact CG1-CD1 3.65Å; V193-I299 WeakPolarHBondContact CA-O 3.37Å; V193-T300 HydrophobicContact CG1-CG2 4.21Å; V193-T300 HydrophobicContact CG2-CG2 3.97Å; V193-L330 HydrophobicContact CG1-CD2 4.18Å
194	L	93.8	Very high	88.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	142.1	-171.4	-60.8	174	0	0	0	110.8	F192 I196 Q225 V277 I280 L298 I299	F192-L194 HydrophobicContact CB-CG 4.24Å; F192-L194 HydrophobicContact CD2-CB 4.37Å; F192-L194 HydrophobicContact CD2-CD1 3.62Å; F192-L194 HydrophobicContact CD2-CG 3.61Å; F192-L194 HydrophobicContact CE2-CD1 3.95Å; F192-L194 HydrophobicContact CE2-CG 4.31Å; F192-L194 HydrophobicContact CG-CD1 4.16Å; F192-L194 HydrophobicContact CG-CG 4.21Å; L194-I196 HydrophobicContact CB-CG2 3.79Å; L194-I196 HydrophobicContact CD1-CG2 4.44Å; L194-Q225 HydrophobicContact CD2-CB 3.84Å; L194-Q225 HydrophobicContact CD2-CG 3.66Å; L194-V277 HydrophobicContact CD1-CB 4.49Å; L194-V277 HydrophobicContact CD1-CG1 4.28Å; L194-V277 HydrophobicContact CD1-CG2 4.17Å; L194-I280 HydrophobicContact CD1-CD1 4.23Å; L194-L298 WeakPolarHBondContact O-CA 3.16Å; L194-I299 HydrophobicContact CB-CD1 4.37Å; L194-I299 HydrophobicContact CB-CG1 3.98Å; L194-I299 PolarHBondContact N-O 3.25Å; L194-I299 PolarHBondContact O-N 2.89Å
195	I	93.9	Very high	86.8	Confident	10 Å²	10	41.2 Å²	41.2	5%	0.051	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	113.5	162.5	-60.3	175	0	0	0	106.4	V223 S224 L226 V296 Y297 L298 W319	I195-V223 HydrophobicContact CG2-CB 4.16Å; I195-V223 WeakPolarHBondContact O-CB 3.21Å; I195-V223 PolarHBondContact O-N 2.96Å; I195-S224 WeakPolarHBondContact CB-OG 3.32Å; I195-S224 WeakPolarHBondContact CD1-OG 3.38Å; I195-S224 PolarHBondContact N-O 2.89Å; I195-S224 PolarHBondContact O-N 3.27Å; I195-S224 VanDerWaalsContact O-N 3.15Å; I195-L226 HydrophobicContact CD1-CD1 3.87Å; I195-L226 HydrophobicContact CD1-CD2 4.23Å; I195-L226 HydrophobicContact CD1-CG 4.12Å; I195-L226 HydrophobicContact CG1-CD1 4.01Å; I195-L226 HydrophobicContact CG1-CG 4.28Å; I195-V296 HydrophobicContact CG2-CG1 3.29Å; I195-Y297 CarbonylContact C-O 3.58Å; I195-Y297 VanDerWaalsContact CA-O 3.27Å; I195-Y297 WeakPolarHBondContact CA-O 3.38Å; I195-L298 HydrophobicContact CG1-CD1 3.94Å; I195-W319 HydrophobicContact CD1-CD2 4.36Å; I195-W319 HydrophobicContact CD1-CE3 3.9Å; I195-W319 HydrophobicContact CD1-CH2 3.4Å; I195-W319 HydrophobicContact CD1-CZ2 3.9Å; I195-W319 HydrophobicContact CD1-CZ3 3.4Å; I195-W319 VanDerWaalsContact CD1-CZ3 3.4Å; I195-W319 HydrophobicContact CG1-CE3 4.19Å; I195-W319 HydrophobicContact CG1-CH2 4.44Å; I195-W319 HydrophobicContact CG1-CZ3 3.97Å
196	I	92.5	Very high	85.1	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	150.3	-173.3	58.9	163.4	0	0	0	111.1	L194 F198 V220 I280 V296 Y297 I299	L194-I196 HydrophobicContact CB-CG2 3.79Å; L194-I196 HydrophobicContact CD1-CG2 4.44Å; I196-F198 HydrophobicContact CD1-CD1 4.31Å; I196-F198 HydrophobicContact CD1-CD2 4.12Å; I196-F198 HydrophobicContact CD1-CE1 3.71Å; I196-F198 HydrophobicContact CD1-CE2 3.49Å; I196-F198 VanDerWaalsContact CD1-CE2 3.49Å; I196-F198 HydrophobicContact CD1-CZ 3.29Å; I196-F198 HydrophobicContact CG1-CE2 4.09Å; I196-F198 HydrophobicContact CG1-CZ 4.35Å; I196-V220 HydrophobicContact CB-CB 4.26Å; I196-V220 HydrophobicContact CD1-CB 4.42Å; I196-V220 HydrophobicContact CD1-CG1 3.86Å; I196-V220 HydrophobicContact CG2-CB 4.49Å; I196-V220 HydrophobicContact CG2-CG2 4.35Å; I196-I280 HydrophobicContact CD1-CD1 4.01Å; I196-I280 HydrophobicContact CG2-CD1 4.14Å; I196-V296 CarbonylContact O-C 3.59Å; I196-V296 VanDerWaalsContact O-CA 3.3Å; I196-V296 WeakPolarHBondContact O-CA 3.45Å; I196-Y297 PolarHBondContact N-O 2.77Å; I196-Y297 PolarHBondContact O-N 2.87Å; I196-I299 HydrophobicContact CD1-CD1 3.39Å; I196-I299 HydrophobicContact CD1-CG1 4Å; I196-I299 HydrophobicContact CD1-CG2 4.16Å; I196-I299 HydrophobicContact CG1-CD1 3.95Å; I196-I299 HydrophobicContact CG1-CG1 4.07Å; I196-I299 HydrophobicContact CG1-CG2 4.37Å; I196-I299 HydrophobicContact CG2-CD1 4.18Å; I196-I299 HydrophobicContact CG2-CG1 4.47Å
197	N	91.5	Very high	83.3	Confident	33 Å²	33	51.1 Å²	51.1	18%	0.176	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.2	164	-175.4	12	0	0	0	108.3	T199 V220 E221 V223 G294 E295 V296	N197-T199 PolarHBondContact O-N 3.06Å; N197-V220 WeakPolarHBondContact O-CA 3.23Å; N197-E221 HydrophobicContact CB-CB 4.46Å; N197-E221 PolarHBondContact N-O 3.32Å; N197-E221 PolarHBondContact O-N 2.83Å; N197-V223 HydrophobicContact CB-CG2 4.08Å; N197-G294 WeakPolarHBondContact OD1-CA 3.32Å; N197-E295 PolarHBondContact OD1-O 2.73Å; N197-V296 HydrophobicContact CB-CG2 4.49Å
198	F	87.1	Confident	81.2	Confident	1 Å²	1	58.7 Å²	58.7	0%	0.004	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	116.5	176	-69.1	-87.1	0	0	0	109.6	I196 F218 V220 Y282 P291 L293 G294 Y297	I196-F198 HydrophobicContact CD1-CD1 4.31Å; I196-F198 HydrophobicContact CD1-CD2 4.12Å; I196-F198 HydrophobicContact CD1-CE1 3.71Å; I196-F198 HydrophobicContact CD1-CE2 3.49Å; I196-F198 VanDerWaalsContact CD1-CE2 3.49Å; I196-F198 HydrophobicContact CD1-CZ 3.29Å; I196-F198 HydrophobicContact CG1-CE2 4.09Å; I196-F198 HydrophobicContact CG1-CZ 4.35Å; F198-F218 HydrophobicContact CD1-CB 3.73Å; F198-F218 AromaticContact CD1-CD1 3.54Å; F198-F218 HydrophobicContact CD1-CD1 3.54Å; F198-F218 HydrophobicContact CD1-CE1 4.38Å; F198-F218 AromaticContact CD1-CG 3.82Å; F198-F218 HydrophobicContact CD1-CG 3.82Å; F198-F218 HydrophobicContact CE1-CB 3.72Å; F198-F218 AromaticContact CE1-CD1 3.75Å; F198-F218 HydrophobicContact CE1-CD1 3.75Å; F198-F218 HydrophobicContact CE1-CD2 4.38Å; F198-F218 HydrophobicContact CE1-CE1 4.44Å; F198-F218 AromaticContact CE1-CG 3.69Å; F198-F218 HydrophobicContact CE1-CG 3.69Å; F198-V220 HydrophobicContact CD1-CG1 3.68Å; F198-V220 HydrophobicContact CE1-CG1 3.88Å; F198-V220 HydrophobicContact CG-CG1 4.44Å; F198-Y282 AromaticContact CE1-CE2 3.92Å; F198-Y282 HydrophobicContact CE1-CE2 3.92Å; F198-Y282 HydrophobicContact CZ-CE2 4.15Å; F198-Y282 AromaticContact CZ-CZ 3.85Å; F198-Y282 VanDerWaalsContact CZ-OH 3.29Å; F198-Y282 WeakPolarHBondContact CZ-OH 3.25Å; F198-P291 HydrophobicContact CD1-CB 4.31Å; F198-P291 HydrophobicContact CD1-CG 3.89Å; F198-P291 HydrophobicContact CD2-CB 3.53Å; F198-P291 HydrophobicContact CD2-CG 4.04Å; F198-P291 HydrophobicContact CE1-CB 4.18Å; F198-P291 HydrophobicContact CE1-CG 3.74Å; F198-P291 HydrophobicContact CE2-CB 3.34Å; F198-P291 HydrophobicContact CE2-CG 3.88Å; F198-P291 HydrophobicContact CG-CB 3.98Å; F198-P291 HydrophobicContact CG-CG 4.01Å; F198-P291 HydrophobicContact CZ-CB 3.66Å; F198-P291 HydrophobicContact CZ-CG 3.69Å; F198-L293 HydrophobicContact CB-CD2 3.96Å; F198-G294 PolarHBondContact O-N 3.33Å; F198-Y297 AromaticContact CD2-CD2 3.48Å; F198-Y297 HydrophobicContact CD2-CD2 3.48Å; F198-Y297 VanDerWaalsContact CD2-CD2 3.48Å; F198-Y297 AromaticContact CD2-CE2 3.98Å; F198-Y297 HydrophobicContact CD2-CE2 3.98Å; F198-Y297 HydrophobicContact CD2-CG 4.14Å; F198-Y297 HydrophobicContact CE2-CD1 4.37Å; F198-Y297 AromaticContact CE2-CD2 3.47Å; F198-Y297 HydrophobicContact CE2-CD2 3.47Å; F198-Y297 VanDerWaalsContact CE2-CD2 3.47Å; F198-Y297 HydrophobicContact CE2-CE2 4.15Å; F198-Y297 AromaticContact CE2-CG 3.64Å; F198-Y297 HydrophobicContact CE2-CG 3.64Å
199	T	87.4	Confident	79	Confident	69 Å²	69	65.8 Å²	65.8	42%	0.423	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	-41.1	-178.4	55	0	0	0	0	111.5	N197 I219 E221	N197-T199 PolarHBondContact O-N 3.06Å; T199-I219 PolarHBondContact N-O 3.16Å; T199-I219 PolarHBondContact OG1-O 3.49Å; T199-E221 HydrophobicContact CG2-CB 4Å
200	Q	84.7	Confident	77	Confident	113 Å²	113	66.5 Å²	66.5	53%	0.528	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	146.9	-177.2	-176.8	176.3	1.4	0	0	111.6	I219	Q200-I219 HydrophobicContact CB-CB 4.16Å; Q200-I219 HydrophobicContact CB-CD1 4.31Å; Q200-I219 HydrophobicContact CG-CD1 4.38Å; Q200-I219 PolarHBondContact N-O 2.56Å; Q200-I219 PolarHBondContact O-N 3.23Å
201	I	80.2	Confident	74.7	Confident	68 Å²	68	74.9 Å²	74.9	35%	0.349	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	131.6	172	-47.4	-174.7	0	0	0	107.9	L203 V216 F218 L293	I201-L203 HydrophobicContact CG2-CG 4.49Å; I201-V216 HydrophobicContact CG2-CG1 3.72Å; I201-F218 HydrophobicContact CB-CD1 4.36Å; I201-F218 HydrophobicContact CB-CE1 4.25Å; I201-F218 HydrophobicContact CD1-CD1 4.46Å; I201-F218 HydrophobicContact CD1-CE1 3.74Å; I201-F218 HydrophobicContact CG1-CD1 3.86Å; I201-F218 HydrophobicContact CG1-CE1 3.62Å; I201-F218 HydrophobicContact CG2-CD1 4.24Å; I201-F218 HydrophobicContact CG2-CE1 3.88Å; I201-F218 HydrophobicContact CG2-CZ 4.29Å; I201-L293 HydrophobicContact CD1-CD2 4.36Å; I201-L293 HydrophobicContact CG1-CD1 4.43Å; I201-L293 HydrophobicContact CG1-CD2 3.85Å; I201-L293 HydrophobicContact CG1-CG 4.42Å
202	Q	77.4	Confident	72.5	Confident	80 Å²	80	80 Å²	80	37%	0.374	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	109.5	171.1	-172	173.5	1.9	0	0	108.5	I204 F217	Q202-I204 HydrophobicContact CG-CG1 4.27Å; Q202-F217 CarbonylContact C-O 3.57Å; Q202-F217 HydrophobicContact CB-CB 4.36Å; Q202-F217 PolarHBondContact N-O 2.01Å; Q202-F217 CarbonylContact O-C 3.59Å; Q202-F217 WeakPolarHBondContact O-CA 3.02Å; Q202-F217 WeakPolarHBondContact O-CB 3.22Å; Q202-F217 PolarHBondContact O-N 3.13Å
203	L	70.5	Confident	70.7	Confident	115 Å²	115	81.9 Å²	81.9	60%	0.602	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	121.3	173.2	-68.7	167.5	0	0	0	108.2	I201 V216	I201-L203 HydrophobicContact CG2-CG 4.49Å; L203-V216 HydrophobicContact CD2-CB 4.2Å; L203-V216 HydrophobicContact CD2-CG1 3.77Å; L203-V216 HydrophobicContact CD2-CG2 3.64Å
204	I	65.5	Low	69.2	Low	60 Å²	60	86.7 Å²	86.7	31%	0.308	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	104.7	169.4	-61.9	177.9	0	0	0	106.6	Q202 N206 F217	Q202-I204 HydrophobicContact CG-CG1 4.27Å; I204-N206 WeakPolarHBondContact CG2-OD1 3.24Å; I204-N206 PolarHBondContact O-N 2.79Å; I204-N206 VanDerWaalsContact O-N 3.11Å; I204-F217 HydrophobicContact CB-CD2 3.88Å; I204-F217 HydrophobicContact CB-CE2 3.86Å; I204-F217 HydrophobicContact CD1-CD2 3.6Å; I204-F217 HydrophobicContact CD1-CE2 3.72Å; I204-F217 HydrophobicContact CD1-CG 4.2Å; I204-F217 HydrophobicContact CD1-CZ 4.39Å; I204-F217 HydrophobicContact CG1-CD2 3.83Å; I204-F217 HydrophobicContact CG1-CE2 4.13Å
205	L	61.7	Low	67.9	Low	128 Å²	128	89 Å²	89	67%	0.67	46%	0.46	S	S	*	.			trans	-75.5	96.8	169.7	-67.7	171.7	0	0	0	107.5	H207	L205-H207 VanDerWaalsContact C-N 3.32Å; L205-H207 PolarHBondContact O-N 3.17Å
206	N	57.3	Low	67	Low	91 Å²	91	89.6 Å²	89.6	49%	0.487	46%	0.464	S	S	.	.			trans	-71.3	92.9	170.5	-86.6	-12.3	0	0	0	108.8	I204 Q208	I204-N206 WeakPolarHBondContact CG2-OD1 3.24Å; I204-N206 PolarHBondContact O-N 2.79Å; I204-N206 VanDerWaalsContact O-N 3.11Å; N206-Q208 PolarHBondContact O-N 2.96Å
207	H	55.7	Low	66.3	Low	150 Å²	150	91.4 Å²	91.4	69%	0.694	47%	0.472	S	S	*	.			trans	-78.7	-1	179.7	-138	-71.7	0	0	0	113.4	L205	L205-H207 VanDerWaalsContact C-N 3.32Å; L205-H207 PolarHBondContact O-N 3.17Å
208	Q	50.4	Low	65.7	Low	169 Å²	169	90 Å²	90	79%	0.79	46%	0.464	S	S	*	.	S	Bend	trans	-95.4	121.2	-175.9	-70.3	-166.1	-10.1	0	0	112.2	N206	N206-Q208 PolarHBondContact O-N 2.96Å
209	K	46.8	Very low	65.3	Low	186 Å²	186	92.2 Å²	92.2	81%	0.809	48%	0.475	S	S	*	.	S	Bend	trans	66.8	72.4	165.2	-60	-177.5	177.8	-179.8	0	116.3	F211	K209-F211 PolarHBondContact O-N 2.64Å
210	G	48.1	Very low	65.1	Low	81 Å²	81	89.2 Å²	89.2	84%	0.835	46%	0.457	S	S	*	.	S	Bend	trans	66.1	-8.5	152.4	0	0	0	0	0	117.9	Y212	G210-Y212 PolarHBondContact O-N 2.85Å
211	F	46.1	Very low	65	Low	180 Å²	180	89.4 Å²	89.4	79%	0.789	46%	0.458	S	S	*	.			trans	-91.5	79.5	172.8	-83.2	-87.8	0	0	0	109.4	K209 G213	K209-F211 PolarHBondContact O-N 2.64Å; F211-G213 PolarHBondContact O-N 3.27Å
212	Y	46	Very low	64.9	Low	147 Å²	147	87 Å²	87	58%	0.576	45%	0.447	S	S	*	.			trans	-71.7	73.2	162.1	-88.4	-86.6	0	0	0	109.1	Y171 G210	Y171-Y212 WeakPolarHBondContact CE1-O 3.49Å; Y171-Y212 PolarHBondContact OH-O 2.92Å; G210-Y212 PolarHBondContact O-N 2.85Å
213	G	54.1	Low	65.1	Low	38 Å²	38	87.1 Å²	87.1	39%	0.392	45%	0.453	S	S	.	.			trans	-126.1	114.7	165.5	0	0	0	0	0	107.5	F211 L215	F211-G213 PolarHBondContact O-N 3.27Å; G213-L215 PolarHBondContact O-N 2.77Å
214	D	61.7	Low	65.8	Low	102 Å²	102	83.5 Å²	83.5	55%	0.545	44%	0.438	S	S	.	.			trans	-62.1	102.8	177.9	-60	-33.2	0	0	0	108.8	V216	D214-V216 PolarHBondContact O-N 3.4Å
215	L	67.3	Low	66.7	Low	49 Å²	49	82 Å²	82	26%	0.257	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	109.4	168.5	-70.7	175.1	0	0	0	107.1	G213 F217 V281 N283	G213-L215 PolarHBondContact O-N 2.77Å; L215-F217 HydrophobicContact CB-CE2 3.99Å; L215-V281 HydrophobicContact CD2-CG1 3.92Å; L215-N283 WeakPolarHBondContact CD2-OD1 2.93Å
216	V	75.4	Confident	67.9	Low	22 Å²	22	77.1 Å²	77.1	13%	0.133	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	118.4	175.3	-171.5	0	0	0	0	108.1	I201 L203 D214 F218 Y282	I201-V216 HydrophobicContact CG2-CG1 3.72Å; L203-V216 HydrophobicContact CD2-CB 4.2Å; L203-V216 HydrophobicContact CD2-CG1 3.77Å; L203-V216 HydrophobicContact CD2-CG2 3.64Å; D214-V216 PolarHBondContact O-N 3.4Å; V216-F218 HydrophobicContact CB-CD2 4.44Å; V216-F218 HydrophobicContact CB-CE2 3.82Å; V216-F218 HydrophobicContact CB-CZ 4.44Å; V216-F218 HydrophobicContact CG1-CD2 3.89Å; V216-F218 HydrophobicContact CG1-CE1 4.35Å; V216-F218 HydrophobicContact CG1-CE2 3.29Å; V216-F218 HydrophobicContact CG1-CZ 3.58Å; V216-Y282 PolarHBondContact N-O 3.47Å; V216-Y282 PolarHBondContact O-N 2.86Å
217	F	77.4	Confident	69.1	Low	37 Å²	37	73.8 Å²	73.8	16%	0.162	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	129	172.4	-66.3	-98.9	0	0	0	108.2	Q202 I204 L215 V281	Q202-F217 CarbonylContact C-O 3.57Å; Q202-F217 HydrophobicContact CB-CB 4.36Å; Q202-F217 PolarHBondContact N-O 2.01Å; Q202-F217 CarbonylContact O-C 3.59Å; Q202-F217 WeakPolarHBondContact O-CA 3.02Å; Q202-F217 WeakPolarHBondContact O-CB 3.22Å; Q202-F217 PolarHBondContact O-N 3.13Å; I204-F217 HydrophobicContact CB-CD2 3.88Å; I204-F217 HydrophobicContact CB-CE2 3.86Å; I204-F217 HydrophobicContact CD1-CD2 3.6Å; I204-F217 HydrophobicContact CD1-CE2 3.72Å; I204-F217 HydrophobicContact CD1-CG 4.2Å; I204-F217 HydrophobicContact CD1-CZ 4.39Å; I204-F217 HydrophobicContact CG1-CD2 3.83Å; I204-F217 HydrophobicContact CG1-CE2 4.13Å; L215-F217 HydrophobicContact CB-CE2 3.99Å; F217-V281 HydrophobicContact CD1-CG2 3.78Å; F217-V281 HydrophobicContact CE1-CG2 3.51Å; F217-V281 HydrophobicContact CZ-CG2 4.3Å
218	F	78.4	Confident	69.8	Low	4 Å²	4	68.9 Å²	68.9	2%	0.018	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	126.6	171.2	-70.3	-92.9	0	0	0	108.6	F198 I201 V216 V220 Q279 I280 Y282 F287 P291	F198-F218 HydrophobicContact CD1-CB 3.73Å; F198-F218 AromaticContact CD1-CD1 3.54Å; F198-F218 HydrophobicContact CD1-CD1 3.54Å; F198-F218 HydrophobicContact CD1-CE1 4.38Å; F198-F218 AromaticContact CD1-CG 3.82Å; F198-F218 HydrophobicContact CD1-CG 3.82Å; F198-F218 HydrophobicContact CE1-CB 3.72Å; F198-F218 AromaticContact CE1-CD1 3.75Å; F198-F218 HydrophobicContact CE1-CD1 3.75Å; F198-F218 HydrophobicContact CE1-CD2 4.38Å; F198-F218 HydrophobicContact CE1-CE1 4.44Å; F198-F218 AromaticContact CE1-CG 3.69Å; F198-F218 HydrophobicContact CE1-CG 3.69Å; I201-F218 HydrophobicContact CB-CD1 4.36Å; I201-F218 HydrophobicContact CB-CE1 4.25Å; I201-F218 HydrophobicContact CD1-CD1 4.46Å; I201-F218 HydrophobicContact CD1-CE1 3.74Å; I201-F218 HydrophobicContact CG1-CD1 3.86Å; I201-F218 HydrophobicContact CG1-CE1 3.62Å; I201-F218 HydrophobicContact CG2-CD1 4.24Å; I201-F218 HydrophobicContact CG2-CE1 3.88Å; I201-F218 HydrophobicContact CG2-CZ 4.29Å; V216-F218 HydrophobicContact CB-CD2 4.44Å; V216-F218 HydrophobicContact CB-CE2 3.82Å; V216-F218 HydrophobicContact CB-CZ 4.44Å; V216-F218 HydrophobicContact CG1-CD2 3.89Å; V216-F218 HydrophobicContact CG1-CE1 4.35Å; V216-F218 HydrophobicContact CG1-CE2 3.29Å; V216-F218 HydrophobicContact CG1-CZ 3.58Å; F218-V220 HydrophobicContact CB-CG1 3.98Å; F218-V220 PolarHBondContact O-N 3.05Å; F218-Q279 WeakPolarHBondContact O-CA 2.93Å; F218-I280 PolarHBondContact N-O 3.35Å; F218-I280 PolarHBondContact O-N 3.4Å; F218-Y282 HydrophobicContact CB-CE2 4.5Å; F218-Y282 AromaticContact CD2-CD2 3.18Å; F218-Y282 HydrophobicContact CD2-CD2 3.18Å; F218-Y282 AromaticContact CD2-CE2 3.72Å; F218-Y282 HydrophobicContact CD2-CE2 3.72Å; F218-Y282 AromaticContact CD2-CG 3.75Å; F218-Y282 HydrophobicContact CD2-CG 3.75Å; F218-Y282 HydrophobicContact CE2-CD1 4.33Å; F218-Y282 AromaticContact CE2-CD2 3.56Å; F218-Y282 HydrophobicContact CE2-CD2 3.56Å; F218-Y282 HydrophobicContact CE2-CE2 4.22Å; F218-Y282 AromaticContact CE2-CG 3.6Å; F218-Y282 HydrophobicContact CE2-CG 3.6Å; F218-Y282 HydrophobicContact CG-CD2 4.14Å; F218-Y282 HydrophobicContact CG-CE2 4.29Å; F218-F287 AromaticContact CE2-CE2 3.71Å; F218-F287 HydrophobicContact CE2-CE2 3.71Å; F218-F287 HydrophobicContact CE2-CZ 4.23Å; F218-F287 HydrophobicContact CZ-CD2 4.28Å; F218-F287 AromaticContact CZ-CE2 3.61Å; F218-F287 HydrophobicContact CZ-CE2 3.61Å; F218-F287 HydrophobicContact CZ-CZ 4.07Å; F218-P291 HydrophobicContact CD1-CG 4.01Å; F218-P291 HydrophobicContact CE1-CG 3.44Å; F218-P291 VanDerWaalsContact CE1-CG 3.44Å; F218-P291 HydrophobicContact CZ-CG 3.86Å
219	I	79.3	Confident	70.4	Confident	47 Å²	47	62.7 Å²	62.7	24%	0.241	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	121.7	165.2	-57.7	176.2	0	0	0	105.9	T199 Q200 R278	T199-I219 PolarHBondContact N-O 3.16Å; T199-I219 PolarHBondContact OG1-O 3.49Å; Q200-I219 HydrophobicContact CB-CB 4.16Å; Q200-I219 HydrophobicContact CB-CD1 4.31Å; Q200-I219 HydrophobicContact CG-CD1 4.38Å; Q200-I219 PolarHBondContact N-O 2.56Å; Q200-I219 PolarHBondContact O-N 3.23Å; I219-R278 VanDerWaalsContact CA-O 3.32Å; I219-R278 WeakPolarHBondContact CA-O 3.34Å
220	V	83.6	Confident	70.7	Confident	7 Å²	7	59.9 Å²	59.9	4%	0.042	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	145.4	-175.9	-57.7	0	0	0	0	109.7	I196 N197 F198 F218 V277 R278 I280	I196-V220 HydrophobicContact CB-CB 4.26Å; I196-V220 HydrophobicContact CD1-CB 4.42Å; I196-V220 HydrophobicContact CD1-CG1 3.86Å; I196-V220 HydrophobicContact CG2-CB 4.49Å; I196-V220 HydrophobicContact CG2-CG2 4.35Å; N197-V220 WeakPolarHBondContact O-CA 3.23Å; F198-V220 HydrophobicContact CD1-CG1 3.68Å; F198-V220 HydrophobicContact CE1-CG1 3.88Å; F198-V220 HydrophobicContact CG-CG1 4.44Å; F218-V220 HydrophobicContact CB-CG1 3.98Å; F218-V220 PolarHBondContact O-N 3.05Å; V220-V277 HydrophobicContact CG2-CG1 4.06Å; V220-V277 WeakPolarHBondContact CG2-O 3.21Å; V220-R278 PolarHBondContact N-O 3.3Å; V220-I280 HydrophobicContact CG1-CD1 4.26Å; V220-I280 HydrophobicContact CG1-CG1 4.41Å; V220-I280 HydrophobicContact CG2-CD1 3.78Å; V220-I280 HydrophobicContact CG2-CG1 3.78Å
221	E	82.9	Confident	70.7	Confident	116 Å²	116	62 Å²	62	54%	0.542	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	111.1	164.7	-171.9	179.1	-168	0	0	107.2	N197 T199 V223	N197-E221 HydrophobicContact CB-CB 4.46Å; N197-E221 PolarHBondContact N-O 3.32Å; N197-E221 PolarHBondContact O-N 2.83Å; T199-E221 HydrophobicContact CG2-CB 4Å; E221-V223 PolarHBondContact O-N 3.11Å
222	S	78.2	Confident	70.6	Confident	17 Å²	17	56.4 Å²	56.4	12%	0.119	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	113.7	176.2	171.8	0	0	0	0	109.7
223	V	81	Confident	70.5	Confident	83 Å²	83	55.2 Å²	55.2	50%	0.503	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-43.5	177.2	-178	0	0	0	0	110.2	I195 N197 E221 V296	I195-V223 HydrophobicContact CG2-CB 4.16Å; I195-V223 WeakPolarHBondContact O-CB 3.21Å; I195-V223 PolarHBondContact O-N 2.96Å; N197-V223 HydrophobicContact CB-CG2 4.08Å; E221-V223 PolarHBondContact O-N 3.11Å; V223-V296 HydrophobicContact CG2-CG1 4.46Å
224	S	84.6	Confident	69.5	Low	40 Å²	40	59.2 Å²	59.2	28%	0.28	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	150.3	174.8	58.6	0	0	0	0	112.2	I195	I195-S224 WeakPolarHBondContact CB-OG 3.32Å; I195-S224 WeakPolarHBondContact CD1-OG 3.38Å; I195-S224 PolarHBondContact N-O 2.89Å; I195-S224 PolarHBondContact O-N 3.27Å; I195-S224 VanDerWaalsContact O-N 3.15Å
225	Q	84.7	Confident	68.8	Low	29 Å²	29	57.8 Å²	57.8	14%	0.136	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	116.4	175.3	-179.7	156.2	37.2	0	0	109.6	L194 L228 P274	L194-Q225 HydrophobicContact CD2-CB 3.84Å; L194-Q225 HydrophobicContact CD2-CG 3.66Å; Q225-L228 HydrophobicContact CG-CB 4.05Å; Q225-P274 HydrophobicContact CB-CB 4.41Å
226	L	86	Confident	67.6	Low	24 Å²	24	60.1 Å²	60.1	13%	0.126	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-30.3	-177.4	-63.6	178.1	0	0	0	112.5	V193 I195 M245 L298 L330	V193-L226 HydrophobicContact CB-CB 4.29Å; V193-L226 HydrophobicContact CG1-CB 4.11Å; V193-L226 HydrophobicContact CG1-CD1 4.07Å; V193-L226 PolarHBondContact O-N 3.35Å; I195-L226 HydrophobicContact CD1-CD1 3.87Å; I195-L226 HydrophobicContact CD1-CD2 4.23Å; I195-L226 HydrophobicContact CD1-CG 4.12Å; I195-L226 HydrophobicContact CG1-CD1 4.01Å; I195-L226 HydrophobicContact CG1-CG 4.28Å; L226-M245 HydrophobicContact CD2-CE 3.61Å; L226-M245 HydrophobicContact CD2-SD 4.12Å; L226-L298 HydrophobicContact CD1-CD1 3.81Å; L226-L330 HydrophobicContact CD1-CB 4.25Å; L226-L330 HydrophobicContact CD1-CD1 4.02Å; L226-L330 HydrophobicContact CD1-CD2 4.23Å; L226-L330 HydrophobicContact CD1-CG 4.4Å
227	K	83.9	Confident	66	Low	22 Å²	22	64.7 Å²	64.7	10%	0.096	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	124.6	175.9	-172.9	-172.2	177.4	-166.2	0	108.1	F187 D190 V193	F187-K227 HydrophobicContact CE1-CD 4.46Å; F187-K227 HydrophobicContact CE2-CB 4.27Å; F187-K227 HydrophobicContact CZ-CB 4.41Å; F187-K227 HydrophobicContact CZ-CD 4.47Å; F187-K227 WeakPolarHBondContact O-CD 3.4Å; F187-K227 WeakPolarHBondContact O-CE 3.48Å; F187-K227 PolarHBondContact O-NZ 3.3Å; D190-K227 PolarHBondContact O-NZ 3.34Å; V193-K227 HydrophobicContact CB-CB 3.88Å; V193-K227 HydrophobicContact CG2-CB 3.91Å; V193-K227 HydrophobicContact CG2-CD 4.16Å; V193-K227 PolarHBondContact N-O 2.72Å; V193-K227 PolarHBondContact O-N 2.77Å
228	L	69.3	Low	64.4	Low	47 Å²	47	66.6 Å²	66.6	25%	0.246	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	98.1	164.5	-175.1	62.7	0	0	0	106.1	Q225 H230 Y303	Q225-L228 HydrophobicContact CG-CB 4.05Å; L228-H230 PolarHBondContact O-N 3.11Å; L228-H230 PolarHBondContact O-ND1 3.22Å; L228-H230 VanDerWaalsContact O-ND1 3.11Å; L228-Y303 HydrophobicContact CD1-CE2 4.42Å
229	D	62.7	Low	62.8	Low	39 Å²	39	76 Å²	76	21%	0.209	44%	0.439	C	S	.	.			trans	-70.8	113.9	162.9	-140.2	-16.5	0	0	0	105.5	D191 H231 K233 F241	D191-D229 PolarHBondContact O-N 3.37Å; D229-H231 PolarHBondContact O-N 3.17Å; D229-H231 VanDerWaalsContact O-N 3.08Å; D229-K233 IonicContact OD2-NZ 2.64Å; D229-F241 VanDerWaalsContact OD1-CE1 3.28Å; D229-F241 WeakPolarHBondContact OD1-CE1 3.07Å; D229-F241 VanDerWaalsContact OD1-CZ 3.25Å; D229-F241 WeakPolarHBondContact OD1-CZ 3.27Å
230	H	53.9	Low	61.5	Low	127 Å²	127	79.1 Å²	79.1	59%	0.588	46%	0.462	S	S	*	.			trans	-68.4	114.2	178.3	-66.9	39.2	0	0	0	105.4	L228 G232	L228-H230 PolarHBondContact O-N 3.11Å; L228-H230 PolarHBondContact O-ND1 3.22Å; L228-H230 VanDerWaalsContact O-ND1 3.11Å; H230-G232 PolarHBondContact O-N 3.15Å
231	H	48.7	Very low	59.9	Low	125 Å²	125	83.6 Å²	83.6	58%	0.579	48%	0.481	S	S	*	.	S	Bend	trans	-41.1	113.4	174.3	-77.7	-71.9	0	0	0	110.9	D229 Y303	D229-H231 PolarHBondContact O-N 3.17Å; D229-H231 VanDerWaalsContact O-N 3.08Å; H231-Y303 WeakPolarHBondContact CE1-CB 3.36Å; H231-Y303 AromaticContact CE1-CD2 3.76Å; H231-Y303 AromaticContact CE1-CG 3.85Å; H231-Y303 WeakPolarHBondContact NE2-CB 3.38Å; H231-Y303 AromaticContact NE2-CD2 3.02Å; H231-Y303 WeakPolarHBondContact NE2-CD2 3.45Å; H231-Y303 AromaticContact NE2-CE2 3.8Å; H231-Y303 AromaticContact NE2-CG 3.18Å
232	G	44.4	Very low	58.3	Low	63 Å²	63	88.4 Å²	88.4	65%	0.649	49%	0.494	S	S	*	.			trans	141.1	65.6	175.6	0	0	0	0	0	114.6	H230 P234	H230-G232 PolarHBondContact O-N 3.15Å; G232-P234 VanDerWaalsContact C-CD 3.43Å; G232-P234 WeakPolarHBondContact O-CD 3Å
233	K	42.2	Very low	56.7	Low	122 Å²	122	90.4 Å²	90.4	53%	0.53	51%	0.506	S	S	.	.			trans	-94.5	96.1	154.9	-80.1	-178	-175.3	158.1	0	110	D229 N236	D229-K233 IonicContact OD2-NZ 2.64Å; K233-N236 HydrophobicContact CD-CB 4.15Å; K233-N236 HydrophobicContact CG-CB 4.3Å
234	P	34.7	Very low	55.2	Low	122 Å²	122	91.4 Å²	91.4	79%	0.792	51%	0.508	S	S	*	.	S	Bend		-116.2	110.7	127.9	31.2	-19.5	0	0	0	108.1	G232	G232-P234 VanDerWaalsContact C-CD 3.43Å; G232-P234 WeakPolarHBondContact O-CD 3Å
235	G	46.6	Very low	53.5	Low	71 Å²	71	93 Å²	93	73%	0.732	51%	0.512	S	S	*	.	S	Bend	trans	101.5	43	169.4	0	0	0	0	0	117.7	T237	G235-T237 PolarHBondContact O-N 2.65Å
236	N	42.5	Very low	51.6	Low	98 Å²	98	94.8 Å²	94.8	52%	0.524	54%	0.538	S	S	.	.			trans	-56	94.4	178.6	-167.9	29.5	0	0	0	113	K233 G238	K233-N236 HydrophobicContact CD-CB 4.15Å; K233-N236 HydrophobicContact CG-CB 4.3Å; N236-G238 PolarHBondContact O-N 3.34Å; N236-G238 VanDerWaalsContact O-N 3.15Å
237	T	40.6	Very low	49.4	Very low	119 Å²	119	101.7 Å²	101.7	73%	0.73	57%	0.574	S	S	*	*			trans	-52.7	116.3	156.8	48.9	0	0	0	0	106.7	G235 R239	G235-T237 PolarHBondContact O-N 2.65Å; T237-R239 PolarHBondContact O-N 3.09Å
238	G	43.3	Very low	47.4	Very low	76 Å²	76	107.1 Å²	107.1	78%	0.784	60%	0.604	S	S	*	*			trans	-63.7	44.3	-166.5	0	0	0	0	0	117.3	N236 P240	N236-G238 PolarHBondContact O-N 3.34Å; N236-G238 VanDerWaalsContact O-N 3.15Å; G238-P240 WeakPolarHBondContact O-CD 3.13Å
239	R	46.3	Very low	45.9	Very low	203 Å²	203	109.5 Å²	109.5	77%	0.766	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-81.6	118	175.3	-136.2	176.5	-168.1	-171.6	4.5	108.1	T237	T237-R239 PolarHBondContact O-N 3.09Å
240	P	52.5	Low	45.1	Very low	112 Å²	112	112.9 Å²	112.9	73%	0.727	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-60.9	141.5	177.2	22.8	-30.9	0	0	0	110.4	G238 R242	G238-P240 WeakPolarHBondContact O-CD 3.13Å; P240-R242 PolarHBondContact O-N 3.04Å; P240-R242 VanDerWaalsContact O-N 3.14Å
241	F	48.8	Very low	44.3	Very low	100 Å²	100	111.2 Å²	111.2	44%	0.439	66%	0.659	S	S	.	*	P	Polyproline II helix	trans	-47.8	119.8	173.2	-68.5	-85.8	0	0	0	110.1	D229 P243	D229-F241 VanDerWaalsContact OD1-CE1 3.28Å; D229-F241 WeakPolarHBondContact OD1-CE1 3.07Å; D229-F241 VanDerWaalsContact OD1-CZ 3.25Å; D229-F241 WeakPolarHBondContact OD1-CZ 3.27Å; F241-P243 WeakPolarHBondContact O-CD 3.29Å
242	R	48.6	Very low	44.2	Very low	217 Å²	217	113.3 Å²	113.3	82%	0.819	67%	0.669	S	S	*	*			trans	-80.2	110.1	162.4	-73.2	-170.8	177.9	-156.3	0.1	106.4	P240 I244	P240-R242 PolarHBondContact O-N 3.04Å; P240-R242 VanDerWaalsContact O-N 3.14Å; R242-I244 PolarHBondContact O-N 3.37Å
243	P	45.9	Very low	44	Very low	59 Å²	59	115.9 Å²	115.9	38%	0.383	67%	0.674	S	S	.	*			trans	-57	129.5	174	21.4	-29.4	0	0	0	108.8	F241 M245 R331	F241-P243 WeakPolarHBondContact O-CD 3.29Å; P243-M245 PolarHBondContact O-N 3.36Å; P243-R331 WeakPolarHBondContact CG-O 3.43Å
244	I	48.2	Very low	44	Very low	104 Å²	104	122 Å²	122	53%	0.533	69%	0.694	S	S	.	*			trans	-76.8	64.2	171.2	-55.2	166.2	0	0	0	107.2	R242 M272	R242-I244 PolarHBondContact O-N 3.37Å; I244-M272 HydrophobicContact CD1-SD 3.82Å; I244-M272 HydrophobicContact CG2-SD 4.43Å
245	M	49.7	Very low	44.4	Very low	74 Å²	74	122.7 Å²	122.7	37%	0.365	70%	0.696	S	S	.	*			trans	-121.2	105.2	162.3	-79.9	-142.8	-100.2	0	0	107.6	L226 P243 L247 R331	L226-M245 HydrophobicContact CD2-CE 3.61Å; L226-M245 HydrophobicContact CD2-SD 4.12Å; P243-M245 PolarHBondContact O-N 3.36Å; M245-L247 PolarHBondContact O-N 3.11Å; M245-R331 HydrophobicContact CE-CB 3.64Å; M245-R331 HydrophobicContact CE-CG 3.39Å
246	G	44.6	Very low	44.4	Very low	67 Å²	67	131.1 Å²	131.1	69%	0.691	71%	0.706	S	S	*	*			trans	-49.2	136.6	168.2	0	0	0	0	0	110.6	L248	G246-L248 PolarHBondContact O-N 3.19Å
247	L	40.5	Very low	44.1	Very low	168 Å²	168	132.4 Å²	132.4	88%	0.88	72%	0.723	S	S	*	*			trans	-54.9	96.9	-177.4	-72.8	151.2	0	0	0	112.1	M245 S249	M245-L247 PolarHBondContact O-N 3.11Å; L247-S249 PolarHBondContact O-N 2.9Å
248	L	41.1	Very low	44.5	Very low	137 Å²	137	138 Å²	138	72%	0.717	73%	0.731	S	S	*	*			trans	-77.7	75.3	155.6	-67.3	176.2	0	0	0	108.5	G246	G246-L248 PolarHBondContact O-N 3.19Å
249	S	37.7	Very low	44.7	Very low	96 Å²	96	143.6 Å²	143.6	67%	0.671	74%	0.736	S	S	*	*			trans	-138.8	63.7	168.4	-167.8	0	0	0	0	109.7	L247 A251	L247-S249 PolarHBondContact O-N 2.9Å; S249-A251 PolarHBondContact O-N 3.44Å
250	S	45.7	Very low	44.7	Very low	111 Å²	111	141.2 Å²	141.2	78%	0.776	74%	0.737	S	S	*	*			trans	-76.4	101.8	155.8	58.7	0	0	0	0	107.7	H252	S250-H252 PolarHBondContact O-N 2.92Å; S250-H252 VanDerWaalsContact O-N 3.13Å
251	A	38.8	Very low	44.6	Very low	91 Å²	91	145 Å²	145	75%	0.752	74%	0.737	S	S	*	*			trans	-68.5	99.2	162.8	0	0	0	0	0	107.3	S249	S249-A251 PolarHBondContact O-N 3.44Å
252	H	45	Very low	45	Very low	169 Å²	169	147.2 Å²	147.2	78%	0.782	76%	0.759	S	S	*	*			trans	-124.3	141.7	164.6	-88.5	26.2	0	0	0	110.8	S250	S250-H252 PolarHBondContact O-N 2.92Å; S250-H252 VanDerWaalsContact O-N 3.13Å
253	P	41.8	Very low	45.4	Very low	118 Å²	118	144.6 Å²	144.6	77%	0.766	76%	0.756	S	S	*	*			trans	-73.1	151.6	-171.5	-6.4	24.9	0	0	0	111.3	T255	P253-T255 PolarHBondContact O-N 3.39Å
254	R	42	Very low	45.3	Very low	249 Å²	249	148.1 Å²	148.1	94%	0.94	77%	0.772	S	S	*	*			trans	-44.8	122.9	177	-74.1	173.1	166.1	128.1	-5.8	113.5
255	T	42.8	Very low	45.6	Very low	138 Å²	138	150.2 Å²	150.2	85%	0.847	78%	0.783	S	S	*	*			trans	-146.9	129	146.3	39.8	0	0	0	0	111.9	P253	P253-T255 PolarHBondContact O-N 3.39Å
256	R	45.6	Very low	45.5	Very low	247 Å²	247	150.9 Å²	150.9	93%	0.932	79%	0.793	S	S	*	*			trans	34.5	119.2	158.6	-96.4	175.9	170.9	169.7	-3.7	121.8	R258	R256-R258 PolarHBondContact O-N 3.06Å
257	S	37.4	Very low	45.5	Very low	126 Å²	126	153.3 Å²	153.3	88%	0.881	79%	0.79	S	S	*	*			trans	-25.4	112.4	157.7	-160.7	0	0	0	0	115.8
258	R	48.6	Very low	45.7	Very low	236 Å²	236	150.3 Å²	150.3	89%	0.891	78%	0.779	S	S	*	*			trans	-136.2	140.9	154.9	-95.1	-175.7	174.4	172	-1.5	109.6	R256 I260	R256-R258 PolarHBondContact O-N 3.06Å; R258-I260 PolarHBondContact O-N 3.41Å
259	E	47.3	Very low	45.7	Very low	193 Å²	193	151.1 Å²	151.1	90%	0.902	78%	0.777	S	S	*	*			trans	-57.2	120.2	-178.4	-169.3	170.4	-169.4	0	0	111.4	R261	E259-R261 PolarHBondContact O-N 2.93Å
260	I	47.2	Very low	45.7	Very low	154 Å²	154	154.8 Å²	154.8	79%	0.79	78%	0.783	S	S	*	*			trans	-82.6	105.1	-175.2	-60.4	173.5	0	0	0	108.9	R258	R258-I260 PolarHBondContact O-N 3.41Å
261	R	49.3	Very low	45.2	Very low	190 Å²	190	158.4 Å²	158.4	72%	0.717	78%	0.781	S	S	*	*			trans	-71	146.2	161.9	-78.1	179.4	175.1	161.9	-1.4	109.3	E259 Q263	E259-R261 PolarHBondContact O-N 2.93Å; R261-Q263 PolarHBondContact O-N 2.91Å
262	T	57	Low	44.9	Very low	148 Å²	148	160.6 Å²	160.6	91%	0.908	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	12.8	178.7	-18.1	0	0	0	0	114.8
263	Q	57.1	Low	44.8	Very low	161 Å²	161	161.9 Å²	161.9	75%	0.752	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-8.5	-175.9	-75.8	175	-23.3	0	0	113.8	R261 L265	R261-Q263 PolarHBondContact O-N 2.91Å; Q263-L265 PolarHBondContact O-N 3.1Å
264	D	44.3	Very low	45.3	Very low	134 Å²	134	158.4 Å²	158.4	72%	0.717	76%	0.761	S	S	*	*			trans	-98.7	35.8	-178.4	-63.1	-32.8	0	0	0	113.5	P266	D264-P266 WeakPolarHBondContact O-CD 3.48Å
265	L	53.6	Low	45.9	Very low	148 Å²	148	150.2 Å²	150.2	78%	0.775	74%	0.742	S	S	*	*	S	Bend	trans	-78.7	112.4	160	-124.9	88	0	0	0	106.5	Q263 D267	Q263-L265 PolarHBondContact O-N 3.1Å; L265-D267 PolarHBondContact O-N 2.81Å; L265-D267 VanDerWaalsContact O-N 3.16Å
266	P	47.8	Very low	47.3	Very low	87 Å²	87	148.7 Å²	148.7	57%	0.565	73%	0.728	S	S	*	*			trans	-58.2	126.1	178.9	23.4	-31.9	0	0	0	108.7	D264 T268	D264-P266 WeakPolarHBondContact O-CD 3.48Å; P266-T268 VanDerWaalsContact C-N 3.31Å; P266-T268 PolarHBondContact O-N 3.46Å; P266-T268 PolarHBondContact O-OG1 3.45Å
267	D	44.1	Very low	48.7	Very low	119 Å²	119	137.4 Å²	137.4	64%	0.636	69%	0.687	S	S	*	*			trans	-58.3	90.7	-176.1	-149.2	3.6	0	0	0	109.2	L265 K269	L265-D267 PolarHBondContact O-N 2.81Å; L265-D267 VanDerWaalsContact O-N 3.16Å; D267-K269 PolarHBondContact O-N 3.27Å; D267-K269 VanDerWaalsContact O-N 3.09Å; D267-K269 WeakPolarHBondContact OD1-CD 3.03Å; D267-K269 WeakPolarHBondContact OD1-CE 3.15Å; D267-K269 VanDerWaalsContact OD1-CG 3.3Å; D267-K269 WeakPolarHBondContact OD1-CG 3.5Å; D267-K269 IonicContact OD1-NZ 3.98Å; D267-K269 PolarHBondContact OD1-NZ 3.23Å; D267-K269 IonicContact OD2-NZ 3.4Å; D267-K269 PolarHBondContact OD2-NZ 2.94Å
268	T	45.7	Very low	50.9	Low	105 Å²	105	139.6 Å²	139.6	64%	0.644	68%	0.676	S	S	*	*			trans	-87.8	39.1	-172.5	-22.7	0	0	0	0	110.4	P266 H270	P266-T268 VanDerWaalsContact C-N 3.31Å; P266-T268 PolarHBondContact O-N 3.46Å; P266-T268 PolarHBondContact O-OG1 3.45Å; T268-H270 PolarHBondContact O-N 2.9Å
269	K	41.8	Very low	52.7	Low	154 Å²	154	133 Å²	133	67%	0.67	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	5.6	-172	-78.5	178.9	-172.9	138.1	0	115.4	D267	D267-K269 PolarHBondContact O-N 3.27Å; D267-K269 VanDerWaalsContact O-N 3.09Å; D267-K269 WeakPolarHBondContact OD1-CD 3.03Å; D267-K269 WeakPolarHBondContact OD1-CE 3.15Å; D267-K269 VanDerWaalsContact OD1-CG 3.3Å; D267-K269 WeakPolarHBondContact OD1-CG 3.5Å; D267-K269 IonicContact OD1-NZ 3.98Å; D267-K269 PolarHBondContact OD1-NZ 3.23Å; D267-K269 IonicContact OD2-NZ 3.4Å; D267-K269 PolarHBondContact OD2-NZ 2.94Å
270	H	36.4	Very low	54.6	Low	173 Å²	173	123.8 Å²	123.8	80%	0.801	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.6	17.1	-172.8	-68.4	-27.9	0	0	0	116.1	T268	T268-H270 PolarHBondContact O-N 2.9Å
271	Y	36.3	Very low	56.5	Low	186 Å²	186	116.6 Å²	116.6	73%	0.729	58%	0.575	S	S	*	*	S	Bend	trans	-125	101.9	179	-75.8	-84.4	0	0	0	111.3
272	M	31.7	Very low	58.3	Low	137 Å²	137	107.8 Å²	107.8	68%	0.675	54%	0.542	S	S	*	.			trans	50.2	106.5	-178.9	-75.7	-175.9	159.8	0	0	112.8	I244 P274	I244-M272 HydrophobicContact CD1-SD 3.82Å; I244-M272 HydrophobicContact CG2-SD 4.43Å; M272-P274 WeakPolarHBondContact O-CD 3.37Å
273	Q	44.2	Very low	59.4	Low	196 Å²	196	102.6 Å²	102.6	92%	0.916	51%	0.509	S	S	*	.			trans	-52.5	107.7	162.3	-80.5	-169.4	-12.3	0	0	106.6	S275	Q273-S275 PolarHBondContact O-N 2.89Å; Q273-S275 VanDerWaalsContact O-N 3.17Å
274	P	50.6	Low	60.1	Low	45 Å²	45	97.7 Å²	97.7	29%	0.292	49%	0.491	S	S	.	.			trans	-56.9	130.3	170.2	-11.6	27.4	0	0	0	103.4	Q225 M272 L276	Q225-P274 HydrophobicContact CB-CB 4.41Å; M272-P274 WeakPolarHBondContact O-CD 3.37Å; P274-L276 VanDerWaalsContact C-N 3.33Å; P274-L276 VanDerWaalsContact O-CA 3.24Å; P274-L276 WeakPolarHBondContact O-CA 3.29Å; P274-L276 PolarHBondContact O-N 2.87Å
275	S	56.3	Low	60.9	Low	78 Å²	78	92.9 Å²	92.9	55%	0.545	47%	0.466	S	S	.	.			trans	-42.6	107.9	170.5	50.5	0	0	0	0	106.3	Q273 V277	Q273-S275 PolarHBondContact O-N 2.89Å; Q273-S275 VanDerWaalsContact O-N 3.17Å; S275-V277 VanDerWaalsContact C-N 3.34Å; S275-V277 PolarHBondContact O-N 3.21Å
276	L	70.2	Confident	61	Low	105 Å²	105	93.8 Å²	93.8	55%	0.55	46%	0.459	S	S	.	.			trans	-62.5	101.6	-157.1	-167.4	81.9	0	0	0	106.3	P274 R278	P274-L276 VanDerWaalsContact C-N 3.33Å; P274-L276 VanDerWaalsContact O-CA 3.24Å; P274-L276 WeakPolarHBondContact O-CA 3.29Å; P274-L276 PolarHBondContact O-N 2.87Å; L276-R278 HydrophobicContact CB-CG 4.38Å; L276-R278 HydrophobicContact CD2-CG 3.71Å; L276-R278 HydrophobicContact CG-CG 4.07Å; L276-R278 PolarHBondContact O-N 2.75Å
277	V	75.3	Confident	61.3	Low	11 Å²	11	92.4 Å²	92.4	7%	0.067	44%	0.444	C	S	.	.			trans	-68.6	96.6	176	174.8	0	0	0	0	104.4	L194 V220 S275 I280 P308	L194-V277 HydrophobicContact CD1-CB 4.49Å; L194-V277 HydrophobicContact CD1-CG1 4.28Å; L194-V277 HydrophobicContact CD1-CG2 4.17Å; V220-V277 HydrophobicContact CG2-CG1 4.06Å; V220-V277 WeakPolarHBondContact CG2-O 3.21Å; S275-V277 VanDerWaalsContact C-N 3.34Å; S275-V277 PolarHBondContact O-N 3.21Å; V277-I280 HydrophobicContact CG1-CD1 4Å; V277-I280 HydrophobicContact CG1-CG1 3.62Å; V277-P308 HydrophobicContact CG1-CG 3.72Å
278	R	83.7	Confident	61.6	Low	172 Å²	172	95.6 Å²	95.6	65%	0.649	46%	0.455	S	S	*	.			trans	-85	-28.8	-179.3	-71.6	179.6	-175	-157.3	-5	111.4	I219 V220 L276	I219-R278 VanDerWaalsContact CA-O 3.32Å; I219-R278 WeakPolarHBondContact CA-O 3.34Å; V220-R278 PolarHBondContact N-O 3.3Å; L276-R278 HydrophobicContact CB-CG 4.38Å; L276-R278 HydrophobicContact CD2-CG 3.71Å; L276-R278 HydrophobicContact CG-CG 4.07Å; L276-R278 PolarHBondContact O-N 2.75Å
279	Q	87.3	Confident	62.2	Low	96 Å²	96	95.9 Å²	95.9	45%	0.449	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	137.4	-172	-66.7	179.2	-7.6	0	0	109.8	F218 P308	F218-Q279 WeakPolarHBondContact O-CA 2.93Å; Q279-P308 WeakPolarHBondContact O-CG 3.48Å
280	I	87.7	Confident	63.4	Low	0 Å²	0	90.1 Å²	90.1	0%	0	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	133.2	171.1	-60.8	-177.7	0	0	0	108.2	L194 I196 F218 V220 V277 Y282 I299 P308 V310	L194-I280 HydrophobicContact CD1-CD1 4.23Å; I196-I280 HydrophobicContact CD1-CD1 4.01Å; I196-I280 HydrophobicContact CG2-CD1 4.14Å; F218-I280 PolarHBondContact N-O 3.35Å; F218-I280 PolarHBondContact O-N 3.4Å; V220-I280 HydrophobicContact CG1-CD1 4.26Å; V220-I280 HydrophobicContact CG1-CG1 4.41Å; V220-I280 HydrophobicContact CG2-CD1 3.78Å; V220-I280 HydrophobicContact CG2-CG1 3.78Å; V277-I280 HydrophobicContact CG1-CD1 4Å; V277-I280 HydrophobicContact CG1-CG1 3.62Å; I280-Y282 HydrophobicContact CB-CE2 4.17Å; I280-Y282 HydrophobicContact CG2-CD2 3.94Å; I280-Y282 HydrophobicContact CG2-CE2 3.56Å; I280-I299 HydrophobicContact CD1-CD1 3.36Å; I280-P308 HydrophobicContact CG1-CB 4.33Å; I280-P308 HydrophobicContact CG1-CG 3.89Å; I280-V310 HydrophobicContact CG2-CB 4.29Å; I280-V310 HydrophobicContact CG2-CG2 3.6Å
281	V	87.3	Confident	65.5	Low	4 Å²	4	82.4 Å²	82.4	2%	0.024	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	123	178.7	-172.9	0	0	0	0	109	L215 F217 N283 V307 P308 H309 V310	L215-V281 HydrophobicContact CD2-CG1 3.92Å; F217-V281 HydrophobicContact CD1-CG2 3.78Å; F217-V281 HydrophobicContact CE1-CG2 3.51Å; F217-V281 HydrophobicContact CZ-CG2 4.3Å; V281-N283 WeakPolarHBondContact CG1-OD1 2.97Å; V281-V307 HydrophobicContact CG2-CG1 3.52Å; V281-P308 PolarHBondContact N-O 2.9Å; V281-H309 WeakPolarHBondContact CB-ND1 3.3Å; V281-H309 WeakPolarHBondContact O-CA 3.42Å; V281-V310 PolarHBondContact O-N 2.79Å
282	Y	85.7	Confident	67.8	Low	4 Å²	4	78.3 Å²	78.3	2%	0.016	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	116.2	174.1	-83.5	-105.9	0	0	0	109.9	F198 V216 F218 I280 D285 F287 V310 K316	F198-Y282 AromaticContact CE1-CE2 3.92Å; F198-Y282 HydrophobicContact CE1-CE2 3.92Å; F198-Y282 HydrophobicContact CZ-CE2 4.15Å; F198-Y282 AromaticContact CZ-CZ 3.85Å; F198-Y282 VanDerWaalsContact CZ-OH 3.29Å; F198-Y282 WeakPolarHBondContact CZ-OH 3.25Å; V216-Y282 PolarHBondContact N-O 3.47Å; V216-Y282 PolarHBondContact O-N 2.86Å; F218-Y282 HydrophobicContact CB-CE2 4.5Å; F218-Y282 AromaticContact CD2-CD2 3.18Å; F218-Y282 HydrophobicContact CD2-CD2 3.18Å; F218-Y282 AromaticContact CD2-CE2 3.72Å; F218-Y282 HydrophobicContact CD2-CE2 3.72Å; F218-Y282 AromaticContact CD2-CG 3.75Å; F218-Y282 HydrophobicContact CD2-CG 3.75Å; F218-Y282 HydrophobicContact CE2-CD1 4.33Å; F218-Y282 AromaticContact CE2-CD2 3.56Å; F218-Y282 HydrophobicContact CE2-CD2 3.56Å; F218-Y282 HydrophobicContact CE2-CE2 4.22Å; F218-Y282 AromaticContact CE2-CG 3.6Å; F218-Y282 HydrophobicContact CE2-CG 3.6Å; F218-Y282 HydrophobicContact CG-CD2 4.14Å; F218-Y282 HydrophobicContact CG-CE2 4.29Å; I280-Y282 HydrophobicContact CB-CE2 4.17Å; I280-Y282 HydrophobicContact CG2-CD2 3.94Å; I280-Y282 HydrophobicContact CG2-CE2 3.56Å; Y282-D285 HydrophobicContact CD1-CB 4.11Å; Y282-D285 WeakPolarHBondContact CD1-OD2 3.35Å; Y282-F287 AromaticContact CD1-CE2 3.65Å; Y282-F287 HydrophobicContact CD1-CE2 3.65Å; Y282-F287 AromaticContact CD1-CZ 3.38Å; Y282-F287 HydrophobicContact CD1-CZ 3.38Å; Y282-F287 HydrophobicContact CE1-CE2 4.3Å; Y282-F287 AromaticContact CE1-CZ 3.57Å; Y282-F287 HydrophobicContact CE1-CZ 3.57Å; Y282-F287 HydrophobicContact CG-CE2 4.08Å; Y282-F287 HydrophobicContact CG-CZ 4.17Å; Y282-V310 CarbonylContact C-O 3.5Å; Y282-V310 VanDerWaalsContact CA-O 3.3Å; Y282-V310 WeakPolarHBondContact CA-O 3.44Å; Y282-V310 HydrophobicContact CD1-CB 4.09Å; Y282-V310 HydrophobicContact CD1-CG1 4.03Å; Y282-V310 HydrophobicContact CD2-CB 4.41Å; Y282-V310 HydrophobicContact CE1-CB 3.78Å; Y282-V310 HydrophobicContact CE1-CG1 3.46Å; Y282-V310 VanDerWaalsContact CE1-CG1 3.46Å; Y282-V310 HydrophobicContact CE2-CB 4.16Å; Y282-V310 HydrophobicContact CE2-CG2 4.36Å; Y282-V310 HydrophobicContact CG-CB 4.39Å; Y282-K316 HydrophobicContact CE1-CD 4.39Å
283	N	79.7	Confident	70.4	Confident	39 Å²	39	76.3 Å²	76.3	21%	0.209	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	134.3	178.7	-68.5	-9.2	0	0	0	109.8	L215 V281 D285 H309 V310 D311	L215-N283 WeakPolarHBondContact CD2-OD1 2.93Å; V281-N283 WeakPolarHBondContact CG1-OD1 2.97Å; N283-D285 PolarHBondContact O-N 3.25Å; N283-H309 PolarHBondContact ND2-ND1 2.75Å; N283-V310 PolarHBondContact N-O 3.15Å; N283-D311 HydrophobicContact CB-CB 4.4Å; N283-D311 WeakPolarHBondContact O-CA 3.28Å; N283-D311 WeakPolarHBondContact O-CB 3.4Å
284	C	71.7	Confident	72.5	Confident	58 Å²	58	69.7 Å²	69.7	39%	0.392	37%	0.372	S	S	.	.	S	Bend	trans	57.5	16.4	170.2	-65.4	0	0	0	0	115.1	C175 R286 S312	C175-C284 HydrophobicContact CB-CB 3.85Å; C175-C284 VanDerWaalsContact SG-CA 3.52Å; C175-C284 VanDerWaalsContact SG-CB 3.53Å; C175-C284 PolarHBondContact SG-O 2.91Å; C284-R286 PolarHBondContact O-N 3.14Å; C284-S312 WeakPolarHBondContact O-CB 3.41Å
285	D	63	Low	74.4	Confident	34 Å²	34	70.9 Å²	70.9	18%	0.182	37%	0.373	C	S	.	.			trans	-85.6	98.1	179.3	-150.6	5.1	0	0	0	108.1	Y282 N283 F287 K316	Y282-D285 HydrophobicContact CD1-CB 4.11Å; Y282-D285 WeakPolarHBondContact CD1-OD2 3.35Å; N283-D285 PolarHBondContact O-N 3.25Å; D285-F287 HydrophobicContact CB-CD2 4Å; D285-F287 HydrophobicContact CB-CE2 3.78Å; D285-F287 HydrophobicContact CB-CZ 4.16Å; D285-F287 PolarHBondContact O-N 3.22Å; D285-F287 VanDerWaalsContact OD2-CE1 3.27Å; D285-F287 WeakPolarHBondContact OD2-CE1 3.12Å; D285-F287 WeakPolarHBondContact OD2-CZ 3.14Å; D285-K316 WeakPolarHBondContact OD1-CE 3.48Å; D285-K316 IonicContact OD1-NZ 2.92Å; D285-K316 PolarHBondContact OD1-NZ 2.93Å; D285-K316 WeakPolarHBondContact OD2-CE 3.45Å; D285-K316 IonicContact OD2-NZ 2.85Å; D285-K316 PolarHBondContact OD2-NZ 2.96Å
286	R	55.2	Low	76.1	Confident	167 Å²	167	69.4 Å²	69.4	63%	0.63	36%	0.361	S	S	*	.			trans	-72.8	79	170.1	-151.7	178.8	-161	-173.6	4.2	106.7	C284 Q288	C284-R286 PolarHBondContact O-N 3.14Å; R286-Q288 PolarHBondContact O-N 3.28Å
287	F	53.3	Low	77.3	Confident	58 Å²	58	65.5 Å²	65.5	25%	0.254	34%	0.339	S	S	.	.			trans	-60.4	89.6	169.6	-76.9	-64.1	0	0	0	107.8	F218 Y282 D285 T289 P291	F218-F287 AromaticContact CE2-CE2 3.71Å; F218-F287 HydrophobicContact CE2-CE2 3.71Å; F218-F287 HydrophobicContact CE2-CZ 4.23Å; F218-F287 HydrophobicContact CZ-CD2 4.28Å; F218-F287 AromaticContact CZ-CE2 3.61Å; F218-F287 HydrophobicContact CZ-CE2 3.61Å; F218-F287 HydrophobicContact CZ-CZ 4.07Å; Y282-F287 AromaticContact CD1-CE2 3.65Å; Y282-F287 HydrophobicContact CD1-CE2 3.65Å; Y282-F287 AromaticContact CD1-CZ 3.38Å; Y282-F287 HydrophobicContact CD1-CZ 3.38Å; Y282-F287 HydrophobicContact CE1-CE2 4.3Å; Y282-F287 AromaticContact CE1-CZ 3.57Å; Y282-F287 HydrophobicContact CE1-CZ 3.57Å; Y282-F287 HydrophobicContact CG-CE2 4.08Å; Y282-F287 HydrophobicContact CG-CZ 4.17Å; D285-F287 HydrophobicContact CB-CD2 4Å; D285-F287 HydrophobicContact CB-CE2 3.78Å; D285-F287 HydrophobicContact CB-CZ 4.16Å; D285-F287 PolarHBondContact O-N 3.22Å; D285-F287 VanDerWaalsContact OD2-CE1 3.27Å; D285-F287 WeakPolarHBondContact OD2-CE1 3.12Å; D285-F287 WeakPolarHBondContact OD2-CZ 3.14Å; F287-T289 WeakPolarHBondContact CD1-O 3.22Å; F287-T289 PolarHBondContact O-N 3.14Å; F287-P291 VanDerWaalsContact CE1-CD 3.4Å; F287-P291 HydrophobicContact CE1-CG 4.26Å; F287-P291 HydrophobicContact CZ-CG 4.15Å
288	Q	50.8	Low	78.2	Confident	185 Å²	185	65 Å²	65	86%	0.864	34%	0.336	S	S	*	.	S	Bend	trans	-57.7	-32.8	162.5	-71.2	-173.7	2.1	0	0	109.1	R286	R286-Q288 PolarHBondContact O-N 3.28Å
289	T	58.1	Low	78.7	Confident	111 Å²	111	56.8 Å²	56.8	68%	0.681	31%	0.305	S	S	*	.	S	Bend	trans	-137.1	116.3	165.8	55.7	0	0	0	0	107.1	F287	F287-T289 WeakPolarHBondContact CD1-O 3.22Å; F287-T289 PolarHBondContact O-N 3.14Å
290	G	67.7	Low	79	Confident	34 Å²	34	52.2 Å²	52.2	35%	0.351	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-49.4	169.5	173.6	0	0	0	0	0	113	M292	G290-M292 PolarHBondContact O-N 2.79Å
291	P	79.9	Confident	79.3	Confident	10 Å²	10	52.2 Å²	52.2	7%	0.065	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-60.4	135.7	162.3	29.9	-25.3	0	0	0	107.3	F198 F218 F287 L293 Y297	F198-P291 HydrophobicContact CD1-CB 4.31Å; F198-P291 HydrophobicContact CD1-CG 3.89Å; F198-P291 HydrophobicContact CD2-CB 3.53Å; F198-P291 HydrophobicContact CD2-CG 4.04Å; F198-P291 HydrophobicContact CE1-CB 4.18Å; F198-P291 HydrophobicContact CE1-CG 3.74Å; F198-P291 HydrophobicContact CE2-CB 3.34Å; F198-P291 HydrophobicContact CE2-CG 3.88Å; F198-P291 HydrophobicContact CG-CB 3.98Å; F198-P291 HydrophobicContact CG-CG 4.01Å; F198-P291 HydrophobicContact CZ-CB 3.66Å; F198-P291 HydrophobicContact CZ-CG 3.69Å; F218-P291 HydrophobicContact CD1-CG 4.01Å; F218-P291 HydrophobicContact CE1-CG 3.44Å; F218-P291 VanDerWaalsContact CE1-CG 3.44Å; F218-P291 HydrophobicContact CZ-CG 3.86Å; F287-P291 VanDerWaalsContact CE1-CD 3.4Å; F287-P291 HydrophobicContact CE1-CG 4.26Å; F287-P291 HydrophobicContact CZ-CG 4.15Å; P291-L293 PolarHBondContact O-N 3.15Å; P291-Y297 HydrophobicContact CB-CD2 4.4Å; P291-Y297 HydrophobicContact CB-CE1 4.31Å; P291-Y297 HydrophobicContact CB-CE2 3.95Å
292	M	85	Confident	79.5	Confident	101 Å²	101	54.7 Å²	54.7	50%	0.498	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-70.4	126.4	176.1	-64.6	-169.5	172.6	0	0	109.1	G290 E295 Y297	G290-M292 PolarHBondContact O-N 2.79Å; M292-E295 HydrophobicContact CB-CB 4.23Å; M292-E295 HydrophobicContact CB-CG 3.89Å; M292-E295 WeakPolarHBondContact O-CB 3.24Å; M292-E295 PolarHBondContact O-N 2.89Å; M292-Y297 PolarHBondContact N-OH 3.44Å
293	L	87	Confident	79.7	Confident	95 Å²	95	56 Å²	56	50%	0.497	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	138.2	175.4	-67.3	-179.9	0	0	0	110.4	F198 I201 P291 E295	F198-L293 HydrophobicContact CB-CD2 3.96Å; I201-L293 HydrophobicContact CD1-CD2 4.36Å; I201-L293 HydrophobicContact CG1-CD1 4.43Å; I201-L293 HydrophobicContact CG1-CD2 3.85Å; I201-L293 HydrophobicContact CG1-CG 4.42Å; P291-L293 PolarHBondContact O-N 3.15Å; L293-E295 PolarHBondContact O-N 2.91Å
294	G	87.1	Confident	80	Confident	57 Å²	57	57.6 Å²	57.6	59%	0.588	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	-5	-176.4	0	0	0	0	0	115.1	N197 F198	N197-G294 WeakPolarHBondContact OD1-CA 3.32Å; F198-G294 PolarHBondContact O-N 3.33Å
295	E	90.4	Very high	80.8	Confident	69 Å²	69	60.7 Å²	60.7	32%	0.322	33%	0.331	S	S	.	.			trans	-87.8	144.1	169	-74.5	-166.1	154.5	0	0	111.3	N197 M292 L293 Y297	N197-E295 PolarHBondContact OD1-O 2.73Å; M292-E295 HydrophobicContact CB-CB 4.23Å; M292-E295 HydrophobicContact CB-CG 3.89Å; M292-E295 WeakPolarHBondContact O-CB 3.24Å; M292-E295 PolarHBondContact O-N 2.89Å; L293-E295 PolarHBondContact O-N 2.91Å; E295-Y297 HydrophobicContact CB-CD2 4.27Å; E295-Y297 HydrophobicContact CB-CE2 3.58Å; E295-Y297 WeakPolarHBondContact O-CD2 3.16Å; E295-Y297 PolarHBondContact OE2-OH 2.95Å
296	V	92.3	Very high	81.9	Confident	47 Å²	47	61.9 Å²	61.9	29%	0.285	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	130.7	175.2	-177.1	0	0	0	0	109.5	I195 I196 N197 V223 W319	I195-V296 HydrophobicContact CG2-CG1 3.29Å; I196-V296 CarbonylContact O-C 3.59Å; I196-V296 VanDerWaalsContact O-CA 3.3Å; I196-V296 WeakPolarHBondContact O-CA 3.45Å; N197-V296 HydrophobicContact CB-CG2 4.49Å; V223-V296 HydrophobicContact CG2-CG1 4.46Å; V296-W319 HydrophobicContact CB-CB 4.05Å; V296-W319 HydrophobicContact CG1-CB 3.87Å; V296-W319 HydrophobicContact CG1-CG 4.3Å; V296-W319 VanDerWaalsContact O-CB 3.3Å; V296-W319 WeakPolarHBondContact O-CB 3.34Å; V296-W319 PolarHBondContact O-N 3.38Å
297	Y	94.4	Very high	83.4	Confident	24 Å²	24	56.6 Å²	56.6	9%	0.094	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	146.5	178.6	-74.4	-104.9	0	0	0	111.4	I195 I196 F198 P291 M292 E295 A317 P318	I195-Y297 CarbonylContact C-O 3.58Å; I195-Y297 VanDerWaalsContact CA-O 3.27Å; I195-Y297 WeakPolarHBondContact CA-O 3.38Å; I196-Y297 PolarHBondContact N-O 2.77Å; I196-Y297 PolarHBondContact O-N 2.87Å; F198-Y297 AromaticContact CD2-CD2 3.48Å; F198-Y297 HydrophobicContact CD2-CD2 3.48Å; F198-Y297 VanDerWaalsContact CD2-CD2 3.48Å; F198-Y297 AromaticContact CD2-CE2 3.98Å; F198-Y297 HydrophobicContact CD2-CE2 3.98Å; F198-Y297 HydrophobicContact CD2-CG 4.14Å; F198-Y297 HydrophobicContact CE2-CD1 4.37Å; F198-Y297 AromaticContact CE2-CD2 3.47Å; F198-Y297 HydrophobicContact CE2-CD2 3.47Å; F198-Y297 VanDerWaalsContact CE2-CD2 3.47Å; F198-Y297 HydrophobicContact CE2-CE2 4.15Å; F198-Y297 AromaticContact CE2-CG 3.64Å; F198-Y297 HydrophobicContact CE2-CG 3.64Å; P291-Y297 HydrophobicContact CB-CD2 4.4Å; P291-Y297 HydrophobicContact CB-CE1 4.31Å; P291-Y297 HydrophobicContact CB-CE2 3.95Å; M292-Y297 PolarHBondContact N-OH 3.44Å; E295-Y297 HydrophobicContact CB-CD2 4.27Å; E295-Y297 HydrophobicContact CB-CE2 3.58Å; E295-Y297 WeakPolarHBondContact O-CD2 3.16Å; E295-Y297 PolarHBondContact OE2-OH 2.95Å; Y297-A317 WeakPolarHBondContact CA-O 3.45Å; Y297-P318 HydrophobicContact CD1-CG 4.28Å; Y297-P318 HydrophobicContact CE1-CB 4.26Å; Y297-P318 HydrophobicContact CE1-CG 3.65Å
298	L	95.4	Very high	85.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	124.6	160.9	173.8	68.5	0	0	0	107.9	L183 V193 L194 I195 L226 W315 K316 A317 W319 V322 L330	L183-L298 HydrophobicContact CD1-CD2 4.16Å; L183-L298 HydrophobicContact CD2-CD2 4.16Å; V193-L298 HydrophobicContact CG1-CD1 3.65Å; L194-L298 WeakPolarHBondContact O-CA 3.16Å; I195-L298 HydrophobicContact CG1-CD1 3.94Å; L226-L298 HydrophobicContact CD1-CD1 3.81Å; L298-W315 HydrophobicContact CB-CZ3 3.9Å; L298-W315 HydrophobicContact CD2-CE3 4.3Å; L298-W315 HydrophobicContact CD2-CH2 3.83Å; L298-W315 HydrophobicContact CD2-CZ3 3.44Å; L298-W315 VanDerWaalsContact CD2-CZ3 3.44Å; L298-W315 HydrophobicContact CG-CE3 4.27Å; L298-W315 HydrophobicContact CG-CH2 4.45Å; L298-W315 HydrophobicContact CG-CZ3 3.61Å; L298-K316 WeakPolarHBondContact O-CA 3.34Å; L298-A317 PolarHBondContact N-O 3.31Å; L298-A317 PolarHBondContact O-N 2.9Å; L298-W319 HydrophobicContact CB-CE3 4.02Å; L298-W319 HydrophobicContact CB-CZ3 4.35Å; L298-W319 HydrophobicContact CD2-CZ3 4.29Å; L298-V322 HydrophobicContact CB-CG2 4.08Å; L298-V322 HydrophobicContact CD2-CG1 4.17Å; L298-V322 HydrophobicContact CD2-CG2 4.01Å; L298-L330 HydrophobicContact CD1-CD1 4.44Å; L298-L330 HydrophobicContact CD2-CD1 3.51Å; L298-L330 HydrophobicContact CD2-CD2 4.48Å
299	I	94	Very high	87.1	Confident	0 Å²	0	47 Å²	47	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	150.4	-179	61.5	163	0	0	0	110.9	F192 V193 L194 I196 I280 V310 W315 K316	F192-I299 HydrophobicContact CE2-CD1 4.1Å; F192-I299 HydrophobicContact CE2-CG1 4.41Å; V193-I299 WeakPolarHBondContact CA-O 3.37Å; L194-I299 HydrophobicContact CB-CD1 4.37Å; L194-I299 HydrophobicContact CB-CG1 3.98Å; L194-I299 PolarHBondContact N-O 3.25Å; L194-I299 PolarHBondContact O-N 2.89Å; I196-I299 HydrophobicContact CD1-CD1 3.39Å; I196-I299 HydrophobicContact CD1-CG1 4Å; I196-I299 HydrophobicContact CD1-CG2 4.16Å; I196-I299 HydrophobicContact CG1-CD1 3.95Å; I196-I299 HydrophobicContact CG1-CG1 4.07Å; I196-I299 HydrophobicContact CG1-CG2 4.37Å; I196-I299 HydrophobicContact CG2-CD1 4.18Å; I196-I299 HydrophobicContact CG2-CG1 4.47Å; I280-I299 HydrophobicContact CD1-CD1 3.36Å; I299-V310 HydrophobicContact CD1-CG2 3.96Å; I299-W315 CarbonylContact C-O 3.53Å; I299-W315 WeakPolarHBondContact CA-O 3.38Å; I299-K316 HydrophobicContact CG2-CB 3.97Å
300	T	94.4	Very high	88.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	150.3	171.3	73.2	0	0	0	0	109.6	L183 S186 D190 F192 V193 S314 W315	L183-T300 HydrophobicContact CD1-CG2 4.22Å; S186-T300 WeakPolarHBondContact CB-OG1 3.41Å; D190-T300 WeakPolarHBondContact OD2-CB 3.43Å; D190-T300 PolarHBondContact OD2-OG1 2.97Å; F192-T300 WeakPolarHBondContact O-CA 3.36Å; V193-T300 HydrophobicContact CG1-CG2 4.21Å; V193-T300 HydrophobicContact CG2-CG2 3.97Å; T300-S314 WeakPolarHBondContact O-CB 3.41Å; T300-S314 PolarHBondContact O-OG 2.92Å; T300-S314 VanDerWaalsContact O-OG 3.05Å; T300-W315 HydrophobicContact CG2-CB 4.09Å; T300-W315 PolarHBondContact N-O 3Å; T300-W315 WeakPolarHBondContact OG1-CB 3.4Å; T300-W315 PolarHBondContact OG1-N 2.98Å; T300-W315 VanDerWaalsContact OG1-N 3.11Å; T300-W315 PolarHBondContact OG1-O 3.19Å
301	G	92.9	Very high	89.5	Confident	0 Å²	0	42 Å²	42	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.7	-176.8	-179.5	0	0	0	0	0	113.5	D190 D191 F192 H309	D190-G301 WeakPolarHBondContact CB-O 3.31Å; D191-G301 PolarHBondContact N-O 3.19Å; F192-G301 VanDerWaalsContact CD1-O 3.29Å; F192-G301 WeakPolarHBondContact CD1-O 3.46Å; F192-G301 VanDerWaalsContact CZ-CA 3.41Å; F192-G301 PolarHBondContact N-O 2.79Å; F192-G301 VanDerWaalsContact N-O 3.11Å; F192-G301 PolarHBondContact O-N 3.33Å; G301-H309 WeakPolarHBondContact CA-O 3Å
302	I	91.1	Very high	89.7	Confident	56 Å²	56	43.3 Å²	43.3	29%	0.287	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	152.1	-175.3	58.9	172	0	0	0	109.7	D191 F192 I304 H309	D191-I302 VanDerWaalsContact OD2-CA 3.31Å; D191-I302 WeakPolarHBondContact OD2-CA 3.27Å; D191-I302 WeakPolarHBondContact OD2-CB 3.46Å; F192-I302 WeakPolarHBondContact CE1-O 3.11Å; I302-I304 HydrophobicContact CD1-CD1 4.14Å; I302-I304 HydrophobicContact CD1-CG1 4.09Å; I302-I304 HydrophobicContact CG1-CG1 4.24Å; I302-H309 HydrophobicContact CG1-CB 4.48Å; I302-H309 PolarHBondContact N-O 2.89Å; I302-H309 VanDerWaalsContact N-O 3.12Å; I302-H309 PolarHBondContact O-N 2.97Å
303	Y	90.2	Very high	89.7	Confident	30 Å²	30	38.9 Å²	38.9	12%	0.118	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	131.6	168.9	-71.1	-87.7	0	0	0	109.7	D191 F192 L228 H231 V307 P308	D191-Y303 HydrophobicContact CB-CD2 3.82Å; D191-Y303 HydrophobicContact CB-CE2 4.47Å; D191-Y303 PolarHBondContact OD2-N 3.07Å; F192-Y303 HydrophobicContact CB-CE2 3.85Å; F192-Y303 AromaticContact CD1-CD2 3.76Å; F192-Y303 HydrophobicContact CD1-CD2 3.76Å; F192-Y303 HydrophobicContact CD1-CE1 4.48Å; F192-Y303 AromaticContact CD1-CE2 3.57Å; F192-Y303 HydrophobicContact CD1-CE2 3.57Å; F192-Y303 HydrophobicContact CD1-CG 4.32Å; F192-Y303 AromaticContact CD1-CZ 3.94Å; F192-Y303 HydrophobicContact CG-CE2 4.14Å; L228-Y303 HydrophobicContact CD1-CE2 4.42Å; H231-Y303 WeakPolarHBondContact CE1-CB 3.36Å; H231-Y303 AromaticContact CE1-CD2 3.76Å; H231-Y303 AromaticContact CE1-CG 3.85Å; H231-Y303 WeakPolarHBondContact NE2-CB 3.38Å; H231-Y303 AromaticContact NE2-CD2 3.02Å; H231-Y303 WeakPolarHBondContact NE2-CD2 3.45Å; H231-Y303 AromaticContact NE2-CE2 3.8Å; H231-Y303 AromaticContact NE2-CG 3.18Å; Y303-V307 CarbonylContact C-O 3.5Å; Y303-V307 VanDerWaalsContact CA-O 3.24Å; Y303-V307 WeakPolarHBondContact CA-O 3.34Å; Y303-P308 HydrophobicContact CD1-CB 3.95Å; Y303-P308 HydrophobicContact CE1-CB 3.72Å; Y303-P308 HydrophobicContact CE1-CG 4.11Å
304	I	87.2	Confident	89.9	Confident	74 Å²	74	34.8 Å²	34.8	38%	0.379	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	119	171.9	-51.4	178.1	0	0	0	106.1	I302 G306 V307 H309	I302-I304 HydrophobicContact CD1-CD1 4.14Å; I302-I304 HydrophobicContact CD1-CG1 4.09Å; I302-I304 HydrophobicContact CG1-CG1 4.24Å; I304-G306 PolarHBondContact O-N 3.31Å; I304-G306 VanDerWaalsContact O-N 3.17Å; I304-V307 PolarHBondContact N-O 3.31Å; I304-V307 PolarHBondContact O-N 2.72Å; I304-H309 VanDerWaalsContact CB-CD2 3.44Å; I304-H309 WeakPolarHBondContact CB-CD2 3.2Å; I304-H309 HydrophobicContact CD1-CB 3.95Å; I304-H309 HydrophobicContact CG1-CB 4.17Å
305	S	87.7	Confident	90.2	Very high	123 Å²	123	32.2 Å²	32.2	86%	0.86	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	38.7	-177.2	-54.9	0	0	0	0	113.5	V307	S305-V307 PolarHBondContact O-N 3.03Å
306	G	86.5	Confident	90.3	Very high	58 Å²	58	31 Å²	31	60%	0.598	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.6	-3.4	-179.5	0	0	0	0	0	115.3	I304	I304-G306 PolarHBondContact O-N 3.31Å; I304-G306 VanDerWaalsContact O-N 3.17Å
307	V	86.9	Confident	90.3	Very high	57 Å²	57	29.1 Å²	29.1	35%	0.345	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	133.7	177.5	-175.9	0	0	0	0	109.3	V281 Y303 I304 S305 H309	V281-V307 HydrophobicContact CG2-CG1 3.52Å; Y303-V307 CarbonylContact C-O 3.5Å; Y303-V307 VanDerWaalsContact CA-O 3.24Å; Y303-V307 WeakPolarHBondContact CA-O 3.34Å; I304-V307 PolarHBondContact N-O 3.31Å; I304-V307 PolarHBondContact O-N 2.72Å; S305-V307 PolarHBondContact O-N 3.03Å; V307-H309 PolarHBondContact O-CD2 3.45Å; V307-H309 PolarHBondContact O-N 3.07Å
308	P	90.9	Very high	90.3	Very high	11 Å²	11	28.8 Å²	28.8	7%	0.071	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	124.3	177.4	27	-30.7	0	0	0	110.9	F192 V277 Q279 I280 V281 Y303	F192-P308 HydrophobicContact CD1-CB 4.12Å; F192-P308 HydrophobicContact CE1-CB 3.43Å; F192-P308 VanDerWaalsContact CE1-CB 3.43Å; F192-P308 HydrophobicContact CZ-CB 3.74Å; V277-P308 HydrophobicContact CG1-CG 3.72Å; Q279-P308 WeakPolarHBondContact O-CG 3.48Å; I280-P308 HydrophobicContact CG1-CB 4.33Å; I280-P308 HydrophobicContact CG1-CG 3.89Å; V281-P308 PolarHBondContact N-O 2.9Å; Y303-P308 HydrophobicContact CD1-CB 3.95Å; Y303-P308 HydrophobicContact CE1-CB 3.72Å; Y303-P308 HydrophobicContact CE1-CG 4.11Å
309	H	90.3	Very high	90.3	Very high	29 Å²	29	32.4 Å²	32.4	13%	0.134	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	135.1	176.7	-74.9	-100.2	0	0	0	111.4	V281 N283 G301 I302 I304 V307	V281-H309 WeakPolarHBondContact CB-ND1 3.3Å; V281-H309 WeakPolarHBondContact O-CA 3.42Å; N283-H309 PolarHBondContact ND2-ND1 2.75Å; G301-H309 WeakPolarHBondContact CA-O 3Å; I302-H309 HydrophobicContact CG1-CB 4.48Å; I302-H309 PolarHBondContact N-O 2.89Å; I302-H309 VanDerWaalsContact N-O 3.12Å; I302-H309 PolarHBondContact O-N 2.97Å; I304-H309 VanDerWaalsContact CB-CD2 3.44Å; I304-H309 WeakPolarHBondContact CB-CD2 3.2Å; I304-H309 HydrophobicContact CD1-CB 3.95Å; I304-H309 HydrophobicContact CG1-CB 4.17Å; V307-H309 PolarHBondContact O-CD2 3.45Å; V307-H309 PolarHBondContact O-N 3.07Å
310	V	89.6	Confident	90.3	Very high	1 Å²	1	37 Å²	37	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	135.1	172.2	-179.6	0	0	0	0	107.5	F192 I280 V281 Y282 N283 I299	F192-V310 HydrophobicContact CE2-CG2 4.16Å; F192-V310 HydrophobicContact CZ-CG2 3.87Å; I280-V310 HydrophobicContact CG2-CB 4.29Å; I280-V310 HydrophobicContact CG2-CG2 3.6Å; V281-V310 PolarHBondContact O-N 2.79Å; Y282-V310 CarbonylContact C-O 3.5Å; Y282-V310 VanDerWaalsContact CA-O 3.3Å; Y282-V310 WeakPolarHBondContact CA-O 3.44Å; Y282-V310 HydrophobicContact CD1-CB 4.09Å; Y282-V310 HydrophobicContact CD1-CG1 4.03Å; Y282-V310 HydrophobicContact CD2-CB 4.41Å; Y282-V310 HydrophobicContact CE1-CB 3.78Å; Y282-V310 HydrophobicContact CE1-CG1 3.46Å; Y282-V310 VanDerWaalsContact CE1-CG1 3.46Å; Y282-V310 HydrophobicContact CE2-CB 4.16Å; Y282-V310 HydrophobicContact CE2-CG2 4.36Å; Y282-V310 HydrophobicContact CG-CB 4.39Å; N283-V310 PolarHBondContact N-O 3.15Å; I299-V310 HydrophobicContact CD1-CG2 3.96Å
311	D	87.1	Confident	90.3	Very high	39 Å²	39	42.8 Å²	42.8	21%	0.209	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	-179	177.6	69.9	19.8	0	0	0	112.9	R150 N283 C313 S314 K316	R150-D311 IonicContact NH1-OD1 2.73Å; R150-D311 PolarHBondContact NH1-OD1 3.32Å; R150-D311 IonicContact NH1-OD2 2.92Å; R150-D311 PolarHBondContact NH1-OD2 3.1Å; N283-D311 HydrophobicContact CB-CB 4.4Å; N283-D311 WeakPolarHBondContact O-CA 3.28Å; N283-D311 WeakPolarHBondContact O-CB 3.4Å; D311-C313 PolarHBondContact O-N 2.79Å; D311-C313 VanDerWaalsContact O-N 3.17Å; D311-C313 VanDerWaalsContact OD1-C 3.24Å; D311-C313 WeakPolarHBondContact OD1-CA 3.39Å; D311-C313 VanDerWaalsContact OD1-CB 3.23Å; D311-C313 WeakPolarHBondContact OD1-CB 3.27Å; D311-C313 PolarHBondContact OD1-N 3.48Å; D311-S314 PolarHBondContact N-OG 2.81Å; D311-S314 VanDerWaalsContact N-OG 3.13Å; D311-S314 WeakPolarHBondContact O-CB 3.27Å; D311-S314 PolarHBondContact O-N 3.22Å; D311-S314 PolarHBondContact OD1-N 3.06Å; D311-S314 PolarHBondContact OD1-OG 3.13Å; D311-K316 PolarHBondContact O-NZ 3.23Å
312	S	83.2	Confident	90.4	Very high	38 Å²	38	43 Å²	43	27%	0.266	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.4	174.3	53.4	0	0	0	0	113.6	C284	C284-S312 WeakPolarHBondContact O-CB 3.41Å
313	C	86.3	Confident	90.6	Very high	8 Å²	8	41.4 Å²	41.4	5%	0.054	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-10.3	-176.8	-52.9	0	0	0	0	113.3	R150 C178 P181 D311	R150-C313 VanDerWaalsContact NH1-CB 3.26Å; C178-C313 HydrophobicContact CB-CB 3.81Å; C178-C313 WeakPolarHBondContact CB-SG 3.34Å; C178-C313 WeakPolarHBondContact SG-CA 3.39Å; C178-C313 WeakPolarHBondContact SG-CB 3.23Å; C178-C313 CovalentContact SG-SG 2.01Å; C178-C313 PolarHBondContact SG-SG 3.33Å; P181-C313 WeakPolarHBondContact CD-O 3.49Å; P181-C313 WeakPolarHBondContact CG-O 3.32Å; D311-C313 PolarHBondContact O-N 2.79Å; D311-C313 VanDerWaalsContact O-N 3.17Å; D311-C313 VanDerWaalsContact OD1-C 3.24Å; D311-C313 WeakPolarHBondContact OD1-CA 3.39Å; D311-C313 VanDerWaalsContact OD1-CB 3.23Å; D311-C313 WeakPolarHBondContact OD1-CB 3.27Å; D311-C313 PolarHBondContact OD1-N 3.48Å
314	S	90.7	Very high	90.8	Very high	9 Å²	9	50.3 Å²	50.3	6%	0.063	28%	0.28	C	S	.	.	S	Bend	trans	-61.6	145.8	169.3	-76.3	0	0	0	0	111.1	T300 D311 K316	T300-S314 WeakPolarHBondContact O-CB 3.41Å; T300-S314 PolarHBondContact O-OG 2.92Å; T300-S314 VanDerWaalsContact O-OG 3.05Å; D311-S314 PolarHBondContact N-OG 2.81Å; D311-S314 VanDerWaalsContact N-OG 3.13Å; D311-S314 WeakPolarHBondContact O-CB 3.27Å; D311-S314 PolarHBondContact O-N 3.22Å; D311-S314 PolarHBondContact OD1-N 3.06Å; D311-S314 PolarHBondContact OD1-OG 3.13Å; S314-K316 PolarHBondContact O-N 2.05Å
315	W	93.3	Very high	91.1	Very high	3 Å²	3	49.1 Å²	49.1	1%	0.011	27%	0.273	C	S	.	.			trans	-75.9	126.9	171.9	-165.2	102	0	0	0	109.6	P181 L183 S186 L298 I299 T300 A317 V322 D375	P181-W315 HydrophobicContact CG-CB 3.93Å; P181-W315 VanDerWaalsContact O-CD1 3.29Å; L183-W315 HydrophobicContact CB-CD2 4.16Å; L183-W315 HydrophobicContact CB-CG 4.33Å; L183-W315 HydrophobicContact CB-CZ2 4.04Å; L183-W315 HydrophobicContact CD1-CD2 3.59Å; L183-W315 HydrophobicContact CD1-CE3 3.65Å; L183-W315 HydrophobicContact CD1-CG 4.06Å; L183-W315 HydrophobicContact CD1-CH2 4.24Å; L183-W315 HydrophobicContact CD1-CZ2 4.19Å; L183-W315 HydrophobicContact CD1-CZ3 4.01Å; L183-W315 HydrophobicContact CD2-CH2 4.09Å; L183-W315 HydrophobicContact CD2-CZ2 3.96Å; L183-W315 HydrophobicContact CG-CD2 4.36Å; L183-W315 HydrophobicContact CG-CZ2 4.28Å; S186-W315 WeakPolarHBondContact OG-CB 3.21Å; L298-W315 HydrophobicContact CB-CZ3 3.9Å; L298-W315 HydrophobicContact CD2-CE3 4.3Å; L298-W315 HydrophobicContact CD2-CH2 3.83Å; L298-W315 HydrophobicContact CD2-CZ3 3.44Å; L298-W315 VanDerWaalsContact CD2-CZ3 3.44Å; L298-W315 HydrophobicContact CG-CE3 4.27Å; L298-W315 HydrophobicContact CG-CH2 4.45Å; L298-W315 HydrophobicContact CG-CZ3 3.61Å; I299-W315 CarbonylContact C-O 3.53Å; I299-W315 WeakPolarHBondContact CA-O 3.38Å; T300-W315 HydrophobicContact CG2-CB 4.09Å; T300-W315 PolarHBondContact N-O 3Å; T300-W315 WeakPolarHBondContact OG1-CB 3.4Å; T300-W315 PolarHBondContact OG1-N 2.98Å; T300-W315 VanDerWaalsContact OG1-N 3.11Å; T300-W315 PolarHBondContact OG1-O 3.19Å; W315-A317 HydrophobicContact CH2-CB 3.61Å; W315-A317 HydrophobicContact CZ2-CB 4.25Å; W315-A317 HydrophobicContact CZ3-CB 3.85Å; W315-V322 HydrophobicContact CH2-CG2 4.07Å; W315-D375 PolarHBondContact NE1-OD1 3.29Å; W315-D375 PolarHBondContact NE1-OD2 3.09Å
316	K	92	Very high	91.5	Very high	44 Å²	44	43.4 Å²	43.4	19%	0.191	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	141.8	177.1	55.4	-173.9	179.4	-114.4	0	111.4	R180 Y282 D285 L298 I299 D311 S314	R180-K316 PolarHBondContact NH2-O 3.48Å; Y282-K316 HydrophobicContact CE1-CD 4.39Å; D285-K316 WeakPolarHBondContact OD1-CE 3.48Å; D285-K316 IonicContact OD1-NZ 2.92Å; D285-K316 PolarHBondContact OD1-NZ 2.93Å; D285-K316 WeakPolarHBondContact OD2-CE 3.45Å; D285-K316 IonicContact OD2-NZ 2.85Å; D285-K316 PolarHBondContact OD2-NZ 2.96Å; L298-K316 WeakPolarHBondContact O-CA 3.34Å; I299-K316 HydrophobicContact CG2-CB 3.97Å; D311-K316 PolarHBondContact O-NZ 3.23Å; S314-K316 PolarHBondContact O-N 2.05Å
317	A	92.8	Very high	91.9	Very high	8 Å²	8	43.1 Å²	43.1	7%	0.066	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	151.8	172.4	0	0	0	0	0	111.2	Y297 L298 W315 W319	Y297-A317 WeakPolarHBondContact CA-O 3.45Å; L298-A317 PolarHBondContact N-O 3.31Å; L298-A317 PolarHBondContact O-N 2.9Å; W315-A317 HydrophobicContact CH2-CB 3.61Å; W315-A317 HydrophobicContact CZ2-CB 4.25Å; W315-A317 HydrophobicContact CZ3-CB 3.85Å; A317-W319 PolarHBondContact O-N 3.45Å
318	P	93.7	Very high	92.2	Very high	17 Å²	17	48.6 Å²	48.6	11%	0.11	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55	137.9	166	-21.5	31.3	0	0	0	110.5	Y297 S320 Q321 V322	Y297-P318 HydrophobicContact CD1-CG 4.28Å; Y297-P318 HydrophobicContact CE1-CB 4.26Å; Y297-P318 HydrophobicContact CE1-CG 3.65Å; P318-S320 PolarHBondContact O-N 3.15Å; P318-S320 VanDerWaalsContact O-N 3.15Å; P318-Q321 HydrophobicContact CB-CG 4.18Å; P318-Q321 HydrophobicContact CG-CG 4.26Å; P318-Q321 WeakPolarHBondContact O-CB 3.3Å; P318-Q321 PolarHBondContact O-N 2.94Å; P318-V322 PolarHBondContact O-N 2.85Å
319	W	94.9	Very high	92.4	Very high	76 Å²	76	49.3 Å²	49.3	29%	0.288	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.7	-179.6	-177.7	-115.5	0	0	0	113	I195 V296 L298 A317 Q321 V322 K327 L330	I195-W319 HydrophobicContact CD1-CD2 4.36Å; I195-W319 HydrophobicContact CD1-CE3 3.9Å; I195-W319 HydrophobicContact CD1-CH2 3.4Å; I195-W319 HydrophobicContact CD1-CZ2 3.9Å; I195-W319 HydrophobicContact CD1-CZ3 3.4Å; I195-W319 VanDerWaalsContact CD1-CZ3 3.4Å; I195-W319 HydrophobicContact CG1-CE3 4.19Å; I195-W319 HydrophobicContact CG1-CH2 4.44Å; I195-W319 HydrophobicContact CG1-CZ3 3.97Å; V296-W319 HydrophobicContact CB-CB 4.05Å; V296-W319 HydrophobicContact CG1-CB 3.87Å; V296-W319 HydrophobicContact CG1-CG 4.3Å; V296-W319 VanDerWaalsContact O-CB 3.3Å; V296-W319 WeakPolarHBondContact O-CB 3.34Å; V296-W319 PolarHBondContact O-N 3.38Å; L298-W319 HydrophobicContact CB-CE3 4.02Å; L298-W319 HydrophobicContact CB-CZ3 4.35Å; L298-W319 HydrophobicContact CD2-CZ3 4.29Å; A317-W319 PolarHBondContact O-N 3.45Å; W319-Q321 VanDerWaalsContact C-N 3.27Å; W319-Q321 PolarHBondContact O-N 2.92Å; W319-V322 HydrophobicContact CE3-CB 4.2Å; W319-V322 HydrophobicContact CE3-CG2 3.94Å; W319-V322 HydrophobicContact CZ3-CB 4.48Å; W319-V322 HydrophobicContact CZ3-CG1 4.34Å; W319-V322 HydrophobicContact CZ3-CG2 4.45Å; W319-V322 PolarHBondContact O-N 3.09Å; W319-K327 VanDerWaalsContact CE2-CE 3.42Å; W319-K327 HydrophobicContact CH2-CD 3.96Å; W319-K327 HydrophobicContact CH2-CG 3.66Å; W319-K327 HydrophobicContact CZ2-CD 3.68Å; W319-K327 VanDerWaalsContact CZ2-CE 3.48Å; W319-K327 HydrophobicContact CZ2-CG 3.93Å; W319-K327 HydrophobicContact CZ3-CG 4.19Å; W319-K327 WeakPolarHBondContact O-CE 3.3Å; W319-K327 PolarHBondContact O-NZ 2.73Å; W319-L330 HydrophobicContact CZ3-CD1 4.45Å
320	S	94.2	Very high	92.6	Very high	97 Å²	97	48.2 Å²	48.2	68%	0.678	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-28.9	172.6	57.4	0	0	0	0	112.9	P318	P318-S320 PolarHBondContact O-N 3.15Å; P318-S320 VanDerWaalsContact O-N 3.15Å
321	Q	94.1	Very high	92.7	Very high	121 Å²	121	54.3 Å²	54.3	57%	0.565	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-14.1	179	-62.3	-175.5	8	0	0	113.6	P318 W319 T323	P318-Q321 HydrophobicContact CB-CG 4.18Å; P318-Q321 HydrophobicContact CG-CG 4.26Å; P318-Q321 WeakPolarHBondContact O-CB 3.3Å; P318-Q321 PolarHBondContact O-N 2.94Å; W319-Q321 VanDerWaalsContact C-N 3.27Å; W319-Q321 PolarHBondContact O-N 2.92Å; Q321-T323 PolarHBondContact O-N 3.3Å
322	V	95	Very high	92.7	Very high	5 Å²	5	56.2 Å²	56.2	3%	0.03	26%	0.256	C	S	.	.	S	Bend	trans	-71	122.4	177.4	-172.8	0	0	0	0	109.6	L298 W315 P318 W319 Q326 K327	L298-V322 HydrophobicContact CB-CG2 4.08Å; L298-V322 HydrophobicContact CD2-CG1 4.17Å; L298-V322 HydrophobicContact CD2-CG2 4.01Å; W315-V322 HydrophobicContact CH2-CG2 4.07Å; P318-V322 PolarHBondContact O-N 2.85Å; W319-V322 HydrophobicContact CE3-CB 4.2Å; W319-V322 HydrophobicContact CE3-CG2 3.94Å; W319-V322 HydrophobicContact CZ3-CB 4.48Å; W319-V322 HydrophobicContact CZ3-CG1 4.34Å; W319-V322 HydrophobicContact CZ3-CG2 4.45Å; W319-V322 PolarHBondContact O-N 3.09Å; V322-Q326 HydrophobicContact CG1-CB 3.66Å; V322-K327 HydrophobicContact CB-CG 4.4Å; V322-K327 HydrophobicContact CG1-CG 3.81Å; V322-K327 WeakPolarHBondContact O-CE 3Å; V322-K327 PolarHBondContact O-NZ 3.46Å
323	T	95.3	Very high	93.2	Very high	21 Å²	21	58.9 Å²	58.9	13%	0.129	26%	0.26	C	S	.	.			trans	-68.7	158.8	-174.9	70.1	0	0	0	0	112.1	Q321 E325 Q326 K327 K376 F377	Q321-T323 PolarHBondContact O-N 3.3Å; T323-E325 PolarHBondContact O-N 2.88Å; T323-Q326 PolarHBondContact O-N 3.2Å; T323-Q326 WeakPolarHBondContact OG1-CB 3.17Å; T323-Q326 VanDerWaalsContact OG1-CG 3.32Å; T323-Q326 WeakPolarHBondContact OG1-CG 3.35Å; T323-Q326 PolarHBondContact OG1-N 2.76Å; T323-Q326 PolarHBondContact OG1-OE1 2.97Å; T323-K327 WeakPolarHBondContact O-CG 3.42Å; T323-K327 PolarHBondContact O-N 3.17Å; T323-K376 HydrophobicContact CG2-CB 3.8Å; T323-K376 HydrophobicContact CG2-CD 3.99Å; T323-K376 HydrophobicContact CG2-CG 3.85Å; T323-K376 PolarHBondContact OG1-O 2.98Å; T323-F377 HydrophobicContact CG2-CE1 3.88Å; T323-F377 HydrophobicContact CG2-CZ 3.94Å
324	R	94.7	Very high	93.6	Very high	218 Å²	218	58.6 Å²	58.6	82%	0.823	26%	0.258	S	S	*	.	H	α-helix	trans	-58.9	-36.9	174.9	-174	179	179.2	-178.2	1.1	111.1	R328	R324-R328 WeakPolarHBondContact O-CB 3.34Å; R324-R328 PolarHBondContact O-N 2.78Å
325	E	94	Very high	93.7	Very high	48 Å²	48	59.3 Å²	59.3	22%	0.224	26%	0.263	C	S	.	.	H	α-helix	trans	-62.5	-51.2	174.7	-70.9	84.5	165.2	0	0	111.6	T323 K327 R328 Y329 F377 S396	T323-E325 PolarHBondContact O-N 2.88Å; E325-K327 PolarHBondContact O-N 3Å; E325-R328 WeakPolarHBondContact O-CB 3.12Å; E325-R328 PolarHBondContact O-N 3.36Å; E325-R328 VanDerWaalsContact O-N 3.13Å; E325-Y329 HydrophobicContact CB-CE2 4.17Å; E325-Y329 WeakPolarHBondContact O-CD1 3.43Å; E325-Y329 WeakPolarHBondContact O-CD2 3.35Å; E325-Y329 PolarHBondContact O-N 2.9Å; E325-F377 HydrophobicContact CB-CD1 4.44Å; E325-F377 HydrophobicContact CG-CD1 4.23Å; E325-S396 PolarHBondContact OE1-OG 2.86Å
326	Q	95.8	Very high	93.6	Very high	3 Å²	3	62.6 Å²	62.6	1%	0.014	28%	0.28	C	S	.	.	H	α-helix	trans	-58.3	-46.6	176	-75.9	174	-41.3	0	0	111.6	L183 V322 T323 R328 Y329 L330 D375	L183-Q326 HydrophobicContact CD2-CB 4.02Å; L183-Q326 HydrophobicContact CD2-CG 4.04Å; V322-Q326 HydrophobicContact CG1-CB 3.66Å; T323-Q326 PolarHBondContact O-N 3.2Å; T323-Q326 WeakPolarHBondContact OG1-CB 3.17Å; T323-Q326 VanDerWaalsContact OG1-CG 3.32Å; T323-Q326 WeakPolarHBondContact OG1-CG 3.35Å; T323-Q326 PolarHBondContact OG1-N 2.76Å; T323-Q326 PolarHBondContact OG1-OE1 2.97Å; Q326-R328 VanDerWaalsContact C-N 3.29Å; Q326-R328 PolarHBondContact O-N 3.14Å; Q326-Y329 PolarHBondContact O-N 3.48Å; Q326-L330 WeakPolarHBondContact O-CG 3.37Å; Q326-L330 PolarHBondContact O-N 3.48Å; Q326-D375 PolarHBondContact NE2-O 3.24Å
327	K	95.2	Very high	93.7	Very high	52 Å²	52	61.4 Å²	61.4	23%	0.226	28%	0.275	C	S	.	.	H	α-helix	trans	-56	-43.3	175.2	-69.3	177.6	-177.2	175.7	0	111.6	W319 V322 T323 E325 Y329 R331	W319-K327 VanDerWaalsContact CE2-CE 3.42Å; W319-K327 HydrophobicContact CH2-CD 3.96Å; W319-K327 HydrophobicContact CH2-CG 3.66Å; W319-K327 HydrophobicContact CZ2-CD 3.68Å; W319-K327 VanDerWaalsContact CZ2-CE 3.48Å; W319-K327 HydrophobicContact CZ2-CG 3.93Å; W319-K327 HydrophobicContact CZ3-CG 4.19Å; W319-K327 WeakPolarHBondContact O-CE 3.3Å; W319-K327 PolarHBondContact O-NZ 2.73Å; V322-K327 HydrophobicContact CB-CG 4.4Å; V322-K327 HydrophobicContact CG1-CG 3.81Å; V322-K327 WeakPolarHBondContact O-CE 3Å; V322-K327 PolarHBondContact O-NZ 3.46Å; T323-K327 WeakPolarHBondContact O-CG 3.42Å; T323-K327 PolarHBondContact O-N 3.17Å; E325-K327 PolarHBondContact O-N 3Å; K327-Y329 VanDerWaalsContact C-N 3.35Å; K327-R331 WeakPolarHBondContact O-CG 3.21Å
328	R	93.9	Very high	93.7	Very high	173 Å²	173	62.8 Å²	62.8	65%	0.653	28%	0.284	S	S	*	.	H	α-helix	trans	-66	-36.7	175.8	-172.3	-179.9	-174.7	-179.7	3.3	112.1	R324 E325 Q326	R324-R328 WeakPolarHBondContact O-CB 3.34Å; R324-R328 PolarHBondContact O-N 2.78Å; E325-R328 WeakPolarHBondContact O-CB 3.12Å; E325-R328 PolarHBondContact O-N 3.36Å; E325-R328 VanDerWaalsContact O-N 3.13Å; Q326-R328 VanDerWaalsContact C-N 3.29Å; Q326-R328 PolarHBondContact O-N 3.14Å
329	Y	95.1	Very high	93.5	Very high	26 Å²	26	66 Å²	66	10%	0.102	32%	0.32	C	S	.	.	I	π-helix	trans	-72.3	-41.6	-179.4	-61.7	-21.3	0	0	0	112.6	E325 Q326 K327 R331 H332 R333 Y334 L379 N394	E325-Y329 HydrophobicContact CB-CE2 4.17Å; E325-Y329 WeakPolarHBondContact O-CD1 3.43Å; E325-Y329 WeakPolarHBondContact O-CD2 3.35Å; E325-Y329 PolarHBondContact O-N 2.9Å; Q326-Y329 PolarHBondContact O-N 3.48Å; K327-Y329 VanDerWaalsContact C-N 3.35Å; Y329-R331 PolarHBondContact O-N 3.02Å; Y329-H332 PolarHBondContact O-N 3.4Å; Y329-R333 HydrophobicContact CD1-CB 4.04Å; Y329-R333 HydrophobicContact CD1-CG 3.92Å; Y329-R333 HydrophobicContact CG-CB 4.43Å; Y329-R333 PolarHBondContact O-N 3.44Å; Y329-Y334 VanDerWaalsContact CB-CZ 3.48Å; Y329-Y334 AromaticContact CD2-CE1 3.97Å; Y329-Y334 HydrophobicContact CD2-CE1 3.97Å; Y329-Y334 HydrophobicContact CG-CE1 4.12Å; Y329-Y334 PolarHBondContact O-N 3.18Å; Y329-L379 HydrophobicContact CD2-CB 4.49Å; Y329-L379 HydrophobicContact CE2-CB 4.13Å; Y329-N394 PolarHBondContact OH-ND2 3.27Å
330	L	94.8	Very high	93.4	Very high	5 Å²	5	65.9 Å²	65.9	3%	0.026	32%	0.324	C	S	.	.	I	π-helix	trans	-53.6	-36.7	174.1	-74.6	164.4	0	0	0	112.6	L183 F187 V193 L226 L298 W319 Q326 H332 Y334	L183-L330 HydrophobicContact CD1-CD2 4.3Å; L183-L330 HydrophobicContact CD2-CD1 4.23Å; L183-L330 HydrophobicContact CD2-CD2 4.22Å; L183-L330 HydrophobicContact CD2-CG 4.25Å; L183-L330 HydrophobicContact CG-CD2 4.38Å; F187-L330 HydrophobicContact CD2-CD2 3.63Å; F187-L330 HydrophobicContact CE2-CD2 4.06Å; V193-L330 HydrophobicContact CG1-CD2 4.18Å; L226-L330 HydrophobicContact CD1-CB 4.25Å; L226-L330 HydrophobicContact CD1-CD1 4.02Å; L226-L330 HydrophobicContact CD1-CD2 4.23Å; L226-L330 HydrophobicContact CD1-CG 4.4Å; L298-L330 HydrophobicContact CD1-CD1 4.44Å; L298-L330 HydrophobicContact CD2-CD1 3.51Å; L298-L330 HydrophobicContact CD2-CD2 4.48Å; W319-L330 HydrophobicContact CZ3-CD1 4.45Å; Q326-L330 WeakPolarHBondContact O-CG 3.37Å; Q326-L330 PolarHBondContact O-N 3.48Å; L330-H332 PolarHBondContact O-N 2.94Å; L330-Y334 HydrophobicContact CD2-CD2 3.9Å; L330-Y334 HydrophobicContact CD2-CE2 3.95Å; L330-Y334 HydrophobicContact CG-CD2 4.16Å; L330-Y334 HydrophobicContact CG-CE2 3.96Å
331	R	91.6	Very high	93.5	Very high	130 Å²	130	61.5 Å²	61.5	49%	0.491	29%	0.294	S	S	.	.	I	π-helix	trans	-65.3	-34.4	-176.1	-49	-147.1	173	152.3	-7	114.6	P243 M245 K327 Y329	P243-R331 WeakPolarHBondContact CG-O 3.43Å; M245-R331 HydrophobicContact CE-CB 3.64Å; M245-R331 HydrophobicContact CE-CG 3.39Å; K327-R331 WeakPolarHBondContact O-CG 3.21Å; Y329-R331 PolarHBondContact O-N 3.02Å
332	H	86.8	Confident	93.5	Very high	78 Å²	78	59.9 Å²	59.9	36%	0.361	29%	0.286	S	S	.	.	I	π-helix	trans	-163.3	-20	-174.1	116.8	-83.5	0	0	0	115.2	Y329 L330 S335 I336	Y329-H332 PolarHBondContact O-N 3.4Å; L330-H332 PolarHBondContact O-N 2.94Å; H332-S335 PolarHBondContact O-OG 2.86Å; H332-I336 WeakPolarHBondContact CD2-CD1 3.41Å; H332-I336 VanDerWaalsContact NE2-CD1 3.25Å; H332-I336 WeakPolarHBondContact NE2-CD1 3.49Å; H332-I336 WeakPolarHBondContact O-CD1 3.45Å; H332-I336 VanDerWaalsContact O-CG1 3.27Å; H332-I336 WeakPolarHBondContact O-CG1 3.22Å
333	R	93.1	Very high	93.4	Very high	94 Å²	94	61 Å²	61	36%	0.355	29%	0.292	S	S	.	.	I	π-helix	trans	-79.4	-42.1	-174.1	-64.5	-68.2	-168.5	-172.9	-0.1	111.8	Y329 I336 Q337 L379	Y329-R333 HydrophobicContact CD1-CB 4.04Å; Y329-R333 HydrophobicContact CD1-CG 3.92Å; Y329-R333 HydrophobicContact CG-CB 4.43Å; Y329-R333 PolarHBondContact O-N 3.44Å; R333-I336 PolarHBondContact O-N 3.47Å; R333-Q337 WeakPolarHBondContact O-CG 3.26Å; R333-Q337 PolarHBondContact O-N 3.39Å; R333-L379 HydrophobicContact CB-CD2 4.06Å
334	Y	94.8	Very high	93.1	Very high	2 Å²	2	64.3 Å²	64.3	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-62.4	-48.9	179.7	-66.4	-32.1	0	0	0	110.9	L183 Q184 F187 Y329 L330 I336 Q337 C338 L379	L183-Y334 HydrophobicContact CD2-CE2 3.89Å; L183-Y334 HydrophobicContact CG-CE2 3.78Å; Q184-Y334 HydrophobicContact CB-CD1 3.72Å; Q184-Y334 HydrophobicContact CB-CE1 3.53Å; Q184-Y334 HydrophobicContact CB-CG 4.47Å; Q184-Y334 HydrophobicContact CG-CD1 3.61Å; Q184-Y334 HydrophobicContact CG-CE1 3.92Å; Q184-Y334 HydrophobicContact CG-CG 4.37Å; F187-Y334 HydrophobicContact CB-CD2 4.08Å; F187-Y334 HydrophobicContact CB-CG 4.45Å; F187-Y334 HydrophobicContact CD1-CD2 4.47Å; F187-Y334 HydrophobicContact CD1-CG 4.35Å; F187-Y334 HydrophobicContact CD2-CD2 4.11Å; F187-Y334 AromaticContact CG-CD2 3.96Å; F187-Y334 HydrophobicContact CG-CD2 3.96Å; F187-Y334 HydrophobicContact CG-CG 4.27Å; Y329-Y334 VanDerWaalsContact CB-CZ 3.48Å; Y329-Y334 AromaticContact CD2-CE1 3.97Å; Y329-Y334 HydrophobicContact CD2-CE1 3.97Å; Y329-Y334 HydrophobicContact CG-CE1 4.12Å; Y329-Y334 PolarHBondContact O-N 3.18Å; L330-Y334 HydrophobicContact CD2-CD2 3.9Å; L330-Y334 HydrophobicContact CD2-CE2 3.95Å; L330-Y334 HydrophobicContact CG-CD2 4.16Å; L330-Y334 HydrophobicContact CG-CE2 3.96Å; Y334-I336 VanDerWaalsContact C-N 3.29Å; Y334-I336 PolarHBondContact O-N 2.99Å; Y334-Q337 PolarHBondContact O-N 3.4Å; Y334-C338 PolarHBondContact O-N 3.41Å; Y334-C338 PolarHBondContact O-SG 2.87Å; Y334-L379 HydrophobicContact CD1-CD1 3.43Å; Y334-L379 VanDerWaalsContact CD1-CD1 3.43Å; Y334-L379 HydrophobicContact CE1-CD1 3.47Å; Y334-L379 VanDerWaalsContact CE1-CD1 3.47Å
335	S	92.3	Very high	92.8	Very high	25 Å²	25	57.6 Å²	57.6	18%	0.175	28%	0.281	C	S	.	.	H	α-helix	trans	-56.7	-38.3	179.5	57.7	0	0	0	0	113.7	H332 Q337	H332-S335 PolarHBondContact O-OG 2.86Å; S335-Q337 VanDerWaalsContact C-N 3.35Å
336	I	92.3	Very high	92.5	Very high	71 Å²	71	55.9 Å²	55.9	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-64	-40.5	175.3	-68.6	172.8	0	0	0	111.6	H332 R333 Y334 I340	H332-I336 WeakPolarHBondContact CD2-CD1 3.41Å; H332-I336 VanDerWaalsContact NE2-CD1 3.25Å; H332-I336 WeakPolarHBondContact NE2-CD1 3.49Å; H332-I336 WeakPolarHBondContact O-CD1 3.45Å; H332-I336 VanDerWaalsContact O-CG1 3.27Å; H332-I336 WeakPolarHBondContact O-CG1 3.22Å; R333-I336 PolarHBondContact O-N 3.47Å; Y334-I336 VanDerWaalsContact C-N 3.29Å; Y334-I336 PolarHBondContact O-N 2.99Å; I336-I340 HydrophobicContact CG2-CD1 4.33Å; I336-I340 WeakPolarHBondContact O-CD1 3.14Å; I336-I340 WeakPolarHBondContact O-CG1 3.37Å
337	Q	94.1	Very high	91.9	Very high	19 Å²	19	62 Å²	62	9%	0.089	31%	0.306	C	S	.	.	H	α-helix	trans	-80.7	-23.6	-176	-58	-49.5	-54.2	0	0	112.3	R333 Y334 S335 G339 I340 C341 C380 R381 L382	R333-Q337 WeakPolarHBondContact O-CG 3.26Å; R333-Q337 PolarHBondContact O-N 3.39Å; Y334-Q337 PolarHBondContact O-N 3.4Å; S335-Q337 VanDerWaalsContact C-N 3.35Å; Q337-G339 PolarHBondContact O-N 3.4Å; Q337-I340 PolarHBondContact O-N 3.42Å; Q337-C341 PolarHBondContact O-N 2.95Å; Q337-C380 WeakPolarHBondContact CG-O 3.46Å; Q337-R381 HydrophobicContact CG-CB 3.94Å; Q337-L382 VanDerWaalsContact OE1-N 3.07Å
338	C	91.9	Very high	91.5	Very high	38 Å²	38	66.6 Å²	66.6	26%	0.257	32%	0.323	S	S	.	.	B	Isolated β-bridge	trans	-59.1	120.1	172.7	-58.8	0	0	0	0	109.7	C188 Y334	C188-C338 WeakPolarHBondContact CA-SG 3.36Å; C188-C338 HydrophobicContact CB-CB 3.88Å; C188-C338 WeakPolarHBondContact CB-SG 3.47Å; C188-C338 WeakPolarHBondContact SG-CA 3.2Å; C188-C338 WeakPolarHBondContact SG-CB 3.3Å; C188-C338 CovalentContact SG-SG 2.05Å; C188-C338 PolarHBondContact SG-SG 3.47Å; Y334-C338 PolarHBondContact O-N 3.41Å; Y334-C338 PolarHBondContact O-SG 2.87Å
339	G	89	Confident	91.1	Very high	84 Å²	84	62.5 Å²	62.5	87%	0.866	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.1	-20.1	-176.4	0	0	0	0	0	115	Q337	Q337-G339 PolarHBondContact O-N 3.4Å
340	I	93.7	Very high	90.7	Very high	73 Å²	73	62.7 Å²	62.7	37%	0.374	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-49	172.8	-57.1	-177.8	0	0	0	110.2	I336 Q337 L382	I336-I340 HydrophobicContact CG2-CD1 4.33Å; I336-I340 WeakPolarHBondContact O-CD1 3.14Å; I336-I340 WeakPolarHBondContact O-CG1 3.37Å; Q337-I340 PolarHBondContact O-N 3.42Å; I340-L382 HydrophobicContact CG2-CB 3.75Å; I340-L382 HydrophobicContact CG2-CD2 3.86Å; I340-L382 HydrophobicContact CG2-CG 4.29Å
341	C	96	Very high	90.4	Very high	6 Å²	6	67 Å²	67	4%	0.041	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-116.5	140.5	-179	-63.4	0	0	0	0	111.3	Q337 K358 C380 L382 C389	Q337-C341 PolarHBondContact O-N 2.95Å; C341-K358 CarbonylContact C-O 3.54Å; C341-K358 WeakPolarHBondContact CA-O 3.46Å; C341-C380 VanDerWaalsContact CB-SG 3.53Å; C341-L382 PolarHBondContact SG-N 3.05Å; C341-C389 WeakPolarHBondContact CA-SG 3.37Å; C341-C389 HydrophobicContact CB-CB 3.67Å; C341-C389 WeakPolarHBondContact CB-SG 3.35Å; C341-C389 WeakPolarHBondContact SG-CB 3.44Å; C341-C389 CovalentContact SG-SG 2.03Å; C341-C389 PolarHBondContact SG-SG 3.21Å
342	Q	94	Very high	90.4	Very high	86 Å²	86	65.8 Å²	65.8	40%	0.402	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	143.4	173.6	-62.4	-176.5	-8.5	0	0	109.2	K358 T359 C360	Q342-K358 PolarHBondContact N-O 2.76Å; Q342-T359 CarbonylContact O-C 3.49Å; Q342-T359 WeakPolarHBondContact O-CA 3.18Å; Q342-C360 PolarHBondContact O-N 3.16Å
343	L	92.3	Very high	90.5	Very high	29 Å²	29	70.2 Å²	70.2	15%	0.152	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	134.1	167.4	-68.8	98.2	0	0	0	107.9	L182 Q184 D185 C380 F391	L182-L343 HydrophobicContact CD1-CD2 3.64Å; Q184-L343 HydrophobicContact CG-CD1 3.97Å; D185-L343 HydrophobicContact CB-CD1 4.5Å; D185-L343 HydrophobicContact CB-CD2 4.41Å; L343-C380 HydrophobicContact CD1-CB 4.38Å; L343-C380 HydrophobicContact CD2-CB 4.25Å; L343-C380 HydrophobicContact CG-CB 4.18Å; L343-F391 HydrophobicContact CD2-CE1 4.17Å; L343-F391 HydrophobicContact CD2-CZ 4.01Å
344	Q	90.6	Very high	90.4	Very high	90 Å²	90	67.8 Å²	67.8	42%	0.421	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	127.1	177.9	-174.3	174.2	0.7	0	0	110.1	V346 T359 C360 Y361 L362	Q344-V346 HydrophobicContact CG-CG1 4.32Å; Q344-T359 HydrophobicContact CB-CG2 3.48Å; Q344-T359 VanDerWaalsContact CB-CG2 3.48Å; Q344-C360 PolarHBondContact N-O 3.47Å; Q344-Y361 HydrophobicContact CB-CD1 4.16Å; Q344-Y361 HydrophobicContact CB-CE1 4.38Å; Q344-Y361 HydrophobicContact CG-CD1 4.45Å; Q344-Y361 CarbonylContact O-C 3.58Å; Q344-Y361 WeakPolarHBondContact O-CA 3.34Å; Q344-L362 PolarHBondContact O-N 2.83Å
345	R	87.3	Confident	90.2	Very high	78 Å²	78	75.5 Å²	75.5	29%	0.294	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	135.5	173.1	-70.4	178.6	-176.5	-97.5	-2	110.5	R180 P181 L362 I364	R180-R345 PolarHBondContact O-NH2 3.15Å; P181-R345 VanDerWaalsContact CA-NH2 3.25Å; R345-L362 CarbonylContact C-O 3.54Å; R345-L362 VanDerWaalsContact CA-O 3.27Å; R345-L362 WeakPolarHBondContact CA-O 3.5Å; R345-L362 HydrophobicContact CG-CB 4.32Å; R345-L362 HydrophobicContact CG-CD2 4.05Å; R345-I364 HydrophobicContact CB-CG1 4.43Å
346	V	87.3	Confident	90.3	Very high	12 Å²	12	77.6 Å²	77.6	7%	0.073	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	151.1	-179	-61.2	0	0	0	0	109.5	Q344 Y348 I349 H354 Y361 L362 P363 I364	Q344-V346 HydrophobicContact CG-CG1 4.32Å; V346-Y348 WeakPolarHBondContact CG2-O 3.44Å; V346-I349 HydrophobicContact CG2-CG1 3.93Å; V346-H354 WeakPolarHBondContact CG1-NE2 3.02Å; V346-Y361 HydrophobicContact CG1-CD1 3.76Å; V346-Y361 HydrophobicContact CG1-CE1 4.46Å; V346-L362 PolarHBondContact N-O 3.5Å; V346-P363 CarbonylContact O-C 3.54Å; V346-P363 VanDerWaalsContact O-CA 3.23Å; V346-P363 WeakPolarHBondContact O-CA 3.45Å; V346-I364 PolarHBondContact O-N 2.95Å
347	L	84.7	Confident	90.5	Very high	132 Å²	132	77 Å²	77	69%	0.691	39%	0.392	S	S	*	.	S	Bend	trans	-62.9	-45.5	178	-69.8	170.1	0	0	0	111.3	I364	L347-I364 HydrophobicContact CD2-CD1 4.16Å
348	Y	85.3	Confident	90.5	Very high	148 Å²	148	82.6 Å²	82.6	58%	0.58	42%	0.416	S	S	*	.	S	Bend	trans	-142.8	151.2	173.7	57	-85.7	0	0	0	109.1	V346 D350 H354	V346-Y348 WeakPolarHBondContact CG2-O 3.44Å; Y348-D350 HydrophobicContact CD2-CB 4.12Å; Y348-D350 HydrophobicContact CE2-CB 3.86Å; Y348-D350 PolarHBondContact O-N 3.49Å; Y348-H354 PolarHBondContact O-CE1 3.03Å
349	I	85.7	Confident	90.7	Very high	86 Å²	86	81 Å²	81	44%	0.441	41%	0.405	S	S	.	.			trans	-84.2	105.9	174.7	-63.1	167.4	0	0	0	108.6	V346 P363	V346-I349 HydrophobicContact CG2-CG1 3.93Å; I349-P363 HydrophobicContact CD1-CB 4.37Å; I349-P363 HydrophobicContact CD1-CG 3.96Å; I349-P363 HydrophobicContact CG1-CB 4.22Å; I349-P363 HydrophobicContact CG1-CG 4.35Å
350	D	87.9	Confident	91	Very high	30 Å²	30	77.1 Å²	77.1	16%	0.16	37%	0.365	C	S	.	.			trans	-95.5	116.8	165.4	-166	-35.6	0	0	0	112	Y348 I352 Y353 H354	Y348-D350 HydrophobicContact CD2-CB 4.12Å; Y348-D350 HydrophobicContact CE2-CB 3.86Å; Y348-D350 PolarHBondContact O-N 3.49Å; D350-I352 PolarHBondContact O-N 2.93Å; D350-I352 VanDerWaalsContact OD1-CB 3.26Å; D350-I352 WeakPolarHBondContact OD1-CB 3.3Å; D350-I352 WeakPolarHBondContact OD1-CG1 3.47Å; D350-I352 PolarHBondContact OD1-N 2.02Å; D350-Y353 HydrophobicContact CB-CD2 3.89Å; D350-Y353 PolarHBondContact O-N 3.48Å; D350-Y353 VanDerWaalsContact OD2-CD2 3.27Å; D350-Y353 WeakPolarHBondContact OD2-CD2 3.46Å; D350-Y353 WeakPolarHBondContact OD2-CE2 3.3Å; D350-H354 PolarHBondContact N-CE1 2.85Å; D350-H354 PolarHBondContact N-ND1 3.17Å; D350-H354 WeakPolarHBondContact O-CB 3.42Å; D350-H354 PolarHBondContact O-N 2.03Å; D350-H354 PolarHBondContact O-ND1 2.8Å
351	P	88.8	Confident	90.9	Very high	97 Å²	97	75.1 Å²	75.1	63%	0.63	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-18.1	176.3	-22.6	33.9	0	0	0	115.3	R355	P351-R355 WeakPolarHBondContact O-CG 3.17Å; P351-R355 PolarHBondContact O-NE 3.29Å
352	I	89.9	Confident	90.5	Very high	104 Å²	104	75 Å²	75	53%	0.533	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-47.5	177.7	-59.5	175.6	0	0	0	109.8	D350 R355	D350-I352 PolarHBondContact O-N 2.93Å; D350-I352 VanDerWaalsContact OD1-CB 3.26Å; D350-I352 WeakPolarHBondContact OD1-CB 3.3Å; D350-I352 WeakPolarHBondContact OD1-CG1 3.47Å; D350-I352 PolarHBondContact OD1-N 2.02Å; I352-R355 WeakPolarHBondContact O-CD 3.28Å; I352-R355 WeakPolarHBondContact O-CG 3.5Å; I352-R355 PolarHBondContact O-NE 3.44Å
353	Y	89.6	Confident	90	Very high	171 Å²	171	71.9 Å²	71.9	67%	0.671	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-27.8	-175.6	-58.3	-68.3	0	0	0	113.5	D350 R355	D350-Y353 HydrophobicContact CB-CD2 3.89Å; D350-Y353 PolarHBondContact O-N 3.48Å; D350-Y353 VanDerWaalsContact OD2-CD2 3.27Å; D350-Y353 WeakPolarHBondContact OD2-CD2 3.46Å; D350-Y353 WeakPolarHBondContact OD2-CE2 3.3Å; Y353-R355 PolarHBondContact O-N 2.75Å
354	H	91	Very high	89.4	Confident	43 Å²	43	74.8 Å²	74.8	20%	0.199	35%	0.354	C	S	.	.			trans	-98.6	62.1	-173.9	-57.2	113.9	0	0	0	112.2	V346 Y348 D350 Y361	V346-H354 WeakPolarHBondContact CG1-NE2 3.02Å; Y348-H354 PolarHBondContact O-CE1 3.03Å; D350-H354 PolarHBondContact N-CE1 2.85Å; D350-H354 PolarHBondContact N-ND1 3.17Å; D350-H354 WeakPolarHBondContact O-CB 3.42Å; D350-H354 PolarHBondContact O-N 2.03Å; D350-H354 PolarHBondContact O-ND1 2.8Å; H354-Y361 VanDerWaalsContact C-CE2 3.43Å; H354-Y361 HydrophobicContact CB-CD1 3.9Å; H354-Y361 HydrophobicContact CB-CD2 3.64Å; H354-Y361 HydrophobicContact CB-CE1 3.82Å; H354-Y361 HydrophobicContact CB-CE2 3.56Å; H354-Y361 HydrophobicContact CB-CG 3.77Å; H354-Y361 AromaticContact CD2-CD1 3.53Å; H354-Y361 AromaticContact CD2-CE1 3.41Å; H354-Y361 VanDerWaalsContact CD2-CE1 3.41Å; H354-Y361 WeakPolarHBondContact CD2-CE1 3.02Å; H354-Y361 AromaticContact CG-CD1 3.87Å; H354-Y361 AromaticContact CG-CE1 3.91Å; H354-Y361 VanDerWaalsContact O-CE2 3.3Å; H354-Y361 WeakPolarHBondContact O-CE2 2.93Å
355	R	91.4	Very high	88.4	Confident	163 Å²	163	71.7 Å²	71.7	62%	0.615	34%	0.342	S	S	*	.			trans	-104.2	-0.4	-174.6	-66.5	-176.8	176.7	-178	3.7	114.8	P351 I352 Y353 P357	P351-R355 WeakPolarHBondContact O-CG 3.17Å; P351-R355 PolarHBondContact O-NE 3.29Å; I352-R355 WeakPolarHBondContact O-CD 3.28Å; I352-R355 WeakPolarHBondContact O-CG 3.5Å; I352-R355 PolarHBondContact O-NE 3.44Å; Y353-R355 PolarHBondContact O-N 2.75Å; R355-P357 VanDerWaalsContact O-CD 3.3Å; R355-P357 WeakPolarHBondContact O-CD 3.32Å; R355-P357 VanDerWaalsContact O-N 3.1Å
356	N	94.3	Very high	87.1	Confident	69 Å²	69	74.6 Å²	74.6	37%	0.369	37%	0.371	S	S	.	.			trans	-63.3	115.6	-176.1	-175	-25.3	0	0	0	110.1	K358 T359 Y361	N356-K358 PolarHBondContact O-N 3.22Å; N356-K358 VanDerWaalsContact O-N 3.13Å; N356-K358 PolarHBondContact OD1-N 3.33Å; N356-T359 PolarHBondContact ND2-OG1 3.03Å; N356-T359 PolarHBondContact O-N 2.87Å; N356-T359 VanDerWaalsContact O-N 3.1Å; N356-Y361 WeakPolarHBondContact CB-OH 3.33Å; N356-Y361 PolarHBondContact N-OH 2.96Å
357	P	95.2	Very high	86.6	Confident	58 Å²	58	76.1 Å²	76.1	38%	0.377	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-17.7	-175	28.8	-36.5	0	0	0	112.8	R355 R388 C389	R355-P357 VanDerWaalsContact O-CD 3.3Å; R355-P357 WeakPolarHBondContact O-CD 3.32Å; R355-P357 VanDerWaalsContact O-N 3.1Å; P357-R388 HydrophobicContact CB-CG 3.77Å; P357-R388 CarbonylContact O-C 3.37Å; P357-R388 VanDerWaalsContact O-CA 3.29Å; P357-R388 WeakPolarHBondContact O-CA 3.44Å; P357-C389 PolarHBondContact O-N 2.86Å
358	K	95.8	Very high	86.4	Confident	138 Å²	138	74 Å²	74	60%	0.6	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	3.6	178.9	-61.7	-176.1	179.9	178.8	0	113.1	C341 Q342 N356	C341-K358 CarbonylContact C-O 3.54Å; C341-K358 WeakPolarHBondContact CA-O 3.46Å; Q342-K358 PolarHBondContact N-O 2.76Å; N356-K358 PolarHBondContact O-N 3.22Å; N356-K358 VanDerWaalsContact O-N 3.13Å; N356-K358 PolarHBondContact OD1-N 3.33Å
359	T	95.6	Very high	86.4	Confident	4 Å²	4	68.9 Å²	68.9	3%	0.025	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	128.7	-171.7	-55.7	0	0	0	0	112.1	Q342 Q344 N356 Y361	Q342-T359 CarbonylContact O-C 3.49Å; Q342-T359 WeakPolarHBondContact O-CA 3.18Å; Q344-T359 HydrophobicContact CB-CG2 3.48Å; Q344-T359 VanDerWaalsContact CB-CG2 3.48Å; N356-T359 PolarHBondContact ND2-OG1 3.03Å; N356-T359 PolarHBondContact O-N 2.87Å; N356-T359 VanDerWaalsContact O-N 3.1Å; T359-Y361 HydrophobicContact CG2-CD1 4Å; T359-Y361 HydrophobicContact CG2-CD2 4.32Å; T359-Y361 HydrophobicContact CG2-CE1 3.75Å; T359-Y361 HydrophobicContact CG2-CE2 4.09Å; T359-Y361 HydrophobicContact CG2-CG 4.32Å
360	C	95	Very high	86.3	Confident	3 Å²	3	66.6 Å²	66.6	2%	0.02	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	111.8	164.5	-63.2	0	0	0	0	109.2	Q342 Q344 C380 C389 N390 F391	Q342-C360 PolarHBondContact O-N 3.16Å; Q344-C360 PolarHBondContact N-O 3.47Å; C360-C380 HydrophobicContact CB-CB 3.66Å; C360-C380 WeakPolarHBondContact CB-SG 3.46Å; C360-C380 VanDerWaalsContact SG-CA 3.57Å; C360-C380 WeakPolarHBondContact SG-CB 3.07Å; C360-C380 CovalentContact SG-SG 2.02Å; C360-C380 PolarHBondContact SG-SG 3.16Å; C360-C389 VanDerWaalsContact SG-C 3.53Å; C360-N390 PolarHBondContact SG-N 3.44Å; C360-F391 HydrophobicContact CB-CD2 3.95Å; C360-F391 HydrophobicContact CB-CE2 3.56Å; C360-F391 HydrophobicContact CB-CZ 3.88Å
361	Y	91.7	Very high	86.2	Confident	31 Å²	31	66.5 Å²	66.5	12%	0.122	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	133.4	178	-61	-82.4	0	0	0	111.1	Q344 V346 H354 N356 T359 F391	Q344-Y361 HydrophobicContact CB-CD1 4.16Å; Q344-Y361 HydrophobicContact CB-CE1 4.38Å; Q344-Y361 HydrophobicContact CG-CD1 4.45Å; Q344-Y361 CarbonylContact O-C 3.58Å; Q344-Y361 WeakPolarHBondContact O-CA 3.34Å; V346-Y361 HydrophobicContact CG1-CD1 3.76Å; V346-Y361 HydrophobicContact CG1-CE1 4.46Å; H354-Y361 VanDerWaalsContact C-CE2 3.43Å; H354-Y361 HydrophobicContact CB-CD1 3.9Å; H354-Y361 HydrophobicContact CB-CD2 3.64Å; H354-Y361 HydrophobicContact CB-CE1 3.82Å; H354-Y361 HydrophobicContact CB-CE2 3.56Å; H354-Y361 HydrophobicContact CB-CG 3.77Å; H354-Y361 AromaticContact CD2-CD1 3.53Å; H354-Y361 AromaticContact CD2-CE1 3.41Å; H354-Y361 VanDerWaalsContact CD2-CE1 3.41Å; H354-Y361 WeakPolarHBondContact CD2-CE1 3.02Å; H354-Y361 AromaticContact CG-CD1 3.87Å; H354-Y361 AromaticContact CG-CE1 3.91Å; H354-Y361 VanDerWaalsContact O-CE2 3.3Å; H354-Y361 WeakPolarHBondContact O-CE2 2.93Å; N356-Y361 WeakPolarHBondContact CB-OH 3.33Å; N356-Y361 PolarHBondContact N-OH 2.96Å; T359-Y361 HydrophobicContact CG2-CD1 4Å; T359-Y361 HydrophobicContact CG2-CD2 4.32Å; T359-Y361 HydrophobicContact CG2-CE1 3.75Å; T359-Y361 HydrophobicContact CG2-CE2 4.09Å; T359-Y361 HydrophobicContact CG2-CG 4.32Å; Y361-F391 WeakPolarHBondContact O-CE2 3.29Å
362	L	88	Confident	86.2	Confident	3 Å²	3	65.3 Å²	65.3	2%	0.016	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	112	179.6	-172.9	69.6	0	0	0	108.1	L182 Q344 R345 V346 M371 F391	L182-L362 HydrophobicContact CD1-CD1 4.09Å; L182-L362 HydrophobicContact CD1-CD2 3.65Å; L182-L362 HydrophobicContact CD1-CG 4.49Å; L182-L362 HydrophobicContact CD2-CD2 4.41Å; L182-L362 HydrophobicContact CG-CD2 3.84Å; Q344-L362 PolarHBondContact O-N 2.83Å; R345-L362 CarbonylContact C-O 3.54Å; R345-L362 VanDerWaalsContact CA-O 3.27Å; R345-L362 WeakPolarHBondContact CA-O 3.5Å; R345-L362 HydrophobicContact CG-CB 4.32Å; R345-L362 HydrophobicContact CG-CD2 4.05Å; V346-L362 PolarHBondContact N-O 3.5Å; L362-M371 HydrophobicContact CD1-CE 3.38Å; L362-M371 HydrophobicContact CD1-SD 3.69Å; L362-M371 HydrophobicContact CD2-SD 3.87Å; L362-M371 HydrophobicContact CG-CE 4.02Å; L362-M371 HydrophobicContact CG-SD 3.8Å; L362-F391 HydrophobicContact CD1-CE2 4.43Å; L362-F391 HydrophobicContact CD1-CZ 4.23Å
363	P	82.9	Confident	86.4	Confident	21 Å²	21	60.3 Å²	60.3	14%	0.136	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	143.3	174.7	29.1	-27.8	0	0	0	108.2	V346 I349 S365	V346-P363 CarbonylContact O-C 3.54Å; V346-P363 VanDerWaalsContact O-CA 3.23Å; V346-P363 WeakPolarHBondContact O-CA 3.45Å; I349-P363 HydrophobicContact CD1-CB 4.37Å; I349-P363 HydrophobicContact CD1-CG 3.96Å; I349-P363 HydrophobicContact CG1-CB 4.22Å; I349-P363 HydrophobicContact CG1-CG 4.35Å; P363-S365 PolarHBondContact O-N 3.36Å
364	I	79.1	Confident	86.5	Confident	90 Å²	90	53.4 Å²	53.4	46%	0.462	28%	0.278	S	S	.	.			trans	-69.8	81.3	162.7	-60.9	179.2	0	0	0	104.9	R345 V346 L347	R345-I364 HydrophobicContact CB-CG1 4.43Å; V346-I364 PolarHBondContact O-N 2.95Å; L347-I364 HydrophobicContact CD2-CD1 4.16Å
365	S	69.1	Low	86.6	Confident	24 Å²	24	52 Å²	52	17%	0.168	27%	0.272	C	S	.	.			trans	-71.6	132	-173.5	-171.6	0	0	0	0	108.8	P363 N367 E370	P363-S365 PolarHBondContact O-N 3.36Å; S365-N367 PolarHBondContact O-N 3.42Å; S365-N367 PolarHBondContact OG-N 2.73Å; S365-E370 WeakPolarHBondContact CB-OE2 3.16Å; S365-E370 PolarHBondContact OG-OE2 2.69Å
366	P	60.4	Low	86.7	Confident	139 Å²	139	47.2 Å²	47.2	90%	0.903	26%	0.256	S	S	*	.	S	Bend	trans	-64.6	-19.2	167.1	28.2	-33.2	0	0	0	111	S368	P366-S368 PolarHBondContact O-N 3.41Å
367	N	77.7	Confident	86.7	Confident	45 Å²	45	45.6 Å²	45.6	24%	0.241	25%	0.245	C	C	.	.			trans	-85.4	97.8	176.6	-170.8	-15	0	0	0	110.9	S365 N369 E370	S365-N367 PolarHBondContact O-N 3.42Å; S365-N367 PolarHBondContact OG-N 2.73Å; N367-N369 PolarHBondContact O-N 2.04Å; N367-N369 VanDerWaalsContact O-N 3.14Å; N367-N369 VanDerWaalsContact OD1-CB 3.28Å; N367-N369 WeakPolarHBondContact OD1-CB 3.27Å; N367-N369 PolarHBondContact OD1-N 3.28Å; N367-E370 HydrophobicContact CB-CB 4.21Å; N367-E370 PolarHBondContact O-N 2.79Å; N367-E370 VanDerWaalsContact O-N 3.17Å; N367-E370 PolarHBondContact OD1-N 3.36Å
368	S	79.7	Confident	86.7	Confident	86 Å²	86	43 Å²	43	60%	0.601	23%	0.229	S	C	*	.	H	α-helix	trans	-55.1	-30.5	175.4	56.1	0	0	0	0	113.2	P366 M371 M372	P366-S368 PolarHBondContact O-N 3.41Å; S368-M371 PolarHBondContact O-N 2.91Å; S368-M372 PolarHBondContact O-N 3.33Å
369	N	84.9	Confident	86.6	Confident	42 Å²	42	36.7 Å²	36.7	23%	0.225	20%	0.201	C	C	.	.	H	α-helix	trans	-73.4	-35.3	-177.5	-58.6	-24.1	0	0	0	112	N367 M371 M372 C373 S404	N367-N369 PolarHBondContact O-N 2.04Å; N367-N369 VanDerWaalsContact O-N 3.14Å; N367-N369 VanDerWaalsContact OD1-CB 3.28Å; N367-N369 WeakPolarHBondContact OD1-CB 3.27Å; N367-N369 PolarHBondContact OD1-N 3.28Å; N369-M371 VanDerWaalsContact C-N 3.33Å; N369-M371 PolarHBondContact O-N 2.92Å; N369-M372 PolarHBondContact O-N 2.95Å; N369-C373 WeakPolarHBondContact O-CB 3.17Å; N369-C373 PolarHBondContact O-N 2.93Å; N369-C373 PolarHBondContact O-SG 3.47Å; N369-S404 VanDerWaalsContact CB-CB 3.46Å; N369-S404 PolarHBondContact ND2-O 3.15Å
370	E	85.4	Confident	86.7	Confident	37 Å²	37	36.5 Å²	36.5	17%	0.173	20%	0.2	C	C	.	.	H	α-helix	trans	-60.6	-46.3	174.6	-168.1	-158.8	154.8	0	0	110.4	S365 N367 M372 C373 R374	S365-E370 WeakPolarHBondContact CB-OE2 3.16Å; S365-E370 PolarHBondContact OG-OE2 2.69Å; N367-E370 HydrophobicContact CB-CB 4.21Å; N367-E370 PolarHBondContact O-N 2.79Å; N367-E370 VanDerWaalsContact O-N 3.17Å; N367-E370 PolarHBondContact OD1-N 3.36Å; E370-M372 PolarHBondContact O-N 3.03Å; E370-C373 PolarHBondContact O-N 2.85Å; E370-R374 VanDerWaalsContact O-CB 3.32Å; E370-R374 WeakPolarHBondContact O-CB 3.45Å; E370-R374 PolarHBondContact O-N 3.4Å; E370-R374 IonicContact OE1-CZ 3.67Å; E370-R374 IonicContact OE1-NE 3.95Å; E370-R374 IonicContact OE1-NH2 2.94Å; E370-R374 PolarHBondContact OE1-NH2 3.46Å
371	M	85.5	Confident	86.8	Confident	29 Å²	29	41.1 Å²	41.1	14%	0.143	22%	0.217	C	C	.	.	H	α-helix	trans	-61.6	-43.3	175.7	-71	-62.4	94.5	0	0	112	L362 S368 N369 R374 D375	L362-M371 HydrophobicContact CD1-CE 3.38Å; L362-M371 HydrophobicContact CD1-SD 3.69Å; L362-M371 HydrophobicContact CD2-SD 3.87Å; L362-M371 HydrophobicContact CG-CE 4.02Å; L362-M371 HydrophobicContact CG-SD 3.8Å; S368-M371 PolarHBondContact O-N 2.91Å; N369-M371 VanDerWaalsContact C-N 3.33Å; N369-M371 PolarHBondContact O-N 2.92Å; M371-R374 PolarHBondContact O-N 2.93Å; M371-D375 WeakPolarHBondContact O-CB 3.41Å; M371-D375 PolarHBondContact O-N 3.23Å
372	M	89	Confident	87	Confident	71 Å²	71	42.2 Å²	42.2	35%	0.35	23%	0.225	S	C	.	.	H	α-helix	trans	-60.2	-48	175.6	-179.3	-164.4	59.4	0	0	111.7	S368 N369 E370 R374 D375 K376	S368-M372 PolarHBondContact O-N 3.33Å; N369-M372 PolarHBondContact O-N 2.95Å; E370-M372 PolarHBondContact O-N 3.03Å; M372-R374 VanDerWaalsContact C-N 3.3Å; M372-R374 PolarHBondContact O-N 3.39Å; M372-D375 PolarHBondContact O-N 3.12Å; M372-K376 HydrophobicContact CG-CD 3.99Å; M372-K376 WeakPolarHBondContact O-CB 3.34Å; M372-K376 WeakPolarHBondContact O-CG 3.25Å; M372-K376 PolarHBondContact O-N 3.3Å
373	C	92.3	Very high	87.4	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.5	-39.3	179.7	-69.9	0	0	0	0	111.5	N369 E370 K376 F377 Y397 C400 S404	N369-C373 WeakPolarHBondContact O-CB 3.17Å; N369-C373 PolarHBondContact O-N 2.93Å; N369-C373 PolarHBondContact O-SG 3.47Å; E370-C373 PolarHBondContact O-N 2.85Å; C373-K376 PolarHBondContact O-N 3.13Å; C373-F377 WeakPolarHBondContact O-CB 3.42Å; C373-F377 PolarHBondContact O-N 3.44Å; C373-Y397 HydrophobicContact CB-CD2 4.29Å; C373-Y397 HydrophobicContact CB-CE2 4.16Å; C373-C400 WeakPolarHBondContact CA-SG 3.45Å; C373-C400 HydrophobicContact CB-CB 3.74Å; C373-C400 WeakPolarHBondContact CB-SG 3.39Å; C373-C400 WeakPolarHBondContact SG-CB 3.28Å; C373-C400 PolarHBondContact SG-O 3.04Å; C373-C400 VanDerWaalsContact SG-O 3.36Å; C373-C400 CovalentContact SG-SG 2.04Å; C373-C400 PolarHBondContact SG-SG 3.48Å; C373-S404 PolarHBondContact SG-OG 3.11Å; C373-S404 VanDerWaalsContact SG-OG 3.41Å
374	R	92.5	Very high	87.9	Confident	26 Å²	26	55.5 Å²	55.5	10%	0.098	28%	0.275	C	S	.	.	H	α-helix	trans	-66.2	-44.9	177.7	-160.7	174.8	-70.7	-137.1	7	111.8	E370 M371 M372 K376 S378 F391 Y397	E370-R374 VanDerWaalsContact O-CB 3.32Å; E370-R374 WeakPolarHBondContact O-CB 3.45Å; E370-R374 PolarHBondContact O-N 3.4Å; E370-R374 IonicContact OE1-CZ 3.67Å; E370-R374 IonicContact OE1-NE 3.95Å; E370-R374 IonicContact OE1-NH2 2.94Å; E370-R374 PolarHBondContact OE1-NH2 3.46Å; M371-R374 PolarHBondContact O-N 2.93Å; M372-R374 VanDerWaalsContact C-N 3.3Å; M372-R374 PolarHBondContact O-N 3.39Å; R374-K376 VanDerWaalsContact C-N 3.29Å; R374-K376 PolarHBondContact O-N 3.23Å; R374-S378 WeakPolarHBondContact O-CA 3.32Å; R374-S378 VanDerWaalsContact O-CB 3.28Å; R374-S378 WeakPolarHBondContact O-CB 3.04Å; R374-S378 PolarHBondContact O-N 3.3Å; R374-F391 HydrophobicContact CG-CD1 4.2Å; R374-F391 HydrophobicContact CG-CE1 4.15Å; R374-F391 VanDerWaalsContact NH1-CE2 3.33Å; R374-Y397 HydrophobicContact CB-CE2 3.94Å; R374-Y397 HydrophobicContact CG-CE2 4.27Å
375	D	92.8	Very high	88.6	Confident	14 Å²	14	63.1 Å²	63.1	8%	0.075	30%	0.298	C	S	.	.	H	α-helix	trans	-59.1	-40	175.1	-172.6	47.4	0	0	0	112.6	L182 L183 W315 Q326 M371 M372	L182-D375 WeakPolarHBondContact CA-OD1 3.44Å; L182-D375 HydrophobicContact CD2-CB 3.7Å; L183-D375 PolarHBondContact N-OD1 2.82Å; W315-D375 PolarHBondContact NE1-OD1 3.29Å; W315-D375 PolarHBondContact NE1-OD2 3.09Å; Q326-D375 PolarHBondContact NE2-O 3.24Å; M371-D375 WeakPolarHBondContact O-CB 3.41Å; M371-D375 PolarHBondContact O-N 3.23Å; M372-D375 PolarHBondContact O-N 3.12Å
376	K	93.6	Very high	89.9	Confident	61 Å²	61	65.5 Å²	65.5	27%	0.265	31%	0.311	S	S	.	.	H	α-helix	trans	-82	-33.7	-175.1	-75.4	-177.7	177.8	175	0	114.7	T323 M372 C373 R374	T323-K376 HydrophobicContact CG2-CB 3.8Å; T323-K376 HydrophobicContact CG2-CD 3.99Å; T323-K376 HydrophobicContact CG2-CG 3.85Å; T323-K376 PolarHBondContact OG1-O 2.98Å; M372-K376 HydrophobicContact CG-CD 3.99Å; M372-K376 WeakPolarHBondContact O-CB 3.34Å; M372-K376 WeakPolarHBondContact O-CG 3.25Å; M372-K376 PolarHBondContact O-N 3.3Å; C373-K376 PolarHBondContact O-N 3.13Å; R374-K376 VanDerWaalsContact C-N 3.29Å; R374-K376 PolarHBondContact O-N 3.23Å
377	F	94.6	Very high	91.6	Very high	35 Å²	35	64.3 Å²	64.3	15%	0.154	30%	0.297	C	S	.	.	H	α-helix	trans	-134	-8.6	-164.4	-56.9	-65.4	0	0	0	115.3	T323 E325 C373 N394 C400	T323-F377 HydrophobicContact CG2-CE1 3.88Å; T323-F377 HydrophobicContact CG2-CZ 3.94Å; E325-F377 HydrophobicContact CB-CD1 4.44Å; E325-F377 HydrophobicContact CG-CD1 4.23Å; C373-F377 WeakPolarHBondContact O-CB 3.42Å; C373-F377 PolarHBondContact O-N 3.44Å; F377-N394 PolarHBondContact O-ND2 2.8Å; F377-C400 HydrophobicContact CD2-CB 3.67Å; F377-C400 HydrophobicContact CE2-CB 3.74Å
378	S	94.4	Very high	92.5	Very high	4 Å²	4	68.5 Å²	68.5	3%	0.028	31%	0.31	C	S	.	.			trans	-103.9	157.6	178	-160.6	0	0	0	0	111.6	R374 F391 I392 N393	R374-S378 WeakPolarHBondContact O-CA 3.32Å; R374-S378 VanDerWaalsContact O-CB 3.28Å; R374-S378 WeakPolarHBondContact O-CB 3.04Å; R374-S378 PolarHBondContact O-N 3.3Å; S378-F391 WeakPolarHBondContact OG-CB 3.41Å; S378-F391 WeakPolarHBondContact OG-CD1 3.39Å; S378-I392 PolarHBondContact OG-O 3.4Å; S378-I392 VanDerWaalsContact OG-O 3.12Å; S378-N393 PolarHBondContact OG-OD1 2.96Å
379	L	95.3	Very high	93.3	Very high	5 Å²	5	64.5 Å²	64.5	3%	0.026	28%	0.282	C	S	.	.			trans	-140.1	124.1	177.3	176.7	73.7	0	0	0	107.9	Y329 R333 Y334 R381 F391 I392	Y329-L379 HydrophobicContact CD2-CB 4.49Å; Y329-L379 HydrophobicContact CE2-CB 4.13Å; R333-L379 HydrophobicContact CB-CD2 4.06Å; Y334-L379 HydrophobicContact CD1-CD1 3.43Å; Y334-L379 VanDerWaalsContact CD1-CD1 3.43Å; Y334-L379 HydrophobicContact CE1-CD1 3.47Å; Y334-L379 VanDerWaalsContact CE1-CD1 3.47Å; L379-R381 HydrophobicContact CD2-CB 4.41Å; L379-R381 PolarHBondContact O-N 2.88Å; L379-F391 WeakPolarHBondContact O-CA 3.42Å; L379-I392 HydrophobicContact CB-CD1 4.24Å; L379-I392 HydrophobicContact CD2-CD1 4.2Å; L379-I392 PolarHBondContact O-N 3.22Å
380	C	96.7	Very high	93.8	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	116.5	166.7	173.2	0	0	0	0	108.8	Q184 Q337 C341 L343 C360 F391	Q184-C380 PolarHBondContact NE2-O 3.23Å; Q337-C380 WeakPolarHBondContact CG-O 3.46Å; C341-C380 VanDerWaalsContact CB-SG 3.53Å; L343-C380 HydrophobicContact CD1-CB 4.38Å; L343-C380 HydrophobicContact CD2-CB 4.25Å; L343-C380 HydrophobicContact CG-CB 4.18Å; C360-C380 HydrophobicContact CB-CB 3.66Å; C360-C380 WeakPolarHBondContact CB-SG 3.46Å; C360-C380 VanDerWaalsContact SG-CA 3.57Å; C360-C380 WeakPolarHBondContact SG-CB 3.07Å; C360-C380 CovalentContact SG-SG 2.02Å; C360-C380 PolarHBondContact SG-SG 3.16Å; C380-F391 HydrophobicContact CB-CD1 4.11Å; C380-F391 HydrophobicContact CB-CE1 3.88Å; C380-F391 HydrophobicContact CB-CZ 4.37Å
381	R	96.3	Very high	94.3	Very high	101 Å²	101	65.2 Å²	65.2	38%	0.381	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	160.6	176.4	72.9	160.6	176.6	-161	-1.9	112.9	Q337 L379 Q383 C389 N390 I392	Q337-R381 HydrophobicContact CG-CB 3.94Å; L379-R381 HydrophobicContact CD2-CB 4.41Å; L379-R381 PolarHBondContact O-N 2.88Å; R381-Q383 PolarHBondContact O-N 3.42Å; R381-C389 WeakPolarHBondContact O-CA 3.43Å; R381-N390 PolarHBondContact N-O 3.02Å; R381-N390 PolarHBondContact O-N 3.24Å; R381-I392 HydrophobicContact CG-CD1 3.61Å; R381-I392 HydrophobicContact CG-CG1 3.65Å; R381-I392 VanDerWaalsContact NE-CG1 3.35Å
382	L	96.8	Very high	94.6	Very high	54 Å²	54	65.7 Å²	65.7	28%	0.283	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	118.8	169.3	-174.4	66.6	0	0	0	110.2	Q337 I340 C341	Q337-L382 VanDerWaalsContact OE1-N 3.07Å; I340-L382 HydrophobicContact CG2-CB 3.75Å; I340-L382 HydrophobicContact CG2-CD2 3.86Å; I340-L382 HydrophobicContact CG2-CG 4.29Å; C341-L382 PolarHBondContact SG-N 3.05Å
383	Q	96	Very high	94.6	Very high	61 Å²	61	65.3 Å²	65.3	29%	0.285	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	111.5	170.5	-67.7	-175.7	-6.7	0	0	109.1	R381 R385 T386 N387 R388 N390	R381-Q383 PolarHBondContact O-N 3.42Å; Q383-R385 PolarHBondContact O-N 3.25Å; Q383-R385 VanDerWaalsContact O-N 3.16Å; Q383-T386 WeakPolarHBondContact CB-OG1 3.46Å; Q383-T386 PolarHBondContact O-N 3.47Å; Q383-N387 WeakPolarHBondContact O-CA 3.47Å; Q383-N387 PolarHBondContact O-N 3.33Å; Q383-R388 WeakPolarHBondContact CB-O 3.49Å; Q383-R388 PolarHBondContact N-O 3.02Å; Q383-N390 HydrophobicContact CG-CB 4.13Å; Q383-N390 VanDerWaalsContact NE2-CB 3.35Å; Q383-N390 PolarHBondContact OE1-ND2 3.44Å
384	R	93.6	Very high	94.4	Very high	242 Å²	242	67.1 Å²	67.1	91%	0.913	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-34.3	-177.9	-67.9	-175.1	178.4	174.8	-2.8	113.7
385	R	94.6	Very high	94.5	Very high	249 Å²	249	74 Å²	74	94%	0.94	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-38.9	-178.1	-68.7	-174	178.8	177.9	-2.3	113.3	Q383	Q383-R385 PolarHBondContact O-N 3.25Å; Q383-R385 VanDerWaalsContact O-N 3.16Å
386	T	95.3	Very high	94.6	Very high	74 Å²	74	75.1 Å²	75.1	45%	0.454	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-9.5	-176.2	52.9	0	0	0	0	112.5	Q383 R388	Q383-T386 WeakPolarHBondContact CB-OG1 3.46Å; Q383-T386 PolarHBondContact O-N 3.47Å; T386-R388 WeakPolarHBondContact O-CG 3.46Å; T386-R388 PolarHBondContact O-N 3.4Å; T386-R388 PolarHBondContact OG1-N 3.32Å
387	N	96	Very high	94.5	Very high	114 Å²	114	72.2 Å²	72.2	61%	0.61	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	34.5	-167.4	-160.6	30.9	0	0	0	112.7	Q383	Q383-N387 WeakPolarHBondContact O-CA 3.47Å; Q383-N387 PolarHBondContact O-N 3.33Å
388	R	96.7	Very high	94.4	Very high	134 Å²	134	78.4 Å²	78.4	51%	0.506	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	141.4	179.5	-66.6	-172.2	178	-174.8	-1	112	P357 Q383 T386 N390	P357-R388 HydrophobicContact CB-CG 3.77Å; P357-R388 CarbonylContact O-C 3.37Å; P357-R388 VanDerWaalsContact O-CA 3.29Å; P357-R388 WeakPolarHBondContact O-CA 3.44Å; Q383-R388 WeakPolarHBondContact CB-O 3.49Å; Q383-R388 PolarHBondContact N-O 3.02Å; T386-R388 WeakPolarHBondContact O-CG 3.46Å; T386-R388 PolarHBondContact O-N 3.4Å; T386-R388 PolarHBondContact OG1-N 3.32Å; R388-N390 PolarHBondContact O-N 2.93Å
389	C	97.2	Very high	94.4	Very high	1 Å²	1	82.1 Å²	82.1	1%	0.007	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	120.2	170	-70.6	0	0	0	0	109.4	C341 P357 C360 R381	C341-C389 WeakPolarHBondContact CA-SG 3.37Å; C341-C389 HydrophobicContact CB-CB 3.67Å; C341-C389 WeakPolarHBondContact CB-SG 3.35Å; C341-C389 WeakPolarHBondContact SG-CB 3.44Å; C341-C389 CovalentContact SG-SG 2.03Å; C341-C389 PolarHBondContact SG-SG 3.21Å; P357-C389 PolarHBondContact O-N 2.86Å; C360-C389 VanDerWaalsContact SG-C 3.53Å; R381-C389 WeakPolarHBondContact O-CA 3.43Å
390	N	95.8	Very high	94.3	Very high	66 Å²	66	82.7 Å²	82.7	35%	0.353	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	152.8	-179.7	-80.6	-31.4	0	0	0	109.8	C360 R381 Q383 R388	C360-N390 PolarHBondContact SG-N 3.44Å; R381-N390 PolarHBondContact N-O 3.02Å; R381-N390 PolarHBondContact O-N 3.24Å; Q383-N390 HydrophobicContact CG-CB 4.13Å; Q383-N390 VanDerWaalsContact NE2-CB 3.35Å; Q383-N390 PolarHBondContact OE1-ND2 3.44Å; R388-N390 PolarHBondContact O-N 2.93Å
391	F	94.8	Very high	93.9	Very high	29 Å²	29	85.9 Å²	85.9	13%	0.127	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	134.5	169.5	-75.7	-71.9	0	0	0	110.9	L182 L343 C360 Y361 L362 R374 S378 L379 C380	L182-F391 HydrophobicContact CD1-CE1 4.12Å; L182-F391 HydrophobicContact CD1-CZ 4.1Å; L343-F391 HydrophobicContact CD2-CE1 4.17Å; L343-F391 HydrophobicContact CD2-CZ 4.01Å; C360-F391 HydrophobicContact CB-CD2 3.95Å; C360-F391 HydrophobicContact CB-CE2 3.56Å; C360-F391 HydrophobicContact CB-CZ 3.88Å; Y361-F391 WeakPolarHBondContact O-CE2 3.29Å; L362-F391 HydrophobicContact CD1-CE2 4.43Å; L362-F391 HydrophobicContact CD1-CZ 4.23Å; R374-F391 HydrophobicContact CG-CD1 4.2Å; R374-F391 HydrophobicContact CG-CE1 4.15Å; R374-F391 VanDerWaalsContact NH1-CE2 3.33Å; S378-F391 WeakPolarHBondContact OG-CB 3.41Å; S378-F391 WeakPolarHBondContact OG-CD1 3.39Å; L379-F391 WeakPolarHBondContact O-CA 3.42Å; C380-F391 HydrophobicContact CB-CD1 4.11Å; C380-F391 HydrophobicContact CB-CE1 3.88Å; C380-F391 HydrophobicContact CB-CZ 4.37Å
392	I	93	Very high	93.6	Very high	38 Å²	38	84.4 Å²	84.4	20%	0.195	39%	0.387	C	S	.	.			trans	-89.9	112.9	170.2	-46.8	163.6	0	0	0	108.8	S378 L379 R381 N394	S378-I392 PolarHBondContact OG-O 3.4Å; S378-I392 VanDerWaalsContact OG-O 3.12Å; L379-I392 HydrophobicContact CB-CD1 4.24Å; L379-I392 HydrophobicContact CD2-CD1 4.2Å; L379-I392 PolarHBondContact O-N 3.22Å; R381-I392 HydrophobicContact CG-CD1 3.61Å; R381-I392 HydrophobicContact CG-CG1 3.65Å; R381-I392 VanDerWaalsContact NE-CG1 3.35Å; I392-N394 PolarHBondContact O-N 2.92Å
393	N	88.4	Confident	93.2	Very high	64 Å²	64	89.5 Å²	89.5	34%	0.342	40%	0.402	S	S	.	.			trans	-93.6	88.8	173.6	-64.7	-5.7	0	0	0	108.7	S378 Y397	S378-N393 PolarHBondContact OG-OD1 2.96Å; N393-Y397 HydrophobicContact CB-CD1 3.56Å; N393-Y397 HydrophobicContact CB-CE1 4.03Å; N393-Y397 HydrophobicContact CB-CG 4.2Å
394	N	89.3	Confident	92.6	Very high	38 Å²	38	87.4 Å²	87.4	20%	0.203	39%	0.394	C	S	.	.			trans	-72.8	176.1	177.2	67.3	27.4	0	0	0	111.5	Y329 F377 I392 S396 Y397 R398	Y329-N394 PolarHBondContact OH-ND2 3.27Å; F377-N394 PolarHBondContact O-ND2 2.8Å; I392-N394 PolarHBondContact O-N 2.92Å; N394-S396 VanDerWaalsContact C-N 3.28Å; N394-S396 PolarHBondContact O-N 3.22Å; N394-S396 WeakPolarHBondContact OD1-CA 3.43Å; N394-S396 WeakPolarHBondContact OD1-CB 3.49Å; N394-S396 PolarHBondContact OD1-N 3.33Å; N394-Y397 PolarHBondContact O-N 2.99Å; N394-Y397 PolarHBondContact OD1-N 3.44Å; N394-R398 PolarHBondContact O-N 3.03Å; N394-R398 VanDerWaalsContact O-N 3.09Å
395	K	94	Very high	91.9	Very high	169 Å²	169	79.4 Å²	79.4	74%	0.735	37%	0.372	S	S	*	.	H	α-helix	trans	-56.5	-41.5	177.2	-175.3	176.6	177.7	177.1	0	111.9	Y397 R398 I399	K395-Y397 PolarHBondContact O-N 3.3Å; K395-R398 PolarHBondContact O-N 3.09Å; K395-I399 HydrophobicContact CG-CD1 3.85Å; K395-I399 HydrophobicContact CG-CG1 4.44Å; K395-I399 VanDerWaalsContact O-CG1 3.26Å; K395-I399 WeakPolarHBondContact O-CG1 3.46Å; K395-I399 PolarHBondContact O-N 3.34Å
396	S	93.6	Very high	91	Very high	39 Å²	39	75 Å²	75	27%	0.273	36%	0.36	S	S	.	.	H	α-helix	trans	-61.2	-42.5	178.2	-50.3	0	0	0	0	112.1	E325 N394 I399 C400	E325-S396 PolarHBondContact OE1-OG 2.86Å; N394-S396 VanDerWaalsContact C-N 3.28Å; N394-S396 PolarHBondContact O-N 3.22Å; N394-S396 WeakPolarHBondContact OD1-CA 3.43Å; N394-S396 WeakPolarHBondContact OD1-CB 3.49Å; N394-S396 PolarHBondContact OD1-N 3.33Å; S396-I399 PolarHBondContact O-N 3.22Å; S396-C400 WeakPolarHBondContact O-CB 3.44Å; S396-C400 PolarHBondContact O-N 3.35Å
397	Y	93.3	Very high	89.5	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-61.2	-50.4	175.5	175.8	-85.6	0	0	0	111	C373 R374 N393 N394 K395 I399 C400 E401	C373-Y397 HydrophobicContact CB-CD2 4.29Å; C373-Y397 HydrophobicContact CB-CE2 4.16Å; R374-Y397 HydrophobicContact CB-CE2 3.94Å; R374-Y397 HydrophobicContact CG-CE2 4.27Å; N393-Y397 HydrophobicContact CB-CD1 3.56Å; N393-Y397 HydrophobicContact CB-CE1 4.03Å; N393-Y397 HydrophobicContact CB-CG 4.2Å; N394-Y397 PolarHBondContact O-N 2.99Å; N394-Y397 PolarHBondContact OD1-N 3.44Å; K395-Y397 PolarHBondContact O-N 3.3Å; Y397-I399 VanDerWaalsContact C-N 3.31Å; Y397-I399 PolarHBondContact O-N 3.37Å; Y397-C400 WeakPolarHBondContact O-CB 3.17Å; Y397-C400 PolarHBondContact O-N 3.11Å; Y397-C400 VanDerWaalsContact O-N 3.11Å; Y397-E401 HydrophobicContact CE1-CB 4.34Å; Y397-E401 WeakPolarHBondContact CE1-OE1 3.39Å; Y397-E401 WeakPolarHBondContact CE1-OE2 3.32Å; Y397-E401 WeakPolarHBondContact O-CB 3.43Å; Y397-E401 PolarHBondContact O-N 2.77Å; Y397-E401 PolarHBondContact OH-OE1 2.9Å
398	R	92.7	Very high	87.4	Confident	165 Å²	165	80 Å²	80	62%	0.623	38%	0.378	S	S	*	.	H	α-helix	trans	-60.6	-41.5	-179.9	-66.3	-178.2	-170.7	-174.5	-2.2	111.9	N394 K395 E401 T402	N394-R398 PolarHBondContact O-N 3.03Å; N394-R398 VanDerWaalsContact O-N 3.09Å; K395-R398 PolarHBondContact O-N 3.09Å; R398-E401 PolarHBondContact O-N 3.02Å; R398-T402 PolarHBondContact O-N 3.13Å; R398-T402 PolarHBondContact O-OG1 3.13Å
399	I	93.4	Very high	87	Confident	82 Å²	82	77.3 Å²	77.3	42%	0.421	37%	0.371	S	S	.	.	H	α-helix	trans	-61	-50.9	173.8	-68	168.2	0	0	0	109.5	K395 S396 Y397 E401 T402 W403	K395-I399 HydrophobicContact CG-CD1 3.85Å; K395-I399 HydrophobicContact CG-CG1 4.44Å; K395-I399 VanDerWaalsContact O-CG1 3.26Å; K395-I399 WeakPolarHBondContact O-CG1 3.46Å; K395-I399 PolarHBondContact O-N 3.34Å; S396-I399 PolarHBondContact O-N 3.22Å; Y397-I399 VanDerWaalsContact C-N 3.31Å; Y397-I399 PolarHBondContact O-N 3.37Å; I399-E401 VanDerWaalsContact C-N 3.29Å; I399-E401 PolarHBondContact O-N 2.87Å; I399-T402 PolarHBondContact O-N 3.27Å; I399-W403 WeakPolarHBondContact O-CB 3.41Å; I399-W403 PolarHBondContact O-N 3.35Å
400	C	93	Very high	86.4	Confident	17 Å²	17	81.3 Å²	81.3	12%	0.115	39%	0.39	C	S	.	.	H	α-helix	trans	-55.4	-45.2	179	-175	0	0	0	0	112.1	C373 F377 S396 Y397 S404	C373-C400 WeakPolarHBondContact CA-SG 3.45Å; C373-C400 HydrophobicContact CB-CB 3.74Å; C373-C400 WeakPolarHBondContact CB-SG 3.39Å; C373-C400 WeakPolarHBondContact SG-CB 3.28Å; C373-C400 PolarHBondContact SG-O 3.04Å; C373-C400 VanDerWaalsContact SG-O 3.36Å; C373-C400 CovalentContact SG-SG 2.04Å; C373-C400 PolarHBondContact SG-SG 3.48Å; F377-C400 HydrophobicContact CD2-CB 3.67Å; F377-C400 HydrophobicContact CE2-CB 3.74Å; S396-C400 WeakPolarHBondContact O-CB 3.44Å; S396-C400 PolarHBondContact O-N 3.35Å; Y397-C400 WeakPolarHBondContact O-CB 3.17Å; Y397-C400 PolarHBondContact O-N 3.11Å; Y397-C400 VanDerWaalsContact O-N 3.11Å; C400-S404 WeakPolarHBondContact O-CB 3.4Å; C400-S404 PolarHBondContact O-N 3.45Å; C400-S404 PolarHBondContact O-OG 3.02Å
401	E	89.2	Confident	85.9	Confident	67 Å²	67	82.2 Å²	82.2	31%	0.313	39%	0.393	S	S	.	.	H	α-helix	trans	-63.3	-50.6	-179.9	-170.6	172.6	-117.7	0	0	111.3	Y397 R398 I399 W403 S404 T405	Y397-E401 HydrophobicContact CE1-CB 4.34Å; Y397-E401 WeakPolarHBondContact CE1-OE1 3.39Å; Y397-E401 WeakPolarHBondContact CE1-OE2 3.32Å; Y397-E401 WeakPolarHBondContact O-CB 3.43Å; Y397-E401 PolarHBondContact O-N 2.77Å; Y397-E401 PolarHBondContact OH-OE1 2.9Å; R398-E401 PolarHBondContact O-N 3.02Å; I399-E401 VanDerWaalsContact C-N 3.29Å; I399-E401 PolarHBondContact O-N 2.87Å; E401-W403 PolarHBondContact O-N 3.29Å; E401-S404 WeakPolarHBondContact O-CB 3.41Å; E401-S404 PolarHBondContact O-N 3.5Å; E401-T405 WeakPolarHBondContact O-CG2 3.35Å; E401-T405 PolarHBondContact O-N 2.98Å; E401-T405 PolarHBondContact O-OG1 3.39Å
402	T	90	Very high	85.4	Confident	69 Å²	69	85.3 Å²	85.3	42%	0.423	41%	0.408	S	S	.	.	H	α-helix	trans	-62.2	-39	178.4	-57.4	0	0	0	0	113.3	R398 I399 T405 K406	R398-T402 PolarHBondContact O-N 3.13Å; R398-T402 PolarHBondContact O-OG1 3.13Å; I399-T402 PolarHBondContact O-N 3.27Å; T402-T405 PolarHBondContact O-OG1 3.4Å; T402-K406 WeakPolarHBondContact O-CG 3.26Å; T402-K406 PolarHBondContact O-N 3.14Å
403	W	87.8	Confident	84.9	Confident	162 Å²	162	88.3 Å²	88.3	61%	0.614	42%	0.422	S	S	*	.	H	α-helix	trans	-70.7	-38.5	177.3	-80.6	73.5	0	0	0	111.4	I399 E401 T405 K406 H407	I399-W403 WeakPolarHBondContact O-CB 3.41Å; I399-W403 PolarHBondContact O-N 3.35Å; E401-W403 PolarHBondContact O-N 3.29Å; W403-T405 VanDerWaalsContact C-N 3.31Å; W403-T405 PolarHBondContact O-N 3.47Å; W403-K406 PolarHBondContact O-N 3.37Å; W403-H407 PolarHBondContact O-CD2 3.4Å
404	S	82.6	Confident	84.7	Confident	16 Å²	16	89.9 Å²	89.9	11%	0.112	43%	0.427	C	S	.	.	H	α-helix	trans	-66.7	-31.4	178.6	-66.9	0	0	0	0	113.6	N369 C373 C400 E401	N369-S404 VanDerWaalsContact CB-CB 3.46Å; N369-S404 PolarHBondContact ND2-O 3.15Å; C373-S404 PolarHBondContact SG-OG 3.11Å; C373-S404 VanDerWaalsContact SG-OG 3.41Å; C400-S404 WeakPolarHBondContact O-CB 3.4Å; C400-S404 PolarHBondContact O-N 3.45Å; C400-S404 PolarHBondContact O-OG 3.02Å; E401-S404 WeakPolarHBondContact O-CB 3.41Å; E401-S404 PolarHBondContact O-N 3.5Å
405	T	79.3	Confident	84.4	Confident	74 Å²	74	93.6 Å²	93.6	45%	0.454	44%	0.443	S	S	.	.	H	α-helix	trans	-78.1	-18.9	176.4	51.8	0	0	0	0	113.3	E401 T402 W403	E401-T405 WeakPolarHBondContact O-CG2 3.35Å; E401-T405 PolarHBondContact O-N 2.98Å; E401-T405 PolarHBondContact O-OG1 3.39Å; T402-T405 PolarHBondContact O-OG1 3.4Å; W403-T405 VanDerWaalsContact C-N 3.31Å; W403-T405 PolarHBondContact O-N 3.47Å
406	K	76.8	Confident	83.6	Confident	158 Å²	158	87.8 Å²	87.8	69%	0.687	42%	0.42	S	S	*	.	S	Bend	trans	-85.3	-12.9	179.4	-75.6	-177.8	178.7	-169.3	0	113.9	T402 W403	T402-K406 WeakPolarHBondContact O-CG 3.26Å; T402-K406 PolarHBondContact O-N 3.14Å; W403-K406 PolarHBondContact O-N 3.37Å
407	H	62.6	Low	82.8	Confident	134 Å²	134	91.8 Å²	91.8	62%	0.62	43%	0.433	S	S	*	.			trans	-109.5	12.8	-179.1	-75	-68.5	0	0	0	113.1	W403	W403-H407 PolarHBondContact O-CD2 3.4Å
408	I	53	Low	81.8	Confident	158 Å²	158	100.2 Å²	100.2	81%	0.81	47%	0.472	S	S	*	.			trans	-99.6	0	162.5	-57.4	169.1	0	0	0	105.7

Retrieved 408 of 408 residues in 611.9 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).