A0A3Q0KV85_SCHMA Loading...

Acylaminoacyl-peptidase (S09 family)

AlphaFold DB , UniProt , Accession A0A3Q0KV85, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 636 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	44.5	Very low	58.8	Low	200 Å²	200	95.2 Å²	95.2	99%	0.985	51%	0.507	S	S	*	.				0	-46.1	0	-88.5	170.9	163.3	0	0	111.3	S3 I4	M1-S3 VanDerWaalsContact C-N 3.26Å; M1-S3 PolarHBondContact O-N 2.89Å; M1-I4 PolarHBondContact O-N 2.78Å; M1-I4 VanDerWaalsContact O-N 3.11Å
2	T	50.7	Low	59.2	Low	126 Å²	126	88.4 Å²	88.4	77%	0.773	47%	0.471	S	S	*	.	H	α-helix	trans	-50.1	-31.8	178.7	48.7	0	0	0	0	116.9	S6	T2-S6 PolarHBondContact O-N 2.65Å
3	S	59.1	Low	59.1	Low	71 Å²	71	87.5 Å²	87.5	50%	0.497	47%	0.466	S	S	.	.	H	α-helix	trans	-67.2	-43.1	177.9	162.8	0	0	0	0	112.9	M1 S6 Y7	M1-S3 VanDerWaalsContact C-N 3.26Å; M1-S3 PolarHBondContact O-N 2.89Å; S3-S6 PolarHBondContact O-N 3.21Å; S3-Y7 VanDerWaalsContact O-CD2 3.25Å; S3-Y7 WeakPolarHBondContact O-CD2 3.35Å; S3-Y7 PolarHBondContact O-N 2.8Å
4	I	60.2	Low	58.7	Low	96 Å²	96	88 Å²	88	49%	0.492	47%	0.469	S	S	.	.	H	α-helix	trans	-68.9	-41.8	-174	-67.4	167.2	0	0	0	110.3	M1 S6 Y7 F8 L346	M1-I4 PolarHBondContact O-N 2.78Å; M1-I4 VanDerWaalsContact O-N 3.11Å; I4-S6 VanDerWaalsContact C-N 3.31Å; I4-S6 PolarHBondContact O-N 3.23Å; I4-Y7 PolarHBondContact O-N 2.74Å; I4-F8 PolarHBondContact O-N 3.47Å; I4-L346 HydrophobicContact CG2-CD1 4.34Å
5	D	59	Low	58.3	Low	111 Å²	111	82.9 Å²	82.9	59%	0.594	44%	0.442	S	S	*	.	H	α-helix	trans	-63.6	-38.8	-179.8	-57.4	-34.4	0	0	0	111.2	F8 G9	D5-F8 PolarHBondContact O-N 3.47Å; D5-G9 PolarHBondContact O-N 3.04Å
6	S	58.2	Low	57.6	Low	64 Å²	64	79.3 Å²	79.3	45%	0.448	42%	0.422	S	S	.	.	H	α-helix	trans	-63.6	-44.4	175	-169.8	0	0	0	0	112.4	T2 S3 I4 F8 G9 E10	T2-S6 PolarHBondContact O-N 2.65Å; S3-S6 PolarHBondContact O-N 3.21Å; I4-S6 VanDerWaalsContact C-N 3.31Å; I4-S6 PolarHBondContact O-N 3.23Å; S6-F8 VanDerWaalsContact C-N 3.35Å; S6-G9 PolarHBondContact O-N 2.92Å; S6-E10 WeakPolarHBondContact O-CG 3.17Å; S6-E10 PolarHBondContact O-N 2.79Å
7	Y	60.1	Low	56.8	Low	136 Å²	136	79.8 Å²	79.8	53%	0.533	43%	0.425	S	S	.	.	H	α-helix	trans	-65.5	-39.3	178.5	-89.3	-79.9	0	0	0	111.9	S3 I4 F11	S3-Y7 VanDerWaalsContact O-CD2 3.25Å; S3-Y7 WeakPolarHBondContact O-CD2 3.35Å; S3-Y7 PolarHBondContact O-N 2.8Å; I4-Y7 PolarHBondContact O-N 2.74Å; Y7-F11 WeakPolarHBondContact O-CB 3.39Å; Y7-F11 PolarHBondContact O-N 2.93Å; Y7-F11 VanDerWaalsContact O-N 3.09Å
8	F	67.1	Low	55.9	Low	63 Å²	63	81.1 Å²	81.1	28%	0.276	43%	0.428	S	S	.	.	H	α-helix	trans	-70.3	-38.7	178	-154.9	-99.5	0	0	0	111.5	I4 D5 S6 F11 L12 I344 F353 V362	I4-F8 PolarHBondContact O-N 3.47Å; D5-F8 PolarHBondContact O-N 3.47Å; S6-F8 VanDerWaalsContact C-N 3.35Å; F8-F11 PolarHBondContact O-N 3.25Å; F8-L12 HydrophobicContact CD1-CD1 3.64Å; F8-L12 HydrophobicContact CD1-CG 4.32Å; F8-L12 HydrophobicContact CE1-CD1 3.59Å; F8-L12 HydrophobicContact CE1-CG 4.26Å; F8-L12 WeakPolarHBondContact O-CG 3.24Å; F8-L12 PolarHBondContact O-N 3.14Å; F8-L12 VanDerWaalsContact O-N 3.15Å; F8-I344 HydrophobicContact CD2-CD1 3.44Å; F8-I344 VanDerWaalsContact CD2-CD1 3.44Å; F8-I344 HydrophobicContact CE2-CD1 3.67Å; F8-I344 HydrophobicContact CG-CD1 4.41Å; F8-F353 AromaticContact CE2-CE2 3.96Å; F8-F353 HydrophobicContact CE2-CE2 3.96Å; F8-F353 HydrophobicContact CE2-CZ 4Å; F8-F353 HydrophobicContact CZ-CE2 4.28Å; F8-F353 HydrophobicContact CZ-CZ 4.11Å; F8-V362 HydrophobicContact CE1-CG1 4.49Å
9	G	59.4	Low	55.1	Low	27 Å²	27	80.3 Å²	80.3	28%	0.278	42%	0.422	S	S	.	.	H	α-helix	trans	-59.8	-50	172.7	0	0	0	0	0	112.5	D5 S6 F11 L12 D13	D5-G9 PolarHBondContact O-N 3.04Å; S6-G9 PolarHBondContact O-N 2.92Å; G9-F11 VanDerWaalsContact C-N 3.32Å; G9-F11 PolarHBondContact O-N 3.36Å; G9-L12 PolarHBondContact O-N 2.97Å; G9-D13 WeakPolarHBondContact O-CB 3.3Å; G9-D13 PolarHBondContact O-N 2.71Å
10	E	63	Low	54.3	Low	110 Å²	110	80.1 Å²	80.1	51%	0.514	42%	0.418	S	S	.	.	H	α-helix	trans	-60.5	-39.3	176.8	-75.9	179.5	-172.9	0	0	112.7	S6 L12 N14	S6-E10 WeakPolarHBondContact O-CG 3.17Å; S6-E10 PolarHBondContact O-N 2.79Å; E10-L12 VanDerWaalsContact C-N 3.34Å; E10-L12 PolarHBondContact O-N 3.02Å; E10-N14 WeakPolarHBondContact O-CB 3.46Å; E10-N14 PolarHBondContact O-N 2.82Å; E10-N14 PolarHBondContact O-ND2 3.36Å
11	F	65.7	Low	53.4	Low	43 Å²	43	83.2 Å²	83.2	19%	0.189	43%	0.431	C	S	.	.	H	α-helix	trans	-59.9	-44.2	175.8	174.8	-99.9	0	0	0	111.9	Y7 F8 G9 R342 I344 L358	Y7-F11 WeakPolarHBondContact O-CB 3.39Å; Y7-F11 PolarHBondContact O-N 2.93Å; Y7-F11 VanDerWaalsContact O-N 3.09Å; F8-F11 PolarHBondContact O-N 3.25Å; G9-F11 VanDerWaalsContact C-N 3.32Å; G9-F11 PolarHBondContact O-N 3.36Å; F11-R342 HydrophobicContact CZ-CB 4.26Å; F11-I344 HydrophobicContact CB-CD1 3.65Å; F11-I344 HydrophobicContact CB-CG1 4.15Å; F11-I344 HydrophobicContact CD1-CD1 3.49Å; F11-I344 VanDerWaalsContact CD1-CD1 3.49Å; F11-I344 HydrophobicContact CD1-CG1 3.89Å; F11-I344 HydrophobicContact CD2-CD1 3.9Å; F11-I344 HydrophobicContact CD2-CG1 3.49Å; F11-I344 VanDerWaalsContact CD2-CG1 3.49Å; F11-I344 HydrophobicContact CE1-CD1 4.05Å; F11-I344 HydrophobicContact CE1-CG1 4.1Å; F11-I344 HydrophobicContact CE2-CD1 4.41Å; F11-I344 HydrophobicContact CE2-CG1 3.72Å; F11-I344 HydrophobicContact CG-CD1 3.39Å; F11-I344 HydrophobicContact CG-CG1 3.56Å; F11-I344 HydrophobicContact CZ-CD1 4.47Å; F11-I344 HydrophobicContact CZ-CG1 4.01Å; F11-L358 HydrophobicContact CE1-CD1 4.45Å; F11-L358 HydrophobicContact CE1-CD2 4.18Å
12	L	63.9	Low	52.9	Low	14 Å²	14	80.6 Å²	80.6	7%	0.073	42%	0.421	C	S	.	.	H	α-helix	trans	-75.7	-38.8	-179.1	-66.9	172	0	0	0	113	F8 G9 E10 E15 D16 R363 F432	F8-L12 HydrophobicContact CD1-CD1 3.64Å; F8-L12 HydrophobicContact CD1-CG 4.32Å; F8-L12 HydrophobicContact CE1-CD1 3.59Å; F8-L12 HydrophobicContact CE1-CG 4.26Å; F8-L12 WeakPolarHBondContact O-CG 3.24Å; F8-L12 PolarHBondContact O-N 3.14Å; F8-L12 VanDerWaalsContact O-N 3.15Å; G9-L12 PolarHBondContact O-N 2.97Å; E10-L12 VanDerWaalsContact C-N 3.34Å; E10-L12 PolarHBondContact O-N 3.02Å; L12-E15 WeakPolarHBondContact O-CB 3.47Å; L12-E15 PolarHBondContact O-N 2.94Å; L12-D16 PolarHBondContact O-N 3.07Å; L12-R363 PolarHBondContact O-NH2 3.31Å; L12-F432 HydrophobicContact CB-CE2 4.22Å; L12-F432 HydrophobicContact CD1-CE2 3.93Å; L12-F432 HydrophobicContact CD1-CZ 3.68Å; L12-F432 HydrophobicContact CD2-CE2 4.42Å; L12-F432 HydrophobicContact CD2-CZ 4.47Å; L12-F432 HydrophobicContact CG-CE2 4.43Å
13	D	56.9	Low	51.9	Low	76 Å²	76	77.9 Å²	77.9	41%	0.406	41%	0.407	S	S	.	.	H	α-helix	trans	-68.3	-35.5	179.5	-78.9	-19.4	0	0	0	112	G9 E15 D16 N17 R434	G9-D13 WeakPolarHBondContact O-CB 3.3Å; G9-D13 PolarHBondContact O-N 2.71Å; D13-E15 VanDerWaalsContact C-N 3.28Å; D13-E15 PolarHBondContact O-N 2.97Å; D13-D16 PolarHBondContact O-N 2.98Å; D13-N17 PolarHBondContact O-N 3.31Å; D13-N17 PolarHBondContact O-ND2 2.77Å; D13-R434 IonicContact OD1-NH2 2.81Å
14	N	53.9	Low	50.6	Low	95 Å²	95	83.4 Å²	83.4	51%	0.508	42%	0.422	S	S	.	.	H	α-helix	trans	-62.4	-36.7	174.3	-76.6	-33.1	0	0	0	111.8	E10 N17 E18	E10-N14 WeakPolarHBondContact O-CB 3.46Å; E10-N14 PolarHBondContact O-N 2.82Å; E10-N14 PolarHBondContact O-ND2 3.36Å; N14-N17 PolarHBondContact O-N 3.25Å; N14-E18 PolarHBondContact O-N 2.95Å
15	E	52.1	Low	49.2	Very low	12 Å²	12	83.9 Å²	83.9	6%	0.056	43%	0.432	C	S	.	.	H	α-helix	trans	-67.8	-35	174.6	-72.9	-164.2	151.8	0	0	112.8	L12 D13 N17 E18 Q19 R342 R363	L12-E15 WeakPolarHBondContact O-CB 3.47Å; L12-E15 PolarHBondContact O-N 2.94Å; D13-E15 VanDerWaalsContact C-N 3.28Å; D13-E15 PolarHBondContact O-N 2.97Å; E15-N17 VanDerWaalsContact C-N 3.29Å; E15-N17 PolarHBondContact O-N 3.46Å; E15-E18 PolarHBondContact O-N 3.19Å; E15-Q19 WeakPolarHBondContact O-CB 3.27Å; E15-Q19 WeakPolarHBondContact O-CG 3.44Å; E15-Q19 PolarHBondContact O-N 3.34Å; E15-R342 WeakPolarHBondContact OE1-CD 3.44Å; E15-R342 IonicContact OE1-CZ 3.46Å; E15-R342 IonicContact OE1-NE 2.76Å; E15-R342 IonicContact OE1-NH1 3.69Å; E15-R342 PolarHBondContact OE1-NH1 3.47Å; E15-R363 IonicContact OE2-CZ 3.98Å; E15-R363 IonicContact OE2-NE 3.04Å; E15-R363 IonicContact OE2-NH2 2.65Å; E15-R363 PolarHBondContact OE2-NH2 3Å
16	D	47.7	Very low	48	Very low	24 Å²	24	85.9 Å²	85.9	13%	0.128	44%	0.441	C	S	.	.	H	α-helix	trans	-63.3	-39.6	176.4	-81.3	-0.9	0	0	0	110.7	L12 D13 E20 R363	L12-D16 PolarHBondContact O-N 3.07Å; D13-D16 PolarHBondContact O-N 2.98Å; D16-E20 WeakPolarHBondContact O-CG 3.07Å; D16-E20 PolarHBondContact O-N 2.77Å; D16-R363 IonicContact OD1-CZ 2.74Å; D16-R363 IonicContact OD1-NH1 2.61Å; D16-R363 PolarHBondContact OD1-NH1 3.13Å; D16-R363 IonicContact OD1-NH2 2.97Å
17	N	44.6	Very low	47	Very low	89 Å²	89	91.9 Å²	91.9	48%	0.476	46%	0.463	S	S	.	.	H	α-helix	trans	-67	-39.7	174.7	-71.6	-42.5	0	0	0	112.7	D13 N14 E15 E20 Q21	D13-N17 PolarHBondContact O-N 3.31Å; D13-N17 PolarHBondContact O-ND2 2.77Å; N14-N17 PolarHBondContact O-N 3.25Å; E15-N17 VanDerWaalsContact C-N 3.29Å; E15-N17 PolarHBondContact O-N 3.46Å; N17-E20 PolarHBondContact O-N 3.47Å; N17-Q21 PolarHBondContact O-N 3.08Å
18	E	39.8	Very low	46.5	Very low	102 Å²	102	91 Å²	91	48%	0.477	47%	0.467	S	S	.	.	H	α-helix	trans	-66.8	-42.1	175.5	-73.8	-176	170	0	0	111.8	N14 E15 E20 Q21 D22 R342	N14-E18 PolarHBondContact O-N 2.95Å; E15-E18 PolarHBondContact O-N 3.19Å; E18-E20 VanDerWaalsContact C-N 3.32Å; E18-E20 PolarHBondContact O-N 3.27Å; E18-Q21 WeakPolarHBondContact O-CB 2.98Å; E18-Q21 PolarHBondContact O-N 2.68Å; E18-Q21 VanDerWaalsContact O-N 3.1Å; E18-D22 PolarHBondContact O-N 2.91Å; E18-R342 IonicContact OE2-NH1 3.65Å; E18-R342 IonicContact OE2-NH2 2.76Å
19	Q	40.9	Very low	46.2	Very low	66 Å²	66	94.9 Å²	94.9	31%	0.308	49%	0.488	S	S	.	.	H	α-helix	trans	-72.7	-22.7	177.6	-70.6	-177	14	0	0	113.5	E15 R428	E15-Q19 WeakPolarHBondContact O-CB 3.27Å; E15-Q19 WeakPolarHBondContact O-CG 3.44Å; E15-Q19 PolarHBondContact O-N 3.34Å; Q19-R428 PolarHBondContact O-NH1 2.93Å
20	E	39.3	Very low	47.1	Very low	76 Å²	76	96.9 Å²	96.9	36%	0.355	49%	0.487	S	S	.	.	H	α-helix	trans	-67.8	-37.9	166.7	-81.4	-171.3	175.1	0	0	110.9	D16 N17 E18 S23	D16-E20 WeakPolarHBondContact O-CG 3.07Å; D16-E20 PolarHBondContact O-N 2.77Å; N17-E20 PolarHBondContact O-N 3.47Å; E18-E20 VanDerWaalsContact C-N 3.32Å; E18-E20 PolarHBondContact O-N 3.27Å; E20-S23 PolarHBondContact O-OG 2.82Å
21	Q	36.1	Very low	48.2	Very low	147 Å²	147	92 Å²	92	69%	0.687	47%	0.465	S	S	*	.	H	α-helix	trans	-71.4	-35	176.7	-69.5	-178	12.1	0	0	113.2	N17 E18 S23	N17-Q21 PolarHBondContact O-N 3.08Å; E18-Q21 WeakPolarHBondContact O-CB 2.98Å; E18-Q21 PolarHBondContact O-N 2.68Å; E18-Q21 VanDerWaalsContact O-N 3.1Å; Q21-S23 VanDerWaalsContact C-N 3.27Å; Q21-S23 PolarHBondContact O-N 2.95Å
22	D	32.2	Very low	49.4	Very low	144 Å²	144	89.9 Å²	89.9	77%	0.77	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	2.9	-178.9	-93.4	-9.1	0	0	0	114.6	E18 K24	E18-D22 PolarHBondContact O-N 2.91Å; D22-K24 VanDerWaalsContact C-N 3.31Å; D22-K24 PolarHBondContact O-N 3.23Å
23	S	31.4	Very low	50.8	Low	70 Å²	70	89.4 Å²	89.4	49%	0.49	45%	0.453	S	S	.	.	S	Bend	trans	-65.1	97.7	165.8	63.2	0	0	0	0	108.2	E20 Q21	E20-S23 PolarHBondContact O-OG 2.82Å; Q21-S23 VanDerWaalsContact C-N 3.27Å; Q21-S23 PolarHBondContact O-N 2.95Å
24	K	30.3	Very low	52.6	Low	186 Å²	186	85.8 Å²	85.8	81%	0.809	43%	0.434	S	S	*	.			trans	-40.9	123.6	164.6	-78.9	179.4	179.5	173.1	0	105.7	D22 L26	D22-K24 VanDerWaalsContact C-N 3.31Å; D22-K24 PolarHBondContact O-N 3.23Å; K24-L26 PolarHBondContact O-N 2.77Å
25	P	30.6	Very low	54.6	Low	106 Å²	106	81.3 Å²	81.3	69%	0.688	41%	0.41	S	S	*	.			trans	-50.8	116.5	175.6	20.1	-29.9	0	0	0	104.9	Q27	P25-Q27 PolarHBondContact O-N 3.35Å
26	L	34.4	Very low	56.7	Low	153 Å²	153	80.7 Å²	80.7	80%	0.801	41%	0.407	S	S	*	.			trans	-42.8	117.2	175	-99.5	100.6	0	0	0	104.1	K24 D28	K24-L26 PolarHBondContact O-N 2.77Å; L26-D28 WeakPolarHBondContact O-CA 3.2Å; L26-D28 PolarHBondContact O-N 2.93Å
27	Q	37	Very low	59	Low	191 Å²	191	79.6 Å²	79.6	89%	0.893	40%	0.401	S	S	*	.			trans	-40.6	94.3	-169.1	-165.7	174.9	11.7	0	0	108.5	P25 M29	P25-Q27 PolarHBondContact O-N 3.35Å; Q27-M29 PolarHBondContact O-N 2.61Å
28	D	49.6	Very low	61.3	Low	118 Å²	118	75.3 Å²	75.3	63%	0.631	38%	0.378	S	S	*	.			trans	-64.3	117.6	-157.7	-104	-30.3	0	0	0	104.6	L26 R30	L26-D28 WeakPolarHBondContact O-CA 3.2Å; L26-D28 PolarHBondContact O-N 2.93Å; D28-R30 VanDerWaalsContact C-N 3.29Å; D28-R30 PolarHBondContact O-N 2.87Å
29	M	61.8	Low	63.6	Low	143 Å²	143	70.6 Å²	70.6	70%	0.704	36%	0.356	S	S	*	.			trans	-64	100.3	-178.1	-81.2	-157.4	106.2	0	0	106.4	Q27 S31 G171	Q27-M29 PolarHBondContact O-N 2.61Å; M29-S31 PolarHBondContact O-N 2.89Å; M29-G171 VanDerWaalsContact CE-CA 3.48Å
30	R	78.6	Confident	65.8	Low	69 Å²	69	67.7 Å²	67.7	26%	0.26	34%	0.343	S	S	.	.			trans	-47.9	130.7	-178.4	-60.1	177.7	-172.9	-149	-6	109	D28 F87 F170 G171	D28-R30 VanDerWaalsContact C-N 3.29Å; D28-R30 PolarHBondContact O-N 2.87Å; R30-F87 HydrophobicContact CG-CB 4.17Å; R30-F170 HydrophobicContact CB-CD1 4.19Å; R30-F170 CarbonylContact O-C 3.58Å; R30-F170 VanDerWaalsContact O-CA 3.26Å; R30-F170 WeakPolarHBondContact O-CA 3.27Å; R30-G171 PolarHBondContact O-N 3.35Å
31	S	86	Confident	67.9	Low	7 Å²	7	64.3 Å²	64.3	5%	0.049	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	140.3	169	83.3	0	0	0	0	109	M29 D88 M89	M29-S31 PolarHBondContact O-N 2.89Å; S31-D88 PolarHBondContact N-OD1 3.28Å; S31-D88 WeakPolarHBondContact O-CA 3.38Å; S31-D88 WeakPolarHBondContact OG-CB 3.26Å; S31-D88 PolarHBondContact OG-OD1 3.44Å; S31-D88 PolarHBondContact OG-OD2 2.9Å; S31-M89 PolarHBondContact O-N 3.25Å
32	G	90.5	Very high	70.3	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	117.3	169.2	0	0	0	0	0	108.1	M89 F163 I172 K173 H174	G32-M89 CarbonylContact C-O 3.56Å; G32-M89 WeakPolarHBondContact CA-O 3.42Å; G32-F163 WeakPolarHBondContact O-CE1 3.46Å; G32-F163 WeakPolarHBondContact O-CZ 3.39Å; G32-I172 PolarHBondContact N-O 3.09Å; G32-K173 CarbonylContact O-C 3.43Å; G32-K173 WeakPolarHBondContact O-CA 3.34Å; G32-H174 PolarHBondContact O-N 3.25Å
33	V	93	Very high	72.9	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.024	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	129	-176.9	178.2	0	0	0	0	109.2	F35 F77 M89 I90 G91 H174 F176	V33-F35 HydrophobicContact CG1-CD2 4.21Å; V33-F35 HydrophobicContact CG1-CE2 3.8Å; V33-F35 HydrophobicContact CG1-CZ 4.47Å; V33-F77 HydrophobicContact CB-CE1 4.22Å; V33-F77 HydrophobicContact CG1-CE1 4.02Å; V33-F77 HydrophobicContact CG1-CZ 4.31Å; V33-F77 HydrophobicContact CG2-CE1 4.31Å; V33-F77 HydrophobicContact CG2-CZ 4.19Å; V33-M89 PolarHBondContact N-O 2.96Å; V33-I90 CarbonylContact O-C 3.58Å; V33-I90 VanDerWaalsContact O-CA 3.23Å; V33-I90 WeakPolarHBondContact O-CA 3.32Å; V33-G91 PolarHBondContact O-N 3.1Å; V33-H174 CarbonylContact C-O 3.53Å; V33-H174 WeakPolarHBondContact CA-O 3.38Å; V33-F176 HydrophobicContact CG1-CD2 3.52Å; V33-F176 HydrophobicContact CG1-CE2 3.49Å; V33-F176 VanDerWaalsContact CG1-CE2 3.49Å
34	I	95.4	Very high	75.5	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	123	173.9	-61.1	176.3	0	0	0	109	G91 V93 L113 C159 Q162 F163 H174 I175 F176	I34-G91 WeakPolarHBondContact CA-O 3.42Å; I34-V93 HydrophobicContact CG2-CB 4.38Å; I34-V93 HydrophobicContact CG2-CG2 3.71Å; I34-L113 HydrophobicContact CG1-CD1 4.08Å; I34-C159 HydrophobicContact CD1-CB 4.07Å; I34-C159 VanDerWaalsContact CD1-O 3.31Å; I34-C159 WeakPolarHBondContact CD1-O 3.36Å; I34-C159 HydrophobicContact CG2-CB 4.47Å; I34-Q162 HydrophobicContact CD1-CB 3.98Å; I34-F163 HydrophobicContact CD1-CD2 3.94Å; I34-F163 HydrophobicContact CD1-CE1 4.19Å; I34-F163 HydrophobicContact CD1-CE2 3.49Å; I34-F163 VanDerWaalsContact CD1-CE2 3.49Å; I34-F163 HydrophobicContact CD1-CG 4.48Å; I34-F163 HydrophobicContact CD1-CZ 3.63Å; I34-F163 HydrophobicContact CG1-CE1 4.26Å; I34-F163 HydrophobicContact CG1-CE2 4.06Å; I34-F163 HydrophobicContact CG1-CZ 3.71Å; I34-H174 PolarHBondContact N-O 3.33Å; I34-I175 HydrophobicContact CB-CG1 4.28Å; I34-I175 CarbonylContact O-C 3.55Å; I34-I175 WeakPolarHBondContact O-CA 3.33Å; I34-F176 PolarHBondContact O-N 2.95Å
35	F	96.2	Very high	77.8	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	113.7	167.8	-72.2	-98.2	0	0	0	108.3	V33 C74 F77 I90 G91 L92 V93 F176 L178 I260	V33-F35 HydrophobicContact CG1-CD2 4.21Å; V33-F35 HydrophobicContact CG1-CE2 3.8Å; V33-F35 HydrophobicContact CG1-CZ 4.47Å; F35-C74 HydrophobicContact CD1-CB 4.03Å; F35-C74 HydrophobicContact CD2-CB 4.41Å; F35-C74 HydrophobicContact CE1-CB 4.29Å; F35-C74 HydrophobicContact CG-CB 4.1Å; F35-F77 HydrophobicContact CE2-CB 4.4Å; F35-F77 AromaticContact CE2-CD1 3.45Å; F35-F77 HydrophobicContact CE2-CD1 3.45Å; F35-F77 VanDerWaalsContact CE2-CD1 3.45Å; F35-F77 AromaticContact CE2-CE1 3.9Å; F35-F77 HydrophobicContact CE2-CE1 3.9Å; F35-F77 HydrophobicContact CE2-CG 4.05Å; F35-F77 HydrophobicContact CZ-CB 3.82Å; F35-F77 AromaticContact CZ-CD1 3.54Å; F35-F77 HydrophobicContact CZ-CD1 3.54Å; F35-F77 HydrophobicContact CZ-CD2 4.33Å; F35-F77 HydrophobicContact CZ-CE1 4.16Å; F35-F77 AromaticContact CZ-CG 3.63Å; F35-F77 HydrophobicContact CZ-CG 3.63Å; F35-I90 HydrophobicContact CD2-CG2 3.92Å; F35-I90 HydrophobicContact CE2-CG2 3.95Å; F35-G91 PolarHBondContact N-O 3.33Å; F35-L92 HydrophobicContact CB-CD1 3.87Å; F35-V93 PolarHBondContact O-N 2.86Å; F35-F176 HydrophobicContact CZ-CD2 4.47Å; F35-L178 HydrophobicContact CD1-CD1 3.83Å; F35-I260 HydrophobicContact CE1-CD1 3.92Å; F35-I260 HydrophobicContact CZ-CD1 4.49Å
36	L	96	Very high	79.7	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	105.7	172.7	-178.7	61.3	0	0	0	108	V93 M95 A155 I175 F176 L177 L178	L36-V93 CarbonylContact C-O 3.56Å; L36-V93 WeakPolarHBondContact CA-O 3.37Å; L36-V93 HydrophobicContact CD1-CB 3.91Å; L36-V93 HydrophobicContact CD1-CG1 3.72Å; L36-M95 HydrophobicContact CD1-CB 4.07Å; L36-M95 HydrophobicContact CD1-CG 4.3Å; L36-M95 HydrophobicContact CD1-SD 4.38Å; L36-M95 HydrophobicContact CD2-SD 4.17Å; L36-M95 HydrophobicContact CG-SD 4.14Å; L36-A155 HydrophobicContact CD1-CB 4.43Å; L36-A155 HydrophobicContact CD2-CB 4.33Å; L36-I175 HydrophobicContact CB-CG2 4.02Å; L36-I175 HydrophobicContact CD2-CG2 4.49Å; L36-F176 PolarHBondContact N-O 3.3Å; L36-L177 HydrophobicContact CB-CD1 4.35Å; L36-L177 HydrophobicContact CD2-CD1 3.92Å; L36-L177 HydrophobicContact CG-CD1 3.89Å; L36-L177 CarbonylContact O-C 3.43Å; L36-L177 WeakPolarHBondContact O-CA 3.43Å; L36-L178 PolarHBondContact O-N 3.49Å
37	I	94.9	Very high	81	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	132.2	-175.9	-55.7	-179.8	0	0	0	109.7	M43 F67 L71 L92 V93 L94 M95 L178	I37-M43 HydrophobicContact CG2-CE 4.3Å; I37-F67 HydrophobicContact CG2-CD2 3.57Å; I37-F67 HydrophobicContact CG2-CE2 3.77Å; I37-L71 HydrophobicContact CD1-CD2 3.9Å; I37-L92 HydrophobicContact CD1-CD1 3.52Å; I37-L92 HydrophobicContact CG1-CD1 4.04Å; I37-V93 PolarHBondContact N-O 3.23Å; I37-L94 HydrophobicContact CB-CD2 3.88Å; I37-L94 HydrophobicContact CG2-CD2 4.45Å; I37-L94 WeakPolarHBondContact O-CA 3.04Å; I37-M95 PolarHBondContact O-N 3.42Å; I37-L178 HydrophobicContact CG1-CD1 4.12Å
38	D	92.5	Very high	81.8	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	132	175.1	-152.4	-8.8	0	0	0	112.5	M43 M95 R96 L178 T179	D38-M43 HydrophobicContact CB-CG 4.42Å; D38-M43 WeakPolarHBondContact O-CB 3.01Å; D38-M95 HydrophobicContact CB-CE 3.59Å; D38-M95 HydrophobicContact CB-CG 4.33Å; D38-M95 WeakPolarHBondContact OD2-CE 3.39Å; D38-R96 WeakPolarHBondContact OD1-CD 3.29Å; D38-R96 IonicContact OD1-NE 3.98Å; D38-L178 WeakPolarHBondContact CB-O 3.5Å; D38-L178 PolarHBondContact N-O 3.26Å; D38-T179 PolarHBondContact OD2-OG1 3.23Å
39	C	89.6	Confident	81.7	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.014	17%	0.172	C	C	.	.			trans	-103.5	57.3	174.1	-64.5	0	0	0	0	111	F67 M95 T97 T141	C39-F67 VanDerWaalsContact SG-CE2 3.58Å; C39-M95 VanDerWaalsContact CB-O 3.3Å; C39-M95 WeakPolarHBondContact CB-O 3.33Å; C39-M95 PolarHBondContact N-O 2.9Å; C39-T97 HydrophobicContact CB-CG2 4.15Å; C39-T141 WeakPolarHBondContact O-CB 3.29Å; C39-T141 WeakPolarHBondContact O-CG2 3.02Å
40	T	87.1	Confident	81.3	Confident	5 Å²	5	24.9 Å²	24.9	3%	0.031	15%	0.147	C	C	.	.			trans	-77.3	151.7	166.6	55.5	0	0	0	0	110.2	T42 M43 L44 V143 D180 D181	T40-T42 WeakPolarHBondContact CB-OG1 3.06Å; T40-T42 PolarHBondContact O-N 3.41Å; T40-T42 PolarHBondContact OG1-OG1 3.05Å; T40-T42 VanDerWaalsContact OG1-OG1 3.05Å; T40-M43 PolarHBondContact O-N 3.39Å; T40-M43 VanDerWaalsContact O-N 3.13Å; T40-M43 VanDerWaalsContact OG1-CB 3.26Å; T40-M43 WeakPolarHBondContact OG1-CB 3.25Å; T40-M43 WeakPolarHBondContact OG1-CG 3.27Å; T40-M43 PolarHBondContact OG1-N 2.96Å; T40-M43 VanDerWaalsContact OG1-N 3.11Å; T40-L44 PolarHBondContact O-N 3.45Å; T40-V143 HydrophobicContact CG2-CG2 4.43Å; T40-D180 PolarHBondContact OG1-OD1 2.96Å; T40-D181 HydrophobicContact CG2-CB 4.49Å
41	P	83.8	Confident	79.7	Confident	6 Å²	6	26 Å²	26	4%	0.039	16%	0.158	C	C	.	.	H	α-helix	trans	-55.7	-30.9	173	-27.2	33.7	0	0	0	112.9	G45 L46 T141 V143	P41-G45 PolarHBondContact O-N 2.86Å; P41-L46 HydrophobicContact CB-CB 4.33Å; P41-L46 HydrophobicContact CB-CD1 4.14Å; P41-L46 WeakPolarHBondContact O-CB 3.43Å; P41-L46 PolarHBondContact O-N 3.32Å; P41-T141 HydrophobicContact CG-CG2 4.42Å; P41-V143 HydrophobicContact CG-CB 3.71Å; P41-V143 HydrophobicContact CG-CG1 4.18Å; P41-V143 HydrophobicContact CG-CG2 4.48Å
42	T	84.9	Confident	78	Confident	49 Å²	49	28.4 Å²	28.4	30%	0.301	17%	0.171	S	C	.	.	H	α-helix	trans	-71.4	-44.4	176.7	46.8	0	0	0	0	111.5	T40 L44 G45 D180 Q216	T40-T42 WeakPolarHBondContact CB-OG1 3.06Å; T40-T42 PolarHBondContact O-N 3.41Å; T40-T42 PolarHBondContact OG1-OG1 3.05Å; T40-T42 VanDerWaalsContact OG1-OG1 3.05Å; T42-L44 VanDerWaalsContact C-N 3.34Å; T42-L44 PolarHBondContact O-N 3.48Å; T42-G45 PolarHBondContact O-N 3.21Å; T42-G45 VanDerWaalsContact O-N 3.1Å; T42-D180 WeakPolarHBondContact CB-OD2 3.34Å; T42-D180 PolarHBondContact OG1-OD1 3.23Å; T42-D180 PolarHBondContact OG1-OD2 2.96Å; T42-Q216 VanDerWaalsContact CG2-NE2 3.32Å
43	M	87.3	Confident	75.5	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-61	-40	171.4	-79.9	-70.5	-79.7	0	0	112.7	I37 D38 T40 G45 S65 G66 F67 D180 I214	I37-M43 HydrophobicContact CG2-CE 4.3Å; D38-M43 HydrophobicContact CB-CG 4.42Å; D38-M43 WeakPolarHBondContact O-CB 3.01Å; T40-M43 PolarHBondContact O-N 3.39Å; T40-M43 VanDerWaalsContact O-N 3.13Å; T40-M43 VanDerWaalsContact OG1-CB 3.26Å; T40-M43 WeakPolarHBondContact OG1-CB 3.25Å; T40-M43 WeakPolarHBondContact OG1-CG 3.27Å; T40-M43 PolarHBondContact OG1-N 2.96Å; T40-M43 VanDerWaalsContact OG1-N 3.11Å; M43-G45 PolarHBondContact O-N 3.01Å; M43-S65 VanDerWaalsContact O-CB 3.26Å; M43-S65 WeakPolarHBondContact O-CB 3.45Å; M43-S65 PolarHBondContact O-OG 3.05Å; M43-G66 PolarHBondContact O-N 2.96Å; M43-F67 HydrophobicContact CB-CB 4.46Å; M43-F67 VanDerWaalsContact O-CB 3.27Å; M43-F67 WeakPolarHBondContact O-CB 3.5Å; M43-F67 PolarHBondContact O-N 2.99Å; M43-D180 HydrophobicContact CG-CB 4.17Å; M43-D180 VanDerWaalsContact CG-CG 3.49Å; M43-D180 WeakPolarHBondContact CG-OD1 3.05Å; M43-D180 PolarHBondContact N-OD2 3.09Å; M43-D180 HydrophobicContact SD-CB 4.05Å; M43-I214 HydrophobicContact CE-CB 4.42Å; M43-I214 HydrophobicContact CE-CG1 3.84Å; M43-I214 HydrophobicContact SD-CB 3.76Å; M43-I214 HydrophobicContact SD-CG1 3.85Å; M43-I214 HydrophobicContact SD-CG2 3.95Å
44	L	85.3	Confident	72.9	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-69.3	-17.7	176.9	-70.6	-178	0	0	0	113.3	T40 T42 L46 S65 F67 P132 L135 E136 T141	T40-L44 PolarHBondContact O-N 3.45Å; T42-L44 VanDerWaalsContact C-N 3.34Å; T42-L44 PolarHBondContact O-N 3.48Å; L44-L46 HydrophobicContact CB-CD1 4.25Å; L44-L46 HydrophobicContact CB-CG 4.03Å; L44-L46 HydrophobicContact CD1-CD1 4.12Å; L44-S65 WeakPolarHBondContact O-CB 3.32Å; L44-S65 PolarHBondContact O-OG 3.3Å; L44-F67 HydrophobicContact CD2-CB 4.02Å; L44-F67 HydrophobicContact CD2-CD1 3.91Å; L44-F67 HydrophobicContact CD2-CD2 4.08Å; L44-F67 HydrophobicContact CD2-CE1 4.37Å; L44-F67 HydrophobicContact CD2-CG 3.73Å; L44-P132 WeakPolarHBondContact O-CB 3.4Å; L44-L135 HydrophobicContact CD2-CB 4.14Å; L44-L135 HydrophobicContact CD2-CD1 4.45Å; L44-E136 HydrophobicContact CD1-CB 4.28Å; L44-T141 HydrophobicContact CD1-CG2 3.27Å; L44-T141 HydrophobicContact CG-CG2 4.27Å
45	G	79.5	Confident	69.9	Low	24 Å²	24	41.3 Å²	41.3	25%	0.247	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	21.4	-177.3	0	0	0	0	0	114.2	P41 T42 M43 H47	P41-G45 PolarHBondContact O-N 2.86Å; T42-G45 PolarHBondContact O-N 3.21Å; T42-G45 VanDerWaalsContact O-N 3.1Å; M43-G45 PolarHBondContact O-N 3.01Å; G45-H47 VanDerWaalsContact C-N 3.33Å
46	L	70.6	Confident	66.9	Low	42 Å²	42	49.1 Å²	49.1	22%	0.22	29%	0.292	C	S	.	.	S	Bend	trans	-75.2	-19.8	-179.2	-62.4	171.6	0	0	0	113.3	P41 L44 P132 E136	P41-L46 HydrophobicContact CB-CB 4.33Å; P41-L46 HydrophobicContact CB-CD1 4.14Å; P41-L46 WeakPolarHBondContact O-CB 3.43Å; P41-L46 PolarHBondContact O-N 3.32Å; L44-L46 HydrophobicContact CB-CD1 4.25Å; L44-L46 HydrophobicContact CB-CG 4.03Å; L44-L46 HydrophobicContact CD1-CD1 4.12Å; L46-P132 HydrophobicContact CD2-CB 4.08Å; L46-E136 HydrophobicContact CD1-CB 4.13Å; L46-E136 HydrophobicContact CD1-CG 3.93Å; L46-E136 VanDerWaalsContact CD1-OE2 3.32Å; L46-E136 WeakPolarHBondContact CD1-OE2 3.28Å
47	H	60.9	Low	64.1	Low	142 Å²	142	51 Å²	51	66%	0.657	31%	0.307	S	S	*	.	S	Bend	trans	-123.4	19.1	-171.8	-68.9	-37.6	0	0	0	115.9	G45	G45-H47 VanDerWaalsContact C-N 3.33Å
48	G	54	Low	61.6	Low	51 Å²	51	57.4 Å²	57.4	53%	0.526	35%	0.346	S	S	.	.	S	Bend	trans	166.6	152.8	175.3	0	0	0	0	0	112.8	F50	G48-F50 PolarHBondContact O-N 3.11Å
49	S	48.8	Very low	59.5	Low	72 Å²	72	63.1 Å²	63.1	50%	0.503	38%	0.377	S	S	.	.			trans	-71.5	126.3	179	56.7	0	0	0	0	110.7	D51 Q217	S49-D51 VanDerWaalsContact C-N 3.25Å; S49-D51 PolarHBondContact O-N 3.48Å; S49-D51 PolarHBondContact OG-OD1 3.29Å; S49-Q217 PolarHBondContact O-NE2 3.06Å
50	F	52	Low	57.6	Low	45 Å²	45	64 Å²	64	20%	0.197	38%	0.383	C	S	.	.			trans	-73.7	84.1	162.1	-144.1	-93.9	0	0	0	106.9	G48 L52 V63 L69 I214 E251	G48-F50 PolarHBondContact O-N 3.11Å; F50-L52 PolarHBondContact O-N 3.27Å; F50-V63 HydrophobicContact CD1-CG1 4.47Å; F50-V63 HydrophobicContact CE1-CG1 4.45Å; F50-L69 HydrophobicContact CE1-CD2 4.5Å; F50-L69 HydrophobicContact CZ-CD2 4.36Å; F50-I214 HydrophobicContact CE2-CG2 4.11Å; F50-I214 HydrophobicContact CZ-CG2 4.01Å; F50-E251 HydrophobicContact CE1-CB 4.23Å; F50-E251 HydrophobicContact CZ-CB 4.43Å
51	D	46.5	Very low	55.9	Low	91 Å²	91	69 Å²	69	49%	0.487	42%	0.418	S	S	.	.			trans	-74.8	96.1	-176.1	-109.8	29.1	0	0	0	111.2	S49 N53	S49-D51 VanDerWaalsContact C-N 3.25Å; S49-D51 PolarHBondContact O-N 3.48Å; S49-D51 PolarHBondContact OG-OD1 3.29Å; D51-N53 PolarHBondContact O-N 3.31Å; D51-N53 PolarHBondContact OD2-ND2 3.35Å
52	L	49	Very low	55.1	Low	59 Å²	59	71.4 Å²	71.4	31%	0.309	44%	0.435	S	S	.	.			trans	-75.3	68.9	170.3	-78	138.4	0	0	0	111.2	F50 S54 V63	F50-L52 PolarHBondContact O-N 3.27Å; L52-S54 VanDerWaalsContact C-N 3.28Å; L52-S54 PolarHBondContact O-N 3.43Å; L52-V63 HydrophobicContact CD1-CB 3.75Å; L52-V63 HydrophobicContact CD1-CG1 4.28Å; L52-V63 WeakPolarHBondContact CD1-O 3.29Å
53	N	37.5	Very low	54.6	Low	135 Å²	135	69.6 Å²	69.6	72%	0.722	42%	0.424	S	S	*	.			trans	-92.7	22.8	172.5	-77.3	-35.8	0	0	0	113.5	D51 S55	D51-N53 PolarHBondContact O-N 3.31Å; D51-N53 PolarHBondContact OD2-ND2 3.35Å; N53-S55 PolarHBondContact O-N 3.26Å
54	S	39.8	Very low	54.1	Low	42 Å²	42	74.1 Å²	74.1	29%	0.294	44%	0.444	S	S	.	.			trans	-97.9	78.4	171.4	161	0	0	0	0	109.7	L52 N56 R252	L52-S54 VanDerWaalsContact C-N 3.28Å; L52-S54 PolarHBondContact O-N 3.43Å; S54-N56 PolarHBondContact O-N 3.33Å; S54-R252 PolarHBondContact OG-NE 3.41Å; S54-R252 VanDerWaalsContact OG-NE 3.16Å; S54-R252 PolarHBondContact OG-NH2 3.48Å
55	S	32.4	Very low	54.1	Low	97 Å²	97	74 Å²	74	68%	0.678	44%	0.443	S	S	*	.			trans	-56.3	127.1	165.3	46.1	0	0	0	0	110.1	N53	N53-S55 PolarHBondContact O-N 3.26Å
56	N	33.4	Very low	54.4	Low	165 Å²	165	72.9 Å²	72.9	88%	0.882	43%	0.432	S	S	*	.			trans	139	27	158.4	-64.7	-26.3	0	0	0	116.4	S54	S54-N56 PolarHBondContact O-N 3.33Å
57	A	35.9	Very low	55.4	Low	39 Å²	39	70.9 Å²	70.9	32%	0.322	42%	0.421	S	S	.	.			trans	-140.6	134.5	160.2	0	0	0	0	0	109.8	D59	A57-D59 VanDerWaalsContact C-N 3.25Å; A57-D59 PolarHBondContact O-N 3.46Å
58	V	42.4	Very low	56.8	Low	134 Å²	134	64.4 Å²	64.4	81%	0.812	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-15.1	-161.5	176.9	0	0	0	0	113.1
59	D	48.6	Very low	58.5	Low	120 Å²	120	62 Å²	62	64%	0.642	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	-13.2	-174.6	-65.1	-27.6	0	0	0	115.3	A57 S61 S62	A57-D59 VanDerWaalsContact C-N 3.25Å; A57-D59 PolarHBondContact O-N 3.46Å; D59-S61 PolarHBondContact O-N 3.22Å; D59-S62 PolarHBondContact O-OG 2.85Å
60	S	49.1	Very low	60.6	Low	20 Å²	20	58.6 Å²	58.6	14%	0.14	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-71.1	-15.1	-178.8	-34.4	0	0	0	0	113.6	S62 V63	S60-S62 PolarHBondContact O-N 3.49Å; S60-S62 VanDerWaalsContact O-N 3.07Å; S60-V63 PolarHBondContact O-N 3.47Å
61	S	51.9	Low	62.6	Low	110 Å²	110	56.5 Å²	56.5	77%	0.769	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-64.3	-12.8	-175.4	63.6	0	0	0	0	114.4	D59	D59-S61 PolarHBondContact O-N 3.22Å
62	S	67.1	Low	64.7	Low	58 Å²	58	52.9 Å²	52.9	41%	0.406	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-95.4	-10.7	-177.8	65.5	0	0	0	0	115.1	D59 S60 K64	D59-S62 PolarHBondContact O-OG 2.85Å; S60-S62 PolarHBondContact O-N 3.49Å; S60-S62 VanDerWaalsContact O-N 3.07Å; S62-K64 PolarHBondContact O-N 3.46Å
63	V	74.2	Confident	66.8	Low	10 Å²	10	50 Å²	50	6%	0.061	30%	0.299	C	S	.	.			trans	-73.7	125.4	-171.6	176.2	0	0	0	0	110.5	F50 L52 S60 D68 L69 L72	F50-V63 HydrophobicContact CD1-CG1 4.47Å; F50-V63 HydrophobicContact CE1-CG1 4.45Å; L52-V63 HydrophobicContact CD1-CB 3.75Å; L52-V63 HydrophobicContact CD1-CG1 4.28Å; L52-V63 WeakPolarHBondContact CD1-O 3.29Å; S60-V63 PolarHBondContact O-N 3.47Å; V63-D68 WeakPolarHBondContact CA-OD2 3.39Å; V63-L69 HydrophobicContact CG1-CB 3.79Å; V63-L69 HydrophobicContact CG1-CD1 4.34Å; V63-L69 HydrophobicContact CG2-CD1 4.26Å; V63-L72 HydrophobicContact CG2-CD2 3.64Å
64	K	77.1	Confident	69.5	Low	97 Å²	97	43.6 Å²	43.6	42%	0.422	27%	0.265	S	S	.	.			trans	-99.6	-30.7	-176.5	-59.7	170	-169.5	158.5	0	113.8	S62 D68 R128 L130	S62-K64 PolarHBondContact O-N 3.46Å; K64-D68 HydrophobicContact CB-CB 4.48Å; K64-D68 PolarHBondContact N-OD2 2.83Å; K64-R128 PolarHBondContact NZ-O 2.78Å; K64-L130 PolarHBondContact NZ-O 3.11Å
65	S	84.9	Confident	72	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.014	25%	0.253	C	S	.	.	S	Bend	trans	-159	169.6	-172.2	67.6	0	0	0	0	111.1	M43 L44 F67 D68 L69	M43-S65 VanDerWaalsContact O-CB 3.26Å; M43-S65 WeakPolarHBondContact O-CB 3.45Å; M43-S65 PolarHBondContact O-OG 3.05Å; L44-S65 WeakPolarHBondContact O-CB 3.32Å; L44-S65 PolarHBondContact O-OG 3.3Å; S65-F67 PolarHBondContact O-N 3.33Å; S65-D68 PolarHBondContact O-N 3.16Å; S65-D68 PolarHBondContact OG-N 3.45Å; S65-L69 PolarHBondContact O-N 3.29Å
66	G	87	Confident	74.7	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.3	-33.1	175.8	0	0	0	0	0	113.1	M43 L69 S70	M43-G66 PolarHBondContact O-N 2.96Å; G66-L69 PolarHBondContact O-N 3.06Å; G66-S70 WeakPolarHBondContact O-CB 3.41Å; G66-S70 PolarHBondContact O-N 3.08Å; G66-S70 PolarHBondContact O-OG 3.24Å
67	F	90.4	Very high	77.4	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.3	-45.1	173.2	-174.6	-97.9	0	0	0	111.8	I37 C39 M43 L44 S65 S70 L71 L94 L135	I37-F67 HydrophobicContact CG2-CD2 3.57Å; I37-F67 HydrophobicContact CG2-CE2 3.77Å; C39-F67 VanDerWaalsContact SG-CE2 3.58Å; M43-F67 HydrophobicContact CB-CB 4.46Å; M43-F67 VanDerWaalsContact O-CB 3.27Å; M43-F67 WeakPolarHBondContact O-CB 3.5Å; M43-F67 PolarHBondContact O-N 2.99Å; L44-F67 HydrophobicContact CD2-CB 4.02Å; L44-F67 HydrophobicContact CD2-CD1 3.91Å; L44-F67 HydrophobicContact CD2-CD2 4.08Å; L44-F67 HydrophobicContact CD2-CE1 4.37Å; L44-F67 HydrophobicContact CD2-CG 3.73Å; S65-F67 PolarHBondContact O-N 3.33Å; F67-S70 WeakPolarHBondContact O-CB 3.47Å; F67-S70 PolarHBondContact O-N 3.44Å; F67-L71 HydrophobicContact CD1-CD1 3.87Å; F67-L71 HydrophobicContact CD1-CG 4.24Å; F67-L71 HydrophobicContact CE1-CD1 3.39Å; F67-L71 HydrophobicContact CE1-CG 3.94Å; F67-L71 HydrophobicContact CZ-CD1 4.06Å; F67-L71 HydrophobicContact CZ-CD2 4.43Å; F67-L71 HydrophobicContact CZ-CG 4.28Å; F67-L71 WeakPolarHBondContact O-CG 3.36Å; F67-L71 PolarHBondContact O-N 3.29Å; F67-L94 HydrophobicContact CE2-CD1 4.41Å; F67-L94 HydrophobicContact CE2-CD2 3.75Å; F67-L94 HydrophobicContact CZ-CD1 4.24Å; F67-L94 HydrophobicContact CZ-CD2 4.07Å; F67-L135 HydrophobicContact CD1-CD1 3.85Å; F67-L135 HydrophobicContact CE1-CD1 3.92Å; F67-L135 HydrophobicContact CE1-CD2 4.07Å
68	D	90.6	Very high	80	Confident	5 Å²	5	29 Å²	29	3%	0.027	17%	0.171	C	C	.	.	H	α-helix	trans	-65.5	-38.1	175.7	-178.7	36.4	0	0	0	111.8	V63 K64 S65 S70 L71 L72 R128	V63-D68 WeakPolarHBondContact CA-OD2 3.39Å; K64-D68 HydrophobicContact CB-CB 4.48Å; K64-D68 PolarHBondContact N-OD2 2.83Å; S65-D68 PolarHBondContact O-N 3.16Å; S65-D68 PolarHBondContact OG-N 3.45Å; D68-S70 VanDerWaalsContact C-N 3.3Å; D68-S70 PolarHBondContact O-N 3.32Å; D68-L71 PolarHBondContact O-N 3.45Å; D68-L72 VanDerWaalsContact O-CB 3.27Å; D68-L72 WeakPolarHBondContact O-CB 3.45Å; D68-L72 PolarHBondContact O-N 2.89Å; D68-R128 WeakPolarHBondContact OD1-CG 3.45Å; D68-R128 IonicContact OD1-CZ 3.16Å; D68-R128 IonicContact OD1-NE 2.84Å; D68-R128 PolarHBondContact OD1-NE 3.2Å; D68-R128 IonicContact OD1-NH2 2.99Å
69	L	90.7	Very high	82.2	Confident	1 Å²	1	24.5 Å²	24.5	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-58.9	-42.8	171.8	-178.2	60.9	0	0	0	111.6	F50 V63 S65 G66 L72 C73 I214 L253 L256	F50-L69 HydrophobicContact CE1-CD2 4.5Å; F50-L69 HydrophobicContact CZ-CD2 4.36Å; V63-L69 HydrophobicContact CG1-CB 3.79Å; V63-L69 HydrophobicContact CG1-CD1 4.34Å; V63-L69 HydrophobicContact CG2-CD1 4.26Å; S65-L69 PolarHBondContact O-N 3.29Å; G66-L69 PolarHBondContact O-N 3.06Å; L69-L72 PolarHBondContact O-N 3.42Å; L69-C73 WeakPolarHBondContact O-CB 3.43Å; L69-C73 PolarHBondContact O-N 3.38Å; L69-I214 HydrophobicContact CD2-CD1 4.32Å; L69-L253 HydrophobicContact CD1-CB 4.22Å; L69-L256 HydrophobicContact CG-CD2 4.2Å
70	S	92.5	Very high	84	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-67.6	-41	179.1	-57.6	0	0	0	0	112	G66 F67 D68 C73 C74	G66-S70 WeakPolarHBondContact O-CB 3.41Å; G66-S70 PolarHBondContact O-N 3.08Å; G66-S70 PolarHBondContact O-OG 3.24Å; F67-S70 WeakPolarHBondContact O-CB 3.47Å; F67-S70 PolarHBondContact O-N 3.44Å; D68-S70 VanDerWaalsContact C-N 3.3Å; D68-S70 PolarHBondContact O-N 3.32Å; S70-C73 PolarHBondContact O-N 2.98Å; S70-C74 PolarHBondContact O-N 2.9Å
71	L	93	Very high	85.7	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-66.7	-42.9	174.1	-72.8	-175.5	0	0	0	112.2	I37 F67 D68 C73 C74 Q75 L92 I124 L127 R128	I37-L71 HydrophobicContact CD1-CD2 3.9Å; F67-L71 HydrophobicContact CD1-CD1 3.87Å; F67-L71 HydrophobicContact CD1-CG 4.24Å; F67-L71 HydrophobicContact CE1-CD1 3.39Å; F67-L71 HydrophobicContact CE1-CG 3.94Å; F67-L71 HydrophobicContact CZ-CD1 4.06Å; F67-L71 HydrophobicContact CZ-CD2 4.43Å; F67-L71 HydrophobicContact CZ-CG 4.28Å; F67-L71 WeakPolarHBondContact O-CG 3.36Å; F67-L71 PolarHBondContact O-N 3.29Å; D68-L71 PolarHBondContact O-N 3.45Å; L71-C73 VanDerWaalsContact C-N 3.29Å; L71-C73 PolarHBondContact O-N 3.25Å; L71-C74 PolarHBondContact O-N 3.24Å; L71-Q75 WeakPolarHBondContact O-CB 3.33Å; L71-Q75 PolarHBondContact O-N 3.12Å; L71-L92 HydrophobicContact CD2-CD2 4.09Å; L71-I124 HydrophobicContact CB-CG2 4.05Å; L71-I124 HydrophobicContact CD2-CG2 4.29Å; L71-I124 WeakPolarHBondContact O-CG2 3.3Å; L71-L127 HydrophobicContact CD1-CB 4.04Å; L71-R128 HydrophobicContact CB-CG 3.73Å; L71-R128 HydrophobicContact CD1-CG 4.01Å
72	L	92.2	Very high	87.3	Confident	15 Å²	15	18 Å²	18	8%	0.079	10%	0.101	C	C	.	.	H	α-helix	trans	-58.8	-44.6	175	173.7	57	0	0	0	110.4	V63 D68 L69 Q75 T76 L253	V63-L72 HydrophobicContact CG2-CD2 3.64Å; D68-L72 VanDerWaalsContact O-CB 3.27Å; D68-L72 WeakPolarHBondContact O-CB 3.45Å; D68-L72 PolarHBondContact O-N 2.89Å; L69-L72 PolarHBondContact O-N 3.42Å; L72-Q75 WeakPolarHBondContact O-CB 3.24Å; L72-Q75 PolarHBondContact O-N 2.87Å; L72-T76 PolarHBondContact O-N 2.75Å; L72-T76 PolarHBondContact O-OG1 3.43Å; L72-T76 VanDerWaalsContact O-OG1 3.1Å; L72-L253 HydrophobicContact CD1-CD2 4.27Å; L72-L253 HydrophobicContact CD2-CD1 4.33Å; L72-L253 HydrophobicContact CD2-CD2 3.82Å; L72-L253 HydrophobicContact CD2-CG 4.48Å; L72-L253 HydrophobicContact CG-CD1 3.95Å; L72-L253 HydrophobicContact CG-CD2 3.84Å; L72-L253 HydrophobicContact CG-CG 4.47Å
73	C	92.2	Very high	87.9	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.6	-47.4	175.2	-176.7	0	0	0	0	112.4	L69 S70 L71 Q75 T76 F77 L253 L256 I260	L69-C73 WeakPolarHBondContact O-CB 3.43Å; L69-C73 PolarHBondContact O-N 3.38Å; S70-C73 PolarHBondContact O-N 2.98Å; L71-C73 VanDerWaalsContact C-N 3.29Å; L71-C73 PolarHBondContact O-N 3.25Å; C73-Q75 VanDerWaalsContact C-N 3.3Å; C73-Q75 PolarHBondContact O-N 3.24Å; C73-T76 PolarHBondContact O-N 3Å; C73-F77 WeakPolarHBondContact O-CB 3.25Å; C73-F77 PolarHBondContact O-N 3.29Å; C73-L253 HydrophobicContact CB-CD1 3.88Å; C73-L256 HydrophobicContact CB-CD2 3.44Å; C73-L256 VanDerWaalsContact CB-CD2 3.44Å; C73-L256 HydrophobicContact CB-CG 4.06Å; C73-L256 VanDerWaalsContact SG-CG 3.6Å; C73-I260 WeakPolarHBondContact SG-CD1 3.23Å
74	C	93.1	Very high	88.1	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-59.6	-41.8	176.1	-170.3	0	0	0	0	111.6	F35 S70 L71 F77 Q78 I124	F35-C74 HydrophobicContact CD1-CB 4.03Å; F35-C74 HydrophobicContact CD2-CB 4.41Å; F35-C74 HydrophobicContact CE1-CB 4.29Å; F35-C74 HydrophobicContact CG-CB 4.1Å; S70-C74 PolarHBondContact O-N 2.9Å; L71-C74 PolarHBondContact O-N 3.24Å; C74-F77 PolarHBondContact O-N 3.32Å; C74-Q78 WeakPolarHBondContact O-CB 3.4Å; C74-Q78 VanDerWaalsContact O-CG 3.31Å; C74-Q78 WeakPolarHBondContact O-CG 3.27Å; C74-Q78 PolarHBondContact O-N 2.85Å; C74-I124 HydrophobicContact CB-CD1 4.45Å
75	Q	92.4	Very high	88.2	Confident	11 Å²	11	19.2 Å²	19.2	5%	0.051	11%	0.106	C	C	.	.	H	α-helix	trans	-61.2	-53.6	177	-175.4	-176	-0.3	0	0	111.6	L71 L72 C73 F77 Q78 Q79 I121 I124	L71-Q75 WeakPolarHBondContact O-CB 3.33Å; L71-Q75 PolarHBondContact O-N 3.12Å; L72-Q75 WeakPolarHBondContact O-CB 3.24Å; L72-Q75 PolarHBondContact O-N 2.87Å; C73-Q75 VanDerWaalsContact C-N 3.3Å; C73-Q75 PolarHBondContact O-N 3.24Å; Q75-F77 VanDerWaalsContact C-N 3.28Å; Q75-F77 PolarHBondContact O-N 3Å; Q75-Q78 PolarHBondContact O-N 2.87Å; Q75-Q79 WeakPolarHBondContact O-CG 3.44Å; Q75-Q79 PolarHBondContact O-N 3.36Å; Q75-I121 HydrophobicContact CG-CG2 4.12Å; Q75-I124 HydrophobicContact CB-CG2 3.92Å
76	T	90.3	Very high	87.9	Confident	25 Å²	25	22.6 Å²	22.6	15%	0.153	13%	0.128	C	C	.	.	H	α-helix	trans	-62.7	-37.9	179.5	-56.1	0	0	0	0	111.3	L72 C73 Q79 N80 L257	L72-T76 PolarHBondContact O-N 2.75Å; L72-T76 PolarHBondContact O-OG1 3.43Å; L72-T76 VanDerWaalsContact O-OG1 3.1Å; C73-T76 PolarHBondContact O-N 3Å; T76-Q79 PolarHBondContact O-N 2.82Å; T76-N80 WeakPolarHBondContact O-CB 3.15Å; T76-N80 VanDerWaalsContact O-CG 3.23Å; T76-N80 PolarHBondContact O-N 3.02Å; T76-N80 PolarHBondContact O-ND2 2.91Å; T76-L257 HydrophobicContact CG2-CD1 3.66Å; T76-L257 HydrophobicContact CG2-CD2 4.27Å
77	F	90.4	Very high	87.7	Confident	1 Å²	1	28.3 Å²	28.3	0%	0.004	15%	0.153	C	C	.	.	H	α-helix	trans	-63.7	-45.4	174.5	-174	-95.8	0	0	0	111.9	V33 F35 C73 C74 Q75 Q79 N80 K81 I90 I260 E264	V33-F77 HydrophobicContact CB-CE1 4.22Å; V33-F77 HydrophobicContact CG1-CE1 4.02Å; V33-F77 HydrophobicContact CG1-CZ 4.31Å; V33-F77 HydrophobicContact CG2-CE1 4.31Å; V33-F77 HydrophobicContact CG2-CZ 4.19Å; F35-F77 HydrophobicContact CE2-CB 4.4Å; F35-F77 AromaticContact CE2-CD1 3.45Å; F35-F77 HydrophobicContact CE2-CD1 3.45Å; F35-F77 VanDerWaalsContact CE2-CD1 3.45Å; F35-F77 AromaticContact CE2-CE1 3.9Å; F35-F77 HydrophobicContact CE2-CE1 3.9Å; F35-F77 HydrophobicContact CE2-CG 4.05Å; F35-F77 HydrophobicContact CZ-CB 3.82Å; F35-F77 AromaticContact CZ-CD1 3.54Å; F35-F77 HydrophobicContact CZ-CD1 3.54Å; F35-F77 HydrophobicContact CZ-CD2 4.33Å; F35-F77 HydrophobicContact CZ-CE1 4.16Å; F35-F77 AromaticContact CZ-CG 3.63Å; F35-F77 HydrophobicContact CZ-CG 3.63Å; C73-F77 WeakPolarHBondContact O-CB 3.25Å; C73-F77 PolarHBondContact O-N 3.29Å; C74-F77 PolarHBondContact O-N 3.32Å; Q75-F77 VanDerWaalsContact C-N 3.28Å; Q75-F77 PolarHBondContact O-N 3Å; F77-Q79 PolarHBondContact O-N 2.6Å; F77-N80 PolarHBondContact O-N 3.11Å; F77-K81 HydrophobicContact CD1-CG 4.13Å; F77-K81 HydrophobicContact CE1-CG 3.79Å; F77-K81 HydrophobicContact CE2-CG 4.47Å; F77-K81 HydrophobicContact CZ-CD 4.48Å; F77-K81 HydrophobicContact CZ-CG 3.98Å; F77-K81 VanDerWaalsContact O-CB 3.29Å; F77-K81 WeakPolarHBondContact O-CB 3.48Å; F77-K81 VanDerWaalsContact O-CG 3.31Å; F77-K81 WeakPolarHBondContact O-CG 3.15Å; F77-K81 PolarHBondContact O-N 2.72Å; F77-I90 HydrophobicContact CD1-CD1 3.83Å; F77-I90 HydrophobicContact CD1-CG1 4.43Å; F77-I90 HydrophobicContact CE1-CD1 3.85Å; F77-I90 HydrophobicContact CE1-CG1 4.11Å; F77-I260 HydrophobicContact CD2-CG2 3.55Å; F77-I260 HydrophobicContact CE2-CG2 3.47Å; F77-I260 VanDerWaalsContact CE2-CG2 3.47Å; F77-I260 HydrophobicContact CG-CG2 4.47Å; F77-I260 HydrophobicContact CZ-CG2 4.32Å; F77-E264 VanDerWaalsContact CE2-OE2 3.24Å; F77-E264 WeakPolarHBondContact CE2-OE2 3.44Å; F77-E264 WeakPolarHBondContact CZ-OE1 3.44Å; F77-E264 WeakPolarHBondContact CZ-OE2 3.44Å
78	Q	91	Very high	87.6	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.1	-41.7	174.7	-74.9	-171.5	14.6	0	0	112.3	C74 Q75 K81 A82 I90 A116 I121	C74-Q78 WeakPolarHBondContact O-CB 3.4Å; C74-Q78 VanDerWaalsContact O-CG 3.31Å; C74-Q78 WeakPolarHBondContact O-CG 3.27Å; C74-Q78 PolarHBondContact O-N 2.85Å; Q75-Q78 PolarHBondContact O-N 2.87Å; Q78-K81 PolarHBondContact O-N 2.9Å; Q78-A82 WeakPolarHBondContact O-CB 3.17Å; Q78-A82 PolarHBondContact O-N 3.42Å; Q78-I90 HydrophobicContact CB-CD1 4.27Å; Q78-I90 HydrophobicContact CG-CB 4.36Å; Q78-I90 HydrophobicContact CG-CD1 3.7Å; Q78-I90 HydrophobicContact CG-CG2 3.97Å; Q78-A116 HydrophobicContact CB-CB 4.33Å; Q78-I121 HydrophobicContact CB-CD1 4.35Å; Q78-I121 HydrophobicContact CB-CG1 3.88Å
79	Q	88.1	Confident	87.6	Confident	39 Å²	39	29.8 Å²	29.8	18%	0.182	16%	0.16	C	C	.	.	H	α-helix	trans	-61	-51.8	175.4	-74	169.8	-41.1	0	0	111.1	Q75 T76 F77 K81 A82 L83 I121 E520	Q75-Q79 WeakPolarHBondContact O-CG 3.44Å; Q75-Q79 PolarHBondContact O-N 3.36Å; T76-Q79 PolarHBondContact O-N 2.82Å; F77-Q79 PolarHBondContact O-N 2.6Å; Q79-K81 PolarHBondContact O-N 2.82Å; Q79-A82 PolarHBondContact O-N 3.13Å; Q79-L83 WeakPolarHBondContact O-CG 3.05Å; Q79-L83 PolarHBondContact O-N 3.18Å; Q79-I121 HydrophobicContact CG-CD1 4.01Å; Q79-I121 HydrophobicContact CG-CG2 4.01Å; Q79-E520 PolarHBondContact NE2-OE1 2.9Å
80	N	85.4	Confident	87.8	Confident	58 Å²	58	29.8 Å²	29.8	31%	0.31	16%	0.16	S	C	.	.	H	α-helix	trans	-58.6	-37.5	177.7	-71.3	-19.6	0	0	0	111.7	T76 F77 L83 H84	T76-N80 WeakPolarHBondContact O-CB 3.15Å; T76-N80 VanDerWaalsContact O-CG 3.23Å; T76-N80 PolarHBondContact O-N 3.02Å; T76-N80 PolarHBondContact O-ND2 2.91Å; F77-N80 PolarHBondContact O-N 3.11Å; N80-L83 PolarHBondContact O-N 2.96Å; N80-H84 WeakPolarHBondContact O-CB 3.33Å; N80-H84 PolarHBondContact O-CD2 3.09Å; N80-H84 VanDerWaalsContact O-CD2 3.3Å; N80-H84 PolarHBondContact O-N 3.13Å
81	K	85.9	Confident	87.9	Confident	14 Å²	14	29.8 Å²	29.8	6%	0.061	16%	0.16	C	C	.	.	H	α-helix	trans	-72.4	-40.9	179.1	-80.7	-72.2	173.5	-177.9	0	114.6	F77 Q78 Q79 L83 H84 S85 D88 I90 E264	F77-K81 HydrophobicContact CD1-CG 4.13Å; F77-K81 HydrophobicContact CE1-CG 3.79Å; F77-K81 HydrophobicContact CE2-CG 4.47Å; F77-K81 HydrophobicContact CZ-CD 4.48Å; F77-K81 HydrophobicContact CZ-CG 3.98Å; F77-K81 VanDerWaalsContact O-CB 3.29Å; F77-K81 WeakPolarHBondContact O-CB 3.48Å; F77-K81 VanDerWaalsContact O-CG 3.31Å; F77-K81 WeakPolarHBondContact O-CG 3.15Å; F77-K81 PolarHBondContact O-N 2.72Å; Q78-K81 PolarHBondContact O-N 2.9Å; Q79-K81 PolarHBondContact O-N 2.82Å; K81-L83 PolarHBondContact O-N 2.96Å; K81-H84 PolarHBondContact O-N 2.98Å; K81-S85 PolarHBondContact NZ-OG 2.86Å; K81-S85 CarbonylContact O-C 3.58Å; K81-S85 WeakPolarHBondContact O-CA 3.49Å; K81-S85 PolarHBondContact O-N 3.01Å; K81-D88 HydrophobicContact CD-CB 4.12Å; K81-D88 IonicContact NZ-OD2 3.74Å; K81-D88 PolarHBondContact NZ-OD2 3.2Å; K81-I90 HydrophobicContact CB-CD1 3.73Å; K81-I90 HydrophobicContact CG-CD1 3.91Å; K81-E264 WeakPolarHBondContact CE-OE1 3.19Å; K81-E264 WeakPolarHBondContact CE-OE2 3.46Å; K81-E264 IonicContact NZ-OE1 2.75Å; K81-E264 PolarHBondContact NZ-OE1 3.48Å; K81-E264 IonicContact NZ-OE2 3Å; K81-E264 PolarHBondContact NZ-OE2 2.97Å; K81-E264 VanDerWaalsContact NZ-OE2 3.12Å
82	A	84.5	Confident	88	Confident	40 Å²	40	29.8 Å²	29.8	33%	0.331	16%	0.16	S	C	.	.	H	α-helix	trans	-56.7	-33.6	172.8	0	0	0	0	0	111.3	Q78 Q79 A116	Q78-A82 WeakPolarHBondContact O-CB 3.17Å; Q78-A82 PolarHBondContact O-N 3.42Å; Q79-A82 PolarHBondContact O-N 3.13Å; A82-A116 HydrophobicContact CB-CB 4.04Å
83	L	79.6	Confident	88.1	Confident	45 Å²	45	29 Å²	29	24%	0.236	16%	0.157	C	C	.	.	H	α-helix	trans	-82.5	-45.8	179.3	-62.8	-180	0	0	0	113.9	Q79 N80 K81 Y516 L519	Q79-L83 WeakPolarHBondContact O-CG 3.05Å; Q79-L83 PolarHBondContact O-N 3.18Å; N80-L83 PolarHBondContact O-N 2.96Å; K81-L83 PolarHBondContact O-N 2.96Å; L83-Y516 HydrophobicContact CB-CD1 4.17Å; L83-Y516 HydrophobicContact CB-CE1 4.05Å; L83-Y516 HydrophobicContact CD1-CD1 3.78Å; L83-Y516 HydrophobicContact CD1-CE1 4.44Å; L83-Y516 HydrophobicContact CD1-CG 3.9Å; L83-Y516 HydrophobicContact CD2-CD1 3.56Å; L83-Y516 HydrophobicContact CD2-CE1 4.09Å; L83-Y516 HydrophobicContact CD2-CG 4.43Å; L83-Y516 HydrophobicContact CG-CD1 4.02Å; L83-Y516 HydrophobicContact CG-CE1 4.41Å; L83-L519 HydrophobicContact CD2-CD2 3.92Å
84	H	78	Confident	88.2	Confident	109 Å²	109	29 Å²	29	51%	0.505	16%	0.157	S	C	.	.	H	α-helix	trans	-103.3	-21.4	-168.7	-62.9	-52.4	0	0	0	115	N80 K81 Y516	N80-H84 WeakPolarHBondContact O-CB 3.33Å; N80-H84 PolarHBondContact O-CD2 3.09Å; N80-H84 VanDerWaalsContact O-CD2 3.3Å; N80-H84 PolarHBondContact O-N 3.13Å; K81-H84 PolarHBondContact O-N 2.98Å; H84-Y516 AromaticContact CE1-CE2 4Å; H84-Y516 AromaticContact CE1-CZ 3.94Å
85	S	79.7	Confident	88.2	Confident	38 Å²	38	29 Å²	29	27%	0.266	16%	0.157	S	C	.	.			trans	-147.7	71.5	-177.4	-47.4	0	0	0	0	110.8	K81 F87 D88	K81-S85 PolarHBondContact NZ-OG 2.86Å; K81-S85 CarbonylContact O-C 3.58Å; K81-S85 WeakPolarHBondContact O-CA 3.49Å; K81-S85 PolarHBondContact O-N 3.01Å; S85-F87 PolarHBondContact O-N 3.36Å; S85-D88 VanDerWaalsContact CB-OD2 3.23Å; S85-D88 WeakPolarHBondContact CB-OD2 3.46Å; S85-D88 WeakPolarHBondContact O-CB 3.41Å; S85-D88 PolarHBondContact O-N 3.45Å; S85-D88 VanDerWaalsContact O-N 3.13Å
86	P	78.6	Confident	88.1	Confident	72 Å²	72	29 Å²	29	47%	0.468	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-8.2	-167.9	28.7	-37.4	0	0	0	114.7
87	F	83.8	Confident	88	Confident	121 Å²	121	27.8 Å²	27.8	53%	0.531	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-6.2	179.4	-59.4	-64	0	0	0	113.9	R30 S85	R30-F87 HydrophobicContact CG-CB 4.17Å; S85-F87 PolarHBondContact O-N 3.36Å
88	D	87.6	Confident	87.7	Confident	19 Å²	19	31 Å²	31	10%	0.102	17%	0.171	C	C	.	.			trans	-73.4	147.7	177.1	-71.9	-7.5	0	0	0	110.3	S31 K81 S85	S31-D88 PolarHBondContact N-OD1 3.28Å; S31-D88 WeakPolarHBondContact O-CA 3.38Å; S31-D88 WeakPolarHBondContact OG-CB 3.26Å; S31-D88 PolarHBondContact OG-OD1 3.44Å; S31-D88 PolarHBondContact OG-OD2 2.9Å; K81-D88 HydrophobicContact CD-CB 4.12Å; K81-D88 IonicContact NZ-OD2 3.74Å; K81-D88 PolarHBondContact NZ-OD2 3.2Å; S85-D88 VanDerWaalsContact CB-OD2 3.23Å; S85-D88 WeakPolarHBondContact CB-OD2 3.46Å; S85-D88 WeakPolarHBondContact O-CB 3.41Å; S85-D88 PolarHBondContact O-N 3.45Å; S85-D88 VanDerWaalsContact O-N 3.13Å
89	M	91.6	Very high	87.2	Confident	16 Å²	16	35.7 Å²	35.7	8%	0.079	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	135	-179	-61.5	-175.1	159.3	0	0	110.6	S31 G32 V33 L113 G114 L115 K168 F170	S31-M89 PolarHBondContact O-N 3.25Å; G32-M89 CarbonylContact C-O 3.56Å; G32-M89 WeakPolarHBondContact CA-O 3.42Å; V33-M89 PolarHBondContact N-O 2.96Å; M89-L113 HydrophobicContact CB-CD1 3.86Å; M89-L113 HydrophobicContact CB-CG 3.84Å; M89-L113 WeakPolarHBondContact O-CD1 3.42Å; M89-G114 CarbonylContact C-O 3.5Å; M89-G114 VanDerWaalsContact CA-O 3.22Å; M89-G114 WeakPolarHBondContact CA-O 3.48Å; M89-L115 HydrophobicContact CE-CD2 4.14Å; M89-L115 HydrophobicContact CE-CG 4.43Å; M89-L115 HydrophobicContact CG-CD2 4.13Å; M89-K168 HydrophobicContact CE-CB 4.07Å; M89-K168 HydrophobicContact CE-CG 3.44Å; M89-K168 VanDerWaalsContact CE-CG 3.44Å; M89-K168 HydrophobicContact SD-CB 4.16Å; M89-K168 HydrophobicContact SD-CG 4.16Å; M89-F170 HydrophobicContact CB-CE1 3.68Å; M89-F170 HydrophobicContact CB-CZ 4.05Å; M89-F170 HydrophobicContact CG-CE1 3.76Å; M89-F170 HydrophobicContact CG-CZ 4.17Å; M89-F170 HydrophobicContact SD-CE1 3.57Å; M89-F170 VanDerWaalsContact SD-CE1 3.57Å; M89-F170 HydrophobicContact SD-CZ 3.47Å; M89-F170 WeakPolarHBondContact SD-CZ 3.48Å
90	I	93.6	Very high	87	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	138.4	-176.5	-55.6	169.1	0	0	0	107.9	V33 F35 F77 Q78 K81 G114 A116 R120	V33-I90 CarbonylContact O-C 3.58Å; V33-I90 VanDerWaalsContact O-CA 3.23Å; V33-I90 WeakPolarHBondContact O-CA 3.32Å; F35-I90 HydrophobicContact CD2-CG2 3.92Å; F35-I90 HydrophobicContact CE2-CG2 3.95Å; F77-I90 HydrophobicContact CD1-CD1 3.83Å; F77-I90 HydrophobicContact CD1-CG1 4.43Å; F77-I90 HydrophobicContact CE1-CD1 3.85Å; F77-I90 HydrophobicContact CE1-CG1 4.11Å; Q78-I90 HydrophobicContact CB-CD1 4.27Å; Q78-I90 HydrophobicContact CG-CB 4.36Å; Q78-I90 HydrophobicContact CG-CD1 3.7Å; Q78-I90 HydrophobicContact CG-CG2 3.97Å; K81-I90 HydrophobicContact CB-CD1 3.73Å; K81-I90 HydrophobicContact CG-CD1 3.91Å; I90-G114 PolarHBondContact N-O 3.08Å; I90-G114 PolarHBondContact O-N 3.36Å; I90-G114 VanDerWaalsContact O-N 3.09Å; I90-A116 HydrophobicContact CD1-CB 4.22Å; I90-R120 PolarHBondContact O-NH2 3.4Å
91	G	94.5	Very high	86.3	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	152	172.7	0	0	0	0	0	110.6	V33 I34 F35 Q111	V33-G91 PolarHBondContact O-N 3.1Å; I34-G91 WeakPolarHBondContact CA-O 3.42Å; F35-G91 PolarHBondContact N-O 3.33Å; G91-Q111 WeakPolarHBondContact CA-O 3.47Å
92	L	95.7	Very high	85.4	Confident	1 Å²	1	39 Å²	39	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	117.4	175.7	179.7	62.1	0	0	0	109.2	F35 I37 L71 L110 Q111 I124	F35-L92 HydrophobicContact CB-CD1 3.87Å; I37-L92 HydrophobicContact CD1-CD1 3.52Å; I37-L92 HydrophobicContact CG1-CD1 4.04Å; L71-L92 HydrophobicContact CD2-CD2 4.09Å; L92-L110 HydrophobicContact CB-CB 4.41Å; L92-L110 HydrophobicContact CD2-CB 4.06Å; L92-L110 HydrophobicContact CD2-CD1 3.72Å; L92-L110 HydrophobicContact CG-CB 4.1Å; L92-L110 HydrophobicContact CG-CD1 4.12Å; L92-L110 PolarHBondContact O-N 3.19Å; L92-Q111 HydrophobicContact CB-CB 3.98Å; L92-Q111 HydrophobicContact CB-CG 4.19Å; L92-Q111 PolarHBondContact N-O 2.94Å; L92-Q111 PolarHBondContact O-N 3.45Å; L92-I124 HydrophobicContact CD2-CD1 4.22Å; L92-I124 HydrophobicContact CD2-CG1 4.14Å
93	V	95	Very high	84.7	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	132.1	-178	-174.9	0	0	0	0	108.8	I34 F35 L36 I37 I107 M108 V109	I34-V93 HydrophobicContact CG2-CB 4.38Å; I34-V93 HydrophobicContact CG2-CG2 3.71Å; F35-V93 PolarHBondContact O-N 2.86Å; L36-V93 CarbonylContact C-O 3.56Å; L36-V93 WeakPolarHBondContact CA-O 3.37Å; L36-V93 HydrophobicContact CD1-CB 3.91Å; L36-V93 HydrophobicContact CD1-CG1 3.72Å; I37-V93 PolarHBondContact N-O 3.23Å; V93-I107 HydrophobicContact CG1-CG2 3.74Å; V93-M108 WeakPolarHBondContact CA-O 3.34Å; V93-V109 HydrophobicContact CG1-CG2 4.47Å; V93-V109 HydrophobicContact CG2-CG2 4.29Å
94	L	94.4	Very high	84.6	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	137.7	171.8	-56.6	-172.4	0	0	0	109.7	I37 F67 T97 I107 M108 L110 Y139	I37-L94 HydrophobicContact CB-CD2 3.88Å; I37-L94 HydrophobicContact CG2-CD2 4.45Å; I37-L94 WeakPolarHBondContact O-CA 3.04Å; F67-L94 HydrophobicContact CE2-CD1 4.41Å; F67-L94 HydrophobicContact CE2-CD2 3.75Å; F67-L94 HydrophobicContact CZ-CD1 4.24Å; F67-L94 HydrophobicContact CZ-CD2 4.07Å; L94-T97 HydrophobicContact CB-CG2 3.6Å; L94-T97 HydrophobicContact CD1-CG2 4.17Å; L94-I107 WeakPolarHBondContact O-CA 3.41Å; L94-M108 HydrophobicContact CB-CB 4.35Å; L94-M108 PolarHBondContact N-O 2.88Å; L94-M108 PolarHBondContact O-N 3.09Å; L94-L110 HydrophobicContact CD1-CD1 3.53Å; L94-L110 HydrophobicContact CD1-CD2 4.38Å; L94-L110 HydrophobicContact CD1-CG 3.89Å; L94-L110 HydrophobicContact CD2-CD1 3.92Å; L94-L110 HydrophobicContact CG-CD1 3.61Å; L94-L110 HydrophobicContact CG-CG 3.89Å; L94-Y139 HydrophobicContact CD1-CD1 4.2Å; L94-Y139 HydrophobicContact CD1-CD2 3.98Å; L94-Y139 HydrophobicContact CD1-CE1 4.38Å; L94-Y139 HydrophobicContact CD1-CE2 4.15Å; L94-Y139 HydrophobicContact CD1-CG 3.99Å
95	M	92.4	Very high	84.9	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	157.5	171.2	68.4	176.9	-161.4	0	0	111.6	L36 I37 D38 C39 T97 F150 L152 A155 L177	L36-M95 HydrophobicContact CD1-CB 4.07Å; L36-M95 HydrophobicContact CD1-CG 4.3Å; L36-M95 HydrophobicContact CD1-SD 4.38Å; L36-M95 HydrophobicContact CD2-SD 4.17Å; L36-M95 HydrophobicContact CG-SD 4.14Å; I37-M95 PolarHBondContact O-N 3.42Å; D38-M95 HydrophobicContact CB-CE 3.59Å; D38-M95 HydrophobicContact CB-CG 4.33Å; D38-M95 WeakPolarHBondContact OD2-CE 3.39Å; C39-M95 VanDerWaalsContact CB-O 3.3Å; C39-M95 WeakPolarHBondContact CB-O 3.33Å; C39-M95 PolarHBondContact N-O 2.9Å; M95-T97 VanDerWaalsContact C-N 3.3Å; M95-T97 PolarHBondContact O-N 3.4Å; M95-F150 HydrophobicContact CB-CE1 3.98Å; M95-F150 HydrophobicContact CB-CZ 3.72Å; M95-F150 HydrophobicContact CG-CE1 4.34Å; M95-F150 HydrophobicContact SD-CE1 3.88Å; M95-L152 HydrophobicContact SD-CD1 4.04Å; M95-A155 HydrophobicContact CB-CB 4.35Å; M95-L177 HydrophobicContact CE-CD1 3.51Å; M95-L177 HydrophobicContact SD-CD1 3.89Å
96	R	89.3	Confident	85.2	Confident	9 Å²	9	45.9 Å²	45.9	3%	0.034	25%	0.249	C	C	.	.	S	Bend	trans	64.2	26.6	-174.9	-58.3	-173.7	179.5	-99.9	11.2	115.5	D38 N106 I142 F150 D181 P184	D38-R96 WeakPolarHBondContact OD1-CD 3.29Å; D38-R96 IonicContact OD1-NE 3.98Å; R96-N106 PolarHBondContact N-O 3.28Å; R96-I142 VanDerWaalsContact CA-CD1 3.46Å; R96-I142 HydrophobicContact CB-CD1 4.12Å; R96-I142 WeakPolarHBondContact O-CD1 3.49Å; R96-I142 WeakPolarHBondContact O-CG1 3.49Å; R96-I142 PolarHBondContact O-N 3.45Å; R96-F150 HydrophobicContact CG-CB 4.26Å; R96-F150 HydrophobicContact CG-CD1 4.16Å; R96-F150 HydrophobicContact CG-CD2 3.77Å; R96-F150 HydrophobicContact CG-CE1 4.48Å; R96-F150 HydrophobicContact CG-CE2 4.13Å; R96-F150 HydrophobicContact CG-CG 3.8Å; R96-F150 HydrophobicContact CG-CZ 4.47Å; R96-F150 VanDerWaalsContact CZ-CB 3.44Å; R96-F150 VanDerWaalsContact NH1-CB 3.3Å; R96-D181 IonicContact CZ-OD2 3.16Å; R96-D181 IonicContact NE-OD2 2.86Å; R96-D181 IonicContact NH2-OD2 3.9Å; R96-D181 PolarHBondContact NH2-OD2 3.45Å; R96-P184 PolarHBondContact NH2-O 3.13Å
97	T	88.8	Confident	85.8	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-78.9	152.7	175.6	54.3	0	0	0	0	111.9	C39 L94 M95 E99 N106 M108 G140 I142	C39-T97 HydrophobicContact CB-CG2 4.15Å; L94-T97 HydrophobicContact CB-CG2 3.6Å; L94-T97 HydrophobicContact CD1-CG2 4.17Å; M95-T97 VanDerWaalsContact C-N 3.3Å; M95-T97 PolarHBondContact O-N 3.4Å; T97-E99 WeakPolarHBondContact CB-O 3.47Å; T97-E99 PolarHBondContact OG1-O 3.38Å; T97-N106 PolarHBondContact N-O 2.94Å; T97-N106 VanDerWaalsContact O-CA 3.27Å; T97-N106 WeakPolarHBondContact O-CA 3.27Å; T97-N106 PolarHBondContact O-ND2 3.43Å; T97-N106 PolarHBondContact OG1-O 3.12Å; T97-M108 HydrophobicContact CG2-CB 4.27Å; T97-G140 WeakPolarHBondContact CA-O 3.43Å; T97-I142 WeakPolarHBondContact O-CD1 3.48Å; T97-I142 WeakPolarHBondContact O-CG1 3.45Å
98	S	84	Confident	86.1	Confident	69 Å²	69	38.2 Å²	38.2	48%	0.483	21%	0.21	S	C	.	.	S	Bend	trans	-72.6	-37.2	169.2	72.3	0	0	0	0	111.6	Y139 G140	S98-Y139 WeakPolarHBondContact CA-O 3.35Å; S98-Y139 WeakPolarHBondContact CB-O 3.49Å; S98-Y139 PolarHBondContact N-O 3Å; S98-Y139 PolarHBondContact OG-O 2.89Å; S98-G140 PolarHBondContact N-O 2.99Å; S98-G140 VanDerWaalsContact OG-CA 3.3Å; S98-G140 WeakPolarHBondContact OG-CA 3.44Å
99	E	81.5	Confident	86.3	Confident	99 Å²	99	38.7 Å²	38.7	46%	0.463	21%	0.213	S	C	.	.	S	Bend	trans	-79.7	157.9	172.9	-61.8	-160.2	156.5	0	0	111.3	T97 R138 Y139	T97-E99 WeakPolarHBondContact CB-O 3.47Å; T97-E99 PolarHBondContact OG1-O 3.38Å; E99-R138 VanDerWaalsContact CD-O 3.29Å; E99-Y139 PolarHBondContact N-O 2.98Å
100	S	82.9	Confident	86.3	Confident	57 Å²	57	38.9 Å²	38.9	40%	0.399	21%	0.214	S	C	.	.			trans	-141.6	130.1	178.2	-51.7	0	0	0	0	108.9	N106 I107	S100-N106 PolarHBondContact OG-N 2.98Å; S100-I107 WeakPolarHBondContact CA-O 3.36Å
101	S	71.6	Confident	86.3	Confident	66 Å²	66	39 Å²	39	46%	0.462	22%	0.215	S	C	.	.	S	Bend	trans	-97.3	-12.5	180	69.7	0	0	0	0	113.1	I107 V109	S101-I107 PolarHBondContact N-O 3.46Å; S101-V109 PolarHBondContact OG-N 2.76Å
102	V	66.1	Low	86.3	Confident	57 Å²	57	43 Å²	43	35%	0.345	24%	0.241	S	C	.	.	S	Bend	trans	-126.5	164	-176.3	-168.3	0	0	0	0	108.1	T104 V109	V102-T104 CarbonylContact O-C 3.59Å; V102-T104 PolarHBondContact O-N 3.45Å; V102-V109 HydrophobicContact CG2-CG2 3.74Å
103	D	71.1	Confident	86.2	Confident	167 Å²	167	44 Å²	44	89%	0.893	25%	0.246	S	C	*	.	S	Bend	trans	-54.6	-11.7	174	-63.8	-36	0	0	0	114.2
104	T	77.5	Confident	86	Confident	10 Å²	10	44.6 Å²	44.6	6%	0.061	25%	0.252	C	S	.	.	S	Bend	trans	-81.7	118.7	170.2	54.4	0	0	0	0	110.7	V102 W157	V102-T104 CarbonylContact O-C 3.59Å; V102-T104 PolarHBondContact O-N 3.45Å; T104-W157 HydrophobicContact CG2-CE3 3.57Å; T104-W157 HydrophobicContact CG2-CZ3 3.62Å
105	K	82.9	Confident	85.9	Confident	154 Å²	154	48.2 Å²	48.2	67%	0.67	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	146.6	175.8	-64.4	-179.2	179.2	179.3	0	109.7	I107	K105-I107 PolarHBondContact O-N 3.19Å
106	N	86.9	Confident	85.7	Confident	45 Å²	45	49.3 Å²	49.3	24%	0.241	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	18.4	167.1	-58.6	120.4	0	0	0	116.3	R96 T97 S100 I142 F150	R96-N106 PolarHBondContact N-O 3.28Å; T97-N106 PolarHBondContact N-O 2.94Å; T97-N106 VanDerWaalsContact O-CA 3.27Å; T97-N106 WeakPolarHBondContact O-CA 3.27Å; T97-N106 PolarHBondContact O-ND2 3.43Å; T97-N106 PolarHBondContact OG1-O 3.12Å; S100-N106 PolarHBondContact OG-N 2.98Å; N106-I142 HydrophobicContact CB-CD1 3.31Å; N106-I142 HydrophobicContact CB-CG1 4.44Å; N106-I142 WeakPolarHBondContact ND2-CD1 3.36Å; N106-I142 VanDerWaalsContact ND2-CG1 3.32Å; N106-I142 WeakPolarHBondContact ND2-CG1 3.22Å; N106-F150 HydrophobicContact CB-CE2 4.06Å
107	I	90.4	Very high	85.6	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	128.1	179.9	-65.7	147.6	0	0	0	108.6	V93 L94 S100 S101 K105 F150 E154 A155 A158	V93-I107 HydrophobicContact CG1-CG2 3.74Å; L94-I107 WeakPolarHBondContact O-CA 3.41Å; S100-I107 WeakPolarHBondContact CA-O 3.36Å; S101-I107 PolarHBondContact N-O 3.46Å; K105-I107 PolarHBondContact O-N 3.19Å; I107-F150 HydrophobicContact CD1-CZ 4.42Å; I107-F150 HydrophobicContact CG1-CE2 4.48Å; I107-F150 HydrophobicContact CG1-CZ 4.09Å; I107-E154 VanDerWaalsContact CD1-C 3.49Å; I107-E154 HydrophobicContact CD1-CB 3.87Å; I107-A155 VanDerWaalsContact CD1-CA 3.47Å; I107-A155 HydrophobicContact CD1-CB 3.96Å; I107-A155 VanDerWaalsContact CD1-N 3.34Å; I107-A155 HydrophobicContact CG1-CB 4.1Å; I107-A158 HydrophobicContact CG2-CB 4.01Å
108	M	91.3	Very high	85.5	Confident	33 Å²	33	53.9 Å²	53.9	16%	0.163	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	118.4	179	-175.2	179.6	-168.7	0	0	110.4	V93 L94 T97 L110 Y139	V93-M108 WeakPolarHBondContact CA-O 3.34Å; L94-M108 HydrophobicContact CB-CB 4.35Å; L94-M108 PolarHBondContact N-O 2.88Å; L94-M108 PolarHBondContact O-N 3.09Å; T97-M108 HydrophobicContact CG2-CB 4.27Å; M108-L110 HydrophobicContact CE-CD2 3.84Å; M108-L110 HydrophobicContact CG-CD2 4.42Å; M108-L110 PolarHBondContact O-N 2.92Å; M108-L110 HydrophobicContact SD-CD2 3.94Å; M108-Y139 HydrophobicContact CE-CD1 4.09Å; M108-Y139 HydrophobicContact CE-CE1 3.73Å; M108-Y139 HydrophobicContact SD-CD1 3.29Å; M108-Y139 WeakPolarHBondContact SD-CD1 3.3Å; M108-Y139 HydrophobicContact SD-CE1 3.43Å; M108-Y139 WeakPolarHBondContact SD-CE1 3.2Å; M108-Y139 HydrophobicContact SD-CG 4.45Å
109	V	92.1	Very high	85.8	Confident	28 Å²	28	55.1 Å²	55.1	17%	0.17	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	98.6	170.5	-177.9	0	0	0	0	107.5	V93 S101 V102 P112	V93-V109 HydrophobicContact CG1-CG2 4.47Å; V93-V109 HydrophobicContact CG2-CG2 4.29Å; S101-V109 PolarHBondContact OG-N 2.76Å; V102-V109 HydrophobicContact CG2-CG2 3.74Å; V109-P112 HydrophobicContact CG1-CB 4.37Å
110	L	91.5	Very high	86.4	Confident	21 Å²	21	51.7 Å²	51.7	11%	0.11	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	-48.8	176	-77.5	179.3	0	0	0	111.1	L92 L94 M108 L127 Y139	L92-L110 HydrophobicContact CB-CB 4.41Å; L92-L110 HydrophobicContact CD2-CB 4.06Å; L92-L110 HydrophobicContact CD2-CD1 3.72Å; L92-L110 HydrophobicContact CG-CB 4.1Å; L92-L110 HydrophobicContact CG-CD1 4.12Å; L92-L110 PolarHBondContact O-N 3.19Å; L94-L110 HydrophobicContact CD1-CD1 3.53Å; L94-L110 HydrophobicContact CD1-CD2 4.38Å; L94-L110 HydrophobicContact CD1-CG 3.89Å; L94-L110 HydrophobicContact CD2-CD1 3.92Å; L94-L110 HydrophobicContact CG-CD1 3.61Å; L94-L110 HydrophobicContact CG-CG 3.89Å; M108-L110 HydrophobicContact CE-CD2 3.84Å; M108-L110 HydrophobicContact CG-CD2 4.42Å; M108-L110 PolarHBondContact O-N 2.92Å; M108-L110 HydrophobicContact SD-CD2 3.94Å; L110-L127 HydrophobicContact CD1-CD1 3.94Å; L110-Y139 HydrophobicContact CD2-CE1 3.61Å; L110-Y139 VanDerWaalsContact CD2-OH 3.27Å; L110-Y139 WeakPolarHBondContact CD2-OH 3.34Å
111	Q	93.7	Very high	86.8	Confident	3 Å²	3	49.5 Å²	49.5	1%	0.014	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	114.3	178.1	-55.2	-172.3	-22.1	0	0	109.4	G91 L92 R120 E123	G91-Q111 WeakPolarHBondContact CA-O 3.47Å; L92-Q111 HydrophobicContact CB-CB 3.98Å; L92-Q111 HydrophobicContact CB-CG 4.19Å; L92-Q111 PolarHBondContact N-O 2.94Å; L92-Q111 PolarHBondContact O-N 3.45Å; Q111-R120 VanDerWaalsContact CB-NH2 3.26Å; Q111-R120 PolarHBondContact NE2-O 3.06Å; Q111-E123 PolarHBondContact NE2-OE2 2.8Å
112	P	93.2	Very high	87.7	Confident	84 Å²	84	48.8 Å²	48.8	55%	0.545	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	154.8	174.5	28.7	-34.3	0	0	0	109.9	V109 G114 R120	V109-P112 HydrophobicContact CG1-CB 4.37Å; P112-G114 PolarHBondContact O-N 2.92Å; P112-R120 PolarHBondContact O-NH1 2.99Å; P112-R120 PolarHBondContact O-NH2 2.84Å
113	L	93	Very high	88.9	Confident	23 Å²	23	49.6 Å²	49.6	12%	0.12	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.3	112.7	178	-167.1	64.7	0	0	0	111.3	I34 M89 Q162 F163 F170	I34-L113 HydrophobicContact CG1-CD1 4.08Å; M89-L113 HydrophobicContact CB-CD1 3.86Å; M89-L113 HydrophobicContact CB-CG 3.84Å; M89-L113 WeakPolarHBondContact O-CD1 3.42Å; L113-Q162 HydrophobicContact CB-CB 4.32Å; L113-F163 HydrophobicContact CD1-CE1 4.4Å; L113-F163 HydrophobicContact CD2-CD1 3.51Å; L113-F163 HydrophobicContact CD2-CE1 3.79Å; L113-F163 HydrophobicContact CD2-CG 4.39Å; L113-F170 HydrophobicContact CD2-CD2 4.47Å; L113-F170 HydrophobicContact CD2-CE1 4.29Å; L113-F170 HydrophobicContact CD2-CE2 3.47Å; L113-F170 VanDerWaalsContact CD2-CE2 3.47Å; L113-F170 HydrophobicContact CD2-CZ 3.34Å; L113-F170 HydrophobicContact CG-CZ 3.98Å
114	G	92.5	Very high	90	Very high	12 Å²	12	41.7 Å²	41.7	12%	0.124	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	174.6	-174.7	0	0	0	0	0	112.2	M89 I90 P112	M89-G114 CarbonylContact C-O 3.5Å; M89-G114 VanDerWaalsContact CA-O 3.22Å; M89-G114 WeakPolarHBondContact CA-O 3.48Å; I90-G114 PolarHBondContact N-O 3.08Å; I90-G114 PolarHBondContact O-N 3.36Å; I90-G114 VanDerWaalsContact O-N 3.09Å; P112-G114 PolarHBondContact O-N 2.92Å
115	L	91.4	Very high	90.6	Very high	76 Å²	76	43.4 Å²	43.4	40%	0.398	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	146.8	-179.9	-59.9	177.8	0	0	0	110.6	M89 D117 R120	M89-L115 HydrophobicContact CE-CD2 4.14Å; M89-L115 HydrophobicContact CE-CG 4.43Å; M89-L115 HydrophobicContact CG-CD2 4.13Å; L115-D117 PolarHBondContact O-N 3.39Å; L115-R120 VanDerWaalsContact O-CD 3.27Å; L115-R120 WeakPolarHBondContact O-CD 3.27Å
116	A	88.8	Confident	90.9	Very high	22 Å²	22	42.6 Å²	42.6	18%	0.182	23%	0.232	C	C	.	.			trans	-66.6	123.6	168.9	0	0	0	0	0	109.1	Q78 A82 I90	Q78-A116 HydrophobicContact CB-CB 4.33Å; A82-A116 HydrophobicContact CB-CB 4.04Å; I90-A116 HydrophobicContact CD1-CB 4.22Å
117	D	86.5	Confident	91.1	Very high	64 Å²	64	40.7 Å²	40.7	34%	0.342	22%	0.222	S	C	.	.			trans	-135.6	165.5	176.5	68.5	41.8	0	0	0	110.4	L115 T119 R120 I121	L115-D117 PolarHBondContact O-N 3.39Å; D117-T119 PolarHBondContact O-N 2.86Å; D117-T119 WeakPolarHBondContact OD1-CA 3.36Å; D117-T119 WeakPolarHBondContact OD1-CB 3.45Å; D117-T119 PolarHBondContact OD1-N 3.5Å; D117-T119 PolarHBondContact OD1-OG1 3.11Å; D117-R120 PolarHBondContact O-N 2.97Å; D117-R120 WeakPolarHBondContact OD1-CB 3.46Å; D117-R120 VanDerWaalsContact OD1-CG 3.25Å; D117-R120 WeakPolarHBondContact OD1-CG 3.34Å; D117-R120 PolarHBondContact OD1-N 3.25Å; D117-I121 WeakPolarHBondContact O-CG1 3.3Å; D117-I121 PolarHBondContact O-N 3.01Å; D117-I121 VanDerWaalsContact O-N 3.13Å
118	S	86.9	Confident	91.1	Very high	42 Å²	42	42.6 Å²	42.6	29%	0.294	23%	0.229	S	C	.	.	H	α-helix	trans	-61	-33.1	-179.3	50	0	0	0	0	112.6	I121 L122 A523	S118-I121 PolarHBondContact O-N 3.2Å; S118-L122 WeakPolarHBondContact O-CB 3.27Å; S118-L122 WeakPolarHBondContact O-CG 3.37Å; S118-L122 PolarHBondContact O-N 3.12Å; S118-A523 WeakPolarHBondContact CB-O 3.49Å; S118-A523 PolarHBondContact OG-O 3.47Å
119	T	90.9	Very high	90.9	Very high	95 Å²	95	47.2 Å²	47.2	58%	0.583	25%	0.25	S	C	*	.	H	α-helix	trans	-67.7	-40.9	-178.6	66.6	0	0	0	0	112.1	D117 E123	D117-T119 PolarHBondContact O-N 2.86Å; D117-T119 WeakPolarHBondContact OD1-CA 3.36Å; D117-T119 WeakPolarHBondContact OD1-CB 3.45Å; D117-T119 PolarHBondContact OD1-N 3.5Å; D117-T119 PolarHBondContact OD1-OG1 3.11Å; T119-E123 WeakPolarHBondContact O-CB 3.35Å; T119-E123 PolarHBondContact O-N 3.47Å
120	R	92.9	Very high	90.7	Very high	27 Å²	27	47.9 Å²	47.9	10%	0.102	25%	0.252	C	S	.	.	H	α-helix	trans	-69.6	-39.8	177.5	-68.5	172.7	70.5	121.3	1.2	111.9	I90 Q111 P112 L115 D117 E123 I124	I90-R120 PolarHBondContact O-NH2 3.4Å; Q111-R120 VanDerWaalsContact CB-NH2 3.26Å; Q111-R120 PolarHBondContact NE2-O 3.06Å; P112-R120 PolarHBondContact O-NH1 2.99Å; P112-R120 PolarHBondContact O-NH2 2.84Å; L115-R120 VanDerWaalsContact O-CD 3.27Å; L115-R120 WeakPolarHBondContact O-CD 3.27Å; D117-R120 PolarHBondContact O-N 2.97Å; D117-R120 WeakPolarHBondContact OD1-CB 3.46Å; D117-R120 VanDerWaalsContact OD1-CG 3.25Å; D117-R120 WeakPolarHBondContact OD1-CG 3.34Å; D117-R120 PolarHBondContact OD1-N 3.25Å; R120-E123 WeakPolarHBondContact O-CB 3.3Å; R120-E123 PolarHBondContact O-N 3.13Å; R120-I124 PolarHBondContact O-N 2.81Å
121	I	90.8	Very high	90.3	Very high	10 Å²	10	53.2 Å²	53.2	5%	0.051	28%	0.275	C	S	.	.	H	α-helix	trans	-64.9	-46.2	175.8	-67	166.9	0	0	0	110	Q75 Q78 Q79 D117 S118 E123 I124 E125 L524	Q75-I121 HydrophobicContact CG-CG2 4.12Å; Q78-I121 HydrophobicContact CB-CD1 4.35Å; Q78-I121 HydrophobicContact CB-CG1 3.88Å; Q79-I121 HydrophobicContact CG-CD1 4.01Å; Q79-I121 HydrophobicContact CG-CG2 4.01Å; D117-I121 WeakPolarHBondContact O-CG1 3.3Å; D117-I121 PolarHBondContact O-N 3.01Å; D117-I121 VanDerWaalsContact O-N 3.13Å; S118-I121 PolarHBondContact O-N 3.2Å; I121-E123 VanDerWaalsContact C-N 3.3Å; I121-E123 PolarHBondContact O-N 3.01Å; I121-I124 PolarHBondContact O-N 2.9Å; I121-E125 PolarHBondContact O-N 2.93Å; I121-L524 HydrophobicContact CG2-CD2 4.44Å
122	L	91.1	Very high	89.8	Confident	52 Å²	52	54.6 Å²	54.6	27%	0.272	28%	0.284	S	S	.	.	H	α-helix	trans	-66	-31	177.7	-71.4	171.2	0	0	0	112.7	S118 E125 K126 L524	S118-L122 WeakPolarHBondContact O-CB 3.27Å; S118-L122 WeakPolarHBondContact O-CG 3.37Å; S118-L122 PolarHBondContact O-N 3.12Å; L122-E125 PolarHBondContact O-N 3.19Å; L122-K126 VanDerWaalsContact O-CG 3.26Å; L122-K126 WeakPolarHBondContact O-CG 3.39Å; L122-K126 PolarHBondContact O-N 3.06Å; L122-L524 HydrophobicContact CD1-CD2 4.25Å; L122-L524 HydrophobicContact CD2-CD2 4.04Å; L122-L524 HydrophobicContact CG-CD2 3.85Å
123	E	92.8	Very high	89.3	Confident	74 Å²	74	55.1 Å²	55.1	35%	0.346	28%	0.282	S	S	.	.	H	α-helix	trans	-62.2	-47.1	173.2	-176.9	-178.3	-155	0	0	111.2	Q111 T119 R120 I121 K126 L127	Q111-E123 PolarHBondContact NE2-OE2 2.8Å; T119-E123 WeakPolarHBondContact O-CB 3.35Å; T119-E123 PolarHBondContact O-N 3.47Å; R120-E123 WeakPolarHBondContact O-CB 3.3Å; R120-E123 PolarHBondContact O-N 3.13Å; I121-E123 VanDerWaalsContact C-N 3.3Å; I121-E123 PolarHBondContact O-N 3.01Å; E123-K126 PolarHBondContact O-N 2.85Å; E123-L127 WeakPolarHBondContact O-CG 3.45Å; E123-L127 PolarHBondContact O-N 2.87Å
124	I	92.6	Very high	88.9	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.7	-42.7	175.9	-62.8	170.5	0	0	0	110.5	L71 C74 Q75 L92 R120 I121 K126 L127 R128	L71-I124 HydrophobicContact CB-CG2 4.05Å; L71-I124 HydrophobicContact CD2-CG2 4.29Å; L71-I124 WeakPolarHBondContact O-CG2 3.3Å; C74-I124 HydrophobicContact CB-CD1 4.45Å; Q75-I124 HydrophobicContact CB-CG2 3.92Å; L92-I124 HydrophobicContact CD2-CD1 4.22Å; L92-I124 HydrophobicContact CD2-CG1 4.14Å; R120-I124 PolarHBondContact O-N 2.81Å; I121-I124 PolarHBondContact O-N 2.9Å; I124-K126 VanDerWaalsContact C-N 3.3Å; I124-K126 PolarHBondContact O-N 2.87Å; I124-L127 WeakPolarHBondContact O-CB 3.45Å; I124-L127 PolarHBondContact O-N 3.2Å; I124-R128 HydrophobicContact CG2-CG 4.46Å; I124-R128 WeakPolarHBondContact O-CG 3.46Å; I124-R128 PolarHBondContact O-N 2.69Å
125	E	89.6	Confident	88.5	Confident	47 Å²	47	58 Å²	58	22%	0.22	29%	0.292	C	S	.	.	H	α-helix	trans	-57.3	-43.4	176.5	-168.6	178	160.9	0	0	111.7	I121 L122 L127 R128 Q129 R526	I121-E125 PolarHBondContact O-N 2.93Å; L122-E125 PolarHBondContact O-N 3.19Å; E125-L127 PolarHBondContact O-N 2.87Å; E125-R128 PolarHBondContact O-N 2.76Å; E125-Q129 WeakPolarHBondContact O-CG 3.35Å; E125-Q129 PolarHBondContact O-N 2.55Å; E125-R526 IonicContact OE1-NH2 3.86Å; E125-R526 PolarHBondContact OE1-NH2 3.34Å; E125-R526 IonicContact OE2-NH2 3.46Å; E125-R526 PolarHBondContact OE2-NH2 3.29Å
126	K	91	Very high	88.1	Confident	137 Å²	137	56.9 Å²	56.9	60%	0.596	29%	0.285	S	S	*	.	H	α-helix	trans	-63.5	-38.2	174.4	-72.9	170.1	-174.9	176.9	0	112.4	L122 E123 I124 R128 Q129	L122-K126 VanDerWaalsContact O-CG 3.26Å; L122-K126 WeakPolarHBondContact O-CG 3.39Å; L122-K126 PolarHBondContact O-N 3.06Å; E123-K126 PolarHBondContact O-N 2.85Å; I124-K126 VanDerWaalsContact C-N 3.3Å; I124-K126 PolarHBondContact O-N 2.87Å; K126-R128 VanDerWaalsContact C-N 3.34Å; K126-Q129 PolarHBondContact O-N 3.23Å
127	L	90.8	Very high	87.9	Confident	4 Å²	4	64.2 Å²	64.2	2%	0.021	31%	0.312	C	S	.	.	H	α-helix	trans	-65.4	-37.4	177.2	-69	178.7	0	0	0	112.3	L71 L110 E123 I124 E125 Q129 L130 Y139	L71-L127 HydrophobicContact CD1-CB 4.04Å; L110-L127 HydrophobicContact CD1-CD1 3.94Å; E123-L127 WeakPolarHBondContact O-CG 3.45Å; E123-L127 PolarHBondContact O-N 2.87Å; I124-L127 WeakPolarHBondContact O-CB 3.45Å; I124-L127 PolarHBondContact O-N 3.2Å; E125-L127 PolarHBondContact O-N 2.87Å; L127-Q129 VanDerWaalsContact C-N 3.29Å; L127-Q129 PolarHBondContact O-N 3.39Å; L127-L130 HydrophobicContact CD2-CD1 3.99Å; L127-L130 WeakPolarHBondContact O-CB 3.31Å; L127-L130 PolarHBondContact O-N 2.8Å; L127-Y139 WeakPolarHBondContact CD1-OH 3.4Å; L127-Y139 HydrophobicContact CD2-CE2 4.27Å; L127-Y139 WeakPolarHBondContact CD2-OH 3.44Å
128	R	89.3	Confident	87.8	Confident	41 Å²	41	67 Å²	67	16%	0.155	32%	0.318	C	S	.	.	H	α-helix	trans	-68.8	-25.8	177.2	-67.2	-178.5	62.1	-140.4	-7.4	113.7	K64 D68 L71 I124 E125 K126 L130	K64-R128 PolarHBondContact NZ-O 2.78Å; D68-R128 WeakPolarHBondContact OD1-CG 3.45Å; D68-R128 IonicContact OD1-CZ 3.16Å; D68-R128 IonicContact OD1-NE 2.84Å; D68-R128 PolarHBondContact OD1-NE 3.2Å; D68-R128 IonicContact OD1-NH2 2.99Å; L71-R128 HydrophobicContact CB-CG 3.73Å; L71-R128 HydrophobicContact CD1-CG 4.01Å; I124-R128 HydrophobicContact CG2-CG 4.46Å; I124-R128 WeakPolarHBondContact O-CG 3.46Å; I124-R128 PolarHBondContact O-N 2.69Å; E125-R128 PolarHBondContact O-N 2.76Å; K126-R128 VanDerWaalsContact C-N 3.34Å; R128-L130 VanDerWaalsContact C-N 3.26Å; R128-L130 PolarHBondContact O-N 3.05Å
129	Q	87.8	Confident	87.7	Confident	129 Å²	129	65.2 Å²	65.2	60%	0.603	31%	0.305	S	S	*	.	H	α-helix	trans	-69.2	-25.8	175.4	-70.2	172.4	7.1	0	0	112.4	E125 K126 L127	E125-Q129 WeakPolarHBondContact O-CG 3.35Å; E125-Q129 PolarHBondContact O-N 2.55Å; K126-Q129 PolarHBondContact O-N 3.23Å; L127-Q129 VanDerWaalsContact C-N 3.29Å; L127-Q129 PolarHBondContact O-N 3.39Å
130	L	87.4	Confident	86.8	Confident	42 Å²	42	61.1 Å²	61.1	22%	0.22	28%	0.282	C	S	.	.	S	Bend	trans	-64.5	153.2	179.2	-60.1	174.6	0	0	0	111.9	K64 L127 R128 E134 L135	K64-L130 PolarHBondContact NZ-O 3.11Å; L127-L130 HydrophobicContact CD2-CD1 3.99Å; L127-L130 WeakPolarHBondContact O-CB 3.31Å; L127-L130 PolarHBondContact O-N 2.8Å; R128-L130 VanDerWaalsContact C-N 3.26Å; R128-L130 PolarHBondContact O-N 3.05Å; L130-E134 WeakPolarHBondContact CA-OE2 3.41Å; L130-E134 HydrophobicContact CB-CB 4.21Å; L130-E134 HydrophobicContact CD2-CB 4.46Å; L130-E134 WeakPolarHBondContact CD2-OE2 3.3Å; L130-L135 HydrophobicContact CB-CD2 4.12Å; L130-L135 HydrophobicContact CB-CG 4.06Å; L130-L135 HydrophobicContact CD1-CD2 3.92Å
131	K	84.4	Confident	86.1	Confident	133 Å²	133	60.3 Å²	60.3	58%	0.578	28%	0.28	S	S	*	.			trans	-80.5	156.1	171.9	-68	-179.2	-179.3	177.3	0	110.9	D133 E134 L135	K131-D133 VanDerWaalsContact C-N 3.25Å; K131-D133 PolarHBondContact O-N 3.37Å; K131-E134 HydrophobicContact CB-CG 4.31Å; K131-E134 PolarHBondContact N-OE2 2.92Å; K131-E134 WeakPolarHBondContact O-CA 3.5Å; K131-E134 WeakPolarHBondContact O-CB 3.19Å; K131-E134 PolarHBondContact O-N 3.39Å; K131-L135 PolarHBondContact O-N 3.4Å
132	P	82.7	Confident	85.3	Confident	33 Å²	33	61.5 Å²	61.5	21%	0.214	29%	0.286	C	S	.	.	H	α-helix	trans	-48.1	-45	173.8	-31.3	37.6	0	0	0	113.7	L44 L46 E134 L135 E136	L44-P132 WeakPolarHBondContact O-CB 3.4Å; L46-P132 HydrophobicContact CD2-CB 4.08Å; P132-E134 VanDerWaalsContact C-N 3.28Å; P132-E134 PolarHBondContact O-N 3.23Å; P132-L135 WeakPolarHBondContact O-CB 3.41Å; P132-L135 PolarHBondContact O-N 2.9Å; P132-E136 PolarHBondContact O-N 3.4Å
133	D	81.9	Confident	84	Confident	95 Å²	95	61.6 Å²	61.6	51%	0.508	29%	0.289	S	S	.	.	H	α-helix	trans	-63.5	-31.7	178.3	-53.7	-15.7	0	0	0	113.2	K131 K137	K131-D133 VanDerWaalsContact C-N 3.25Å; K131-D133 PolarHBondContact O-N 3.37Å; D133-K137 WeakPolarHBondContact O-CB 3.39Å; D133-K137 WeakPolarHBondContact O-CG 3.43Å; D133-K137 PolarHBondContact O-N 2.83Å
134	E	85.2	Confident	82.2	Confident	86 Å²	86	62.9 Å²	62.9	40%	0.402	30%	0.298	S	S	.	.	H	α-helix	trans	-76.8	-36.9	177.7	-66.9	171	170.7	0	0	110.9	L130 K131 P132 K137 R138	L130-E134 WeakPolarHBondContact CA-OE2 3.41Å; L130-E134 HydrophobicContact CB-CB 4.21Å; L130-E134 HydrophobicContact CD2-CB 4.46Å; L130-E134 WeakPolarHBondContact CD2-OE2 3.3Å; K131-E134 HydrophobicContact CB-CG 4.31Å; K131-E134 PolarHBondContact N-OE2 2.92Å; K131-E134 WeakPolarHBondContact O-CA 3.5Å; K131-E134 WeakPolarHBondContact O-CB 3.19Å; K131-E134 PolarHBondContact O-N 3.39Å; P132-E134 VanDerWaalsContact C-N 3.28Å; P132-E134 PolarHBondContact O-N 3.23Å; E134-K137 PolarHBondContact O-N 3.44Å; E134-R138 VanDerWaalsContact O-CB 3.27Å; E134-R138 WeakPolarHBondContact O-CB 3.5Å; E134-R138 PolarHBondContact O-N 3.25Å
135	L	84.4	Confident	80.4	Confident	8 Å²	8	69 Å²	69	4%	0.042	33%	0.326	C	S	.	.	H	α-helix	trans	-64.7	-42.9	172.2	-69.2	170.6	0	0	0	111	L44 F67 L130 K131 P132 R138 Y139	L44-L135 HydrophobicContact CD2-CB 4.14Å; L44-L135 HydrophobicContact CD2-CD1 4.45Å; F67-L135 HydrophobicContact CD1-CD1 3.85Å; F67-L135 HydrophobicContact CE1-CD1 3.92Å; F67-L135 HydrophobicContact CE1-CD2 4.07Å; L130-L135 HydrophobicContact CB-CD2 4.12Å; L130-L135 HydrophobicContact CB-CG 4.06Å; L130-L135 HydrophobicContact CD1-CD2 3.92Å; K131-L135 PolarHBondContact O-N 3.4Å; P132-L135 WeakPolarHBondContact O-CB 3.41Å; P132-L135 PolarHBondContact O-N 2.9Å; L135-R138 PolarHBondContact O-N 2.98Å; L135-Y139 HydrophobicContact CD2-CD2 4.32Å; L135-Y139 HydrophobicContact CD2-CE2 3.98Å; L135-Y139 PolarHBondContact O-N 3.45Å
136	E	83.2	Confident	78.5	Confident	54 Å²	54	72.4 Å²	72.4	25%	0.252	35%	0.353	S	S	.	.	H	α-helix	trans	-62.6	-42.7	173.2	-169.7	-176.2	-167.6	0	0	111	L44 L46 P132 R138 G140 N144	L44-E136 HydrophobicContact CD1-CB 4.28Å; L46-E136 HydrophobicContact CD1-CB 4.13Å; L46-E136 HydrophobicContact CD1-CG 3.93Å; L46-E136 VanDerWaalsContact CD1-OE2 3.32Å; L46-E136 WeakPolarHBondContact CD1-OE2 3.28Å; P132-E136 PolarHBondContact O-N 3.4Å; E136-R138 VanDerWaalsContact C-N 3.28Å; E136-R138 PolarHBondContact O-N 3.4Å; E136-G140 WeakPolarHBondContact O-CA 3.48Å; E136-G140 PolarHBondContact O-N 3.27Å; E136-N144 PolarHBondContact OE1-ND2 3.47Å
137	K	84.8	Confident	76.9	Confident	175 Å²	175	72.2 Å²	72.2	76%	0.761	36%	0.358	S	S	*	.	H	α-helix	trans	-63.4	-34.4	175.2	-76.9	170.1	-171.4	176.1	0	113.3	D133 E134	D133-K137 WeakPolarHBondContact O-CB 3.39Å; D133-K137 WeakPolarHBondContact O-CG 3.43Å; D133-K137 PolarHBondContact O-N 2.83Å; E134-K137 PolarHBondContact O-N 3.44Å
138	R	83.6	Confident	75.9	Confident	123 Å²	123	74.8 Å²	74.8	46%	0.464	37%	0.372	S	S	.	.	H	α-helix	trans	-81.6	-45.3	-173.9	-172.2	172.4	-176.7	170.4	-3.1	112.8	E99 E134 L135 E136	E99-R138 VanDerWaalsContact CD-O 3.29Å; E134-R138 VanDerWaalsContact O-CB 3.27Å; E134-R138 WeakPolarHBondContact O-CB 3.5Å; E134-R138 PolarHBondContact O-N 3.25Å; L135-R138 PolarHBondContact O-N 2.98Å; E136-R138 VanDerWaalsContact C-N 3.28Å; E136-R138 PolarHBondContact O-N 3.4Å
139	Y	84.2	Confident	75.3	Confident	4 Å²	4	75.2 Å²	75.2	2%	0.016	38%	0.379	C	S	.	.	H	α-helix	trans	-105.7	-29.2	-176.4	-57.7	-52.7	0	0	0	112.2	L94 S98 E99 M108 L110 L127 L135	L94-Y139 HydrophobicContact CD1-CD1 4.2Å; L94-Y139 HydrophobicContact CD1-CD2 3.98Å; L94-Y139 HydrophobicContact CD1-CE1 4.38Å; L94-Y139 HydrophobicContact CD1-CE2 4.15Å; L94-Y139 HydrophobicContact CD1-CG 3.99Å; S98-Y139 WeakPolarHBondContact CA-O 3.35Å; S98-Y139 WeakPolarHBondContact CB-O 3.49Å; S98-Y139 PolarHBondContact N-O 3Å; S98-Y139 PolarHBondContact OG-O 2.89Å; E99-Y139 PolarHBondContact N-O 2.98Å; M108-Y139 HydrophobicContact CE-CD1 4.09Å; M108-Y139 HydrophobicContact CE-CE1 3.73Å; M108-Y139 HydrophobicContact SD-CD1 3.29Å; M108-Y139 WeakPolarHBondContact SD-CD1 3.3Å; M108-Y139 HydrophobicContact SD-CE1 3.43Å; M108-Y139 WeakPolarHBondContact SD-CE1 3.2Å; M108-Y139 HydrophobicContact SD-CG 4.45Å; L110-Y139 HydrophobicContact CD2-CE1 3.61Å; L110-Y139 VanDerWaalsContact CD2-OH 3.27Å; L110-Y139 WeakPolarHBondContact CD2-OH 3.34Å; L127-Y139 WeakPolarHBondContact CD1-OH 3.4Å; L127-Y139 HydrophobicContact CD2-CE2 4.27Å; L127-Y139 WeakPolarHBondContact CD2-OH 3.44Å; L135-Y139 HydrophobicContact CD2-CD2 4.32Å; L135-Y139 HydrophobicContact CD2-CE2 3.98Å; L135-Y139 PolarHBondContact O-N 3.45Å
140	G	72.9	Confident	75.2	Confident	9 Å²	9	69.2 Å²	69.2	9%	0.093	35%	0.351	C	S	.	.			trans	63.5	159.8	-171.2	0	0	0	0	0	113.1	T97 S98 E136	T97-G140 WeakPolarHBondContact CA-O 3.43Å; S98-G140 PolarHBondContact N-O 2.99Å; S98-G140 VanDerWaalsContact OG-CA 3.3Å; S98-G140 WeakPolarHBondContact OG-CA 3.44Å; E136-G140 WeakPolarHBondContact O-CA 3.48Å; E136-G140 PolarHBondContact O-N 3.27Å
141	T	78.2	Confident	75.3	Confident	11 Å²	11	68.3 Å²	68.3	7%	0.067	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-118.9	138.4	169.4	66.8	0	0	0	0	108.5	C39 P41 L44 V143	C39-T141 WeakPolarHBondContact O-CB 3.29Å; C39-T141 WeakPolarHBondContact O-CG2 3.02Å; P41-T141 HydrophobicContact CG-CG2 4.42Å; L44-T141 HydrophobicContact CD1-CG2 3.27Å; L44-T141 HydrophobicContact CG-CG2 4.27Å; T141-V143 PolarHBondContact O-N 3.1Å
142	I	72.9	Confident	75.7	Confident	34 Å²	34	62 Å²	62	17%	0.174	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-76.2	-16.1	177.3	-55	150.9	0	0	0	110.7	R96 T97 N106 N144 I148	R96-I142 VanDerWaalsContact CA-CD1 3.46Å; R96-I142 HydrophobicContact CB-CD1 4.12Å; R96-I142 WeakPolarHBondContact O-CD1 3.49Å; R96-I142 WeakPolarHBondContact O-CG1 3.49Å; R96-I142 PolarHBondContact O-N 3.45Å; T97-I142 WeakPolarHBondContact O-CD1 3.48Å; T97-I142 WeakPolarHBondContact O-CG1 3.45Å; N106-I142 HydrophobicContact CB-CD1 3.31Å; N106-I142 HydrophobicContact CB-CG1 4.44Å; N106-I142 WeakPolarHBondContact ND2-CD1 3.36Å; N106-I142 VanDerWaalsContact ND2-CG1 3.32Å; N106-I142 WeakPolarHBondContact ND2-CG1 3.22Å; I142-N144 PolarHBondContact O-N 2.93Å; I142-N144 VanDerWaalsContact O-N 3.08Å; I142-I148 HydrophobicContact CG2-CD1 3.73Å; I142-I148 HydrophobicContact CG2-CG2 3.91Å; I142-I148 WeakPolarHBondContact O-CD1 3.23Å
143	V	64.7	Low	76.1	Confident	54 Å²	54	61.9 Å²	61.9	33%	0.327	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-77.5	3.6	-165.1	-167.2	0	0	0	0	113	T40 P41 T141 Q145	T40-V143 HydrophobicContact CG2-CG2 4.43Å; P41-V143 HydrophobicContact CG-CB 3.71Å; P41-V143 HydrophobicContact CG-CG1 4.18Å; P41-V143 HydrophobicContact CG-CG2 4.48Å; T141-V143 PolarHBondContact O-N 3.1Å; V143-Q145 PolarHBondContact O-N 2.81Å
144	N	54.7	Low	76.6	Confident	102 Å²	102	60.3 Å²	60.3	55%	0.545	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-67.5	5.4	173.1	-73.8	-18.2	0	0	0	114.1	E136 I142	E136-N144 PolarHBondContact OE1-ND2 3.47Å; I142-N144 PolarHBondContact O-N 2.93Å; I142-N144 VanDerWaalsContact O-N 3.08Å
145	Q	53.9	Low	77	Confident	128 Å²	128	56.2 Å²	56.2	60%	0.598	29%	0.287	S	S	*	.	S	Bend	trans	-124.6	133.3	170.2	-54	-173	-4.7	0	0	112.1	V143 I148	V143-Q145 PolarHBondContact O-N 2.81Å; Q145-I148 HydrophobicContact CB-CD1 3.69Å; Q145-I148 HydrophobicContact CB-CG1 4.14Å; Q145-I148 HydrophobicContact CG-CD1 4.21Å
146	P	50.2	Low	77.4	Confident	119 Å²	119	55.9 Å²	55.9	77%	0.773	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	140.7	173.9	25	-31.6	0	0	0	110.9
147	N	58	Low	77.9	Confident	133 Å²	133	58.5 Å²	58.5	71%	0.711	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	15.9	176.1	-56.2	-37	0	0	0	118.8	T149	N147-T149 PolarHBondContact O-N 3.34Å
148	I	68.9	Low	78.3	Confident	58 Å²	58	50.4 Å²	50.4	30%	0.297	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-74.4	119.6	174.6	-66.1	-179.8	0	0	0	111.1	I142 Q145	I142-I148 HydrophobicContact CG2-CD1 3.73Å; I142-I148 HydrophobicContact CG2-CG2 3.91Å; I142-I148 WeakPolarHBondContact O-CD1 3.23Å; Q145-I148 HydrophobicContact CB-CD1 3.69Å; Q145-I148 HydrophobicContact CB-CG1 4.14Å; Q145-I148 HydrophobicContact CG-CD1 4.21Å
149	T	78.1	Confident	78.8	Confident	50 Å²	50	44.6 Å²	44.6	31%	0.307	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-83.8	129.1	171.4	59.4	0	0	0	0	109.4	N147 V185 N186 N188 L191	N147-T149 PolarHBondContact O-N 3.34Å; T149-V185 WeakPolarHBondContact CG2-O 3.32Å; T149-N186 HydrophobicContact CG2-CB 4.17Å; T149-N188 HydrophobicContact CG2-CB 3.98Å; T149-L191 HydrophobicContact CG2-CD1 4.45Å
150	F	85.9	Confident	79.3	Confident	3 Å²	3	44.6 Å²	44.6	1%	0.013	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-96.9	129.7	174.2	178	-107.7	0	0	0	111.3	M95 R96 N106 I107 L152 A155 P184	M95-F150 HydrophobicContact CB-CE1 3.98Å; M95-F150 HydrophobicContact CB-CZ 3.72Å; M95-F150 HydrophobicContact CG-CE1 4.34Å; M95-F150 HydrophobicContact SD-CE1 3.88Å; R96-F150 HydrophobicContact CG-CB 4.26Å; R96-F150 HydrophobicContact CG-CD1 4.16Å; R96-F150 HydrophobicContact CG-CD2 3.77Å; R96-F150 HydrophobicContact CG-CE1 4.48Å; R96-F150 HydrophobicContact CG-CE2 4.13Å; R96-F150 HydrophobicContact CG-CG 3.8Å; R96-F150 HydrophobicContact CG-CZ 4.47Å; R96-F150 VanDerWaalsContact CZ-CB 3.44Å; R96-F150 VanDerWaalsContact NH1-CB 3.3Å; N106-F150 HydrophobicContact CB-CE2 4.06Å; I107-F150 HydrophobicContact CD1-CZ 4.42Å; I107-F150 HydrophobicContact CG1-CE2 4.48Å; I107-F150 HydrophobicContact CG1-CZ 4.09Å; F150-L152 VanDerWaalsContact C-N 3.31Å; F150-L152 HydrophobicContact CD1-CB 4.45Å; F150-L152 HydrophobicContact CE1-CD1 4.37Å; F150-L152 PolarHBondContact O-N 3.21Å; F150-A155 HydrophobicContact CE1-CB 4.03Å; F150-A155 HydrophobicContact CZ-CB 4Å; F150-P184 PolarHBondContact N-O 2.91Å
151	P	89.2	Confident	80.2	Confident	23 Å²	23	46 Å²	46	15%	0.149	24%	0.242	C	C	.	.			trans	-75.9	79.8	176.6	32.1	-35	0	0	0	110.9	H153 E154 L191	P151-H153 WeakPolarHBondContact CB-CE1 3.19Å; P151-H153 PolarHBondContact O-N 3.42Å; P151-E154 HydrophobicContact CB-CB 4.5Å; P151-E154 HydrophobicContact CB-CG 4.03Å; P151-E154 HydrophobicContact CG-CB 4.41Å; P151-E154 HydrophobicContact CG-CG 4.15Å; P151-E154 WeakPolarHBondContact O-CB 3.49Å; P151-E154 PolarHBondContact O-N 2.99Å; P151-L191 HydrophobicContact CB-CD2 4.07Å
152	L	91.7	Very high	80.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-50.3	-34.5	-179.3	-178	62.7	0	0	0	113.6	M95 F150 E154 A155 L156 P184 A195 L226 Y227 L230	M95-L152 HydrophobicContact SD-CD1 4.04Å; F150-L152 VanDerWaalsContact C-N 3.31Å; F150-L152 HydrophobicContact CD1-CB 4.45Å; F150-L152 HydrophobicContact CE1-CD1 4.37Å; F150-L152 PolarHBondContact O-N 3.21Å; L152-E154 PolarHBondContact O-N 3.49Å; L152-A155 WeakPolarHBondContact O-CB 3.35Å; L152-A155 PolarHBondContact O-N 3.28Å; L152-A155 VanDerWaalsContact O-N 3.12Å; L152-L156 HydrophobicContact CG-CD1 4.27Å; L152-L156 HydrophobicContact CG-CG 4.39Å; L152-L156 WeakPolarHBondContact O-CG 3.46Å; L152-L156 PolarHBondContact O-N 2.83Å; L152-P184 HydrophobicContact CD2-CG 4.2Å; L152-A195 HydrophobicContact CB-CB 4.46Å; L152-L226 HydrophobicContact CD2-CD2 3.92Å; L152-Y227 HydrophobicContact CD2-CE1 4.35Å; L152-L230 HydrophobicContact CD2-CD2 3.94Å
153	H	92.3	Very high	81.8	Confident	31 Å²	31	45.5 Å²	45.5	14%	0.144	24%	0.238	C	C	.	.	H	α-helix	trans	-57.7	-29.6	175.5	70.1	-74.6	0	0	0	114.5	P151 W157 R194 A195 K198	P151-H153 WeakPolarHBondContact CB-CE1 3.19Å; P151-H153 PolarHBondContact O-N 3.42Å; H153-W157 WeakPolarHBondContact O-CB 3.31Å; H153-W157 PolarHBondContact O-N 3.35Å; H153-R194 HydrophobicContact CB-CB 4.29Å; H153-A195 HydrophobicContact CB-CB 4.42Å; H153-K198 HydrophobicContact CB-CB 4.08Å; H153-K198 HydrophobicContact CB-CG 4.46Å
154	E	92.4	Very high	83.1	Confident	62 Å²	62	47.7 Å²	47.7	29%	0.29	25%	0.247	S	C	.	.	H	α-helix	trans	-72.1	-38.4	176.1	-67.7	-177.5	-169.1	0	0	111.2	I107 P151 L152 W157 A158	I107-E154 VanDerWaalsContact CD1-C 3.49Å; I107-E154 HydrophobicContact CD1-CB 3.87Å; P151-E154 HydrophobicContact CB-CB 4.5Å; P151-E154 HydrophobicContact CB-CG 4.03Å; P151-E154 HydrophobicContact CG-CB 4.41Å; P151-E154 HydrophobicContact CG-CG 4.15Å; P151-E154 WeakPolarHBondContact O-CB 3.49Å; P151-E154 PolarHBondContact O-N 2.99Å; L152-E154 PolarHBondContact O-N 3.49Å; E154-W157 PolarHBondContact O-N 2.9Å; E154-A158 PolarHBondContact O-N 3Å
155	A	92.7	Very high	84.7	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65.7	-43.7	175	0	0	0	0	0	111	L36 M95 I107 F150 L152 W157 A158 C159	L36-A155 HydrophobicContact CD1-CB 4.43Å; L36-A155 HydrophobicContact CD2-CB 4.33Å; M95-A155 HydrophobicContact CB-CB 4.35Å; I107-A155 VanDerWaalsContact CD1-CA 3.47Å; I107-A155 HydrophobicContact CD1-CB 3.96Å; I107-A155 VanDerWaalsContact CD1-N 3.34Å; I107-A155 HydrophobicContact CG1-CB 4.1Å; F150-A155 HydrophobicContact CE1-CB 4.03Å; F150-A155 HydrophobicContact CZ-CB 4Å; L152-A155 WeakPolarHBondContact O-CB 3.35Å; L152-A155 PolarHBondContact O-N 3.28Å; L152-A155 VanDerWaalsContact O-N 3.12Å; A155-W157 VanDerWaalsContact C-N 3.33Å; A155-W157 PolarHBondContact O-N 3.2Å; A155-A158 PolarHBondContact O-N 3.23Å; A155-C159 PolarHBondContact O-N 3.41Å; A155-C159 PolarHBondContact O-SG 3.17Å; A155-C159 VanDerWaalsContact O-SG 3.36Å
156	L	93.9	Very high	86.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61	-41	174.3	-68.3	177.6	0	0	0	112.1	L152 C159 Q160 K198 M199 M202 L209	L152-L156 HydrophobicContact CG-CD1 4.27Å; L152-L156 HydrophobicContact CG-CG 4.39Å; L152-L156 WeakPolarHBondContact O-CG 3.46Å; L152-L156 PolarHBondContact O-N 2.83Å; L156-C159 PolarHBondContact O-N 2.81Å; L156-Q160 PolarHBondContact O-N 2.92Å; L156-K198 HydrophobicContact CB-CG 4.13Å; L156-M199 HydrophobicContact CD1-CG 3.69Å; L156-M199 HydrophobicContact CD1-SD 3.68Å; L156-M199 HydrophobicContact CD2-SD 3.97Å; L156-M199 HydrophobicContact CG-SD 4.4Å; L156-M202 HydrophobicContact CB-CE 4.46Å; L156-M202 HydrophobicContact CB-SD 3.71Å; L156-M202 HydrophobicContact CD2-CE 4.38Å; L156-M202 HydrophobicContact CD2-SD 4.4Å; L156-M202 HydrophobicContact CG-SD 4.47Å; L156-L209 HydrophobicContact CD2-CD1 4.13Å; L156-L209 HydrophobicContact CD2-CD2 4Å
157	W	93.6	Very high	88	Confident	110 Å²	110	43.1 Å²	43.1	42%	0.417	24%	0.235	S	C	.	.	H	α-helix	trans	-63.3	-43.7	173.9	-176.3	81.5	0	0	0	112.2	T104 H153 E154 A155 C159 Q160 N161	T104-W157 HydrophobicContact CG2-CE3 3.57Å; T104-W157 HydrophobicContact CG2-CZ3 3.62Å; H153-W157 WeakPolarHBondContact O-CB 3.31Å; H153-W157 PolarHBondContact O-N 3.35Å; E154-W157 PolarHBondContact O-N 2.9Å; A155-W157 VanDerWaalsContact C-N 3.33Å; A155-W157 PolarHBondContact O-N 3.2Å; W157-C159 VanDerWaalsContact C-N 3.33Å; W157-C159 PolarHBondContact O-N 3.46Å; W157-Q160 PolarHBondContact O-N 3.32Å; W157-N161 WeakPolarHBondContact CH2-ND2 3.47Å; W157-N161 WeakPolarHBondContact CZ2-ND2 3.46Å; W157-N161 WeakPolarHBondContact CZ3-ND2 3.46Å; W157-N161 WeakPolarHBondContact O-CB 3.16Å; W157-N161 PolarHBondContact O-N 3.48Å
158	A	93.1	Very high	89.3	Confident	5 Å²	5	41 Å²	41	4%	0.041	22%	0.22	C	C	.	.	H	α-helix	trans	-59.9	-42.3	175.8	0	0	0	0	0	111.9	I107 E154 A155 N161 Q162	I107-A158 HydrophobicContact CG2-CB 4.01Å; E154-A158 PolarHBondContact O-N 3Å; A155-A158 PolarHBondContact O-N 3.23Å; A158-N161 PolarHBondContact O-N 2.89Å; A158-Q162 PolarHBondContact O-N 3.46Å
159	C	94.2	Very high	90	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.7	-44.7	174.3	-66.9	0	0	0	0	112.3	I34 A155 L156 W157 N161 Q162 F163 I175	I34-C159 HydrophobicContact CD1-CB 4.07Å; I34-C159 VanDerWaalsContact CD1-O 3.31Å; I34-C159 WeakPolarHBondContact CD1-O 3.36Å; I34-C159 HydrophobicContact CG2-CB 4.47Å; A155-C159 PolarHBondContact O-N 3.41Å; A155-C159 PolarHBondContact O-SG 3.17Å; A155-C159 VanDerWaalsContact O-SG 3.36Å; L156-C159 PolarHBondContact O-N 2.81Å; W157-C159 VanDerWaalsContact C-N 3.33Å; W157-C159 PolarHBondContact O-N 3.46Å; C159-N161 VanDerWaalsContact C-N 3.32Å; C159-N161 PolarHBondContact O-N 3.46Å; C159-Q162 PolarHBondContact O-N 3.03Å; C159-F163 WeakPolarHBondContact O-CD2 2.98Å; C159-F163 PolarHBondContact O-N 3.21Å; C159-I175 HydrophobicContact CB-CD1 3.55Å; C159-I175 HydrophobicContact CB-CG1 4.24Å
160	Q	93.6	Very high	90.3	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.019	23%	0.232	C	C	.	.	H	α-helix	trans	-60.5	-41.8	176.4	179.4	178.9	11.9	0	0	112	L156 W157 Q162 F163 I164 M202 Y205 I207	L156-Q160 PolarHBondContact O-N 2.92Å; W157-Q160 PolarHBondContact O-N 3.32Å; Q160-Q162 VanDerWaalsContact C-N 3.25Å; Q160-Q162 PolarHBondContact O-N 3.36Å; Q160-F163 WeakPolarHBondContact O-CB 3.26Å; Q160-F163 PolarHBondContact O-N 2.89Å; Q160-F163 VanDerWaalsContact O-N 3.08Å; Q160-I164 HydrophobicContact CG-CD1 3.83Å; Q160-I164 HydrophobicContact CG-CG1 4.39Å; Q160-I164 WeakPolarHBondContact O-CG1 3.38Å; Q160-I164 PolarHBondContact O-N 3.49Å; Q160-M202 HydrophobicContact CB-CE 4.44Å; Q160-M202 HydrophobicContact CB-CG 4.3Å; Q160-M202 HydrophobicContact CG-CG 4.44Å; Q160-Y205 VanDerWaalsContact NE2-CD2 3.27Å; Q160-I207 HydrophobicContact CB-CD1 4.08Å; Q160-I207 HydrophobicContact CG-CD1 3.7Å
161	N	92.6	Very high	90	Very high	40 Å²	40	44.4 Å²	44.4	21%	0.214	25%	0.248	C	C	.	.	H	α-helix	trans	-62.2	-32.5	178.8	-78.1	-15.8	0	0	0	113	W157 A158 C159 F163 I164 T165	W157-N161 WeakPolarHBondContact CH2-ND2 3.47Å; W157-N161 WeakPolarHBondContact CZ2-ND2 3.46Å; W157-N161 WeakPolarHBondContact CZ3-ND2 3.46Å; W157-N161 WeakPolarHBondContact O-CB 3.16Å; W157-N161 PolarHBondContact O-N 3.48Å; A158-N161 PolarHBondContact O-N 2.89Å; C159-N161 VanDerWaalsContact C-N 3.32Å; C159-N161 PolarHBondContact O-N 3.46Å; N161-F163 VanDerWaalsContact C-N 3.34Å; N161-I164 PolarHBondContact O-N 3.35Å; N161-T165 VanDerWaalsContact O-CB 3.25Å; N161-T165 WeakPolarHBondContact O-CB 3.42Å; N161-T165 PolarHBondContact O-N 3.07Å; N161-T165 PolarHBondContact O-OG1 3.31Å
162	Q	92	Very high	89.7	Confident	22 Å²	22	45.1 Å²	45.1	10%	0.103	25%	0.251	C	S	.	.	H	α-helix	trans	-64.2	-39.5	173.2	-71.2	-170.8	60.1	0	0	112.3	I34 L113 A158 C159 Q160 I164 S166	I34-Q162 HydrophobicContact CD1-CB 3.98Å; L113-Q162 HydrophobicContact CB-CB 4.32Å; A158-Q162 PolarHBondContact O-N 3.46Å; C159-Q162 PolarHBondContact O-N 3.03Å; Q160-Q162 VanDerWaalsContact C-N 3.25Å; Q160-Q162 PolarHBondContact O-N 3.36Å; Q162-I164 VanDerWaalsContact C-N 3.34Å; Q162-S166 PolarHBondContact O-N 3.27Å
163	F	92.8	Very high	89.6	Confident	12 Å²	12	47.5 Å²	47.5	5%	0.053	26%	0.261	C	S	.	.	H	α-helix	trans	-65.2	-37.6	173.2	-70.1	-59.9	0	0	0	112.6	G32 I34 L113 C159 Q160 N161 F170 K173 I175 I207	G32-F163 WeakPolarHBondContact O-CE1 3.46Å; G32-F163 WeakPolarHBondContact O-CZ 3.39Å; I34-F163 HydrophobicContact CD1-CD2 3.94Å; I34-F163 HydrophobicContact CD1-CE1 4.19Å; I34-F163 HydrophobicContact CD1-CE2 3.49Å; I34-F163 VanDerWaalsContact CD1-CE2 3.49Å; I34-F163 HydrophobicContact CD1-CG 4.48Å; I34-F163 HydrophobicContact CD1-CZ 3.63Å; I34-F163 HydrophobicContact CG1-CE1 4.26Å; I34-F163 HydrophobicContact CG1-CE2 4.06Å; I34-F163 HydrophobicContact CG1-CZ 3.71Å; L113-F163 HydrophobicContact CD1-CE1 4.4Å; L113-F163 HydrophobicContact CD2-CD1 3.51Å; L113-F163 HydrophobicContact CD2-CE1 3.79Å; L113-F163 HydrophobicContact CD2-CG 4.39Å; C159-F163 WeakPolarHBondContact O-CD2 2.98Å; C159-F163 PolarHBondContact O-N 3.21Å; Q160-F163 WeakPolarHBondContact O-CB 3.26Å; Q160-F163 PolarHBondContact O-N 2.89Å; Q160-F163 VanDerWaalsContact O-N 3.08Å; N161-F163 VanDerWaalsContact C-N 3.34Å; F163-F170 AromaticContact CD1-CD2 3.94Å; F163-F170 HydrophobicContact CD1-CD2 3.94Å; F163-F170 HydrophobicContact CD1-CE2 4.04Å; F163-K173 HydrophobicContact CB-CD 4.44Å; F163-K173 HydrophobicContact CD1-CB 4.22Å; F163-K173 HydrophobicContact CD1-CD 4.42Å; F163-K173 HydrophobicContact CD1-CG 4.06Å; F163-K173 HydrophobicContact CD2-CB 4.49Å; F163-K173 HydrophobicContact CE1-CB 4.01Å; F163-K173 HydrophobicContact CE1-CG 4.24Å; F163-K173 HydrophobicContact CE2-CB 4.26Å; F163-K173 HydrophobicContact CG-CB 4.47Å; F163-K173 HydrophobicContact CG-CD 4.32Å; F163-K173 HydrophobicContact CG-CG 4.4Å; F163-K173 HydrophobicContact CZ-CB 4.02Å; F163-I175 HydrophobicContact CE2-CD1 4.19Å; F163-I175 HydrophobicContact CE2-CG1 3.86Å; F163-I175 HydrophobicContact CZ-CG1 4.45Å; F163-I207 HydrophobicContact CB-CD1 4.47Å; F163-I207 HydrophobicContact CD2-CD1 3.8Å; F163-I207 HydrophobicContact CD2-CG1 4.07Å; F163-I207 HydrophobicContact CD2-CG2 4.29Å; F163-I207 HydrophobicContact CE2-CG1 4.46Å; F163-I207 HydrophobicContact CE2-CG2 3.95Å; F163-I207 HydrophobicContact CG-CD1 4.47Å
164	I	90.4	Very high	89.6	Confident	99 Å²	99	46.2 Å²	46.2	51%	0.508	26%	0.255	S	S	.	.	H	α-helix	trans	-72.6	-40.5	-179.9	-65.4	170.7	0	0	0	111.6	Q160 N161 Q162 S166	Q160-I164 HydrophobicContact CG-CD1 3.83Å; Q160-I164 HydrophobicContact CG-CG1 4.39Å; Q160-I164 WeakPolarHBondContact O-CG1 3.38Å; Q160-I164 PolarHBondContact O-N 3.49Å; N161-I164 PolarHBondContact O-N 3.35Å; Q162-I164 VanDerWaalsContact C-N 3.34Å; I164-S166 VanDerWaalsContact C-N 3.29Å; I164-S166 PolarHBondContact O-N 3.31Å
165	T	89.7	Confident	89.7	Confident	118 Å²	118	43.3 Å²	43.3	72%	0.724	24%	0.241	S	C	*	.	H	α-helix	trans	-77.8	-17.1	-175.8	-51.4	0	0	0	0	112.1	N161 S167	N161-T165 VanDerWaalsContact O-CB 3.25Å; N161-T165 WeakPolarHBondContact O-CB 3.42Å; N161-T165 PolarHBondContact O-N 3.07Å; N161-T165 PolarHBondContact O-OG1 3.31Å; T165-S167 PolarHBondContact O-N 2.96Å
166	S	87.6	Confident	89.7	Confident	26 Å²	26	43.3 Å²	43.3	18%	0.182	24%	0.242	C	C	.	.			trans	-62.9	133.9	177.7	-176.8	0	0	0	0	111.9	Q162 I164 K168 F170	Q162-S166 PolarHBondContact O-N 3.27Å; I164-S166 VanDerWaalsContact C-N 3.29Å; I164-S166 PolarHBondContact O-N 3.31Å; S166-K168 PolarHBondContact O-N 3.27Å; S166-K168 VanDerWaalsContact O-N 3.16Å; S166-K168 PolarHBondContact OG-N 2.97Å; S166-F170 WeakPolarHBondContact OG-CE2 3.46Å; S166-F170 WeakPolarHBondContact OG-CZ 3.38Å
167	S	84.6	Confident	89.7	Confident	109 Å²	109	43.3 Å²	43.3	76%	0.762	24%	0.242	S	C	*	.	S	Bend	trans	-68.4	-8.6	175.1	64.9	0	0	0	0	114	T165	T165-S167 PolarHBondContact O-N 2.96Å
168	K	85	Confident	89.7	Confident	90 Å²	90	38.1 Å²	38.1	39%	0.391	22%	0.222	S	C	.	.	S	Bend	trans	-112.7	143.8	-174.1	-56.6	-56.4	-177.8	-171.9	0	111	M89 S166 F170	M89-K168 HydrophobicContact CE-CB 4.07Å; M89-K168 HydrophobicContact CE-CG 3.44Å; M89-K168 VanDerWaalsContact CE-CG 3.44Å; M89-K168 HydrophobicContact SD-CB 4.16Å; M89-K168 HydrophobicContact SD-CG 4.16Å; S166-K168 PolarHBondContact O-N 3.27Å; S166-K168 VanDerWaalsContact O-N 3.16Å; S166-K168 PolarHBondContact OG-N 2.97Å; K168-F170 WeakPolarHBondContact O-CE2 3.26Å
169	T	84.9	Confident	89.7	Confident	128 Å²	128	37.9 Å²	37.9	79%	0.785	22%	0.22	S	C	*	.			trans	-83	130.6	173.6	54.3	0	0	0	0	110.2
170	F	84.1	Confident	89.5	Confident	19 Å²	19	38.3 Å²	38.3	8%	0.083	22%	0.222	C	C	.	.			trans	-104	135.3	174.8	-54.9	-73	0	0	0	109.9	R30 M89 L113 F163 S166 K168 K173	R30-F170 HydrophobicContact CB-CD1 4.19Å; R30-F170 CarbonylContact O-C 3.58Å; R30-F170 VanDerWaalsContact O-CA 3.26Å; R30-F170 WeakPolarHBondContact O-CA 3.27Å; M89-F170 HydrophobicContact CB-CE1 3.68Å; M89-F170 HydrophobicContact CB-CZ 4.05Å; M89-F170 HydrophobicContact CG-CE1 3.76Å; M89-F170 HydrophobicContact CG-CZ 4.17Å; M89-F170 HydrophobicContact SD-CE1 3.57Å; M89-F170 VanDerWaalsContact SD-CE1 3.57Å; M89-F170 HydrophobicContact SD-CZ 3.47Å; M89-F170 WeakPolarHBondContact SD-CZ 3.48Å; L113-F170 HydrophobicContact CD2-CD2 4.47Å; L113-F170 HydrophobicContact CD2-CE1 4.29Å; L113-F170 HydrophobicContact CD2-CE2 3.47Å; L113-F170 VanDerWaalsContact CD2-CE2 3.47Å; L113-F170 HydrophobicContact CD2-CZ 3.34Å; L113-F170 HydrophobicContact CG-CZ 3.98Å; F163-F170 AromaticContact CD1-CD2 3.94Å; F163-F170 HydrophobicContact CD1-CD2 3.94Å; F163-F170 HydrophobicContact CD1-CE2 4.04Å; S166-F170 WeakPolarHBondContact OG-CE2 3.46Å; S166-F170 WeakPolarHBondContact OG-CZ 3.38Å; K168-F170 WeakPolarHBondContact O-CE2 3.26Å; F170-K173 HydrophobicContact CB-CG 3.8Å
171	G	79.4	Confident	89.2	Confident	34 Å²	34	40 Å²	40	35%	0.351	23%	0.231	S	C	.	.	S	Bend	trans	-85.9	-24.6	168.4	0	0	0	0	0	113	M29 R30	M29-G171 VanDerWaalsContact CE-CA 3.48Å; R30-G171 PolarHBondContact O-N 3.35Å
172	I	83.1	Confident	89	Confident	39 Å²	39	39.4 Å²	39.4	20%	0.2	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	128.9	176.1	-61.5	174.9	0	0	0	107.7	G32 H174 R266	G32-I172 PolarHBondContact N-O 3.09Å; I172-H174 WeakPolarHBondContact CG2-CD2 3.5Å; I172-R266 HydrophobicContact CD1-CB 4.09Å
173	K	90.4	Very high	88.9	Confident	50 Å²	50	39.3 Å²	39.3	22%	0.217	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	109.9	177.4	-58	171.3	-165.1	166.6	0	108.4	G32 F163 F170 Y205 I207 E208	G32-K173 CarbonylContact O-C 3.43Å; G32-K173 WeakPolarHBondContact O-CA 3.34Å; F163-K173 HydrophobicContact CB-CD 4.44Å; F163-K173 HydrophobicContact CD1-CB 4.22Å; F163-K173 HydrophobicContact CD1-CD 4.42Å; F163-K173 HydrophobicContact CD1-CG 4.06Å; F163-K173 HydrophobicContact CD2-CB 4.49Å; F163-K173 HydrophobicContact CE1-CB 4.01Å; F163-K173 HydrophobicContact CE1-CG 4.24Å; F163-K173 HydrophobicContact CE2-CB 4.26Å; F163-K173 HydrophobicContact CG-CB 4.47Å; F163-K173 HydrophobicContact CG-CD 4.32Å; F163-K173 HydrophobicContact CG-CG 4.4Å; F163-K173 HydrophobicContact CZ-CB 4.02Å; F170-K173 HydrophobicContact CB-CG 3.8Å; K173-Y205 PolarHBondContact NZ-O 3.26Å; K173-I207 HydrophobicContact CB-CB 4.35Å; K173-I207 HydrophobicContact CB-CG1 3.88Å; K173-I207 HydrophobicContact CB-CG2 4.49Å; K173-I207 HydrophobicContact CD-CG1 3.67Å; K173-I207 HydrophobicContact CG-CG1 4.45Å; K173-I207 WeakPolarHBondContact O-CA 3.47Å; K173-E208 PolarHBondContact O-N 3.46Å
174	H	90.9	Very high	88.6	Confident	4 Å²	4	38.7 Å²	38.7	2%	0.019	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	143.4	-178.5	-91.4	-76.3	0	0	0	111.8	G32 V33 I34 I172 F176 E208	G32-H174 PolarHBondContact O-N 3.25Å; V33-H174 CarbonylContact C-O 3.53Å; V33-H174 WeakPolarHBondContact CA-O 3.38Å; I34-H174 PolarHBondContact N-O 3.33Å; I172-H174 WeakPolarHBondContact CG2-CD2 3.5Å; H174-F176 HydrophobicContact CB-CE2 4.45Å; H174-E208 CarbonylContact C-O 3.5Å; H174-E208 WeakPolarHBondContact CA-O 3.34Å; H174-E208 WeakPolarHBondContact CE1-CB 3.49Å; H174-E208 IonicContact CE1-OE2 3.79Å; H174-E208 PolarHBondContact CE1-OE2 3.44Å; H174-E208 WeakPolarHBondContact ND1-CB 3.49Å; H174-E208 IonicContact NE2-OE2 2.72Å; H174-E208 PolarHBondContact NE2-OE2 3.3Å
175	I	94.2	Very high	88.5	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	121.8	170.3	-58.2	168.1	0	0	0	107.2	I34 L36 C159 F163 M202 I207 E208 L209 E210	I34-I175 HydrophobicContact CB-CG1 4.28Å; I34-I175 CarbonylContact O-C 3.55Å; I34-I175 WeakPolarHBondContact O-CA 3.33Å; L36-I175 HydrophobicContact CB-CG2 4.02Å; L36-I175 HydrophobicContact CD2-CG2 4.49Å; C159-I175 HydrophobicContact CB-CD1 3.55Å; C159-I175 HydrophobicContact CB-CG1 4.24Å; F163-I175 HydrophobicContact CE2-CD1 4.19Å; F163-I175 HydrophobicContact CE2-CG1 3.86Å; F163-I175 HydrophobicContact CZ-CG1 4.45Å; I175-M202 HydrophobicContact CD1-CE 3.22Å; I175-I207 HydrophobicContact CD1-CG2 3.62Å; I175-I207 HydrophobicContact CG1-CG2 4.01Å; I175-E208 PolarHBondContact N-O 3.33Å; I175-L209 HydrophobicContact CB-CD1 3.87Å; I175-L209 HydrophobicContact CG2-CD1 3.65Å; I175-L209 WeakPolarHBondContact O-CA 2.89Å; I175-E210 PolarHBondContact O-N 3.44Å
176	F	93.9	Very high	88.3	Confident	1 Å²	1	31.6 Å²	31.6	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	113.3	171.1	-64.3	-71	0	0	0	108.5	V33 I34 F35 L36 H174 L178 E210 I212 I260 H263	V33-F176 HydrophobicContact CG1-CD2 3.52Å; V33-F176 HydrophobicContact CG1-CE2 3.49Å; V33-F176 VanDerWaalsContact CG1-CE2 3.49Å; I34-F176 PolarHBondContact O-N 2.95Å; F35-F176 HydrophobicContact CZ-CD2 4.47Å; L36-F176 PolarHBondContact N-O 3.3Å; H174-F176 HydrophobicContact CB-CE2 4.45Å; F176-L178 HydrophobicContact CB-CD1 4.37Å; F176-E210 HydrophobicContact CD1-CB 4.01Å; F176-E210 HydrophobicContact CD1-CG 4.46Å; F176-E210 HydrophobicContact CE1-CB 4.32Å; F176-E210 WeakPolarHBondContact CE1-OE2 3.35Å; F176-I212 HydrophobicContact CB-CD1 4.34Å; F176-I212 HydrophobicContact CD1-CD1 3.7Å; F176-I212 HydrophobicContact CE1-CD1 4.43Å; F176-I212 HydrophobicContact CG-CD1 4.35Å; F176-I260 HydrophobicContact CD1-CG1 3.94Å; F176-I260 HydrophobicContact CD2-CG1 4.4Å; F176-I260 HydrophobicContact CD2-CG2 4.34Å; F176-I260 HydrophobicContact CE1-CB 4.28Å; F176-I260 HydrophobicContact CE1-CG1 3.93Å; F176-I260 HydrophobicContact CE1-CG2 4.34Å; F176-I260 HydrophobicContact CE2-CG1 4.42Å; F176-I260 HydrophobicContact CE2-CG2 3.76Å; F176-I260 HydrophobicContact CG-CG1 4.18Å; F176-I260 HydrophobicContact CZ-CB 4.18Å; F176-I260 HydrophobicContact CZ-CG1 4.2Å; F176-I260 HydrophobicContact CZ-CG2 3.76Å; F176-H263 HydrophobicContact CE1-CB 4.26Å; F176-H263 HydrophobicContact CZ-CB 4.4Å
177	L	94.5	Very high	88.1	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	111.7	174.1	170.8	58.3	0	0	0	109.5	L36 M95 T179 L209 E210 V211 I212 Y227	L36-L177 HydrophobicContact CB-CD1 4.35Å; L36-L177 HydrophobicContact CD2-CD1 3.92Å; L36-L177 HydrophobicContact CG-CD1 3.89Å; L36-L177 CarbonylContact O-C 3.43Å; L36-L177 WeakPolarHBondContact O-CA 3.43Å; M95-L177 HydrophobicContact CE-CD1 3.51Å; M95-L177 HydrophobicContact SD-CD1 3.89Å; L177-T179 HydrophobicContact CD1-CG2 4.28Å; L177-T179 HydrophobicContact CD2-CG2 4.27Å; L177-T179 HydrophobicContact CG-CG2 3.95Å; L177-L209 HydrophobicContact CB-CD1 4.01Å; L177-E210 PolarHBondContact N-O 2.92Å; L177-V211 HydrophobicContact CD2-CG1 4.42Å; L177-V211 HydrophobicContact CD2-CG2 4.24Å; L177-I212 PolarHBondContact O-N 2.91Å; L177-Y227 HydrophobicContact CD2-CE1 3.67Å
178	L	93.6	Very high	88.3	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	111.7	175	-57.2	101.2	0	0	0	109.3	F35 L36 I37 D38 F176 I214 L256	F35-L178 HydrophobicContact CD1-CD1 3.83Å; L36-L178 PolarHBondContact O-N 3.49Å; I37-L178 HydrophobicContact CG1-CD1 4.12Å; D38-L178 WeakPolarHBondContact CB-O 3.5Å; D38-L178 PolarHBondContact N-O 3.26Å; F176-L178 HydrophobicContact CB-CD1 4.37Å; L178-I214 HydrophobicContact CB-CG1 4.47Å; L178-I214 HydrophobicContact CD2-CD1 4.32Å; L178-L256 HydrophobicContact CD2-CD1 3.88Å; L178-L256 HydrophobicContact CD2-CD2 3.87Å; L178-L256 HydrophobicContact CD2-CG 4.41Å
179	T	91.8	Very high	88.6	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	151.9	-173.9	-179.9	0	0	0	0	110.6	D38 L177 D181 V211 P213 I214 F221	D38-T179 PolarHBondContact OD2-OG1 3.23Å; L177-T179 HydrophobicContact CD1-CG2 4.28Å; L177-T179 HydrophobicContact CD2-CG2 4.27Å; L177-T179 HydrophobicContact CG-CG2 3.95Å; T179-D181 PolarHBondContact OG1-N 3.46Å; T179-V211 HydrophobicContact CG2-CG1 4.29Å; T179-P213 CarbonylContact O-C 3.59Å; T179-P213 VanDerWaalsContact O-CA 3.31Å; T179-P213 WeakPolarHBondContact O-CA 3.46Å; T179-I214 PolarHBondContact O-N 3.03Å; T179-F221 HydrophobicContact CG2-CE2 4.28Å; T179-F221 HydrophobicContact CG2-CZ 4.25Å
180	D	89.7	Confident	88.9	Confident	10 Å²	10	32.9 Å²	32.9	5%	0.053	18%	0.181	C	C	.	.	S	Bend	trans	-101	-5.7	168.5	64.1	-10.1	0	0	0	112.8	T40 T42 M43 P182 Q216	T40-D180 PolarHBondContact OG1-OD1 2.96Å; T42-D180 WeakPolarHBondContact CB-OD2 3.34Å; T42-D180 PolarHBondContact OG1-OD1 3.23Å; T42-D180 PolarHBondContact OG1-OD2 2.96Å; M43-D180 HydrophobicContact CG-CB 4.17Å; M43-D180 VanDerWaalsContact CG-CG 3.49Å; M43-D180 WeakPolarHBondContact CG-OD1 3.05Å; M43-D180 PolarHBondContact N-OD2 3.09Å; M43-D180 HydrophobicContact SD-CB 4.05Å; D180-P182 WeakPolarHBondContact O-CD 3.49Å; D180-Q216 HydrophobicContact CB-CB 4.4Å
181	D	88.9	Confident	89.3	Confident	39 Å²	39	33 Å²	33	21%	0.209	18%	0.182	C	C	.	.			trans	-95.6	112.4	-175.4	-177.1	6.2	0	0	0	111.5	T40 R96 T179 D183 P184 Y227	T40-D181 HydrophobicContact CG2-CB 4.49Å; R96-D181 IonicContact CZ-OD2 3.16Å; R96-D181 IonicContact NE-OD2 2.86Å; R96-D181 IonicContact NH2-OD2 3.9Å; R96-D181 PolarHBondContact NH2-OD2 3.45Å; T179-D181 PolarHBondContact OG1-N 3.46Å; D181-D183 VanDerWaalsContact C-N 3.32Å; D181-D183 PolarHBondContact O-N 3.38Å; D181-D183 PolarHBondContact OD1-N 3.17Å; D181-P184 VanDerWaalsContact OD2-CA 3.29Å; D181-P184 WeakPolarHBondContact OD2-CA 3.39Å; D181-Y227 WeakPolarHBondContact O-CE2 3.24Å; D181-Y227 PolarHBondContact O-OH 2.94Å
182	P	88.3	Confident	89.8	Confident	28 Å²	28	32.9 Å²	32.9	18%	0.182	17%	0.172	C	C	.	.	S	Bend	trans	-76	-14.7	179.8	32.6	-36.5	0	0	0	113.8	D180 F221 L225	D180-P182 WeakPolarHBondContact O-CD 3.49Å; P182-F221 HydrophobicContact CB-CD1 4.41Å; P182-F221 HydrophobicContact CB-CD2 4.09Å; P182-F221 HydrophobicContact CB-CE1 4.47Å; P182-F221 HydrophobicContact CB-CE2 4.16Å; P182-F221 HydrophobicContact CB-CG 4.23Å; P182-F221 HydrophobicContact CB-CZ 4.36Å; P182-L225 HydrophobicContact CB-CD1 4.12Å; P182-L225 HydrophobicContact CG-CD1 4.1Å
183	D	88.3	Confident	90.2	Very high	19 Å²	19	38.9 Å²	38.9	10%	0.102	19%	0.192	C	C	.	.			trans	-141.8	75.1	-179.9	-176.6	14.3	0	0	0	112.7	D181 V185 N186 K187 L225	D181-D183 VanDerWaalsContact C-N 3.32Å; D181-D183 PolarHBondContact O-N 3.38Å; D181-D183 PolarHBondContact OD1-N 3.17Å; D183-V185 PolarHBondContact O-N 2.92Å; D183-V185 VanDerWaalsContact O-N 3.11Å; D183-V185 WeakPolarHBondContact OD1-CG2 3.39Å; D183-V185 PolarHBondContact OD1-N 3.26Å; D183-N186 PolarHBondContact O-N 2.93Å; D183-N186 PolarHBondContact OD1-N 2.95Å; D183-K187 WeakPolarHBondContact OD2-CG 3.48Å; D183-K187 PolarHBondContact OD2-N 3.47Å; D183-L225 HydrophobicContact CB-CB 4.05Å; D183-L225 HydrophobicContact CB-CD1 4.17Å
184	P	87.8	Confident	90.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-19.9	-177.7	22.9	-35.6	0	0	0	115.6	R96 F150 L152 D181 N186 L226	R96-P184 PolarHBondContact NH2-O 3.13Å; F150-P184 PolarHBondContact N-O 2.91Å; L152-P184 HydrophobicContact CD2-CG 4.2Å; D181-P184 VanDerWaalsContact OD2-CA 3.29Å; D181-P184 WeakPolarHBondContact OD2-CA 3.39Å; P184-N186 VanDerWaalsContact C-N 3.3Å; P184-L226 VanDerWaalsContact CD-CD2 3.48Å; P184-L226 HydrophobicContact CG-CD2 3.52Å
185	V	87.1	Confident	90.5	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.006	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-4.1	177.4	-60.9	0	0	0	0	112.6	T149 D183 K187 N188 L191 K192 L226	T149-V185 WeakPolarHBondContact CG2-O 3.32Å; D183-V185 PolarHBondContact O-N 2.92Å; D183-V185 VanDerWaalsContact O-N 3.11Å; D183-V185 WeakPolarHBondContact OD1-CG2 3.39Å; D183-V185 PolarHBondContact OD1-N 3.26Å; V185-K187 PolarHBondContact O-N 3.22Å; V185-N188 WeakPolarHBondContact O-CB 3.44Å; V185-N188 PolarHBondContact O-N 2.96Å; V185-N188 VanDerWaalsContact O-N 3.08Å; V185-L191 HydrophobicContact CB-CB 4.07Å; V185-L191 HydrophobicContact CG1-CB 3.88Å; V185-K192 HydrophobicContact CG2-CB 4.2Å; V185-L226 HydrophobicContact CG1-CD2 4.38Å; V185-L226 HydrophobicContact CG2-CD1 4.03Å; V185-L226 HydrophobicContact CG2-CD2 4.32Å
186	N	85.5	Confident	90.3	Very high	67 Å²	67	45.8 Å²	45.8	36%	0.358	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	46	57.7	178.9	-175	31.8	0	0	0	112	T149 D183 P184 N188	T149-N186 HydrophobicContact CG2-CB 4.17Å; D183-N186 PolarHBondContact O-N 2.93Å; D183-N186 PolarHBondContact OD1-N 2.95Å; P184-N186 VanDerWaalsContact C-N 3.3Å; N186-N188 PolarHBondContact O-N 3Å
187	K	84.3	Confident	90.3	Very high	172 Å²	172	48.7 Å²	48.7	75%	0.748	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.2	13.7	179.7	-55	177.6	-178	173.6	0	116	D183 V185 A189	D183-K187 WeakPolarHBondContact OD2-CG 3.48Å; D183-K187 PolarHBondContact OD2-N 3.47Å; V185-K187 PolarHBondContact O-N 3.22Å; K187-A189 PolarHBondContact O-N 3.32Å; K187-A189 VanDerWaalsContact O-N 3.13Å
188	N	89.8	Confident	90.2	Very high	55 Å²	55	50.3 Å²	50.3	29%	0.294	25%	0.251	S	S	.	.			trans	-76	102.9	176.1	-171.2	-30.9	0	0	0	111.1	T149 V185 N186 N190 L191 K192	T149-N188 HydrophobicContact CG2-CB 3.98Å; V185-N188 WeakPolarHBondContact O-CB 3.44Å; V185-N188 PolarHBondContact O-N 2.96Å; V185-N188 VanDerWaalsContact O-N 3.08Å; N186-N188 PolarHBondContact O-N 3Å; N188-N190 PolarHBondContact O-N 3.07Å; N188-N190 PolarHBondContact OD1-N 3.13Å; N188-N190 VanDerWaalsContact OD1-N 3.09Å; N188-L191 HydrophobicContact CB-CB 4.24Å; N188-L191 HydrophobicContact CB-CD1 4.12Å; N188-L191 HydrophobicContact CB-CG 4.31Å; N188-L191 PolarHBondContact O-N 3.13Å; N188-L191 PolarHBondContact OD1-N 2.81Å; N188-K192 PolarHBondContact O-N 3.05Å
189	A	89.4	Confident	90.2	Very high	52 Å²	52	50.4 Å²	50.4	43%	0.43	25%	0.252	S	S	.	.	H	α-helix	trans	-57.2	-32.5	-177.9	0	0	0	0	0	114	K187 R193	K187-A189 PolarHBondContact O-N 3.32Å; K187-A189 VanDerWaalsContact O-N 3.13Å; A189-R193 WeakPolarHBondContact O-CG 3.39Å; A189-R193 PolarHBondContact O-N 2.61Å
190	N	92.2	Very high	90.1	Very high	101 Å²	101	52.7 Å²	52.7	54%	0.54	27%	0.27	S	S	.	.	H	α-helix	trans	-72.6	-42	-179.8	-71.3	-27.9	0	0	0	111.7	N188 R193 R194	N188-N190 PolarHBondContact O-N 3.07Å; N188-N190 PolarHBondContact OD1-N 3.13Å; N188-N190 VanDerWaalsContact OD1-N 3.09Å; N190-R193 PolarHBondContact OD1-NH1 3.17Å; N190-R194 WeakPolarHBondContact O-CG 3.32Å; N190-R194 PolarHBondContact O-N 2.96Å; N190-R194 VanDerWaalsContact O-N 3.12Å
191	L	91.6	Very high	90.2	Very high	20 Å²	20	54.6 Å²	54.6	11%	0.105	28%	0.28	C	S	.	.	H	α-helix	trans	-69.5	-38.1	176.3	-67.3	177.6	0	0	0	111.4	T149 P151 V185 N188 R194 A195	T149-L191 HydrophobicContact CG2-CD1 4.45Å; P151-L191 HydrophobicContact CB-CD2 4.07Å; V185-L191 HydrophobicContact CB-CB 4.07Å; V185-L191 HydrophobicContact CG1-CB 3.88Å; N188-L191 HydrophobicContact CB-CB 4.24Å; N188-L191 HydrophobicContact CB-CD1 4.12Å; N188-L191 HydrophobicContact CB-CG 4.31Å; N188-L191 PolarHBondContact O-N 3.13Å; N188-L191 PolarHBondContact OD1-N 2.81Å; L191-R194 PolarHBondContact O-N 3.26Å; L191-A195 PolarHBondContact O-N 3.02Å
192	K	91.1	Very high	90.4	Very high	33 Å²	33	52.8 Å²	52.8	14%	0.143	27%	0.271	C	S	.	.	H	α-helix	trans	-55.7	-53.5	172.4	-174.1	167.4	-170.8	-176.4	0	111.5	V185 N188 R194 A195 I196 L225 L226 E229	V185-K192 HydrophobicContact CG2-CB 4.2Å; N188-K192 PolarHBondContact O-N 3.05Å; K192-R194 VanDerWaalsContact C-N 3.31Å; K192-R194 PolarHBondContact O-N 3.28Å; K192-A195 PolarHBondContact O-N 2.86Å; K192-A195 VanDerWaalsContact O-N 3.13Å; K192-I196 HydrophobicContact CG-CD1 3.94Å; K192-I196 WeakPolarHBondContact O-CG1 3.33Å; K192-I196 PolarHBondContact O-N 2.81Å; K192-L225 PolarHBondContact NZ-O 2.83Å; K192-L226 HydrophobicContact CB-CD1 4.35Å; K192-L226 HydrophobicContact CD-CD1 4.12Å; K192-L226 HydrophobicContact CG-CD1 3.68Å; K192-E229 VanDerWaalsContact CE-CD 3.43Å; K192-E229 WeakPolarHBondContact CE-OE2 3.42Å; K192-E229 IonicContact NZ-OE1 3.75Å; K192-E229 PolarHBondContact NZ-OE1 2.79Å; K192-E229 IonicContact NZ-OE2 3.16Å; K192-E229 PolarHBondContact NZ-OE2 3.28Å
193	R	91.9	Very high	90.4	Very high	164 Å²	164	54 Å²	54	62%	0.619	27%	0.273	S	S	*	.	H	α-helix	trans	-58.5	-39.9	177.5	-73.5	180	-165.9	129.2	-0.6	112.9	A189 N190 I196 A197	A189-R193 WeakPolarHBondContact O-CG 3.39Å; A189-R193 PolarHBondContact O-N 2.61Å; N190-R193 PolarHBondContact OD1-NH1 3.17Å; R193-I196 PolarHBondContact O-N 2.89Å; R193-A197 WeakPolarHBondContact O-CB 3.26Å; R193-A197 PolarHBondContact O-N 2.87Å
194	R	93.7	Very high	90.3	Very high	150 Å²	150	60.2 Å²	60.2	57%	0.566	30%	0.302	S	S	*	.	H	α-helix	trans	-65.7	-39.3	176.8	-73.2	179.2	-178.4	-169.2	1.7	112.2	H153 N190 L191 K192 K198	H153-R194 HydrophobicContact CB-CB 4.29Å; N190-R194 WeakPolarHBondContact O-CG 3.32Å; N190-R194 PolarHBondContact O-N 2.96Å; N190-R194 VanDerWaalsContact O-N 3.12Å; L191-R194 PolarHBondContact O-N 3.26Å; K192-R194 VanDerWaalsContact C-N 3.31Å; K192-R194 PolarHBondContact O-N 3.28Å; R194-K198 VanDerWaalsContact O-CB 3.3Å; R194-K198 WeakPolarHBondContact O-CB 3.48Å; R194-K198 PolarHBondContact O-N 2.81Å
195	A	92.6	Very high	90.3	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-64.6	-45.1	175.5	0	0	0	0	0	111.7	L152 H153 L191 K192 K198 M199 L230	L152-A195 HydrophobicContact CB-CB 4.46Å; H153-A195 HydrophobicContact CB-CB 4.42Å; L191-A195 PolarHBondContact O-N 3.02Å; K192-A195 PolarHBondContact O-N 2.86Å; K192-A195 VanDerWaalsContact O-N 3.13Å; A195-K198 PolarHBondContact O-N 2.88Å; A195-M199 PolarHBondContact O-N 3.47Å; A195-L230 VanDerWaalsContact C-CD1 3.48Å; A195-L230 HydrophobicContact CB-CD1 3.89Å; A195-L230 WeakPolarHBondContact O-CD1 3.37Å
196	I	91.5	Very high	90.3	Very high	50 Å²	50	68.1 Å²	68.1	26%	0.256	35%	0.345	S	S	.	.	H	α-helix	trans	-61.3	-50.2	176.5	-64.1	166.4	0	0	0	111	K192 R193 K198 M199 A200 E229 L230	K192-I196 HydrophobicContact CG-CD1 3.94Å; K192-I196 WeakPolarHBondContact O-CG1 3.33Å; K192-I196 PolarHBondContact O-N 2.81Å; R193-I196 PolarHBondContact O-N 2.89Å; I196-K198 PolarHBondContact O-N 2.83Å; I196-M199 PolarHBondContact O-N 2.71Å; I196-M199 VanDerWaalsContact O-N 3.13Å; I196-A200 PolarHBondContact O-N 2.87Å; I196-E229 HydrophobicContact CD1-CB 3.94Å; I196-L230 HydrophobicContact CG1-CD1 4.27Å
197	A	92.3	Very high	90.5	Very high	62 Å²	62	65 Å²	65	51%	0.512	33%	0.329	S	S	.	.	H	α-helix	trans	-58.9	-37.1	177.1	0	0	0	0	0	111.9	R193 D201	R193-A197 WeakPolarHBondContact O-CB 3.26Å; R193-A197 PolarHBondContact O-N 2.87Å; A197-D201 PolarHBondContact O-N 2.74Å
198	K	93.7	Very high	90.7	Very high	33 Å²	33	59.8 Å²	59.8	14%	0.143	31%	0.307	C	S	.	.	H	α-helix	trans	-69.4	-38.5	177.7	-171.8	56	-178.8	167.5	0	112.7	H153 L156 R194 A195 I196 D201 M202	H153-K198 HydrophobicContact CB-CB 4.08Å; H153-K198 HydrophobicContact CB-CG 4.46Å; L156-K198 HydrophobicContact CB-CG 4.13Å; R194-K198 VanDerWaalsContact O-CB 3.3Å; R194-K198 WeakPolarHBondContact O-CB 3.48Å; R194-K198 PolarHBondContact O-N 2.81Å; A195-K198 PolarHBondContact O-N 2.88Å; I196-K198 PolarHBondContact O-N 2.83Å; K198-D201 IonicContact NZ-OD2 3.3Å; K198-D201 PolarHBondContact NZ-OD2 3.39Å; K198-D201 WeakPolarHBondContact O-CB 3.24Å; K198-D201 PolarHBondContact O-N 3.36Å; K198-M202 HydrophobicContact CG-SD 4.24Å; K198-M202 WeakPolarHBondContact O-CG 3.42Å; K198-M202 PolarHBondContact O-N 2.8Å
199	M	92.6	Very high	90.8	Very high	3 Å²	3	57.9 Å²	57.9	2%	0.015	30%	0.297	C	S	.	.	H	α-helix	trans	-66.7	-39.6	175.2	-81.4	-56.8	-55.6	0	0	112.8	L156 A195 I196 D201 M202 K203 L209 L230	L156-M199 HydrophobicContact CD1-CG 3.69Å; L156-M199 HydrophobicContact CD1-SD 3.68Å; L156-M199 HydrophobicContact CD2-SD 3.97Å; L156-M199 HydrophobicContact CG-SD 4.4Å; A195-M199 PolarHBondContact O-N 3.47Å; I196-M199 PolarHBondContact O-N 2.71Å; I196-M199 VanDerWaalsContact O-N 3.13Å; M199-D201 VanDerWaalsContact C-N 3.32Å; M199-D201 PolarHBondContact O-N 2.63Å; M199-M202 PolarHBondContact O-N 2.82Å; M199-M202 HydrophobicContact SD-CE 4.42Å; M199-M202 HydrophobicContact SD-SD 4.01Å; M199-K203 WeakPolarHBondContact O-CG 3.05Å; M199-K203 PolarHBondContact O-N 3.02Å; M199-L209 HydrophobicContact CE-CB 3.33Å; M199-L209 HydrophobicContact CE-CD2 3.87Å; M199-L209 HydrophobicContact CE-CG 4.25Å; M199-L209 HydrophobicContact CG-CD2 4.44Å; M199-L209 HydrophobicContact SD-CB 3.92Å; M199-L209 HydrophobicContact SD-CD2 3.62Å; M199-L209 HydrophobicContact SD-CG 4.38Å; M199-L230 HydrophobicContact CB-CD1 3.96Å; M199-L230 HydrophobicContact CB-CG 4.42Å; M199-L230 HydrophobicContact CG-CD1 3.37Å; M199-L230 HydrophobicContact CG-CD2 4.29Å; M199-L230 HydrophobicContact CG-CG 3.68Å
200	A	90.6	Very high	90.8	Very high	47 Å²	47	56.1 Å²	56.1	39%	0.388	28%	0.279	S	S	.	.	H	α-helix	trans	-59.2	-43.5	173.3	0	0	0	0	0	111.8	I196 K203 Q204	I196-A200 PolarHBondContact O-N 2.87Å; A200-K203 PolarHBondContact O-N 3.47Å; A200-Q204 WeakPolarHBondContact O-CG 3.4Å; A200-Q204 PolarHBondContact O-N 3.45Å
201	D	91.8	Very high	90.6	Very high	51 Å²	51	51.4 Å²	51.4	27%	0.273	25%	0.254	S	S	.	.	H	α-helix	trans	-59.9	-48.9	172.6	173.5	42.5	0	0	0	111.5	A197 K198 M199 K203 Q204 Y205	A197-D201 PolarHBondContact O-N 2.74Å; K198-D201 IonicContact NZ-OD2 3.3Å; K198-D201 PolarHBondContact NZ-OD2 3.39Å; K198-D201 WeakPolarHBondContact O-CB 3.24Å; K198-D201 PolarHBondContact O-N 3.36Å; M199-D201 VanDerWaalsContact C-N 3.32Å; M199-D201 PolarHBondContact O-N 2.63Å; D201-K203 VanDerWaalsContact C-N 3.33Å; D201-K203 PolarHBondContact O-N 2.87Å; D201-Q204 WeakPolarHBondContact O-CB 3.36Å; D201-Q204 PolarHBondContact O-N 3.12Å; D201-Q204 VanDerWaalsContact O-N 3.09Å; D201-Y205 WeakPolarHBondContact O-CD2 3.32Å; D201-Y205 PolarHBondContact O-N 3.22Å; D201-Y205 VanDerWaalsContact OD1-CE2 3.3Å; D201-Y205 WeakPolarHBondContact OD1-CE2 3.38Å
202	M	92.2	Very high	90.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.6	-38.1	178.8	-73.8	173	69.2	0	0	113.5	L156 Q160 I175 K198 M199 Q204 Y205 G206 I207	L156-M202 HydrophobicContact CB-CE 4.46Å; L156-M202 HydrophobicContact CB-SD 3.71Å; L156-M202 HydrophobicContact CD2-CE 4.38Å; L156-M202 HydrophobicContact CD2-SD 4.4Å; L156-M202 HydrophobicContact CG-SD 4.47Å; Q160-M202 HydrophobicContact CB-CE 4.44Å; Q160-M202 HydrophobicContact CB-CG 4.3Å; Q160-M202 HydrophobicContact CG-CG 4.44Å; I175-M202 HydrophobicContact CD1-CE 3.22Å; K198-M202 HydrophobicContact CG-SD 4.24Å; K198-M202 WeakPolarHBondContact O-CG 3.42Å; K198-M202 PolarHBondContact O-N 2.8Å; M199-M202 PolarHBondContact O-N 2.82Å; M199-M202 HydrophobicContact SD-CE 4.42Å; M199-M202 HydrophobicContact SD-SD 4.01Å; M202-Q204 VanDerWaalsContact C-N 3.32Å; M202-Q204 PolarHBondContact O-N 3.26Å; M202-Y205 CarbonylContact O-C 3.08Å; M202-Y205 WeakPolarHBondContact O-CA 3.37Å; M202-Y205 WeakPolarHBondContact O-CB 3.45Å; M202-Y205 PolarHBondContact O-N 2.9Å; M202-Y205 VanDerWaalsContact O-N 3.09Å; M202-G206 PolarHBondContact O-N 3.39Å; M202-I207 HydrophobicContact CB-CB 4.21Å; M202-I207 HydrophobicContact CE-CB 4.33Å; M202-I207 HydrophobicContact CE-CG2 3.66Å; M202-I207 PolarHBondContact O-N 3.04Å
203	K	88.3	Confident	90.4	Very high	53 Å²	53	48.9 Å²	48.9	23%	0.23	24%	0.242	C	C	.	.	H	α-helix	trans	-61.6	-39.1	174.4	-74.8	-179	-179.7	-170.7	0	111.8	M199 A200 D201 Y205 G206 L231 E232	M199-K203 WeakPolarHBondContact O-CG 3.05Å; M199-K203 PolarHBondContact O-N 3.02Å; A200-K203 PolarHBondContact O-N 3.47Å; D201-K203 VanDerWaalsContact C-N 3.33Å; D201-K203 PolarHBondContact O-N 2.87Å; K203-Y205 PolarHBondContact O-N 3.34Å; K203-G206 WeakPolarHBondContact O-CA 3.23Å; K203-G206 PolarHBondContact O-N 3.47Å; K203-L231 PolarHBondContact NZ-O 2.88Å; K203-E232 PolarHBondContact NZ-O 2.93Å
204	Q	87.4	Confident	90.2	Very high	151 Å²	151	41.2 Å²	41.2	71%	0.706	21%	0.214	S	C	*	.	H	α-helix	trans	-63	-31.4	174.3	-66.1	178.3	6.5	0	0	112.4	A200 D201 M202 G206	A200-Q204 WeakPolarHBondContact O-CG 3.4Å; A200-Q204 PolarHBondContact O-N 3.45Å; D201-Q204 WeakPolarHBondContact O-CB 3.36Å; D201-Q204 PolarHBondContact O-N 3.12Å; D201-Q204 VanDerWaalsContact O-N 3.09Å; M202-Q204 VanDerWaalsContact C-N 3.32Å; M202-Q204 PolarHBondContact O-N 3.26Å; Q204-G206 PolarHBondContact O-N 2.9Å
205	Y	86.7	Confident	89.8	Confident	124 Å²	124	38.2 Å²	38.2	49%	0.486	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	1.4	172.4	-80.1	-82.1	0	0	0	114.6	Q160 K173 D201 M202 K203 I207	Q160-Y205 VanDerWaalsContact NE2-CD2 3.27Å; K173-Y205 PolarHBondContact NZ-O 3.26Å; D201-Y205 WeakPolarHBondContact O-CD2 3.32Å; D201-Y205 PolarHBondContact O-N 3.22Å; D201-Y205 VanDerWaalsContact OD1-CE2 3.3Å; D201-Y205 WeakPolarHBondContact OD1-CE2 3.38Å; M202-Y205 CarbonylContact O-C 3.08Å; M202-Y205 WeakPolarHBondContact O-CA 3.37Å; M202-Y205 WeakPolarHBondContact O-CB 3.45Å; M202-Y205 PolarHBondContact O-N 2.9Å; M202-Y205 VanDerWaalsContact O-N 3.09Å; K203-Y205 PolarHBondContact O-N 3.34Å; Y205-I207 VanDerWaalsContact C-N 3.34Å
206	G	86.9	Confident	89.2	Confident	42 Å²	42	41.5 Å²	41.5	43%	0.433	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	26.3	-177.6	0	0	0	0	0	113.7	M202 K203 Q204	M202-G206 PolarHBondContact O-N 3.39Å; K203-G206 WeakPolarHBondContact O-CA 3.23Å; K203-G206 PolarHBondContact O-N 3.47Å; Q204-G206 PolarHBondContact O-N 2.9Å
207	I	90.5	Very high	88.3	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.5	174.3	-57.5	165.5	0	0	0	108.6	Q160 F163 K173 I175 M202 Y205	Q160-I207 HydrophobicContact CB-CD1 4.08Å; Q160-I207 HydrophobicContact CG-CD1 3.7Å; F163-I207 HydrophobicContact CB-CD1 4.47Å; F163-I207 HydrophobicContact CD2-CD1 3.8Å; F163-I207 HydrophobicContact CD2-CG1 4.07Å; F163-I207 HydrophobicContact CD2-CG2 4.29Å; F163-I207 HydrophobicContact CE2-CG1 4.46Å; F163-I207 HydrophobicContact CE2-CG2 3.95Å; F163-I207 HydrophobicContact CG-CD1 4.47Å; K173-I207 HydrophobicContact CB-CB 4.35Å; K173-I207 HydrophobicContact CB-CG1 3.88Å; K173-I207 HydrophobicContact CB-CG2 4.49Å; K173-I207 HydrophobicContact CD-CG1 3.67Å; K173-I207 HydrophobicContact CG-CG1 4.45Å; K173-I207 WeakPolarHBondContact O-CA 3.47Å; I175-I207 HydrophobicContact CD1-CG2 3.62Å; I175-I207 HydrophobicContact CG1-CG2 4.01Å; M202-I207 HydrophobicContact CB-CB 4.21Å; M202-I207 HydrophobicContact CE-CB 4.33Å; M202-I207 HydrophobicContact CE-CG2 3.66Å; M202-I207 PolarHBondContact O-N 3.04Å; Y205-I207 VanDerWaalsContact C-N 3.34Å
208	E	88.9	Confident	87.2	Confident	62 Å²	62	49.3 Å²	49.3	29%	0.29	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	133.9	-179.4	-70.5	175.1	-153.5	0	0	110.2	K173 H174 I175 R266	K173-E208 PolarHBondContact O-N 3.46Å; H174-E208 CarbonylContact C-O 3.5Å; H174-E208 WeakPolarHBondContact CA-O 3.34Å; H174-E208 WeakPolarHBondContact CE1-CB 3.49Å; H174-E208 IonicContact CE1-OE2 3.79Å; H174-E208 PolarHBondContact CE1-OE2 3.44Å; H174-E208 WeakPolarHBondContact ND1-CB 3.49Å; H174-E208 IonicContact NE2-OE2 2.72Å; H174-E208 PolarHBondContact NE2-OE2 3.3Å; I175-E208 PolarHBondContact N-O 3.33Å; E208-R266 VanDerWaalsContact CD-CZ 3.48Å; E208-R266 IonicContact OE1-CZ 3.48Å; E208-R266 IonicContact OE1-NH1 3.69Å; E208-R266 PolarHBondContact OE1-NH1 2.88Å; E208-R266 IonicContact OE1-NH2 4Å; E208-R266 PolarHBondContact OE1-NH2 3.35Å; E208-R266 IonicContact OE2-CZ 3.6Å; E208-R266 IonicContact OE2-NE 3.98Å; E208-R266 IonicContact OE2-NH1 3.7Å; E208-R266 IonicContact OE2-NH2 3.33Å; E208-R266 PolarHBondContact OE2-NH2 3.35Å
209	L	90.7	Very high	86.4	Confident	16 Å²	16	51.1 Å²	51.1	8%	0.084	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	131.7	174.3	179.1	69.6	0	0	0	108.6	L156 I175 L177 M199 V211 L230 L231	L156-L209 HydrophobicContact CD2-CD1 4.13Å; L156-L209 HydrophobicContact CD2-CD2 4Å; I175-L209 HydrophobicContact CB-CD1 3.87Å; I175-L209 HydrophobicContact CG2-CD1 3.65Å; I175-L209 WeakPolarHBondContact O-CA 2.89Å; L177-L209 HydrophobicContact CB-CD1 4.01Å; M199-L209 HydrophobicContact CE-CB 3.33Å; M199-L209 HydrophobicContact CE-CD2 3.87Å; M199-L209 HydrophobicContact CE-CG 4.25Å; M199-L209 HydrophobicContact CG-CD2 4.44Å; M199-L209 HydrophobicContact SD-CB 3.92Å; M199-L209 HydrophobicContact SD-CD2 3.62Å; M199-L209 HydrophobicContact SD-CG 4.38Å; L209-V211 HydrophobicContact CD2-CG2 4.44Å; L209-V211 HydrophobicContact CG-CG2 4.47Å; L209-L230 HydrophobicContact CD2-CD2 3.92Å; L209-L231 HydrophobicContact CB-CD2 4.35Å; L209-L231 HydrophobicContact CD2-CD2 4.34Å; L209-L231 HydrophobicContact CG-CD2 4.39Å; L209-L231 WeakPolarHBondContact O-CD2 3.18Å
210	E	88.7	Confident	86	Confident	14 Å²	14	59.9 Å²	59.9	7%	0.065	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	131.8	168.7	-173.8	178.9	161	0	0	109.4	I175 F176 L177 I212 H263	I175-E210 PolarHBondContact O-N 3.44Å; F176-E210 HydrophobicContact CD1-CB 4.01Å; F176-E210 HydrophobicContact CD1-CG 4.46Å; F176-E210 HydrophobicContact CE1-CB 4.32Å; F176-E210 WeakPolarHBondContact CE1-OE2 3.35Å; L177-E210 PolarHBondContact N-O 2.92Å; E210-I212 HydrophobicContact CG-CG1 4.18Å; E210-H263 IonicContact OE1-CD2 3.61Å; E210-H263 PolarHBondContact OE1-CD2 2.86Å; E210-H263 IonicContact OE1-CE1 3.53Å; E210-H263 IonicContact OE1-CG 3.64Å; E210-H263 IonicContact OE1-NE2 2.67Å; E210-H263 PolarHBondContact OE1-NE2 3.27Å; E210-H263 VanDerWaalsContact OE2-CB 3.31Å; E210-H263 WeakPolarHBondContact OE2-CB 3.2Å; E210-H263 IonicContact OE2-CD2 2.84Å; E210-H263 PolarHBondContact OE2-CD2 3.02Å; E210-H263 IonicContact OE2-CE1 3.24Å; E210-H263 PolarHBondContact OE2-CE1 3.41Å; E210-H263 IonicContact OE2-CG 3.38Å; E210-H263 IonicContact OE2-ND1 2.98Å; E210-H263 PolarHBondContact OE2-ND1 2.91Å; E210-H263 VanDerWaalsContact OE2-ND1 3.16Å; E210-H263 IonicContact OE2-NE2 3.5Å; E210-H263 PolarHBondContact OE2-NE2 3.16Å
211	V	90	Very high	85.7	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.012	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	116.8	179.5	-175.5	0	0	0	0	107.3	L177 T179 L209 P213 F221 Y227 L231 P247	L177-V211 HydrophobicContact CD2-CG1 4.42Å; L177-V211 HydrophobicContact CD2-CG2 4.24Å; T179-V211 HydrophobicContact CG2-CG1 4.29Å; L209-V211 HydrophobicContact CD2-CG2 4.44Å; L209-V211 HydrophobicContact CG-CG2 4.47Å; V211-P213 WeakPolarHBondContact O-CD 2.69Å; V211-F221 HydrophobicContact CG1-CE1 4.46Å; V211-F221 HydrophobicContact CG1-CZ 4.17Å; V211-Y227 HydrophobicContact CB-CD1 4.31Å; V211-Y227 HydrophobicContact CG1-CD1 4.02Å; V211-Y227 HydrophobicContact CG1-CD2 4.14Å; V211-Y227 HydrophobicContact CG1-CE1 3.99Å; V211-Y227 HydrophobicContact CG1-CE2 4.13Å; V211-Y227 HydrophobicContact CG1-CG 4.09Å; V211-Y227 HydrophobicContact CG2-CD1 3.5Å; V211-Y227 VanDerWaalsContact CG2-CD1 3.5Å; V211-Y227 HydrophobicContact CG2-CE1 3.86Å; V211-Y227 HydrophobicContact CG2-CG 4.08Å; V211-L231 HydrophobicContact CG2-CD1 4.05Å; V211-L231 HydrophobicContact CG2-CD2 4.41Å; V211-P247 WeakPolarHBondContact O-CG 3.36Å
212	I	89	Confident	85.4	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	101	178.4	-54.8	167	0	0	0	108.1	F176 L177 E210 I214 T250 L256 I260	F176-I212 HydrophobicContact CB-CD1 4.34Å; F176-I212 HydrophobicContact CD1-CD1 3.7Å; F176-I212 HydrophobicContact CE1-CD1 4.43Å; F176-I212 HydrophobicContact CG-CD1 4.35Å; L177-I212 PolarHBondContact O-N 2.91Å; E210-I212 HydrophobicContact CG-CG1 4.18Å; I212-I214 PolarHBondContact O-N 3.43Å; I212-T250 HydrophobicContact CG2-CG2 4.38Å; I212-L256 HydrophobicContact CB-CD1 4.2Å; I212-L256 HydrophobicContact CD1-CD1 4.04Å; I212-L256 HydrophobicContact CG2-CD1 3.35Å; I212-I260 HydrophobicContact CD1-CD1 4.05Å; I212-I260 HydrophobicContact CD1-CG1 3.56Å
213	P	88.9	Confident	85.1	Confident	0 Å²	0	60 Å²	60	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	133.7	-178.3	25	-32	0	0	0	111.1	T179 V211 F221 Y223 P247 P249 T250	T179-P213 CarbonylContact O-C 3.59Å; T179-P213 VanDerWaalsContact O-CA 3.31Å; T179-P213 WeakPolarHBondContact O-CA 3.46Å; V211-P213 WeakPolarHBondContact O-CD 2.69Å; P213-F221 HydrophobicContact CB-CB 4.19Å; P213-F221 HydrophobicContact CB-CD1 3.76Å; P213-F221 HydrophobicContact CB-CD2 3.6Å; P213-F221 HydrophobicContact CB-CE1 3.93Å; P213-F221 HydrophobicContact CB-CE2 3.78Å; P213-F221 HydrophobicContact CB-CG 3.58Å; P213-F221 HydrophobicContact CB-CZ 3.92Å; P213-F221 HydrophobicContact CG-CD1 4.2Å; P213-F221 HydrophobicContact CG-CE1 4.42Å; P213-F221 HydrophobicContact CG-CG 4.38Å; P213-Y223 WeakPolarHBondContact CD-OH 3.31Å; P213-Y223 HydrophobicContact CG-CE2 4.36Å; P213-Y223 WeakPolarHBondContact CG-OH 2.86Å; P213-P247 VanDerWaalsContact CG-O 3.31Å; P213-P247 WeakPolarHBondContact CG-O 3.49Å; P213-P249 HydrophobicContact CB-CB 4.11Å; P213-P249 HydrophobicContact CB-CG 4.02Å; P213-P249 HydrophobicContact CG-CB 4.32Å; P213-P249 HydrophobicContact CG-CG 4.08Å; P213-P249 WeakPolarHBondContact O-CA 3.24Å; P213-T250 PolarHBondContact O-N 2.95Å
214	I	87.8	Confident	85	Confident	4 Å²	4	64.6 Å²	64.6	2%	0.021	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-89.2	131.4	168.8	-57.4	-58.5	0	0	0	108.3	M43 F50 L69 L178 T179 I212 Q216	M43-I214 HydrophobicContact CE-CB 4.42Å; M43-I214 HydrophobicContact CE-CG1 3.84Å; M43-I214 HydrophobicContact SD-CB 3.76Å; M43-I214 HydrophobicContact SD-CG1 3.85Å; M43-I214 HydrophobicContact SD-CG2 3.95Å; F50-I214 HydrophobicContact CE2-CG2 4.11Å; F50-I214 HydrophobicContact CZ-CG2 4.01Å; L69-I214 HydrophobicContact CD2-CD1 4.32Å; L178-I214 HydrophobicContact CB-CG1 4.47Å; L178-I214 HydrophobicContact CD2-CD1 4.32Å; T179-I214 PolarHBondContact O-N 3.03Å; I212-I214 PolarHBondContact O-N 3.43Å; I214-Q216 PolarHBondContact O-N 3.04Å
215	K	85	Confident	84.9	Confident	86 Å²	86	60.6 Å²	60.6	37%	0.374	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-69.1	124.2	-176.5	-172.2	173.4	164.4	-152.9	0	110.8	P249 T250 E251	K215-P249 HydrophobicContact CB-CB 3.82Å; K215-P249 HydrophobicContact CG-CB 4.22Å; K215-T250 PolarHBondContact N-O 3.3Å; K215-E251 HydrophobicContact CB-CB 4.29Å; K215-E251 HydrophobicContact CD-CB 4.46Å; K215-E251 HydrophobicContact CD-CG 4.47Å; K215-E251 WeakPolarHBondContact CD-OE2 3.4Å; K215-E251 WeakPolarHBondContact CE-OE2 3.48Å; K215-E251 IonicContact NZ-OE1 3.91Å; K215-E251 PolarHBondContact NZ-OE1 2.84Å; K215-E251 IonicContact NZ-OE2 2.76Å; K215-E251 PolarHBondContact NZ-OE2 3.32Å
216	Q	80	Confident	85	Confident	69 Å²	69	54.7 Å²	54.7	32%	0.322	28%	0.275	S	S	.	.			trans	-107.7	146.2	169.9	-180	-175	15.7	0	0	109.5	T42 D180 I214 T219	T42-Q216 VanDerWaalsContact CG2-NE2 3.32Å; D180-Q216 HydrophobicContact CB-CB 4.4Å; I214-Q216 PolarHBondContact O-N 3.04Å; Q216-T219 WeakPolarHBondContact CB-OG1 3.45Å; Q216-T219 VanDerWaalsContact CG-OG1 3.27Å; Q216-T219 WeakPolarHBondContact CG-OG1 3.42Å; Q216-T219 PolarHBondContact O-OG1 3.48Å; Q216-T219 PolarHBondContact OE1-OG1 2.98Å
217	Q	71.4	Confident	85	Confident	106 Å²	106	52.7 Å²	52.7	50%	0.495	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	140.4	177.8	-67.2	-174.9	-1.3	0	0	111.1	S49 T219	S49-Q217 PolarHBondContact O-NE2 3.06Å; Q217-T219 PolarHBondContact O-N 3.24Å; Q217-T219 PolarHBondContact O-OG1 3.24Å
218	N	70.5	Confident	84.8	Confident	170 Å²	170	53.9 Å²	53.9	91%	0.909	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	17.4	173.2	-57.8	-31.6	0	0	0	116
219	T	76.8	Confident	84.6	Confident	71 Å²	71	55.1 Å²	55.1	44%	0.436	27%	0.266	S	S	.	.			trans	-126.5	132.4	179.5	41.1	0	0	0	0	109.3	Q216 Q217	Q216-T219 WeakPolarHBondContact CB-OG1 3.45Å; Q216-T219 VanDerWaalsContact CG-OG1 3.27Å; Q216-T219 WeakPolarHBondContact CG-OG1 3.42Å; Q216-T219 PolarHBondContact O-OG1 3.48Å; Q216-T219 PolarHBondContact OE1-OG1 2.98Å; Q217-T219 PolarHBondContact O-N 3.24Å; Q217-T219 PolarHBondContact O-OG1 3.24Å
220	K	83.2	Confident	84.3	Confident	188 Å²	188	54.5 Å²	54.5	82%	0.817	26%	0.263	S	S	*	.			trans	-93.2	124.4	172.4	-173.8	-179.2	179.9	-176.3	0	107.7	D222	K220-D222 PolarHBondContact O-N 2.95Å
221	F	85.3	Confident	84.1	Confident	18 Å²	18	56.3 Å²	56.3	8%	0.079	27%	0.272	C	S	.	.			trans	-73.8	108.4	172.6	-164.1	-85.6	0	0	0	109	T179 P182 V211 P213 Y223 Y227 P249	T179-F221 HydrophobicContact CG2-CE2 4.28Å; T179-F221 HydrophobicContact CG2-CZ 4.25Å; P182-F221 HydrophobicContact CB-CD1 4.41Å; P182-F221 HydrophobicContact CB-CD2 4.09Å; P182-F221 HydrophobicContact CB-CE1 4.47Å; P182-F221 HydrophobicContact CB-CE2 4.16Å; P182-F221 HydrophobicContact CB-CG 4.23Å; P182-F221 HydrophobicContact CB-CZ 4.36Å; V211-F221 HydrophobicContact CG1-CE1 4.46Å; V211-F221 HydrophobicContact CG1-CZ 4.17Å; P213-F221 HydrophobicContact CB-CB 4.19Å; P213-F221 HydrophobicContact CB-CD1 3.76Å; P213-F221 HydrophobicContact CB-CD2 3.6Å; P213-F221 HydrophobicContact CB-CE1 3.93Å; P213-F221 HydrophobicContact CB-CE2 3.78Å; P213-F221 HydrophobicContact CB-CG 3.58Å; P213-F221 HydrophobicContact CB-CZ 3.92Å; P213-F221 HydrophobicContact CG-CD1 4.2Å; P213-F221 HydrophobicContact CG-CE1 4.42Å; P213-F221 HydrophobicContact CG-CG 4.38Å; F221-Y223 AromaticContact CD1-CD2 3.89Å; F221-Y223 HydrophobicContact CD1-CD2 3.89Å; F221-Y223 HydrophobicContact CD1-CE1 4.45Å; F221-Y223 AromaticContact CD1-CE2 3.75Å; F221-Y223 HydrophobicContact CD1-CE2 3.75Å; F221-Y223 HydrophobicContact CD1-CG 4.3Å; F221-Y223 HydrophobicContact CE1-CD1 4.14Å; F221-Y223 HydrophobicContact CE1-CD2 4.29Å; F221-Y223 HydrophobicContact CE1-CE1 4.02Å; F221-Y223 HydrophobicContact CE1-CE2 4.16Å; F221-Y223 HydrophobicContact CE1-CG 4.28Å; F221-Y227 AromaticContact CE1-CD2 3.79Å; F221-Y227 HydrophobicContact CE1-CD2 3.79Å; F221-Y227 HydrophobicContact CE1-CE2 4.01Å; F221-Y227 HydrophobicContact CE2-CE2 4.43Å; F221-Y227 AromaticContact CZ-CD2 3.76Å; F221-Y227 HydrophobicContact CZ-CD2 3.76Å; F221-Y227 AromaticContact CZ-CE2 3.47Å; F221-Y227 HydrophobicContact CZ-CE2 3.47Å; F221-Y227 VanDerWaalsContact CZ-CE2 3.47Å; F221-P249 HydrophobicContact CB-CG 3.55Å; F221-P249 HydrophobicContact CG-CG 4.46Å
222	D	85.6	Confident	83.3	Confident	64 Å²	64	61.9 Å²	61.9	34%	0.342	30%	0.298	S	S	.	.			trans	-100.5	103.6	-178	-170.7	5.7	0	0	0	110.9	K220 K224 L225	K220-D222 PolarHBondContact O-N 2.95Å; D222-K224 PolarHBondContact O-N 3.42Å; D222-K224 WeakPolarHBondContact OD1-CB 3.29Å; D222-K224 PolarHBondContact OD1-N 3.26Å; D222-L225 HydrophobicContact CB-CD1 4.1Å; D222-L225 HydrophobicContact CB-CG 4.11Å; D222-L225 PolarHBondContact O-N 3.04Å
223	Y	85.5	Confident	82	Confident	17 Å²	17	65.4 Å²	65.4	7%	0.067	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-63	-26.5	179.9	-73.4	-97	0	0	0	113.4	P213 F221 L225 L226 Y227 D228 H246 P247	P213-Y223 WeakPolarHBondContact CD-OH 3.31Å; P213-Y223 HydrophobicContact CG-CE2 4.36Å; P213-Y223 WeakPolarHBondContact CG-OH 2.86Å; F221-Y223 AromaticContact CD1-CD2 3.89Å; F221-Y223 HydrophobicContact CD1-CD2 3.89Å; F221-Y223 HydrophobicContact CD1-CE1 4.45Å; F221-Y223 AromaticContact CD1-CE2 3.75Å; F221-Y223 HydrophobicContact CD1-CE2 3.75Å; F221-Y223 HydrophobicContact CD1-CG 4.3Å; F221-Y223 HydrophobicContact CE1-CD1 4.14Å; F221-Y223 HydrophobicContact CE1-CD2 4.29Å; F221-Y223 HydrophobicContact CE1-CE1 4.02Å; F221-Y223 HydrophobicContact CE1-CE2 4.16Å; F221-Y223 HydrophobicContact CE1-CG 4.28Å; Y223-L225 PolarHBondContact O-N 3.04Å; Y223-L225 VanDerWaalsContact O-N 3.14Å; Y223-L226 PolarHBondContact O-N 3.07Å; Y223-Y227 PolarHBondContact O-N 2.61Å; Y223-D228 WeakPolarHBondContact CB-OD1 3.19Å; Y223-D228 PolarHBondContact O-N 3.23Å; Y223-H246 AromaticContact CD1-ND1 3.29Å; Y223-H246 VanDerWaalsContact CD1-ND1 3.29Å; Y223-H246 WeakPolarHBondContact CD1-ND1 3.36Å; Y223-H246 HydrophobicContact CD2-CB 3.77Å; Y223-H246 AromaticContact CD2-CG 3.79Å; Y223-H246 AromaticContact CD2-ND1 3.77Å; Y223-H246 HydrophobicContact CE1-CB 4.42Å; Y223-H246 AromaticContact CE1-ND1 3.7Å; Y223-H246 HydrophobicContact CE2-CB 3.59Å; Y223-H246 HydrophobicContact CG-CB 4.26Å; Y223-H246 AromaticContact CG-CE1 3.98Å; Y223-H246 AromaticContact CG-CG 3.82Å; Y223-H246 AromaticContact CG-ND1 3.33Å; Y223-H246 VanDerWaalsContact CG-ND1 3.33Å; Y223-P247 WeakPolarHBondContact OH-CD 3.4Å; Y223-P247 VanDerWaalsContact OH-CG 3.29Å; Y223-P247 WeakPolarHBondContact OH-CG 3.49Å; Y223-P247 PolarHBondContact OH-O 3.21Å
224	K	85.9	Confident	80.2	Confident	150 Å²	150	74.2 Å²	74.2	65%	0.652	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-63.3	-21.5	-177.9	-70	179.9	176.8	-171.5	0	113.7	D222 D228	D222-K224 PolarHBondContact O-N 3.42Å; D222-K224 WeakPolarHBondContact OD1-CB 3.29Å; D222-K224 PolarHBondContact OD1-N 3.26Å; K224-D228 WeakPolarHBondContact CA-OD2 3.25Å; K224-D228 WeakPolarHBondContact CG-OD2 3.31Å; K224-D228 PolarHBondContact N-OD2 3.26Å
225	L	86.2	Confident	78.4	Confident	68 Å²	68	80.6 Å²	80.6	36%	0.356	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-66	-44.4	-177.8	-64.6	176.7	0	0	0	111.5	P182 D183 K192 D222 Y223	P182-L225 HydrophobicContact CB-CD1 4.12Å; P182-L225 HydrophobicContact CG-CD1 4.1Å; D183-L225 HydrophobicContact CB-CB 4.05Å; D183-L225 HydrophobicContact CB-CD1 4.17Å; K192-L225 PolarHBondContact NZ-O 2.83Å; D222-L225 HydrophobicContact CB-CD1 4.1Å; D222-L225 HydrophobicContact CB-CG 4.11Å; D222-L225 PolarHBondContact O-N 3.04Å; Y223-L225 PolarHBondContact O-N 3.04Å; Y223-L225 VanDerWaalsContact O-N 3.14Å
226	L	87.3	Confident	76.7	Confident	0 Å²	0	82 Å²	82	0%	0	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-141.4	-50.7	-176.6	179.4	64.2	0	0	0	113.6	L152 P184 V185 K192 Y223 D228 L230	L152-L226 HydrophobicContact CD2-CD2 3.92Å; P184-L226 VanDerWaalsContact CD-CD2 3.48Å; P184-L226 HydrophobicContact CG-CD2 3.52Å; V185-L226 HydrophobicContact CG1-CD2 4.38Å; V185-L226 HydrophobicContact CG2-CD1 4.03Å; V185-L226 HydrophobicContact CG2-CD2 4.32Å; K192-L226 HydrophobicContact CB-CD1 4.35Å; K192-L226 HydrophobicContact CD-CD1 4.12Å; K192-L226 HydrophobicContact CG-CD1 3.68Å; Y223-L226 PolarHBondContact O-N 3.07Å; L226-D228 PolarHBondContact O-N 2.74Å; L226-L230 WeakPolarHBondContact O-CB 3.38Å; L226-L230 PolarHBondContact O-N 3.17Å; L226-L230 VanDerWaalsContact O-N 3.17Å
227	Y	88.4	Confident	74.8	Confident	0 Å²	0	87.7 Å²	87.7	0%	0	42%	0.421	C	S	.	.	H	α-helix	trans	-73	-27.7	-163.4	-64.7	-65.4	0	0	0	114.5	L152 L177 D181 V211 F221 Y223 L230 L231	L152-Y227 HydrophobicContact CD2-CE1 4.35Å; L177-Y227 HydrophobicContact CD2-CE1 3.67Å; D181-Y227 WeakPolarHBondContact O-CE2 3.24Å; D181-Y227 PolarHBondContact O-OH 2.94Å; V211-Y227 HydrophobicContact CB-CD1 4.31Å; V211-Y227 HydrophobicContact CG1-CD1 4.02Å; V211-Y227 HydrophobicContact CG1-CD2 4.14Å; V211-Y227 HydrophobicContact CG1-CE1 3.99Å; V211-Y227 HydrophobicContact CG1-CE2 4.13Å; V211-Y227 HydrophobicContact CG1-CG 4.09Å; V211-Y227 HydrophobicContact CG2-CD1 3.5Å; V211-Y227 VanDerWaalsContact CG2-CD1 3.5Å; V211-Y227 HydrophobicContact CG2-CE1 3.86Å; V211-Y227 HydrophobicContact CG2-CG 4.08Å; F221-Y227 AromaticContact CE1-CD2 3.79Å; F221-Y227 HydrophobicContact CE1-CD2 3.79Å; F221-Y227 HydrophobicContact CE1-CE2 4.01Å; F221-Y227 HydrophobicContact CE2-CE2 4.43Å; F221-Y227 AromaticContact CZ-CD2 3.76Å; F221-Y227 HydrophobicContact CZ-CD2 3.76Å; F221-Y227 AromaticContact CZ-CE2 3.47Å; F221-Y227 HydrophobicContact CZ-CE2 3.47Å; F221-Y227 VanDerWaalsContact CZ-CE2 3.47Å; Y223-Y227 PolarHBondContact O-N 2.61Å; Y227-L230 HydrophobicContact CD1-CD2 3.88Å; Y227-L230 HydrophobicContact CE1-CD2 4.26Å; Y227-L230 PolarHBondContact O-N 3.46Å; Y227-L231 VanDerWaalsContact O-CB 3.3Å; Y227-L231 WeakPolarHBondContact O-CB 3.49Å; Y227-L231 VanDerWaalsContact O-CG 3.23Å; Y227-L231 WeakPolarHBondContact O-CG 3.27Å; Y227-L231 PolarHBondContact O-N 2.67Å
228	D	85.4	Confident	73.4	Confident	27 Å²	27	88.5 Å²	88.5	14%	0.144	44%	0.435	C	S	.	.	H	α-helix	trans	-58.2	-57.2	173.7	-76	-2.3	0	0	0	110.8	Y223 K224 L226 L230 L231 E232 H246	Y223-D228 WeakPolarHBondContact CB-OD1 3.19Å; Y223-D228 PolarHBondContact O-N 3.23Å; K224-D228 WeakPolarHBondContact CA-OD2 3.25Å; K224-D228 WeakPolarHBondContact CG-OD2 3.31Å; K224-D228 PolarHBondContact N-OD2 3.26Å; L226-D228 PolarHBondContact O-N 2.74Å; D228-L230 PolarHBondContact O-N 2.88Å; D228-L231 PolarHBondContact O-N 2.83Å; D228-E232 WeakPolarHBondContact O-CG 3.15Å; D228-E232 PolarHBondContact O-N 2.84Å; D228-H246 IonicContact OD1-CE1 2.89Å; D228-H246 PolarHBondContact OD1-CE1 3.46Å; D228-H246 IonicContact OD1-ND1 3.95Å; D228-H246 IonicContact OD1-NE2 3.77Å; D228-H246 PolarHBondContact OD1-NE2 2.91Å; D228-H246 VanDerWaalsContact OD1-NE2 3.16Å
229	E	84.2	Confident	72.2	Confident	87 Å²	87	87.6 Å²	87.6	41%	0.407	43%	0.431	S	S	.	.	H	α-helix	trans	-63.8	-27.5	177.8	-69	177.1	-136.9	0	0	112.5	K192 I196	K192-E229 VanDerWaalsContact CE-CD 3.43Å; K192-E229 WeakPolarHBondContact CE-OE2 3.42Å; K192-E229 IonicContact NZ-OE1 3.75Å; K192-E229 PolarHBondContact NZ-OE1 2.79Å; K192-E229 IonicContact NZ-OE2 3.16Å; K192-E229 PolarHBondContact NZ-OE2 3.28Å; I196-E229 HydrophobicContact CD1-CB 3.94Å
230	L	85.9	Confident	70.7	Confident	3 Å²	3	87.7 Å²	87.7	2%	0.016	43%	0.431	C	S	.	.	H	α-helix	trans	-74.8	-36	178.5	-169.5	70.1	0	0	0	112.4	L152 A195 I196 M199 L209 L226 Y227 D228	L152-L230 HydrophobicContact CD2-CD2 3.94Å; A195-L230 VanDerWaalsContact C-CD1 3.48Å; A195-L230 HydrophobicContact CB-CD1 3.89Å; A195-L230 WeakPolarHBondContact O-CD1 3.37Å; I196-L230 HydrophobicContact CG1-CD1 4.27Å; M199-L230 HydrophobicContact CB-CD1 3.96Å; M199-L230 HydrophobicContact CB-CG 4.42Å; M199-L230 HydrophobicContact CG-CD1 3.37Å; M199-L230 HydrophobicContact CG-CD2 4.29Å; M199-L230 HydrophobicContact CG-CG 3.68Å; L209-L230 HydrophobicContact CD2-CD2 3.92Å; L226-L230 WeakPolarHBondContact O-CB 3.38Å; L226-L230 PolarHBondContact O-N 3.17Å; L226-L230 VanDerWaalsContact O-N 3.17Å; Y227-L230 HydrophobicContact CD1-CD2 3.88Å; Y227-L230 HydrophobicContact CE1-CD2 4.26Å; Y227-L230 PolarHBondContact O-N 3.46Å; D228-L230 PolarHBondContact O-N 2.88Å
231	L	83.8	Confident	68.5	Low	52 Å²	52	86.9 Å²	86.9	27%	0.272	44%	0.436	S	S	.	.	H	α-helix	trans	-94.5	-16.6	-174.2	-65.4	175.2	0	0	0	113.2	K203 L209 V211 Y227 D228 D233	K203-L231 PolarHBondContact NZ-O 2.88Å; L209-L231 HydrophobicContact CB-CD2 4.35Å; L209-L231 HydrophobicContact CD2-CD2 4.34Å; L209-L231 HydrophobicContact CG-CD2 4.39Å; L209-L231 WeakPolarHBondContact O-CD2 3.18Å; V211-L231 HydrophobicContact CG2-CD1 4.05Å; V211-L231 HydrophobicContact CG2-CD2 4.41Å; Y227-L231 VanDerWaalsContact O-CB 3.3Å; Y227-L231 WeakPolarHBondContact O-CB 3.49Å; Y227-L231 VanDerWaalsContact O-CG 3.23Å; Y227-L231 WeakPolarHBondContact O-CG 3.27Å; Y227-L231 PolarHBondContact O-N 2.67Å; D228-L231 PolarHBondContact O-N 2.83Å; L231-D233 PolarHBondContact O-N 3.32Å
232	E	72.7	Confident	66.6	Low	119 Å²	119	93.2 Å²	93.2	56%	0.556	46%	0.463	S	S	*	.			trans	-48.6	128.5	175.8	-91.5	177.3	-166.2	0	0	112.6	K203 D228	K203-E232 PolarHBondContact NZ-O 2.93Å; D228-E232 WeakPolarHBondContact O-CG 3.15Å; D228-E232 PolarHBondContact O-N 2.84Å
233	D	61.6	Low	64.7	Low	75 Å²	75	94.5 Å²	94.5	40%	0.401	48%	0.477	S	S	.	.			trans	-102.8	87.3	-177.8	-165.5	12.4	0	0	0	110.1	L231 L235 M236	L231-D233 PolarHBondContact O-N 3.32Å; D233-L235 PolarHBondContact O-N 3Å; D233-M236 PolarHBondContact O-N 2.66Å; D233-M236 VanDerWaalsContact OD2-CG 3.28Å; D233-M236 WeakPolarHBondContact OD2-CG 3.45Å
234	E	52.5	Low	63.2	Low	184 Å²	184	97.2 Å²	97.2	86%	0.86	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-14.6	177.8	-68.8	-173.7	160.8	0	0	113.4
235	L	49.9	Very low	62.1	Low	138 Å²	138	95 Å²	95	72%	0.723	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-4.2	-176.5	-68.3	168	0	0	0	114.1	D233	D233-L235 PolarHBondContact O-N 3Å
236	M	48.1	Very low	61.4	Low	116 Å²	116	94.5 Å²	94.5	57%	0.571	48%	0.483	S	S	*	.	S	Bend	trans	-95.5	139.1	175.9	-78.4	-81.5	-173.7	0	0	110.8	D233	D233-M236 PolarHBondContact O-N 2.66Å; D233-M236 VanDerWaalsContact OD2-CG 3.28Å; D233-M236 WeakPolarHBondContact OD2-CG 3.45Å
237	Y	39.9	Very low	60.7	Low	189 Å²	189	94.8 Å²	94.8	74%	0.741	48%	0.484	S	S	*	.			trans	-45.8	131.7	-179.7	-74.5	-88.2	0	0	0	112	D239	Y237-D239 PolarHBondContact O-N 2.99Å
238	P	42.5	Very low	60	Low	122 Å²	122	97.4 Å²	97.4	79%	0.792	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-10.9	-174.9	22.4	-32.2	0	0	0	114.6	V240	P238-V240 VanDerWaalsContact C-N 3.35Å; P238-V240 PolarHBondContact O-N 3.38Å
239	D	46.2	Very low	59.7	Low	152 Å²	152	98 Å²	98	81%	0.813	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	18.3	-174.8	-68.6	-27.8	0	0	0	114.6	Y237	Y237-D239 PolarHBondContact O-N 2.99Å
240	V	44.1	Very low	59.5	Low	72 Å²	72	93.9 Å²	93.9	44%	0.436	48%	0.484	S	S	.	.			trans	-118.5	102.1	172.1	-165.5	0	0	0	0	109	P238 K242	P238-V240 VanDerWaalsContact C-N 3.35Å; P238-V240 PolarHBondContact O-N 3.38Å; V240-K242 HydrophobicContact CG1-CG 3.91Å; V240-K242 PolarHBondContact O-N 3.14Å
241	D	38.5	Very low	59.1	Low	172 Å²	172	96.6 Å²	96.6	92%	0.92	50%	0.497	S	S	*	.			trans	-59.3	73.5	159.1	-78.8	-28.7	0	0	0	108.8	S243	D241-S243 PolarHBondContact O-N 3.4Å
242	K	44.2	Very low	58.9	Low	150 Å²	150	99.1 Å²	99.1	65%	0.652	50%	0.503	S	S	*	.			trans	-75.1	105	158.3	-83	-175.3	178.5	177.1	0	104.7	V240 S244	V240-K242 HydrophobicContact CG1-CG 3.91Å; V240-K242 PolarHBondContact O-N 3.14Å; K242-S244 PolarHBondContact O-N 3.38Å
243	S	45.3	Very low	59.4	Low	91 Å²	91	94.2 Å²	94.2	64%	0.636	48%	0.481	S	S	*	.			trans	-50.4	112.9	157.9	54.6	0	0	0	0	106.7	D241 Y245	D241-S243 PolarHBondContact O-N 3.4Å; S243-Y245 PolarHBondContact O-N 2.73Å
244	S	54.1	Low	60.2	Low	74 Å²	74	95.2 Å²	95.2	52%	0.517	49%	0.486	S	S	.	.			trans	-47.8	115.4	175.4	-59.6	0	0	0	0	108	K242 H246	K242-S244 PolarHBondContact O-N 3.38Å; S244-H246 WeakPolarHBondContact CB-NE2 3.29Å; S244-H246 PolarHBondContact O-CD2 3.44Å; S244-H246 VanDerWaalsContact O-CD2 3.26Å; S244-H246 PolarHBondContact O-N 3.38Å; S244-H246 VanDerWaalsContact O-N 3.15Å
245	Y	63.5	Low	61.5	Low	103 Å²	103	89.4 Å²	89.4	40%	0.404	46%	0.459	S	S	.	.			trans	-74.8	107.7	179.3	176.6	-99.6	0	0	0	107.1	S243 P247	S243-Y245 PolarHBondContact O-N 2.73Å; Y245-P247 HydrophobicContact CE1-CB 4.2Å; Y245-P247 HydrophobicContact CE1-CG 4.46Å
246	H	72.2	Confident	63	Low	59 Å²	59	82.8 Å²	82.8	27%	0.273	42%	0.424	S	S	.	.			trans	-104.9	107.9	175.9	-66.4	-52.9	0	0	0	108.2	Y223 D228 S244 D248	Y223-H246 AromaticContact CD1-ND1 3.29Å; Y223-H246 VanDerWaalsContact CD1-ND1 3.29Å; Y223-H246 WeakPolarHBondContact CD1-ND1 3.36Å; Y223-H246 HydrophobicContact CD2-CB 3.77Å; Y223-H246 AromaticContact CD2-CG 3.79Å; Y223-H246 AromaticContact CD2-ND1 3.77Å; Y223-H246 HydrophobicContact CE1-CB 4.42Å; Y223-H246 AromaticContact CE1-ND1 3.7Å; Y223-H246 HydrophobicContact CE2-CB 3.59Å; Y223-H246 HydrophobicContact CG-CB 4.26Å; Y223-H246 AromaticContact CG-CE1 3.98Å; Y223-H246 AromaticContact CG-CG 3.82Å; Y223-H246 AromaticContact CG-ND1 3.33Å; Y223-H246 VanDerWaalsContact CG-ND1 3.33Å; D228-H246 IonicContact OD1-CE1 2.89Å; D228-H246 PolarHBondContact OD1-CE1 3.46Å; D228-H246 IonicContact OD1-ND1 3.95Å; D228-H246 IonicContact OD1-NE2 3.77Å; D228-H246 PolarHBondContact OD1-NE2 2.91Å; D228-H246 VanDerWaalsContact OD1-NE2 3.16Å; S244-H246 WeakPolarHBondContact CB-NE2 3.29Å; S244-H246 PolarHBondContact O-CD2 3.44Å; S244-H246 VanDerWaalsContact O-CD2 3.26Å; S244-H246 PolarHBondContact O-N 3.38Å; S244-H246 VanDerWaalsContact O-N 3.15Å; H246-D248 PolarHBondContact O-N 3.05Å
247	P	71.3	Confident	64.8	Low	6 Å²	6	78.2 Å²	78.2	4%	0.039	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-63.2	134.6	173.4	21.1	-27.6	0	0	0	110.1	V211 P213 Y223 Y245	V211-P247 WeakPolarHBondContact O-CG 3.36Å; P213-P247 VanDerWaalsContact CG-O 3.31Å; P213-P247 WeakPolarHBondContact CG-O 3.49Å; Y223-P247 WeakPolarHBondContact OH-CD 3.4Å; Y223-P247 VanDerWaalsContact OH-CG 3.29Å; Y223-P247 WeakPolarHBondContact OH-CG 3.49Å; Y223-P247 PolarHBondContact OH-O 3.21Å; Y245-P247 HydrophobicContact CE1-CB 4.2Å; Y245-P247 HydrophobicContact CE1-CG 4.46Å
248	D	75.1	Confident	66.7	Low	54 Å²	54	72.7 Å²	72.7	29%	0.289	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-64.1	147.3	174.9	-75.6	-33.8	0	0	0	111.1	H246 T250 R259 A451 N452	H246-D248 PolarHBondContact O-N 3.05Å; D248-T250 PolarHBondContact O-N 3.16Å; D248-R259 PolarHBondContact O-NH1 3.39Å; D248-R259 PolarHBondContact O-NH2 2.99Å; D248-A451 WeakPolarHBondContact OD2-CB 3.24Å; D248-N452 PolarHBondContact OD2-OD1 3.43Å
249	P	79.4	Confident	68.3	Low	39 Å²	39	67.5 Å²	67.5	25%	0.253	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-53.9	125.7	173.9	-24.9	34.6	0	0	0	112	P213 K215 F221	P213-P249 HydrophobicContact CB-CB 4.11Å; P213-P249 HydrophobicContact CB-CG 4.02Å; P213-P249 HydrophobicContact CG-CB 4.32Å; P213-P249 HydrophobicContact CG-CG 4.08Å; P213-P249 WeakPolarHBondContact O-CA 3.24Å; K215-P249 HydrophobicContact CB-CB 3.82Å; K215-P249 HydrophobicContact CG-CB 4.22Å; F221-P249 HydrophobicContact CB-CG 3.55Å; F221-P249 HydrophobicContact CG-CG 4.46Å
250	T	79.7	Confident	69.9	Low	1 Å²	1	60.3 Å²	60.3	1%	0.006	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-108.3	147.3	-177	-169.6	0	0	0	0	112.3	I212 P213 K215 D248 R252 E255 L256	I212-T250 HydrophobicContact CG2-CG2 4.38Å; P213-T250 PolarHBondContact O-N 2.95Å; K215-T250 PolarHBondContact N-O 3.3Å; D248-T250 PolarHBondContact O-N 3.16Å; T250-R252 PolarHBondContact OG1-N 3.16Å; T250-R252 PolarHBondContact OG1-O 3.42Å; T250-E255 VanDerWaalsContact OG1-CB 3.31Å; T250-E255 WeakPolarHBondContact OG1-CB 3.46Å; T250-E255 PolarHBondContact OG1-OE2 3.22Å; T250-L256 HydrophobicContact CG2-CB 4.02Å; T250-L256 HydrophobicContact CG2-CD1 4.2Å
251	E	77.7	Confident	71.4	Confident	60 Å²	60	59.2 Å²	59.2	28%	0.28	31%	0.309	S	S	.	.			trans	-118	-2.1	171.9	67.5	-160.3	168.3	0	0	111.9	F50 K215	F50-E251 HydrophobicContact CE1-CB 4.23Å; F50-E251 HydrophobicContact CZ-CB 4.43Å; K215-E251 HydrophobicContact CB-CB 4.29Å; K215-E251 HydrophobicContact CD-CB 4.46Å; K215-E251 HydrophobicContact CD-CG 4.47Å; K215-E251 WeakPolarHBondContact CD-OE2 3.4Å; K215-E251 WeakPolarHBondContact CE-OE2 3.48Å; K215-E251 IonicContact NZ-OE1 3.91Å; K215-E251 PolarHBondContact NZ-OE1 2.84Å; K215-E251 IonicContact NZ-OE2 2.76Å; K215-E251 PolarHBondContact NZ-OE2 3.32Å
252	R	79.7	Confident	73	Confident	106 Å²	106	54.5 Å²	54.5	40%	0.4	29%	0.289	S	S	.	.			trans	-111	132.9	-172.6	-69.9	180	172.8	156.3	-5.5	110.8	S54 T250 D254 E255 L256	S54-R252 PolarHBondContact OG-NE 3.41Å; S54-R252 VanDerWaalsContact OG-NE 3.16Å; S54-R252 PolarHBondContact OG-NH2 3.48Å; T250-R252 PolarHBondContact OG1-N 3.16Å; T250-R252 PolarHBondContact OG1-O 3.42Å; R252-D254 VanDerWaalsContact C-N 3.3Å; R252-D254 PolarHBondContact O-N 3.04Å; R252-E255 HydrophobicContact CB-CB 4.28Å; R252-E255 HydrophobicContact CB-CG 4.16Å; R252-E255 WeakPolarHBondContact CD-OE1 3.44Å; R252-E255 IonicContact NH1-OE1 2.86Å; R252-E255 PolarHBondContact NH1-OE1 3.14Å; R252-E255 PolarHBondContact O-N 3.36Å; R252-L256 WeakPolarHBondContact O-CB 3.09Å; R252-L256 PolarHBondContact O-N 2.9Å; R252-L256 VanDerWaalsContact O-N 3.13Å
253	L	82.2	Confident	74.1	Confident	16 Å²	16	50.2 Å²	50.2	8%	0.084	27%	0.272	C	S	.	.	H	α-helix	trans	-59.2	-42.3	176.4	-179.3	65.6	0	0	0	111.8	L69 L72 C73 E255 L256 L257	L69-L253 HydrophobicContact CD1-CB 4.22Å; L72-L253 HydrophobicContact CD1-CD2 4.27Å; L72-L253 HydrophobicContact CD2-CD1 4.33Å; L72-L253 HydrophobicContact CD2-CD2 3.82Å; L72-L253 HydrophobicContact CD2-CG 4.48Å; L72-L253 HydrophobicContact CG-CD1 3.95Å; L72-L253 HydrophobicContact CG-CD2 3.84Å; L72-L253 HydrophobicContact CG-CG 4.47Å; C73-L253 HydrophobicContact CB-CD1 3.88Å; L253-E255 PolarHBondContact O-N 3Å; L253-L256 PolarHBondContact O-N 3.41Å; L253-L257 HydrophobicContact CD1-CD1 3.96Å; L253-L257 HydrophobicContact CD1-CG 3.97Å; L253-L257 HydrophobicContact CD2-CD1 4.17Å; L253-L257 HydrophobicContact CG-CD1 3.72Å; L253-L257 HydrophobicContact CG-CG 4.15Å; L253-L257 WeakPolarHBondContact O-CB 3.33Å; L253-L257 WeakPolarHBondContact O-CG 3.37Å; L253-L257 PolarHBondContact O-N 3.22Å
254	D	79	Confident	74.9	Confident	96 Å²	96	47.2 Å²	47.2	51%	0.513	25%	0.247	S	C	.	.	H	α-helix	trans	-63.3	-41.2	-176.5	-58	-30.5	0	0	0	112.2	R252 S258	R252-D254 VanDerWaalsContact C-N 3.3Å; R252-D254 PolarHBondContact O-N 3.04Å; D254-S258 WeakPolarHBondContact O-CB 2.99Å; D254-S258 PolarHBondContact O-N 3.13Å
255	E	79.7	Confident	75	Confident	61 Å²	61	50 Å²	50	29%	0.285	26%	0.256	S	S	.	.	H	α-helix	trans	-66.7	-43	175.7	-71.8	174.4	-166.4	0	0	111	T250 R252 L253 S258 R259	T250-E255 VanDerWaalsContact OG1-CB 3.31Å; T250-E255 WeakPolarHBondContact OG1-CB 3.46Å; T250-E255 PolarHBondContact OG1-OE2 3.22Å; R252-E255 HydrophobicContact CB-CB 4.28Å; R252-E255 HydrophobicContact CB-CG 4.16Å; R252-E255 WeakPolarHBondContact CD-OE1 3.44Å; R252-E255 IonicContact NH1-OE1 2.86Å; R252-E255 PolarHBondContact NH1-OE1 3.14Å; R252-E255 PolarHBondContact O-N 3.36Å; L253-E255 PolarHBondContact O-N 3Å; E255-S258 PolarHBondContact O-N 3.43Å; E255-R259 VanDerWaalsContact O-CG 3.29Å; E255-R259 WeakPolarHBondContact O-CG 3.44Å; E255-R259 PolarHBondContact O-N 3.42Å
256	L	81.9	Confident	74.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.1	-48	178.4	-177.4	57.7	0	0	0	111.9	L69 C73 L178 I212 T250 R252 L253 R259 I260	L69-L256 HydrophobicContact CG-CD2 4.2Å; C73-L256 HydrophobicContact CB-CD2 3.44Å; C73-L256 VanDerWaalsContact CB-CD2 3.44Å; C73-L256 HydrophobicContact CB-CG 4.06Å; C73-L256 VanDerWaalsContact SG-CG 3.6Å; L178-L256 HydrophobicContact CD2-CD1 3.88Å; L178-L256 HydrophobicContact CD2-CD2 3.87Å; L178-L256 HydrophobicContact CD2-CG 4.41Å; I212-L256 HydrophobicContact CB-CD1 4.2Å; I212-L256 HydrophobicContact CD1-CD1 4.04Å; I212-L256 HydrophobicContact CG2-CD1 3.35Å; T250-L256 HydrophobicContact CG2-CB 4.02Å; T250-L256 HydrophobicContact CG2-CD1 4.2Å; R252-L256 WeakPolarHBondContact O-CB 3.09Å; R252-L256 PolarHBondContact O-N 2.9Å; R252-L256 VanDerWaalsContact O-N 3.13Å; L253-L256 PolarHBondContact O-N 3.41Å; L256-R259 PolarHBondContact O-N 2.82Å; L256-I260 HydrophobicContact CD1-CD1 4.04Å; L256-I260 HydrophobicContact CG-CD1 4.1Å; L256-I260 WeakPolarHBondContact O-CG1 3.36Å; L256-I260 PolarHBondContact O-N 2.72Å
257	L	84.2	Confident	74	Confident	19 Å²	19	55.4 Å²	55.4	10%	0.099	27%	0.273	C	S	.	.	H	α-helix	trans	-64.3	-41.4	175.6	-74.1	173.7	0	0	0	111.7	T76 L253 R259 I260 N261	T76-L257 HydrophobicContact CG2-CD1 3.66Å; T76-L257 HydrophobicContact CG2-CD2 4.27Å; L253-L257 HydrophobicContact CD1-CD1 3.96Å; L253-L257 HydrophobicContact CD1-CG 3.97Å; L253-L257 HydrophobicContact CD2-CD1 4.17Å; L253-L257 HydrophobicContact CG-CD1 3.72Å; L253-L257 HydrophobicContact CG-CG 4.15Å; L253-L257 WeakPolarHBondContact O-CB 3.33Å; L253-L257 WeakPolarHBondContact O-CG 3.37Å; L253-L257 PolarHBondContact O-N 3.22Å; L257-R259 VanDerWaalsContact C-N 3.3Å; L257-R259 PolarHBondContact O-N 3.37Å; L257-I260 PolarHBondContact O-N 3.23Å; L257-N261 WeakPolarHBondContact O-CB 3.3Å; L257-N261 PolarHBondContact O-N 3.3Å; L257-N261 PolarHBondContact O-ND2 2.86Å; L257-N261 VanDerWaalsContact O-ND2 3.14Å
258	S	79.8	Confident	73.7	Confident	74 Å²	74	60.2 Å²	60.2	52%	0.517	31%	0.307	S	S	.	.	H	α-helix	trans	-58.3	-43.6	176.5	-178.1	0	0	0	0	111.5	D254 E255 S262	D254-S258 WeakPolarHBondContact O-CB 2.99Å; D254-S258 PolarHBondContact O-N 3.13Å; E255-S258 PolarHBondContact O-N 3.43Å; S258-S262 VanDerWaalsContact O-CB 3.29Å; S258-S262 WeakPolarHBondContact O-CB 3.46Å; S258-S262 PolarHBondContact O-N 2.94Å
259	R	77.2	Confident	73.8	Confident	13 Å²	13	61 Å²	61	5%	0.049	31%	0.306	C	S	.	.	H	α-helix	trans	-64	-53.5	176.4	-71	168.3	-174.8	-179.9	-1.8	111.8	D248 E255 L256 L257 N261 S262 H263	D248-R259 PolarHBondContact O-NH1 3.39Å; D248-R259 PolarHBondContact O-NH2 2.99Å; E255-R259 VanDerWaalsContact O-CG 3.29Å; E255-R259 WeakPolarHBondContact O-CG 3.44Å; E255-R259 PolarHBondContact O-N 3.42Å; L256-R259 PolarHBondContact O-N 2.82Å; L257-R259 VanDerWaalsContact C-N 3.3Å; L257-R259 PolarHBondContact O-N 3.37Å; R259-N261 VanDerWaalsContact C-N 3.31Å; R259-N261 PolarHBondContact O-N 2.75Å; R259-S262 WeakPolarHBondContact O-CB 3.31Å; R259-S262 PolarHBondContact O-N 3.01Å; R259-S262 PolarHBondContact O-OG 3.16Å; R259-H263 PolarHBondContact O-CD2 2.88Å; R259-H263 PolarHBondContact O-N 3.37Å
260	I	78.8	Confident	74.1	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-56	-46.6	178.5	-74	161.6	0	0	0	111.3	F35 C73 F77 F176 I212 L256 L257 S262 H263 E264	F35-I260 HydrophobicContact CE1-CD1 3.92Å; F35-I260 HydrophobicContact CZ-CD1 4.49Å; C73-I260 WeakPolarHBondContact SG-CD1 3.23Å; F77-I260 HydrophobicContact CD2-CG2 3.55Å; F77-I260 HydrophobicContact CE2-CG2 3.47Å; F77-I260 VanDerWaalsContact CE2-CG2 3.47Å; F77-I260 HydrophobicContact CG-CG2 4.47Å; F77-I260 HydrophobicContact CZ-CG2 4.32Å; F176-I260 HydrophobicContact CD1-CG1 3.94Å; F176-I260 HydrophobicContact CD2-CG1 4.4Å; F176-I260 HydrophobicContact CD2-CG2 4.34Å; F176-I260 HydrophobicContact CE1-CB 4.28Å; F176-I260 HydrophobicContact CE1-CG1 3.93Å; F176-I260 HydrophobicContact CE1-CG2 4.34Å; F176-I260 HydrophobicContact CE2-CG1 4.42Å; F176-I260 HydrophobicContact CE2-CG2 3.76Å; F176-I260 HydrophobicContact CG-CG1 4.18Å; F176-I260 HydrophobicContact CZ-CB 4.18Å; F176-I260 HydrophobicContact CZ-CG1 4.2Å; F176-I260 HydrophobicContact CZ-CG2 3.76Å; I212-I260 HydrophobicContact CD1-CD1 4.05Å; I212-I260 HydrophobicContact CD1-CG1 3.56Å; L256-I260 HydrophobicContact CD1-CD1 4.04Å; L256-I260 HydrophobicContact CG-CD1 4.1Å; L256-I260 WeakPolarHBondContact O-CG1 3.36Å; L256-I260 PolarHBondContact O-N 2.72Å; L257-I260 PolarHBondContact O-N 3.23Å; I260-S262 VanDerWaalsContact C-N 3.32Å; I260-S262 PolarHBondContact O-N 2.99Å; I260-H263 PolarHBondContact O-N 3.22Å; I260-E264 WeakPolarHBondContact O-CB 3.49Å; I260-E264 PolarHBondContact O-N 3.39Å
261	N	76.9	Confident	74.5	Confident	49 Å²	49	63.5 Å²	63.5	26%	0.262	32%	0.319	S	S	.	.	H	α-helix	trans	-65.7	-34.8	179.2	-69.7	-23.4	0	0	0	112.1	L257 R259 H263 E264 L265	L257-N261 WeakPolarHBondContact O-CB 3.3Å; L257-N261 PolarHBondContact O-N 3.3Å; L257-N261 PolarHBondContact O-ND2 2.86Å; L257-N261 VanDerWaalsContact O-ND2 3.14Å; R259-N261 VanDerWaalsContact C-N 3.31Å; R259-N261 PolarHBondContact O-N 2.75Å; N261-H263 VanDerWaalsContact C-N 3.28Å; N261-H263 PolarHBondContact O-N 3.02Å; N261-E264 PolarHBondContact O-N 3.49Å; N261-L265 WeakPolarHBondContact O-CB 3.48Å; N261-L265 VanDerWaalsContact O-CG 3.31Å; N261-L265 WeakPolarHBondContact O-CG 3.32Å; N261-L265 PolarHBondContact O-N 3.07Å
262	S	71.8	Confident	75.2	Confident	73 Å²	73	68 Å²	68	51%	0.51	33%	0.333	S	S	.	.	H	α-helix	trans	-64.7	-32.4	178.9	75.6	0	0	0	0	112.8	S258 R259 I260	S258-S262 VanDerWaalsContact O-CB 3.29Å; S258-S262 WeakPolarHBondContact O-CB 3.46Å; S258-S262 PolarHBondContact O-N 2.94Å; R259-S262 WeakPolarHBondContact O-CB 3.31Å; R259-S262 PolarHBondContact O-N 3.01Å; R259-S262 PolarHBondContact O-OG 3.16Å; I260-S262 VanDerWaalsContact C-N 3.32Å; I260-S262 PolarHBondContact O-N 2.99Å
263	H	66.6	Low	75.8	Confident	61 Å²	61	63.2 Å²	63.2	28%	0.282	32%	0.316	S	S	.	.	H	α-helix	trans	-83.7	-33.5	177.2	-80.1	-94.3	0	0	0	112.6	F176 E210 R259 I260 N261	F176-H263 HydrophobicContact CE1-CB 4.26Å; F176-H263 HydrophobicContact CZ-CB 4.4Å; E210-H263 IonicContact OE1-CD2 3.61Å; E210-H263 PolarHBondContact OE1-CD2 2.86Å; E210-H263 IonicContact OE1-CE1 3.53Å; E210-H263 IonicContact OE1-CG 3.64Å; E210-H263 IonicContact OE1-NE2 2.67Å; E210-H263 PolarHBondContact OE1-NE2 3.27Å; E210-H263 VanDerWaalsContact OE2-CB 3.31Å; E210-H263 WeakPolarHBondContact OE2-CB 3.2Å; E210-H263 IonicContact OE2-CD2 2.84Å; E210-H263 PolarHBondContact OE2-CD2 3.02Å; E210-H263 IonicContact OE2-CE1 3.24Å; E210-H263 PolarHBondContact OE2-CE1 3.41Å; E210-H263 IonicContact OE2-CG 3.38Å; E210-H263 IonicContact OE2-ND1 2.98Å; E210-H263 PolarHBondContact OE2-ND1 2.91Å; E210-H263 VanDerWaalsContact OE2-ND1 3.16Å; E210-H263 IonicContact OE2-NE2 3.5Å; E210-H263 PolarHBondContact OE2-NE2 3.16Å; R259-H263 PolarHBondContact O-CD2 2.88Å; R259-H263 PolarHBondContact O-N 3.37Å; I260-H263 PolarHBondContact O-N 3.22Å; N261-H263 VanDerWaalsContact C-N 3.28Å; N261-H263 PolarHBondContact O-N 3.02Å
264	E	62.6	Low	76.4	Confident	28 Å²	28	64.4 Å²	64.4	13%	0.131	33%	0.325	C	S	.	.	H	α-helix	trans	-68	-43.2	176.2	169.3	157.1	-110	0	0	113.5	F77 K81 I260 N261 R266	F77-E264 VanDerWaalsContact CE2-OE2 3.24Å; F77-E264 WeakPolarHBondContact CE2-OE2 3.44Å; F77-E264 WeakPolarHBondContact CZ-OE1 3.44Å; F77-E264 WeakPolarHBondContact CZ-OE2 3.44Å; K81-E264 WeakPolarHBondContact CE-OE1 3.19Å; K81-E264 WeakPolarHBondContact CE-OE2 3.46Å; K81-E264 IonicContact NZ-OE1 2.75Å; K81-E264 PolarHBondContact NZ-OE1 3.48Å; K81-E264 IonicContact NZ-OE2 3Å; K81-E264 PolarHBondContact NZ-OE2 2.97Å; K81-E264 VanDerWaalsContact NZ-OE2 3.12Å; I260-E264 WeakPolarHBondContact O-CB 3.49Å; I260-E264 PolarHBondContact O-N 3.39Å; N261-E264 PolarHBondContact O-N 3.49Å; E264-R266 PolarHBondContact O-N 3.16Å
265	L	56.3	Low	77.2	Confident	133 Å²	133	59.9 Å²	59.9	70%	0.696	30%	0.3	S	S	*	.			trans	-74.3	48.1	-177.4	-69.4	167.6	0	0	0	111.4	N261 R267	N261-L265 WeakPolarHBondContact O-CB 3.48Å; N261-L265 VanDerWaalsContact O-CG 3.31Å; N261-L265 WeakPolarHBondContact O-CG 3.32Å; N261-L265 PolarHBondContact O-N 3.07Å; L265-R267 PolarHBondContact O-N 2.68Å
266	R	55	Low	78	Confident	133 Å²	133	58.2 Å²	58.2	50%	0.502	29%	0.293	S	S	.	.			trans	-54	90.8	169.5	-91.3	-174.7	165.8	-160.9	-10.6	109.5	I172 E208 E264 S268	I172-R266 HydrophobicContact CD1-CB 4.09Å; E208-R266 VanDerWaalsContact CD-CZ 3.48Å; E208-R266 IonicContact OE1-CZ 3.48Å; E208-R266 IonicContact OE1-NH1 3.69Å; E208-R266 PolarHBondContact OE1-NH1 2.88Å; E208-R266 IonicContact OE1-NH2 4Å; E208-R266 PolarHBondContact OE1-NH2 3.35Å; E208-R266 IonicContact OE2-CZ 3.6Å; E208-R266 IonicContact OE2-NE 3.98Å; E208-R266 IonicContact OE2-NH1 3.7Å; E208-R266 IonicContact OE2-NH2 3.33Å; E208-R266 PolarHBondContact OE2-NH2 3.35Å; E264-R266 PolarHBondContact O-N 3.16Å; R266-S268 VanDerWaalsContact C-N 3.3Å; R266-S268 PolarHBondContact O-N 3.36Å
267	R	58.6	Low	78.5	Confident	141 Å²	141	59.8 Å²	59.8	53%	0.532	30%	0.301	S	S	.	.			trans	18.8	68.8	161.8	-62.9	-173.4	-174.7	-171.3	0.6	112.1	L265 R269 Y290	L265-R267 PolarHBondContact O-N 2.68Å; R267-R269 PolarHBondContact O-N 2.81Å; R267-Y290 HydrophobicContact CB-CD1 4.04Å; R267-Y290 HydrophobicContact CB-CE1 3.47Å; R267-Y290 VanDerWaalsContact CB-CE1 3.47Å; R267-Y290 HydrophobicContact CG-CE1 4.35Å; R267-Y290 WeakPolarHBondContact O-CE1 3.28Å
268	S	64.8	Low	78.5	Confident	107 Å²	107	60.4 Å²	60.4	75%	0.748	31%	0.312	S	S	*	.			trans	-58.4	108.5	174	-176.6	0	0	0	0	107	R266	R266-S268 VanDerWaalsContact C-N 3.3Å; R266-S268 PolarHBondContact O-N 3.36Å
269	R	77.5	Confident	78.5	Confident	72 Å²	72	63.6 Å²	63.6	27%	0.272	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	120.8	-169.3	-174.2	-177.3	-56.6	-166	-0.6	107	R267 A271 R272 S288 Y290 D396	R267-R269 PolarHBondContact O-N 2.81Å; R269-A271 WeakPolarHBondContact CG-O 3.31Å; R269-R272 VanDerWaalsContact CD-CG 3.45Å; R269-R272 VanDerWaalsContact NH1-CD 3.3Å; R269-R272 VanDerWaalsContact NH1-CG 3.28Å; R269-S288 PolarHBondContact NE-OG 3.01Å; R269-S288 VanDerWaalsContact NE-OG 3.13Å; R269-S288 PolarHBondContact NH1-OG 2.89Å; R269-S288 PolarHBondContact NH2-OG 2.96Å; R269-Y290 HydrophobicContact CB-CD1 4.38Å; R269-Y290 HydrophobicContact CB-CE1 3.82Å; R269-Y290 HydrophobicContact CG-CE1 4Å; R269-D396 IonicContact CZ-OD1 3.48Å; R269-D396 IonicContact NH1-OD1 3.12Å; R269-D396 PolarHBondContact NH1-OD1 2.75Å; R269-D396 IonicContact NH1-OD2 2.63Å; R269-D396 PolarHBondContact NH1-OD2 3.16Å; R269-D396 IonicContact NH2-OD1 2.71Å; R269-D396 PolarHBondContact NH2-OD1 3.47Å
270	L	86.2	Confident	78.6	Confident	74 Å²	74	65.9 Å²	65.9	39%	0.387	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	-45.3	176	-176.5	70.1	0	0	0	111	V289	L270-V289 HydrophobicContact CB-CB 4.44Å; L270-V289 HydrophobicContact CB-CG1 4.42Å; L270-V289 WeakPolarHBondContact CB-O 3.48Å; L270-V289 HydrophobicContact CD2-CG1 4.05Å; L270-V289 PolarHBondContact N-O 3.4Å
271	A	88.8	Confident	78.6	Confident	18 Å²	18	74.1 Å²	74.1	15%	0.149	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	156.8	-179.4	0	0	0	0	0	112.5	R269 L273 V289 Q427	R269-A271 WeakPolarHBondContact CG-O 3.31Å; A271-L273 HydrophobicContact CB-CD1 4.47Å; A271-L273 HydrophobicContact CB-CD2 4.26Å; A271-L273 HydrophobicContact CB-CG 4.09Å; A271-V289 HydrophobicContact CB-CB 4.44Å; A271-V289 HydrophobicContact CB-CG2 4.45Å; A271-V289 PolarHBondContact O-N 3.27Å; A271-Q427 HydrophobicContact CB-CG 4.2Å
272	R	91.4	Very high	78.9	Confident	153 Å²	153	79.2 Å²	79.2	58%	0.577	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	123.6	163	-66.1	-174	-175.7	-177.4	-6.7	107.9	R269 D396	R269-R272 VanDerWaalsContact CD-CG 3.45Å; R269-R272 VanDerWaalsContact NH1-CD 3.3Å; R269-R272 VanDerWaalsContact NH1-CG 3.28Å; R272-D396 IonicContact NE-OD2 4Å
273	L	93.6	Very high	79.8	Confident	7 Å²	7	79.4 Å²	79.4	4%	0.037	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	146.7	-175.2	-61.5	177.3	0	0	0	111	A271 I287 V289 V368 Y425 Q427	A271-L273 HydrophobicContact CB-CD1 4.47Å; A271-L273 HydrophobicContact CB-CD2 4.26Å; A271-L273 HydrophobicContact CB-CG 4.09Å; L273-I287 HydrophobicContact CB-CD1 4.47Å; L273-I287 HydrophobicContact CB-CG1 4.12Å; L273-I287 PolarHBondContact N-O 3.4Å; L273-I287 WeakPolarHBondContact O-CG1 3.41Å; L273-I287 PolarHBondContact O-N 3.27Å; L273-V289 HydrophobicContact CD1-CG2 3.6Å; L273-V289 HydrophobicContact CG-CG2 4.15Å; L273-V368 HydrophobicContact CD2-CG1 3.55Å; L273-Y425 HydrophobicContact CD1-CD2 4.26Å; L273-Y425 HydrophobicContact CD1-CE2 3.48Å; L273-Y425 VanDerWaalsContact CD1-CE2 3.48Å; L273-Q427 WeakPolarHBondContact CD2-O 3.43Å
274	P	94.8	Very high	81	Confident	41 Å²	41	77.7 Å²	77.7	27%	0.266	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	136.3	163.3	30.9	-32.2	0	0	0	110	T284 G369 L370	P274-T284 HydrophobicContact CB-CG2 3.49Å; P274-T284 VanDerWaalsContact CB-CG2 3.49Å; P274-G369 WeakPolarHBondContact O-CA 3.46Å; P274-L370 PolarHBondContact O-N 3.08Å
275	F	95.8	Very high	82.5	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	103.5	170.6	-177.3	-163.6	0	0	0	109.6	L277 T284 L285 I287 L370 L372 L410 L438	F275-L277 HydrophobicContact CD1-CD2 4.22Å; F275-L277 HydrophobicContact CD2-CD2 4.4Å; F275-L277 HydrophobicContact CE1-CD2 3.8Å; F275-L277 HydrophobicContact CE2-CD2 4.01Å; F275-L277 HydrophobicContact CZ-CD2 3.68Å; F275-T284 CarbonylContact O-C 3.54Å; F275-T284 WeakPolarHBondContact O-CA 3.31Å; F275-L285 HydrophobicContact CB-CB 4.25Å; F275-L285 HydrophobicContact CD1-CD1 4.22Å; F275-L285 PolarHBondContact N-O 2.99Å; F275-L285 PolarHBondContact O-N 2.65Å; F275-I287 HydrophobicContact CB-CD1 4.05Å; F275-I287 HydrophobicContact CB-CG1 4.13Å; F275-I287 HydrophobicContact CB-CG2 3.84Å; F275-I287 HydrophobicContact CD1-CG2 4.19Å; F275-I287 HydrophobicContact CG-CG2 4.47Å; F275-L370 CarbonylContact C-O 3.54Å; F275-L370 WeakPolarHBondContact CA-O 3.33Å; F275-L370 HydrophobicContact CB-CB 4.46Å; F275-L370 HydrophobicContact CD1-CD2 4.42Å; F275-L370 HydrophobicContact CD2-CB 3.81Å; F275-L370 HydrophobicContact CD2-CD2 3.67Å; F275-L370 HydrophobicContact CD2-CG 3.76Å; F275-L370 WeakPolarHBondContact CD2-O 3.5Å; F275-L370 HydrophobicContact CE1-CD2 4.49Å; F275-L370 HydrophobicContact CE2-CB 4.45Å; F275-L370 HydrophobicContact CE2-CD2 3.75Å; F275-L370 HydrophobicContact CE2-CG 3.9Å; F275-L370 HydrophobicContact CG-CB 4.37Å; F275-L370 HydrophobicContact CG-CD2 4.02Å; F275-L370 HydrophobicContact CG-CG 4.5Å; F275-L370 HydrophobicContact CZ-CD2 4.18Å; F275-L372 HydrophobicContact CE2-CB 4.04Å; F275-L410 HydrophobicContact CE1-CD2 3.72Å; F275-L410 HydrophobicContact CZ-CD2 4.17Å; F275-L438 HydrophobicContact CE1-CD1 4.33Å; F275-L438 HydrophobicContact CE2-CD1 4.27Å; F275-L438 HydrophobicContact CZ-CD1 3.72Å
276	H	94.9	Very high	84.3	Confident	27 Å²	27	70.4 Å²	70.4	13%	0.125	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	117.7	179.5	-57.5	-66.5	0	0	0	110	G278 T284 L370 H371 L372	H276-G278 VanDerWaalsContact C-N 3.33Å; H276-T284 PolarHBondContact CE1-OG1 2.99Å; H276-T284 PolarHBondContact ND1-OG1 2.72Å; H276-L370 PolarHBondContact N-O 2.89Å; H276-H371 AromaticContact CD2-CE1 3.27Å; H276-H371 PolarHBondContact CD2-CE1 3.44Å; H276-H371 AromaticContact CD2-ND1 3.36Å; H276-H371 PolarHBondContact CD2-ND1 3.37Å; H276-H371 AromaticContact CG-ND1 3.96Å; H276-H371 AromaticContact NE2-CE1 3.95Å; H276-L372 WeakPolarHBondContact O-CB 3.43Å; H276-L372 PolarHBondContact O-N 3.22Å
277	L	92.2	Very high	86.2	Confident	33 Å²	33	64.1 Å²	64.1	17%	0.173	34%	0.343	C	S	.	.	S	Bend	trans	-85.5	-7.4	178.5	-62.9	180	0	0	0	113	F275 L283 L285 L372 L410	F275-L277 HydrophobicContact CD1-CD2 4.22Å; F275-L277 HydrophobicContact CD2-CD2 4.4Å; F275-L277 HydrophobicContact CE1-CD2 3.8Å; F275-L277 HydrophobicContact CE2-CD2 4.01Å; F275-L277 HydrophobicContact CZ-CD2 3.68Å; L277-L283 HydrophobicContact CB-CD2 3.58Å; L277-L283 HydrophobicContact CB-CG 3.84Å; L277-L283 HydrophobicContact CD1-CD2 4.18Å; L277-L283 HydrophobicContact CD1-CG 4.05Å; L277-L283 HydrophobicContact CG-CD2 4.5Å; L277-L283 HydrophobicContact CG-CG 4.42Å; L277-L283 PolarHBondContact N-O 3.25Å; L277-L285 HydrophobicContact CD1-CD1 4.07Å; L277-L285 HydrophobicContact CD1-CG 4.28Å; L277-L285 HydrophobicContact CG-CD1 4.47Å; L277-L372 HydrophobicContact CB-CD2 4.45Å; L277-L372 HydrophobicContact CD2-CD2 3.97Å; L277-L410 HydrophobicContact CD2-CD2 4.26Å
278	G	85.6	Confident	87.9	Confident	32 Å²	32	57.4 Å²	57.4	33%	0.33	32%	0.317	S	S	.	.	S	Bend	trans	-164	-178.5	175	0	0	0	0	0	111.2	H276 S280	H276-G278 VanDerWaalsContact C-N 3.33Å; G278-S280 PolarHBondContact O-N 3.45Å
279	S	79.7	Confident	89.2	Confident	141 Å²	141	52.3 Å²	52.3	99%	0.986	28%	0.282	S	S	*	.	S	Bend	trans	-65	-21.6	-175.9	-44.3	0	0	0	0	113.9
280	S	79.2	Confident	89.9	Confident	61 Å²	61	49.7 Å²	49.7	43%	0.427	27%	0.272	S	S	.	.	S	Bend	trans	-85.9	132.5	176	178.7	0	0	0	0	111.2	G278 N282 L283	G278-S280 PolarHBondContact O-N 3.45Å; S280-N282 PolarHBondContact O-N 2.87Å; S280-N282 VanDerWaalsContact O-N 3.09Å; S280-N282 WeakPolarHBondContact OG-CB 3.47Å; S280-N282 PolarHBondContact OG-N 3.48Å; S280-L283 PolarHBondContact O-N 2.97Å
281	K	77.8	Confident	90.1	Very high	173 Å²	173	48.3 Å²	48.3	75%	0.752	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-13.6	173.3	-65.6	-176.2	179.8	179.6	0	113.4	L283 T284	K281-L283 PolarHBondContact O-N 2.87Å; K281-T284 WeakPolarHBondContact O-CB 3.14Å; K281-T284 PolarHBondContact O-OG1 3.1Å
282	N	83.9	Confident	90	Very high	155 Å²	155	51.9 Å²	51.9	83%	0.829	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-25.1	179.9	-62.4	-9.2	0	0	0	112.7	S280	S280-N282 PolarHBondContact O-N 2.87Å; S280-N282 VanDerWaalsContact O-N 3.09Å; S280-N282 WeakPolarHBondContact OG-CB 3.47Å; S280-N282 PolarHBondContact OG-N 3.48Å
283	L	89.6	Confident	89.8	Confident	78 Å²	78	49.7 Å²	49.7	41%	0.408	29%	0.288	S	S	.	.	S	Bend	trans	-107.3	66	179.7	-163	71.2	0	0	0	110.2	L277 S280 K281	L277-L283 HydrophobicContact CB-CD2 3.58Å; L277-L283 HydrophobicContact CB-CG 3.84Å; L277-L283 HydrophobicContact CD1-CD2 4.18Å; L277-L283 HydrophobicContact CD1-CG 4.05Å; L277-L283 HydrophobicContact CG-CD2 4.5Å; L277-L283 HydrophobicContact CG-CG 4.42Å; L277-L283 PolarHBondContact N-O 3.25Å; S280-L283 PolarHBondContact O-N 2.97Å; K281-L283 PolarHBondContact O-N 2.87Å
284	T	93.4	Very high	89.2	Confident	24 Å²	24	56.1 Å²	56.1	15%	0.147	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	132.2	-177.1	-54.3	0	0	0	0	110.9	P274 F275 H276 K281 I400	P274-T284 HydrophobicContact CB-CG2 3.49Å; P274-T284 VanDerWaalsContact CB-CG2 3.49Å; F275-T284 CarbonylContact O-C 3.54Å; F275-T284 WeakPolarHBondContact O-CA 3.31Å; H276-T284 PolarHBondContact CE1-OG1 2.99Å; H276-T284 PolarHBondContact ND1-OG1 2.72Å; K281-T284 WeakPolarHBondContact O-CB 3.14Å; K281-T284 PolarHBondContact O-OG1 3.1Å; T284-I400 HydrophobicContact CG2-CD1 3.99Å
285	L	94	Very high	88.8	Confident	8 Å²	8	57.5 Å²	57.5	4%	0.042	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	147.7	173.5	-50.2	177	0	0	0	110.4	F275 L277 W406	F275-L285 HydrophobicContact CB-CB 4.25Å; F275-L285 HydrophobicContact CD1-CD1 4.22Å; F275-L285 PolarHBondContact N-O 2.99Å; F275-L285 PolarHBondContact O-N 2.65Å; L277-L285 HydrophobicContact CD1-CD1 4.07Å; L277-L285 HydrophobicContact CD1-CG 4.28Å; L277-L285 HydrophobicContact CG-CD1 4.47Å; L285-W406 HydrophobicContact CD1-CB 3.97Å; L285-W406 HydrophobicContact CD2-CB 3.43Å; L285-W406 VanDerWaalsContact CD2-CB 3.43Å; L285-W406 HydrophobicContact CD2-CG 3.91Å; L285-W406 HydrophobicContact CG-CB 4.35Å
286	G	94	Very high	88.2	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	123.1	169.4	0	0	0	0	0	109.6	D396 S399 S403	G286-D396 PolarHBondContact O-N 3.16Å; G286-S399 WeakPolarHBondContact CA-OG 3.31Å; G286-S403 PolarHBondContact N-OG 2.78Å
287	I	94.7	Very high	87.7	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	152.8	176	65.1	164.3	0	0	0	111.8	L273 F275 L370 I393 F407	L273-I287 HydrophobicContact CB-CD1 4.47Å; L273-I287 HydrophobicContact CB-CG1 4.12Å; L273-I287 PolarHBondContact N-O 3.4Å; L273-I287 WeakPolarHBondContact O-CG1 3.41Å; L273-I287 PolarHBondContact O-N 3.27Å; F275-I287 HydrophobicContact CB-CD1 4.05Å; F275-I287 HydrophobicContact CB-CG1 4.13Å; F275-I287 HydrophobicContact CB-CG2 3.84Å; F275-I287 HydrophobicContact CD1-CG2 4.19Å; F275-I287 HydrophobicContact CG-CG2 4.47Å; I287-L370 HydrophobicContact CD1-CB 4.19Å; I287-L370 HydrophobicContact CD1-CD2 3.84Å; I287-I393 HydrophobicContact CD1-CB 4.3Å; I287-I393 HydrophobicContact CD1-CD1 4.19Å; I287-I393 HydrophobicContact CD1-CG2 3.93Å; I287-F407 HydrophobicContact CG2-CD2 4.26Å; I287-F407 HydrophobicContact CG2-CE2 4.37Å
288	S	93.4	Very high	87.5	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	134.1	171	-59	0	0	0	0	109.8	R269 Y290 I393 Y394 D396	R269-S288 PolarHBondContact NE-OG 3.01Å; R269-S288 VanDerWaalsContact NE-OG 3.13Å; R269-S288 PolarHBondContact NH1-OG 2.89Å; R269-S288 PolarHBondContact NH2-OG 2.96Å; S288-Y290 VanDerWaalsContact CB-CE2 3.44Å; S288-Y290 VanDerWaalsContact CB-CZ 3.46Å; S288-Y290 VanDerWaalsContact CB-OH 3.23Å; S288-Y290 WeakPolarHBondContact CB-OH 3.28Å; S288-I393 VanDerWaalsContact O-CA 3.31Å; S288-I393 WeakPolarHBondContact O-CA 3.48Å; S288-Y394 PolarHBondContact N-O 2.69Å; S288-Y394 PolarHBondContact O-N 3.31Å; S288-D396 WeakPolarHBondContact OG-CB 3.47Å
289	V	93.3	Very high	87.4	Confident	0 Å²	0	72 Å²	72	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	136.1	175.8	-171.2	0	0	0	0	109.5	L270 A271 L273 H391 F392 I393 Y425	L270-V289 HydrophobicContact CB-CB 4.44Å; L270-V289 HydrophobicContact CB-CG1 4.42Å; L270-V289 WeakPolarHBondContact CB-O 3.48Å; L270-V289 HydrophobicContact CD2-CG1 4.05Å; L270-V289 PolarHBondContact N-O 3.4Å; A271-V289 HydrophobicContact CB-CB 4.44Å; A271-V289 HydrophobicContact CB-CG2 4.45Å; A271-V289 PolarHBondContact O-N 3.27Å; L273-V289 HydrophobicContact CD1-CG2 3.6Å; L273-V289 HydrophobicContact CG-CG2 4.15Å; V289-H391 HydrophobicContact CG1-CB 3.75Å; V289-F392 CarbonylContact C-O 3.57Å; V289-F392 WeakPolarHBondContact CA-O 3.41Å; V289-I393 HydrophobicContact CG2-CG2 4.09Å; V289-Y425 HydrophobicContact CG2-CE2 4.42Å
290	Y	91.5	Very high	87.7	Confident	17 Å²	17	70 Å²	70	7%	0.067	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	152.9	178.7	-56.2	-78.5	0	0	0	110.4	R267 R269 S288 F392	R267-Y290 HydrophobicContact CB-CD1 4.04Å; R267-Y290 HydrophobicContact CB-CE1 3.47Å; R267-Y290 VanDerWaalsContact CB-CE1 3.47Å; R267-Y290 HydrophobicContact CG-CE1 4.35Å; R267-Y290 WeakPolarHBondContact O-CE1 3.28Å; R269-Y290 HydrophobicContact CB-CD1 4.38Å; R269-Y290 HydrophobicContact CB-CE1 3.82Å; R269-Y290 HydrophobicContact CG-CE1 4Å; S288-Y290 VanDerWaalsContact CB-CE2 3.44Å; S288-Y290 VanDerWaalsContact CB-CZ 3.46Å; S288-Y290 VanDerWaalsContact CB-OH 3.23Å; S288-Y290 WeakPolarHBondContact CB-OH 3.28Å; Y290-F392 HydrophobicContact CD2-CD1 4.39Å; Y290-F392 PolarHBondContact N-O 2.83Å; Y290-F392 PolarHBondContact O-N 3.43Å
291	C	90	Very high	88.1	Confident	46 Å²	46	73 Å²	73	31%	0.311	39%	0.391	S	S	.	.			trans	-107.3	104.1	168.4	-64.9	0	0	0	0	108.2	V293	C291-V293 VanDerWaalsContact C-N 3.34Å
292	L	86.8	Confident	88.6	Confident	93 Å²	93	70.5 Å²	70.5	49%	0.487	39%	0.385	S	S	.	.	S	Bend	trans	-77	-26.9	177.4	-57.6	179	0	0	0	112	F392 P458	L292-F392 HydrophobicContact CD1-CB 3.68Å; L292-F392 HydrophobicContact CD1-CD1 4.13Å; L292-F392 HydrophobicContact CD1-CD2 3.85Å; L292-F392 HydrophobicContact CD1-CE2 4.48Å; L292-F392 HydrophobicContact CD1-CG 3.63Å; L292-F392 HydrophobicContact CD2-CB 4.39Å; L292-F392 HydrophobicContact CD2-CD1 4.41Å; L292-F392 HydrophobicContact CG-CB 3.71Å; L292-F392 HydrophobicContact CG-CD1 4.46Å; L292-F392 HydrophobicContact CG-CG 4.1Å; L292-P458 HydrophobicContact CD1-CG 4.19Å
293	V	87.2	Confident	89	Confident	106 Å²	106	72.1 Å²	72.1	64%	0.642	38%	0.379	S	S	*	.	S	Bend	trans	-128.3	127.2	176.4	-178.2	0	0	0	0	107.8	C291	C291-V293 VanDerWaalsContact C-N 3.34Å
294	Y	81.7	Confident	89.1	Confident	143 Å²	143	72.7 Å²	72.7	56%	0.561	38%	0.382	S	S	*	.			trans	-138.4	137.6	175.9	-170.1	-92.1	0	0	0	109.4	T296	Y294-T296 PolarHBondContact O-N 2.61Å; Y294-T296 VanDerWaalsContact O-N 3.16Å
295	P	85.3	Confident	89.1	Confident	70 Å²	70	73.2 Å²	73.2	46%	0.455	39%	0.387	S	S	.	.			trans	-68.2	112	176.9	27.4	-33.6	0	0	0	110.6	R297	P295-R297 PolarHBondContact O-N 3.27Å
296	T	84.6	Confident	89.1	Confident	86 Å²	86	78.5 Å²	78.5	53%	0.528	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-67	116.1	172.9	-50.2	0	0	0	0	109.6	Y294 L512	Y294-T296 PolarHBondContact O-N 2.61Å; Y294-T296 VanDerWaalsContact O-N 3.16Å; T296-L512 HydrophobicContact CG2-CD1 3.62Å
297	R	84.2	Confident	89.1	Confident	156 Å²	156	83.6 Å²	83.6	59%	0.589	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-93.8	157.5	176.5	-60.6	-177.6	-176.5	-177.6	1.7	109.9	P295	P295-R297 PolarHBondContact O-N 3.27Å
298	L	86.9	Confident	89	Confident	88 Å²	88	86.9 Å²	86.9	46%	0.461	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-62.1	137	167.7	-82.8	80.4	0	0	0	108.8	S300 T511 L512 F515	L298-S300 PolarHBondContact O-N 3.06Å; L298-T511 HydrophobicContact CD1-CG2 4.18Å; L298-L512 HydrophobicContact CD1-CD2 3.71Å; L298-L512 HydrophobicContact CD1-CG 4.47Å; L298-L512 HydrophobicContact CG-CD2 3.84Å; L298-F515 HydrophobicContact CD2-CB 4.5Å; L298-F515 HydrophobicContact CD2-CD2 4.11Å; L298-F515 HydrophobicContact CD2-CG 4.29Å
299	P	84.2	Confident	88.8	Confident	66 Å²	66	92.5 Å²	92.5	43%	0.429	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-55.1	136.3	173.8	-25.1	34.3	0	0	0	111.2	F515 Y516	P299-F515 HydrophobicContact CG-CE1 4.04Å; P299-Y516 HydrophobicContact CG-CE1 4.43Å
300	S	85.6	Confident	88.6	Confident	99 Å²	99	99 Å²	99	69%	0.692	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-67	139.8	174	55.4	0	0	0	0	110.2	L298	L298-S300 PolarHBondContact O-N 3.06Å
301	P	88.4	Confident	88.6	Confident	123 Å²	123	103.3 Å²	103.3	80%	0.799	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-61.9	143.7	177.5	26.9	-34.4	0	0	0	111.2
302	I	87.9	Confident	88.6	Confident	122 Å²	122	104.6 Å²	104.6	63%	0.626	57%	0.571	S	S	*	*			trans	-104.5	134.6	176.5	-58.3	172.2	0	0	0	108.4	L304 T311	I302-L304 HydrophobicContact CG2-CD2 4.33Å; I302-T311 HydrophobicContact CG2-CG2 3.83Å
303	W	91.4	Very high	88.7	Confident	188 Å²	188	109.8 Å²	109.8	71%	0.712	58%	0.584	S	S	*	*			trans	-71.9	128.1	175.7	-65	94	0	0	0	110.6	V312 V314	W303-V312 HydrophobicContact CB-CB 4.15Å; W303-V312 PolarHBondContact O-N 3.16Å; W303-V314 HydrophobicContact CB-CG2 4.43Å; W303-V314 HydrophobicContact CG-CG2 4.08Å
304	L	93.2	Very high	88.7	Confident	90 Å²	90	108.8 Å²	108.8	47%	0.471	58%	0.577	S	S	.	*	B	Isolated β-bridge	trans	-119.1	146.2	179	-56.8	-179.3	0	0	0	110.6	I302 K310 T311	I302-L304 HydrophobicContact CG2-CD2 4.33Å; L304-K310 WeakPolarHBondContact CA-O 3.46Å; L304-T311 HydrophobicContact CD2-CG2 3.87Å
305	S	93.5	Very high	89	Confident	35 Å²	35	107.6 Å²	107.6	25%	0.245	58%	0.577	C	S	.	*			trans	-71.8	126.6	169.2	157.9	0	0	0	0	109.3	S307 D308 N309 K310	S305-S307 PolarHBondContact O-N 2.92Å; S305-S307 PolarHBondContact OG-OG 3.07Å; S305-D308 WeakPolarHBondContact CB-OD1 3.1Å; S305-D308 PolarHBondContact O-N 2.64Å; S305-D308 PolarHBondContact OG-OD1 3.41Å; S305-N309 VanDerWaalsContact O-CA 3.24Å; S305-N309 WeakPolarHBondContact O-CA 3.4Å; S305-N309 PolarHBondContact O-N 2.76Å; S305-K310 PolarHBondContact N-O 3.22Å
306	S	93.6	Very high	89.1	Confident	120 Å²	120	114.2 Å²	114.2	84%	0.839	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-21.5	-175.1	62.4	0	0	0	0	114
307	S	94.5	Very high	89.2	Confident	108 Å²	108	114.6 Å²	114.6	76%	0.755	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-32	-177.6	52.4	0	0	0	0	113.6	S305	S305-S307 PolarHBondContact O-N 2.92Å; S305-S307 PolarHBondContact OG-OG 3.07Å
308	D	92.4	Very high	89.3	Confident	68 Å²	68	113.8 Å²	113.8	36%	0.364	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-135.5	3.8	-172.1	69.1	-17.7	0	0	0	114.6	S305 K310	S305-D308 WeakPolarHBondContact CB-OD1 3.1Å; S305-D308 PolarHBondContact O-N 2.64Å; S305-D308 PolarHBondContact OG-OD1 3.41Å; D308-K310 HydrophobicContact CB-CG 4.42Å; D308-K310 PolarHBondContact O-N 3.02Å; D308-K310 PolarHBondContact OD1-N 2.66Å; D308-K310 WeakPolarHBondContact OD2-CD 3.36Å; D308-K310 VanDerWaalsContact OD2-CE 3.24Å; D308-K310 WeakPolarHBondContact OD2-CE 3.42Å; D308-K310 WeakPolarHBondContact OD2-CG 3.12Å; D308-K310 IonicContact OD2-NZ 3.44Å; D308-K310 PolarHBondContact OD2-NZ 3.2Å
309	N	88	Confident	89.3	Confident	119 Å²	119	113.1 Å²	113.1	64%	0.636	58%	0.581	S	S	*	*			trans	54	21.3	-179.4	-64.9	-36.1	0	0	0	114.5	S305	S305-N309 VanDerWaalsContact O-CA 3.24Å; S305-N309 WeakPolarHBondContact O-CA 3.4Å; S305-N309 PolarHBondContact O-N 2.76Å
310	K	90.4	Very high	89.3	Confident	137 Å²	137	116.1 Å²	116.1	60%	0.596	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-80.9	151.4	174.8	-66.9	-172.6	-161.8	128.2	0	111.2	L304 S305 D308	L304-K310 WeakPolarHBondContact CA-O 3.46Å; S305-K310 PolarHBondContact N-O 3.22Å; D308-K310 HydrophobicContact CB-CG 4.42Å; D308-K310 PolarHBondContact O-N 3.02Å; D308-K310 PolarHBondContact OD1-N 2.66Å; D308-K310 WeakPolarHBondContact OD2-CD 3.36Å; D308-K310 VanDerWaalsContact OD2-CE 3.24Å; D308-K310 WeakPolarHBondContact OD2-CE 3.42Å; D308-K310 WeakPolarHBondContact OD2-CG 3.12Å; D308-K310 IonicContact OD2-NZ 3.44Å; D308-K310 PolarHBondContact OD2-NZ 3.2Å
311	T	89.7	Confident	89.2	Confident	107 Å²	107	116.7 Å²	116.7	66%	0.656	58%	0.582	S	S	*	*	B	Isolated β-bridge	trans	-66.4	135.5	179.8	54.6	0	0	0	0	111.7	I302 L304	I302-T311 HydrophobicContact CG2-CG2 3.83Å; L304-T311 HydrophobicContact CD2-CG2 3.87Å
312	V	90.5	Very high	88.8	Confident	73 Å²	73	116.4 Å²	116.4	44%	0.442	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-101.1	130.9	178.9	-178.8	0	0	0	0	109.3	W303	W303-V312 HydrophobicContact CB-CB 4.15Å; W303-V312 PolarHBondContact O-N 3.16Å
313	R	89.8	Confident	88.4	Confident	202 Å²	202	112.9 Å²	112.9	76%	0.762	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-83.7	116	173.3	-170.2	176.5	-180	-170.4	-3.3	109.5	H315	R313-H315 VanDerWaalsContact CD-NE2 3.28Å; R313-H315 WeakPolarHBondContact CD-NE2 3.37Å; R313-H315 PolarHBondContact NE-CE1 3.33Å; R313-H315 PolarHBondContact NE-NE2 3.16Å
314	V	87.2	Confident	87.8	Confident	84 Å²	84	110.1 Å²	110.1	51%	0.509	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-87.4	126.4	176	-178	0	0	0	0	109.3	W303	W303-V314 HydrophobicContact CB-CG2 4.43Å; W303-V314 HydrophobicContact CG-CG2 4.08Å
315	H	87.5	Confident	87.1	Confident	118 Å²	118	116 Å²	116	55%	0.546	58%	0.578	S	S	.	*			trans	-110.6	138.3	170.2	-73.6	-90.5	0	0	0	108.8	R313	R313-H315 VanDerWaalsContact CD-NE2 3.28Å; R313-H315 WeakPolarHBondContact CD-NE2 3.37Å; R313-H315 PolarHBondContact NE-CE1 3.33Å; R313-H315 PolarHBondContact NE-NE2 3.16Å
316	R	86.5	Confident	86.5	Confident	209 Å²	209	116 Å²	116	79%	0.789	58%	0.584	S	S	*	*			trans	-119.4	113.5	177	-70.3	-176.9	178.7	177	0	108.4
317	D	86.7	Confident	85.8	Confident	94 Å²	94	113 Å²	113	50%	0.503	56%	0.563	S	S	.	*			trans	-116.5	143.4	177.6	-62.3	-41.1	0	0	0	109	Y319 L334	D317-Y319 HydrophobicContact CB-CE2 3.65Å; D317-Y319 WeakPolarHBondContact CB-OH 3.16Å; D317-L334 HydrophobicContact CB-CD1 3.73Å
318	Y	87	Confident	85.2	Confident	140 Å²	140	112.4 Å²	112.4	55%	0.549	55%	0.547	S	S	.	.			trans	-103.1	134.7	179.3	-64.7	-88.7	0	0	0	109.1	L335 L340	Y318-L335 PolarHBondContact O-N 2.87Å; Y318-L340 HydrophobicContact CD2-CD1 4.04Å; Y318-L340 HydrophobicContact CG-CD1 4.13Å
319	Y	87.1	Confident	84.7	Confident	73 Å²	73	111.9 Å²	111.9	29%	0.286	54%	0.544	S	S	.	.	B	Isolated β-bridge	trans	-123.6	144.7	-179.4	-59.3	-87.2	0	0	0	110.7	D317 I321 F328 P330 D333 L334	D317-Y319 HydrophobicContact CB-CE2 3.65Å; D317-Y319 WeakPolarHBondContact CB-OH 3.16Å; Y319-I321 PolarHBondContact O-N 2.59Å; Y319-F328 AromaticContact CD1-CD2 3.69Å; Y319-F328 HydrophobicContact CD1-CD2 3.69Å; Y319-F328 AromaticContact CD1-CE2 3.97Å; Y319-F328 HydrophobicContact CD1-CE2 3.97Å; Y319-F328 HydrophobicContact CD2-CD2 4.23Å; Y319-F328 AromaticContact CD2-CE2 3.95Å; Y319-F328 HydrophobicContact CD2-CE2 3.95Å; Y319-F328 HydrophobicContact CE1-CD2 4.3Å; Y319-F328 HydrophobicContact CE1-CE2 4.21Å; Y319-F328 HydrophobicContact CE2-CE2 4.19Å; Y319-F328 AromaticContact CG-CD2 3.65Å; Y319-F328 HydrophobicContact CG-CD2 3.65Å; Y319-F328 AromaticContact CG-CE2 3.84Å; Y319-F328 HydrophobicContact CG-CE2 3.84Å; Y319-F328 HydrophobicContact CG-CG 4.36Å; Y319-P330 HydrophobicContact CE1-CB 4.29Å; Y319-P330 WeakPolarHBondContact CE1-O 3.31Å; Y319-D333 CarbonylContact C-O 3.58Å; Y319-D333 VanDerWaalsContact CA-O 3.24Å; Y319-D333 WeakPolarHBondContact CA-O 3.41Å; Y319-L334 HydrophobicContact CD1-CB 4.24Å; Y319-L334 HydrophobicContact CD1-CD1 4.33Å; Y319-L334 HydrophobicContact CE1-CB 4.04Å; Y319-L334 HydrophobicContact CE1-CD1 3.78Å
320	K	84.8	Confident	84.3	Confident	130 Å²	130	109.8 Å²	109.8	57%	0.565	54%	0.538	S	S	*	.			trans	-77.7	118.4	170.6	-171.3	177.8	179.6	179.5	0	109.1	I322 D333 L335	K320-I322 PolarHBondContact O-N 3.31Å; K320-D333 HydrophobicContact CB-CB 4.39Å; K320-D333 PolarHBondContact N-O 2.84Å; K320-L335 HydrophobicContact CB-CD1 3.99Å; K320-L335 HydrophobicContact CB-CD2 4.17Å; K320-L335 HydrophobicContact CB-CG 4.07Å
321	I	83.8	Confident	83.8	Confident	111 Å²	111	109.4 Å²	109.4	57%	0.569	55%	0.546	S	S	*	.			trans	-79.9	120.8	173.6	-63.6	172.5	0	0	0	108.3	Y319 D323	Y319-I321 PolarHBondContact O-N 2.59Å; I321-D323 WeakPolarHBondContact CG2-O 3.29Å
322	I	78.2	Confident	83.4	Confident	117 Å²	117	112.1 Å²	112.1	60%	0.6	55%	0.549	S	S	*	.			trans	-86.1	-38.6	-176.3	-58.5	174.4	0	0	0	111.3	K320 S327 D333	K320-I322 PolarHBondContact O-N 3.31Å; I322-S327 PolarHBondContact N-O 3Å; I322-D333 VanDerWaalsContact CD1-OD2 3.3Å; I322-D333 WeakPolarHBondContact CD1-OD2 3.29Å
323	D	80.8	Confident	83.1	Confident	47 Å²	47	109.9 Å²	109.9	25%	0.251	54%	0.535	S	S	.	.	S	Bend	trans	-121.1	161.7	-176.1	71.4	13.9	0	0	0	112.9	I321 Y325 G326 S327	I321-D323 WeakPolarHBondContact CG2-O 3.29Å; D323-Y325 PolarHBondContact O-N 2.84Å; D323-Y325 PolarHBondContact OD1-N 3.46Å; D323-Y325 VanDerWaalsContact OD1-N 3.12Å; D323-G326 PolarHBondContact O-N 3.41Å; D323-G326 PolarHBondContact OD1-N 3.49Å; D323-S327 PolarHBondContact OD1-N 3.31Å; D323-S327 PolarHBondContact OD1-OG 3.26Å; D323-S327 VanDerWaalsContact OD1-OG 3.11Å; D323-S327 WeakPolarHBondContact OD2-CB 3.09Å; D323-S327 PolarHBondContact OD2-OG 3.1Å
324	P	78.3	Confident	82.9	Confident	131 Å²	131	104.1 Å²	104.1	85%	0.851	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-13.2	177.7	-20.8	32.6	0	0	0	114.3	G326	P324-G326 VanDerWaalsContact C-N 3.34Å
325	Y	79.6	Confident	82.8	Confident	212 Å²	212	102.3 Å²	102.3	83%	0.831	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-5.5	-178.4	-58.3	-73.1	0	0	0	112.6	D323	D323-Y325 PolarHBondContact O-N 2.84Å; D323-Y325 PolarHBondContact OD1-N 3.46Å; D323-Y325 VanDerWaalsContact OD1-N 3.12Å
326	G	79.6	Confident	82.7	Confident	35 Å²	35	99.1 Å²	99.1	36%	0.361	50%	0.495	S	S	.	.			trans	82.9	21.4	178.9	0	0	0	0	0	113.5	D323 P324 F328	D323-G326 PolarHBondContact O-N 3.41Å; D323-G326 PolarHBondContact OD1-N 3.49Å; P324-G326 VanDerWaalsContact C-N 3.34Å; G326-F328 WeakPolarHBondContact O-CD1 3.17Å
327	S	79.6	Confident	82.4	Confident	58 Å²	58	93.3 Å²	93.3	41%	0.406	49%	0.487	S	S	.	.			trans	-73.8	136.2	174.5	78.9	0	0	0	0	111.1	I322 D323	I322-S327 PolarHBondContact N-O 3Å; D323-S327 PolarHBondContact OD1-N 3.31Å; D323-S327 PolarHBondContact OD1-OG 3.26Å; D323-S327 VanDerWaalsContact OD1-OG 3.11Å; D323-S327 WeakPolarHBondContact OD2-CB 3.09Å; D323-S327 PolarHBondContact OD2-OG 3.1Å
328	F	81.3	Confident	82.2	Confident	95 Å²	95	96 Å²	96	42%	0.417	50%	0.496	S	S	.	.			trans	-149.9	147.4	175.9	67.8	-85.7	0	0	0	109.7	Y319 G326 P330 D333	Y319-F328 AromaticContact CD1-CD2 3.69Å; Y319-F328 HydrophobicContact CD1-CD2 3.69Å; Y319-F328 AromaticContact CD1-CE2 3.97Å; Y319-F328 HydrophobicContact CD1-CE2 3.97Å; Y319-F328 HydrophobicContact CD2-CD2 4.23Å; Y319-F328 AromaticContact CD2-CE2 3.95Å; Y319-F328 HydrophobicContact CD2-CE2 3.95Å; Y319-F328 HydrophobicContact CE1-CD2 4.3Å; Y319-F328 HydrophobicContact CE1-CE2 4.21Å; Y319-F328 HydrophobicContact CE2-CE2 4.19Å; Y319-F328 AromaticContact CG-CD2 3.65Å; Y319-F328 HydrophobicContact CG-CD2 3.65Å; Y319-F328 AromaticContact CG-CE2 3.84Å; Y319-F328 HydrophobicContact CG-CE2 3.84Å; Y319-F328 HydrophobicContact CG-CG 4.36Å; G326-F328 WeakPolarHBondContact O-CD1 3.17Å; F328-P330 HydrophobicContact CD2-CG 4.33Å; F328-P330 HydrophobicContact CE2-CB 4.42Å; F328-P330 HydrophobicContact CE2-CG 4Å; F328-D333 HydrophobicContact CB-CB 4.26Å
329	D	81.5	Confident	82.1	Confident	57 Å²	57	93.9 Å²	93.9	31%	0.305	49%	0.494	S	S	.	.			trans	-92.2	113.9	168.4	-179.2	-22.7	0	0	0	108.3	V331 K332 D333	D329-V331 PolarHBondContact O-N 3.24Å; D329-V331 PolarHBondContact OD1-N 3.04Å; D329-K332 HydrophobicContact CB-CB 4.1Å; D329-K332 PolarHBondContact O-N 3.36Å; D329-K332 PolarHBondContact OD1-N 3.13Å; D329-K332 VanDerWaalsContact OD2-CD 3.29Å; D329-K332 WeakPolarHBondContact OD2-CD 3.47Å; D329-K332 WeakPolarHBondContact OD2-CG 3.29Å; D329-K332 IonicContact OD2-NZ 2.78Å; D329-D333 PolarHBondContact N-OD2 2.77Å; D329-D333 WeakPolarHBondContact O-CB 3.29Å; D329-D333 PolarHBondContact O-N 2.98Å
330	P	80.2	Confident	81.9	Confident	76 Å²	76	93.4 Å²	93.4	49%	0.494	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-21.1	-177.2	-23.1	31.4	0	0	0	114.5	Y319 F328	Y319-P330 HydrophobicContact CE1-CB 4.29Å; Y319-P330 WeakPolarHBondContact CE1-O 3.31Å; F328-P330 HydrophobicContact CD2-CG 4.33Å; F328-P330 HydrophobicContact CE2-CB 4.42Å; F328-P330 HydrophobicContact CE2-CG 4Å
331	V	80.9	Confident	82	Confident	128 Å²	128	90.9 Å²	90.9	78%	0.776	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-39.5	-179.4	-177.1	0	0	0	0	111.4	D329	D329-V331 PolarHBondContact O-N 3.24Å; D329-V331 PolarHBondContact OD1-N 3.04Å
332	K	81.8	Confident	82	Confident	165 Å²	165	90.8 Å²	90.8	72%	0.717	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-33.5	-173.3	-64.5	-179.1	-172.6	164.7	0	113.9	D329	D329-K332 HydrophobicContact CB-CB 4.1Å; D329-K332 PolarHBondContact O-N 3.36Å; D329-K332 PolarHBondContact OD1-N 3.13Å; D329-K332 VanDerWaalsContact OD2-CD 3.29Å; D329-K332 WeakPolarHBondContact OD2-CD 3.47Å; D329-K332 WeakPolarHBondContact OD2-CG 3.29Å; D329-K332 IonicContact OD2-NZ 2.78Å
333	D	83.2	Confident	82.3	Confident	26 Å²	26	87 Å²	87	14%	0.139	47%	0.473	C	S	.	.	S	Bend	trans	-97.5	5	-171.9	-61.7	-39.5	0	0	0	112.9	Y319 K320 I322 F328 D329 L335	Y319-D333 CarbonylContact C-O 3.58Å; Y319-D333 VanDerWaalsContact CA-O 3.24Å; Y319-D333 WeakPolarHBondContact CA-O 3.41Å; K320-D333 HydrophobicContact CB-CB 4.39Å; K320-D333 PolarHBondContact N-O 2.84Å; I322-D333 VanDerWaalsContact CD1-OD2 3.3Å; I322-D333 WeakPolarHBondContact CD1-OD2 3.29Å; F328-D333 HydrophobicContact CB-CB 4.26Å; D329-D333 PolarHBondContact N-OD2 2.77Å; D329-D333 WeakPolarHBondContact O-CB 3.29Å; D329-D333 PolarHBondContact O-N 2.98Å; D333-L335 PolarHBondContact O-N 3.13Å
334	L	86.7	Confident	82.6	Confident	80 Å²	80	85.5 Å²	85.5	42%	0.419	47%	0.465	S	S	.	.	B	Isolated β-bridge	trans	-60	122.1	172	-179.8	67.3	0	0	0	109.3	D317 Y319 P336	D317-L334 HydrophobicContact CB-CD1 3.73Å; Y319-L334 HydrophobicContact CD1-CB 4.24Å; Y319-L334 HydrophobicContact CD1-CD1 4.33Å; Y319-L334 HydrophobicContact CE1-CB 4.04Å; Y319-L334 HydrophobicContact CE1-CD1 3.78Å; L334-P336 WeakPolarHBondContact O-CD 3.24Å
335	L	84.6	Confident	83.1	Confident	47 Å²	47	85.2 Å²	85.2	25%	0.246	45%	0.451	C	S	.	.			trans	-94.3	111.2	177.7	-71.1	170.7	0	0	0	110	Y318 K320 D333 D339 L340	Y318-L335 PolarHBondContact O-N 2.87Å; K320-L335 HydrophobicContact CB-CD1 3.99Å; K320-L335 HydrophobicContact CB-CD2 4.17Å; K320-L335 HydrophobicContact CB-CG 4.07Å; D333-L335 PolarHBondContact O-N 3.13Å; L335-D339 HydrophobicContact CD2-CB 4.44Å; L335-L340 HydrophobicContact CB-CD2 4.24Å; L335-L340 HydrophobicContact CD1-CD2 4.07Å
336	P	83.8	Confident	83.5	Confident	50 Å²	50	77.1 Å²	77.1	33%	0.325	42%	0.422	S	S	.	.			trans	-61.3	154.6	168.7	-19.8	32.9	0	0	0	111.5	L334 H338 D339	L334-P336 WeakPolarHBondContact O-CD 3.24Å; P336-H338 WeakPolarHBondContact CB-CE1 3.47Å; P336-H338 WeakPolarHBondContact CB-ND1 3.25Å; P336-H338 PolarHBondContact O-N 3.12Å; P336-D339 WeakPolarHBondContact CD-OD2 3.44Å; P336-D339 PolarHBondContact O-N 2.76Å
337	S	81.4	Confident	84	Confident	88 Å²	88	83.6 Å²	83.6	62%	0.615	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-19.8	-178.9	-50.5	0	0	0	0	115
338	H	82.3	Confident	84.3	Confident	151 Å²	151	83.7 Å²	83.7	70%	0.699	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-17.7	177.4	59.4	-95.7	0	0	0	113.3	P336 L340	P336-H338 WeakPolarHBondContact CB-CE1 3.47Å; P336-H338 WeakPolarHBondContact CB-ND1 3.25Å; P336-H338 PolarHBondContact O-N 3.12Å; H338-L340 VanDerWaalsContact C-N 3.32Å
339	D	84.2	Confident	84.8	Confident	95 Å²	95	88.6 Å²	88.6	51%	0.508	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-8.8	174.3	-69.8	-16.7	0	0	0	111.9	L335 P336	L335-D339 HydrophobicContact CD2-CB 4.44Å; P336-D339 WeakPolarHBondContact CD-OD2 3.44Å; P336-D339 PolarHBondContact O-N 2.76Å
340	L	84.5	Confident	85.1	Confident	62 Å²	62	93.2 Å²	93.2	33%	0.325	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-87.7	116.8	177	-65.1	175.7	0	0	0	110.2	Y318 L335 H338	Y318-L340 HydrophobicContact CD2-CD1 4.04Å; Y318-L340 HydrophobicContact CG-CD1 4.13Å; L335-L340 HydrophobicContact CB-CD2 4.24Å; L335-L340 HydrophobicContact CD1-CD2 4.07Å; H338-L340 VanDerWaalsContact C-N 3.32Å
341	V	86	Confident	85.6	Confident	78 Å²	78	93.1 Å²	93.1	47%	0.473	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-100.7	138.9	172.9	-169.6	0	0	0	0	108.9	C352 F353	V341-C352 HydrophobicContact CG1-CB 3.69Å; V341-F353 VanDerWaalsContact CG1-O 3.24Å; V341-F353 WeakPolarHBondContact CG1-O 3.47Å
342	R	83.4	Confident	85.9	Confident	109 Å²	109	90.6 Å²	90.6	41%	0.411	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	147.2	174.9	-66.7	-168.5	174.4	-146	-6.1	109.3	F11 E15 E18 C352 F353 L358	F11-R342 HydrophobicContact CZ-CB 4.26Å; E15-R342 WeakPolarHBondContact OE1-CD 3.44Å; E15-R342 IonicContact OE1-CZ 3.46Å; E15-R342 IonicContact OE1-NE 2.76Å; E15-R342 IonicContact OE1-NH1 3.69Å; E15-R342 PolarHBondContact OE1-NH1 3.47Å; E18-R342 IonicContact OE2-NH1 3.65Å; E18-R342 IonicContact OE2-NH2 2.76Å; R342-C352 CarbonylContact O-C 3.56Å; R342-C352 VanDerWaalsContact O-CA 3.31Å; R342-C352 WeakPolarHBondContact O-CA 3.24Å; R342-F353 PolarHBondContact N-O 3.46Å; R342-F353 VanDerWaalsContact N-O 3.12Å; R342-F353 PolarHBondContact O-N 3.26Å; R342-L358 HydrophobicContact CB-CD1 4.1Å
343	G	85.1	Confident	86.2	Confident	36 Å²	36	84.6 Å²	84.6	37%	0.371	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	156.5	178.2	0	0	0	0	0	114.3	I351	G343-I351 CarbonylContact C-O 3.5Å; G343-I351 WeakPolarHBondContact CA-O 3.48Å
344	I	87.3	Confident	86.3	Confident	17 Å²	17	87.1 Å²	87.1	9%	0.087	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	136.5	177.4	-51.8	172.3	0	0	0	108	F8 F11 L346 I351	F8-I344 HydrophobicContact CD2-CD1 3.44Å; F8-I344 VanDerWaalsContact CD2-CD1 3.44Å; F8-I344 HydrophobicContact CE2-CD1 3.67Å; F8-I344 HydrophobicContact CG-CD1 4.41Å; F11-I344 HydrophobicContact CB-CD1 3.65Å; F11-I344 HydrophobicContact CB-CG1 4.15Å; F11-I344 HydrophobicContact CD1-CD1 3.49Å; F11-I344 VanDerWaalsContact CD1-CD1 3.49Å; F11-I344 HydrophobicContact CD1-CG1 3.89Å; F11-I344 HydrophobicContact CD2-CD1 3.9Å; F11-I344 HydrophobicContact CD2-CG1 3.49Å; F11-I344 VanDerWaalsContact CD2-CG1 3.49Å; F11-I344 HydrophobicContact CE1-CD1 4.05Å; F11-I344 HydrophobicContact CE1-CG1 4.1Å; F11-I344 HydrophobicContact CE2-CD1 4.41Å; F11-I344 HydrophobicContact CE2-CG1 3.72Å; F11-I344 HydrophobicContact CG-CD1 3.39Å; F11-I344 HydrophobicContact CG-CG1 3.56Å; F11-I344 HydrophobicContact CZ-CD1 4.47Å; F11-I344 HydrophobicContact CZ-CG1 4.01Å; I344-L346 HydrophobicContact CG2-CD2 4.09Å; I344-L346 HydrophobicContact CG2-CG 4.04Å; I344-I351 PolarHBondContact N-O 2.83Å; I344-I351 PolarHBondContact O-N 3.2Å
345	K	89.3	Confident	86	Confident	124 Å²	124	89.4 Å²	89.4	54%	0.539	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	111.8	173.8	-169.4	-178.3	-172.1	166.3	0	109.8	R349 Y350	K345-R349 CarbonylContact C-O 3.55Å; K345-R349 WeakPolarHBondContact CA-O 3.31Å; K345-Y350 HydrophobicContact CB-CD1 4.03Å; K345-Y350 HydrophobicContact CB-CE1 3.83Å; K345-Y350 HydrophobicContact CD-CE1 3.96Å; K345-Y350 HydrophobicContact CD-CE2 4.23Å; K345-Y350 HydrophobicContact CG-CD1 4.29Å; K345-Y350 HydrophobicContact CG-CE1 3.96Å; K345-Y350 HydrophobicContact CG-CE2 4.33Å; K345-Y350 PolarHBondContact NZ-OH 2.67Å
346	L	88.2	Confident	86	Confident	43 Å²	43	93 Å²	93	23%	0.225	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122.3	175.4	-64.5	179.4	0	0	0	109.8	I4 I344 G348 R349 I351	I4-L346 HydrophobicContact CG2-CD1 4.34Å; I344-L346 HydrophobicContact CG2-CD2 4.09Å; I344-L346 HydrophobicContact CG2-CG 4.04Å; L346-G348 VanDerWaalsContact C-N 3.27Å; L346-G348 PolarHBondContact O-N 2.84Å; L346-R349 PolarHBondContact N-O 2.89Å; L346-R349 PolarHBondContact O-N 3Å; L346-I351 HydrophobicContact CD1-CD1 3.85Å
347	D	88.5	Confident	86	Confident	170 Å²	170	95.2 Å²	95.2	91%	0.909	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	46.2	178	-163.4	31.6	0	0	0	114.1	R349	D347-R349 PolarHBondContact O-N 2.95Å
348	G	87.6	Confident	86	Confident	60 Å²	60	91.1 Å²	91.1	62%	0.619	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	-6.2	179.9	0	0	0	0	0	115.7	L346	L346-G348 VanDerWaalsContact C-N 3.27Å; L346-G348 PolarHBondContact O-N 2.84Å
349	R	90.6	Very high	85.9	Confident	199 Å²	199	85.6 Å²	85.6	75%	0.751	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	139.1	174.1	-62.3	-177.9	-177.3	175.5	1.4	110.5	K345 L346 D347	K345-R349 CarbonylContact C-O 3.55Å; K345-R349 WeakPolarHBondContact CA-O 3.31Å; L346-R349 PolarHBondContact N-O 2.89Å; L346-R349 PolarHBondContact O-N 3Å; D347-R349 PolarHBondContact O-N 2.95Å
350	Y	88.9	Confident	85.6	Confident	154 Å²	154	87 Å²	87	60%	0.604	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	123.9	171.3	-69.4	-90	0	0	0	108.7	K345	K345-Y350 HydrophobicContact CB-CD1 4.03Å; K345-Y350 HydrophobicContact CB-CE1 3.83Å; K345-Y350 HydrophobicContact CD-CE1 3.96Å; K345-Y350 HydrophobicContact CD-CE2 4.23Å; K345-Y350 HydrophobicContact CG-CD1 4.29Å; K345-Y350 HydrophobicContact CG-CE1 3.96Å; K345-Y350 HydrophobicContact CG-CE2 4.33Å; K345-Y350 PolarHBondContact NZ-OH 2.67Å
351	I	88.7	Confident	85.2	Confident	73 Å²	73	88 Å²	88	37%	0.374	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	110.4	168.2	-54.8	178.7	0	0	0	105.7	G343 I344 L346 F353	G343-I351 CarbonylContact C-O 3.5Å; G343-I351 WeakPolarHBondContact CA-O 3.48Å; I344-I351 PolarHBondContact N-O 2.83Å; I344-I351 PolarHBondContact O-N 3.2Å; L346-I351 HydrophobicContact CD1-CD1 3.85Å; I351-F353 HydrophobicContact CB-CE2 4.44Å; I351-F353 HydrophobicContact CG2-CD2 4.45Å; I351-F353 HydrophobicContact CG2-CE1 4.22Å; I351-F353 HydrophobicContact CG2-CE2 3.6Å; I351-F353 HydrophobicContact CG2-CZ 3.46Å; I351-F353 VanDerWaalsContact CG2-CZ 3.46Å
352	C	88.6	Confident	84.8	Confident	75 Å²	75	86.1 Å²	86.1	51%	0.507	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	143	-176.7	-59.2	0	0	0	0	109.7	V341 R342	V341-C352 HydrophobicContact CG1-CB 3.69Å; R342-C352 CarbonylContact O-C 3.56Å; R342-C352 VanDerWaalsContact O-CA 3.31Å; R342-C352 WeakPolarHBondContact O-CA 3.24Å
353	F	86.8	Confident	84.7	Confident	39 Å²	39	81 Å²	81	17%	0.171	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	139	176.8	-57.2	-82.3	0	0	0	109.5	F8 V341 R342 I351 E357 L358	F8-F353 AromaticContact CE2-CE2 3.96Å; F8-F353 HydrophobicContact CE2-CE2 3.96Å; F8-F353 HydrophobicContact CE2-CZ 4Å; F8-F353 HydrophobicContact CZ-CE2 4.28Å; F8-F353 HydrophobicContact CZ-CZ 4.11Å; V341-F353 VanDerWaalsContact CG1-O 3.24Å; V341-F353 WeakPolarHBondContact CG1-O 3.47Å; R342-F353 PolarHBondContact N-O 3.46Å; R342-F353 VanDerWaalsContact N-O 3.12Å; R342-F353 PolarHBondContact O-N 3.26Å; I351-F353 HydrophobicContact CB-CE2 4.44Å; I351-F353 HydrophobicContact CG2-CD2 4.45Å; I351-F353 HydrophobicContact CG2-CE1 4.22Å; I351-F353 HydrophobicContact CG2-CE2 3.6Å; I351-F353 HydrophobicContact CG2-CZ 3.46Å; I351-F353 VanDerWaalsContact CG2-CZ 3.46Å; F353-E357 WeakPolarHBondContact CA-OE2 3.09Å; F353-L358 HydrophobicContact CB-CD1 4.09Å; F353-L358 HydrophobicContact CB-CD2 3.82Å; F353-L358 HydrophobicContact CB-CG 3.63Å; F353-L358 HydrophobicContact CD1-CD2 4.5Å; F353-L358 HydrophobicContact CD2-CD2 3.97Å; F353-L358 HydrophobicContact CG-CD2 3.86Å; F353-L358 HydrophobicContact CG-CG 4.24Å
354	D	85.7	Confident	84.6	Confident	80 Å²	80	81.4 Å²	81.4	43%	0.428	42%	0.421	S	S	.	.			trans	-71.2	154.7	167.2	-70.1	-24.9	0	0	0	110.2	D356 E357 L358	D354-D356 PolarHBondContact O-N 3.07Å; D354-E357 HydrophobicContact CB-CB 4.41Å; D354-E357 HydrophobicContact CB-CG 4.05Å; D354-E357 PolarHBondContact N-OE2 3.31Å; D354-E357 WeakPolarHBondContact O-CB 3.23Å; D354-E357 PolarHBondContact O-N 3.26Å; D354-E357 VanDerWaalsContact O-N 3.13Å; D354-L358 PolarHBondContact O-N 3.15Å
355	K	81.7	Confident	84.5	Confident	128 Å²	128	86.2 Å²	86.2	56%	0.557	45%	0.446	S	S	*	.	H	α-helix	trans	-58.2	-37.6	179.2	-173.6	179.7	178.6	-179.3	0	112.1	T359	K355-T359 WeakPolarHBondContact O-CB 3.45Å; K355-T359 PolarHBondContact O-N 3.41Å; K355-T359 VanDerWaalsContact O-N 3.1Å; K355-T359 PolarHBondContact O-OG1 3.38Å
356	D	83.2	Confident	84.4	Confident	123 Å²	123	81.4 Å²	81.4	66%	0.658	43%	0.429	S	S	*	.	H	α-helix	trans	-72.7	-35.2	179.2	-67.4	-16.6	0	0	0	111.3	D354 T359 E360	D354-D356 PolarHBondContact O-N 3.07Å; D356-T359 PolarHBondContact O-N 3.38Å; D356-E360 WeakPolarHBondContact O-CB 3.33Å; D356-E360 PolarHBondContact O-N 3.22Å
357	E	85	Confident	84.5	Confident	95 Å²	95	83.8 Å²	83.8	44%	0.444	45%	0.448	S	S	.	.	I	π-helix	trans	-63.4	-46.4	173.9	-68.7	-179	144.4	0	0	111.5	F353 D354 T359 A361 V362	F353-E357 WeakPolarHBondContact CA-OE2 3.09Å; D354-E357 HydrophobicContact CB-CB 4.41Å; D354-E357 HydrophobicContact CB-CG 4.05Å; D354-E357 PolarHBondContact N-OE2 3.31Å; D354-E357 WeakPolarHBondContact O-CB 3.23Å; D354-E357 PolarHBondContact O-N 3.26Å; D354-E357 VanDerWaalsContact O-N 3.13Å; E357-T359 VanDerWaalsContact C-N 3.3Å; E357-T359 PolarHBondContact O-N 3.42Å; E357-A361 WeakPolarHBondContact O-CA 3.07Å; E357-A361 VanDerWaalsContact O-CB 3.27Å; E357-A361 WeakPolarHBondContact O-CB 2.98Å; E357-A361 PolarHBondContact O-N 2.84Å; E357-V362 PolarHBondContact O-N 3.47Å
358	L	81.7	Confident	84.6	Confident	3 Å²	3	77.9 Å²	77.9	2%	0.016	42%	0.417	C	S	.	.	I	π-helix	trans	-59.4	-43.5	175.5	-72.3	170.4	0	0	0	111.4	F11 R342 F353 D354 V362 R363	F11-L358 HydrophobicContact CE1-CD1 4.45Å; F11-L358 HydrophobicContact CE1-CD2 4.18Å; R342-L358 HydrophobicContact CB-CD1 4.1Å; F353-L358 HydrophobicContact CB-CD1 4.09Å; F353-L358 HydrophobicContact CB-CD2 3.82Å; F353-L358 HydrophobicContact CB-CG 3.63Å; F353-L358 HydrophobicContact CD1-CD2 4.5Å; F353-L358 HydrophobicContact CD2-CD2 3.97Å; F353-L358 HydrophobicContact CG-CD2 3.86Å; F353-L358 HydrophobicContact CG-CG 4.24Å; D354-L358 PolarHBondContact O-N 3.15Å; L358-V362 WeakPolarHBondContact O-CB 3.45Å; L358-R363 VanDerWaalsContact O-CD 3.32Å; L358-R363 WeakPolarHBondContact O-CD 3.14Å; L358-R363 WeakPolarHBondContact O-CG 3.35Å; L358-R363 PolarHBondContact O-N 3.49Å; L358-R363 VanDerWaalsContact O-N 3.16Å
359	T	78.6	Confident	84.9	Confident	35 Å²	35	75 Å²	75	22%	0.215	39%	0.388	C	S	.	.	I	π-helix	trans	-74.2	-49.2	-175	-52.2	0	0	0	0	112.3	K355 D356 E357 N364	K355-T359 WeakPolarHBondContact O-CB 3.45Å; K355-T359 PolarHBondContact O-N 3.41Å; K355-T359 VanDerWaalsContact O-N 3.1Å; K355-T359 PolarHBondContact O-OG1 3.38Å; D356-T359 PolarHBondContact O-N 3.38Å; E357-T359 VanDerWaalsContact C-N 3.3Å; E357-T359 PolarHBondContact O-N 3.42Å; T359-N364 PolarHBondContact O-N 2.9Å; T359-N364 PolarHBondContact O-ND2 3.13Å
360	E	79.2	Confident	85.2	Confident	125 Å²	125	65.5 Å²	65.5	58%	0.584	35%	0.352	S	S	*	.	I	π-helix	trans	-87.5	-44.4	-173	-67.4	-63.3	156.7	0	0	113.1	D356 N364	D356-E360 WeakPolarHBondContact O-CB 3.33Å; D356-E360 PolarHBondContact O-N 3.22Å; E360-N364 VanDerWaalsContact CD-ND2 3.26Å; E360-N364 PolarHBondContact OE1-ND2 3.29Å; E360-N364 PolarHBondContact OE2-ND2 3.04Å
361	A	75.9	Confident	85.5	Confident	83 Å²	83	60 Å²	60	69%	0.686	33%	0.331	S	S	*	.	I	π-helix	trans	-84.9	-37.2	-173.7	0	0	0	0	0	112.7	E357	E357-A361 WeakPolarHBondContact O-CA 3.07Å; E357-A361 VanDerWaalsContact O-CB 3.27Å; E357-A361 WeakPolarHBondContact O-CB 2.98Å; E357-A361 PolarHBondContact O-N 2.84Å
362	V	77.6	Confident	85.8	Confident	38 Å²	38	57.9 Å²	57.9	23%	0.23	32%	0.321	C	S	.	.	I	π-helix	trans	-94.9	-46.6	-172.9	-173.1	0	0	0	0	111.8	F8 E357 L358 I365 F432	F8-V362 HydrophobicContact CE1-CG1 4.49Å; E357-V362 PolarHBondContact O-N 3.47Å; L358-V362 WeakPolarHBondContact O-CB 3.45Å; V362-I365 WeakPolarHBondContact O-CG1 3.33Å; V362-F432 HydrophobicContact CG1-CE1 4.39Å; V362-F432 HydrophobicContact CG1-CZ 4Å; V362-F432 VanDerWaalsContact O-CE1 3.28Å; V362-F432 WeakPolarHBondContact O-CE1 3.41Å
363	R	80.3	Confident	86.1	Confident	1 Å²	1	59.4 Å²	59.4	0%	0.004	32%	0.323	C	S	.	.	I	π-helix	trans	-88.9	-38.2	-171.1	-70	159.5	169.6	-95.9	-7.4	114.3	L12 E15 D16 L358 I365 G430 F432	L12-R363 PolarHBondContact O-NH2 3.31Å; E15-R363 IonicContact OE2-CZ 3.98Å; E15-R363 IonicContact OE2-NE 3.04Å; E15-R363 IonicContact OE2-NH2 2.65Å; E15-R363 PolarHBondContact OE2-NH2 3Å; D16-R363 IonicContact OD1-CZ 2.74Å; D16-R363 IonicContact OD1-NH1 2.61Å; D16-R363 PolarHBondContact OD1-NH1 3.13Å; D16-R363 IonicContact OD1-NH2 2.97Å; L358-R363 VanDerWaalsContact O-CD 3.32Å; L358-R363 WeakPolarHBondContact O-CD 3.14Å; L358-R363 WeakPolarHBondContact O-CG 3.35Å; L358-R363 PolarHBondContact O-N 3.49Å; L358-R363 VanDerWaalsContact O-N 3.16Å; R363-I365 PolarHBondContact O-N 2.88Å; R363-G430 WeakPolarHBondContact CB-O 3.43Å; R363-G430 VanDerWaalsContact CD-O 3.31Å; R363-G430 WeakPolarHBondContact CD-O 3.25Å; R363-G430 PolarHBondContact NH1-O 2.99Å; R363-G430 VanDerWaalsContact NH1-O 3.13Å; R363-F432 HydrophobicContact CB-CZ 4.46Å; R363-F432 HydrophobicContact CG-CD2 4.31Å; R363-F432 HydrophobicContact CG-CE2 3.67Å; R363-F432 HydrophobicContact CG-CZ 3.78Å
364	N	83	Confident	86.5	Confident	45 Å²	45	58.8 Å²	58.8	24%	0.241	33%	0.328	C	S	.	.			trans	-77.7	54.5	-174.8	-75.5	-20.6	0	0	0	113.9	T359 E360 G430	T359-N364 PolarHBondContact O-N 2.9Å; T359-N364 PolarHBondContact O-ND2 3.13Å; E360-N364 VanDerWaalsContact CD-ND2 3.26Å; E360-N364 PolarHBondContact OE1-ND2 3.29Å; E360-N364 PolarHBondContact OE2-ND2 3.04Å; N364-G430 WeakPolarHBondContact OD1-CA 3.37Å; N364-G430 PolarHBondContact OD1-N 2.77Å
365	I	85.7	Confident	87.1	Confident	117 Å²	117	59.7 Å²	59.7	60%	0.6	33%	0.329	S	S	*	.	S	Bend	trans	-71.9	-33.9	-178.2	-56.6	175.7	0	0	0	112.1	V362 R363 F432 P433	V362-I365 WeakPolarHBondContact O-CG1 3.33Å; R363-I365 PolarHBondContact O-N 2.88Å; I365-F432 HydrophobicContact CD1-CD1 3.91Å; I365-F432 HydrophobicContact CD1-CE1 4.05Å; I365-P433 HydrophobicContact CB-CG 4.14Å; I365-P433 HydrophobicContact CG2-CG 4.38Å
366	A	86.8	Confident	87.8	Confident	24 Å²	24	56.5 Å²	56.5	20%	0.198	32%	0.317	C	S	.	.	S	Bend	trans	-135	147.4	-178.1	0	0	0	0	0	111.1	V426 P433	A366-V426 HydrophobicContact CB-CG2 3.89Å; A366-P433 HydrophobicContact CB-CB 4.17Å; A366-P433 HydrophobicContact CB-CG 4.4Å
367	P	89.6	Confident	88.4	Confident	93 Å²	93	52.6 Å²	52.6	60%	0.604	30%	0.3	S	S	*	.			trans	-67.5	149.3	179.6	26.7	-32.2	0	0	0	111.4	G369 H371	P367-G369 PolarHBondContact O-N 3.48Å; P367-H371 PolarHBondContact O-NE2 3.12Å
368	V	92.5	Very high	88.8	Confident	45 Å²	45	51 Å²	51	27%	0.273	29%	0.292	S	S	.	.	S	Bend	trans	-56.1	128.7	177	178.8	0	0	0	0	110.8	L273 V426 R428 K429	L273-V368 HydrophobicContact CD2-CG1 3.55Å; V368-V426 HydrophobicContact CG2-CG1 4.23Å; V368-R428 VanDerWaalsContact CG2-C 3.46Å; V368-K429 HydrophobicContact CG2-CB 4.33Å; V368-K429 HydrophobicContact CG2-CG 3.61Å; V368-K429 VanDerWaalsContact CG2-N 3.3Å
369	G	94	Very high	89.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	146.8	180	-176.8	0	0	0	0	0	113.1	P274 P367 V426	P274-G369 WeakPolarHBondContact O-CA 3.46Å; P367-G369 PolarHBondContact O-N 3.48Å; G369-V426 PolarHBondContact N-O 3.19Å; G369-V426 PolarHBondContact O-N 3.34Å
370	L	95.6	Very high	90	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	121.9	170.3	-170.5	67.9	0	0	0	107.8	P274 F275 H276 I287 I393 A423 I424 Y425 V436 L438	P274-L370 PolarHBondContact O-N 3.08Å; F275-L370 CarbonylContact C-O 3.54Å; F275-L370 WeakPolarHBondContact CA-O 3.33Å; F275-L370 HydrophobicContact CB-CB 4.46Å; F275-L370 HydrophobicContact CD1-CD2 4.42Å; F275-L370 HydrophobicContact CD2-CB 3.81Å; F275-L370 HydrophobicContact CD2-CD2 3.67Å; F275-L370 HydrophobicContact CD2-CG 3.76Å; F275-L370 WeakPolarHBondContact CD2-O 3.5Å; F275-L370 HydrophobicContact CE1-CD2 4.49Å; F275-L370 HydrophobicContact CE2-CB 4.45Å; F275-L370 HydrophobicContact CE2-CD2 3.75Å; F275-L370 HydrophobicContact CE2-CG 3.9Å; F275-L370 HydrophobicContact CG-CB 4.37Å; F275-L370 HydrophobicContact CG-CD2 4.02Å; F275-L370 HydrophobicContact CG-CG 4.5Å; F275-L370 HydrophobicContact CZ-CD2 4.18Å; H276-L370 PolarHBondContact N-O 2.89Å; I287-L370 HydrophobicContact CD1-CB 4.19Å; I287-L370 HydrophobicContact CD1-CD2 3.84Å; L370-I393 HydrophobicContact CD2-CD1 3.99Å; L370-A423 HydrophobicContact CD1-CB 3.7Å; L370-A423 HydrophobicContact CG-CB 4.01Å; L370-I424 WeakPolarHBondContact CA-O 3.23Å; L370-Y425 HydrophobicContact CD1-CD2 3.93Å; L370-Y425 HydrophobicContact CD1-CG 4.38Å; L370-V436 HydrophobicContact CD1-CG2 3.92Å; L370-L438 HydrophobicContact CD1-CD2 4.35Å; L370-L438 HydrophobicContact CD2-CD1 3.72Å; L370-L438 HydrophobicContact CD2-CD2 4.04Å; L370-L438 HydrophobicContact CD2-CG 4.5Å
371	H	95.1	Very high	90.7	Very high	37 Å²	37	58.4 Å²	58.4	17%	0.171	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	109.4	-175.4	-57.1	-84.3	0	0	0	109.8	H276 P367 L373 A423 I424	H276-H371 AromaticContact CD2-CE1 3.27Å; H276-H371 PolarHBondContact CD2-CE1 3.44Å; H276-H371 AromaticContact CD2-ND1 3.36Å; H276-H371 PolarHBondContact CD2-ND1 3.37Å; H276-H371 AromaticContact CG-ND1 3.96Å; H276-H371 AromaticContact NE2-CE1 3.95Å; P367-H371 PolarHBondContact O-NE2 3.12Å; H371-L373 PolarHBondContact O-N 2.97Å; H371-A423 CarbonylContact O-C 3.59Å; H371-A423 WeakPolarHBondContact O-CA 3.46Å; H371-A423 VanDerWaalsContact O-CB 3.26Å; H371-A423 WeakPolarHBondContact O-CB 3.26Å; H371-I424 HydrophobicContact CB-CB 4.33Å; H371-I424 PolarHBondContact N-O 2.68Å; H371-I424 PolarHBondContact O-N 3.17Å
372	L	95.8	Very high	91.5	Very high	30 Å²	30	58.4 Å²	58.4	16%	0.157	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	127.2	-179.5	-177	65.8	0	0	0	111	F275 H276 L277 F375 A421	F275-L372 HydrophobicContact CE2-CB 4.04Å; H276-L372 WeakPolarHBondContact O-CB 3.43Å; H276-L372 PolarHBondContact O-N 3.22Å; L277-L372 HydrophobicContact CB-CD2 4.45Å; L277-L372 HydrophobicContact CD2-CD2 3.97Å; L372-F375 HydrophobicContact CD1-CZ 4.24Å; L372-F375 HydrophobicContact CD2-CE2 3.9Å; L372-F375 HydrophobicContact CD2-CZ 3.8Å; L372-A421 HydrophobicContact CD1-CB 3.68Å
373	L	95	Very high	92.2	Very high	106 Å²	106	68.1 Å²	68.1	56%	0.555	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	-39	172.9	-62.5	-177.5	0	0	0	111.9	H371 I422 I424 L435	H371-L373 PolarHBondContact O-N 2.97Å; L373-I422 HydrophobicContact CB-CG2 4.42Å; L373-I422 WeakPolarHBondContact CB-O 3.43Å; L373-I422 HydrophobicContact CD1-CG2 4.17Å; L373-I422 PolarHBondContact N-O 2.62Å; L373-I424 HydrophobicContact CD1-CD1 4.3Å; L373-I424 HydrophobicContact CD1-CG1 3.88Å; L373-I424 HydrophobicContact CD2-CD1 4.03Å; L373-I424 HydrophobicContact CD2-CG1 4.18Å; L373-I424 HydrophobicContact CG-CG1 4.17Å; L373-L435 HydrophobicContact CD1-CD1 3.76Å
374	G	95.4	Very high	92.8	Very high	27 Å²	27	75.5 Å²	75.5	28%	0.278	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	167.3	-165.3	-178.6	0	0	0	0	0	113	A421 I422	G374-A421 CarbonylContact O-C 3.59Å; G374-A421 WeakPolarHBondContact O-CA 3.44Å; G374-I422 PolarHBondContact N-O 3.39Å; G374-I422 PolarHBondContact O-N 2.79Å
375	F	96.8	Very high	93.3	Very high	99 Å²	99	76 Å²	76	43%	0.434	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	136.2	-178.6	-60.1	-88.9	0	0	0	111.5	L372 L410 L419 L420 A421	L372-F375 HydrophobicContact CD1-CZ 4.24Å; L372-F375 HydrophobicContact CD2-CE2 3.9Å; L372-F375 HydrophobicContact CD2-CZ 3.8Å; F375-L410 HydrophobicContact CE1-CD1 3.83Å; F375-L410 HydrophobicContact CZ-CD1 3.72Å; F375-L419 HydrophobicContact CB-CD1 4.29Å; F375-L420 CarbonylContact C-O 3.59Å; F375-L420 VanDerWaalsContact CA-O 3.22Å; F375-L420 WeakPolarHBondContact CA-O 3.28Å; F375-A421 HydrophobicContact CD1-CB 3.83Å; F375-A421 HydrophobicContact CE1-CB 3.63Å
376	I	96.5	Very high	93.6	Very high	60 Å²	60	77.8 Å²	77.8	31%	0.308	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	156.8	176.8	-169.6	167.3	0	0	0	109.8	F380 L419 L420 I422	I376-F380 HydrophobicContact CD1-CB 3.67Å; I376-F380 HydrophobicContact CD1-CD1 4.44Å; I376-F380 HydrophobicContact CD1-CD2 3.67Å; I376-F380 HydrophobicContact CD1-CE2 4.36Å; I376-F380 HydrophobicContact CD1-CG 3.68Å; I376-F380 HydrophobicContact CG1-CB 4.09Å; I376-F380 HydrophobicContact CG1-CD2 3.47Å; I376-F380 VanDerWaalsContact CG1-CD2 3.47Å; I376-F380 HydrophobicContact CG1-CE2 4.11Å; I376-F380 HydrophobicContact CG1-CG 4Å; I376-L419 CarbonylContact O-C 3.57Å; I376-L419 WeakPolarHBondContact O-CA 3.33Å; I376-L420 HydrophobicContact CG2-CB 3.89Å; I376-L420 HydrophobicContact CG2-CD1 4.35Å; I376-L420 PolarHBondContact N-O 2.92Å; I376-L420 PolarHBondContact O-N 2.98Å; I376-I422 HydrophobicContact CB-CG1 4.37Å; I376-I422 HydrophobicContact CG2-CD1 3.69Å; I376-I422 HydrophobicContact CG2-CG1 3.62Å
377	S	96.5	Very high	93.9	Very high	42 Å²	42	80.2 Å²	80.2	29%	0.294	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	143.1	174.7	178.7	0	0	0	0	111.6	K379 F380	S377-K379 PolarHBondContact O-N 3.15Å; S377-K379 WeakPolarHBondContact OG-CG 3.31Å; S377-F380 PolarHBondContact O-N 3.45Å
378	Q	93.2	Very high	94	Very high	61 Å²	61	80.3 Å²	80.3	29%	0.285	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-55	-25.9	177.4	-76	175.8	8.6	0	0	114.4	F380 L381 K418 L419 L420 L439	Q378-F380 PolarHBondContact O-N 3.16Å; Q378-F380 VanDerWaalsContact O-N 3.13Å; Q378-L381 PolarHBondContact O-N 3.41Å; Q378-L381 VanDerWaalsContact O-N 3.16Å; Q378-K418 WeakPolarHBondContact CG-O 3.5Å; Q378-K418 PolarHBondContact N-O 3.33Å; Q378-L419 PolarHBondContact NE2-O 2.86Å; Q378-L420 HydrophobicContact CB-CG 4.28Å; Q378-L420 HydrophobicContact CG-CD1 4.34Å; Q378-L420 HydrophobicContact CG-CD2 3.69Å; Q378-L420 HydrophobicContact CG-CG 3.62Å; Q378-L439 HydrophobicContact CG-CD1 4.42Å
379	K	93	Very high	94	Very high	160 Å²	160	80.3 Å²	80.3	70%	0.696	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-60.2	-22	178.9	71.7	-173.9	-179.5	172.1	0	114.8	S377	S377-K379 PolarHBondContact O-N 3.15Å; S377-K379 WeakPolarHBondContact OG-CG 3.31Å
380	F	93.3	Very high	94	Very high	114 Å²	114	82 Å²	82	50%	0.5	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-83.8	-16.2	-178.5	-71.1	-78.1	0	0	0	113	I376 S377 Q378 K382	I376-F380 HydrophobicContact CD1-CB 3.67Å; I376-F380 HydrophobicContact CD1-CD1 4.44Å; I376-F380 HydrophobicContact CD1-CD2 3.67Å; I376-F380 HydrophobicContact CD1-CE2 4.36Å; I376-F380 HydrophobicContact CD1-CG 3.68Å; I376-F380 HydrophobicContact CG1-CB 4.09Å; I376-F380 HydrophobicContact CG1-CD2 3.47Å; I376-F380 VanDerWaalsContact CG1-CD2 3.47Å; I376-F380 HydrophobicContact CG1-CE2 4.11Å; I376-F380 HydrophobicContact CG1-CG 4Å; S377-F380 PolarHBondContact O-N 3.45Å; Q378-F380 PolarHBondContact O-N 3.16Å; Q378-F380 VanDerWaalsContact O-N 3.13Å; F380-K382 PolarHBondContact O-N 2.98Å
381	L	93.1	Very high	94	Very high	44 Å²	44	82.4 Å²	82.4	23%	0.23	38%	0.38	C	S	.	.			trans	-83.4	113.4	175.2	-179.1	70	0	0	0	109.5	Q378 L420 A437 I464 L466	Q378-L381 PolarHBondContact O-N 3.41Å; Q378-L381 VanDerWaalsContact O-N 3.16Å; L381-L420 HydrophobicContact CB-CD1 3.44Å; L381-L420 VanDerWaalsContact CB-CD1 3.44Å; L381-L420 HydrophobicContact CD2-CD1 3.97Å; L381-L420 HydrophobicContact CD2-CD2 4.36Å; L381-L420 HydrophobicContact CG-CD1 4.27Å; L381-A437 HydrophobicContact CD1-CB 4.36Å; L381-I464 HydrophobicContact CD1-CG2 4.24Å; L381-I464 HydrophobicContact CD2-CD1 3.57Å; L381-L466 HydrophobicContact CD1-CD2 3.77Å
382	K	93.6	Very high	94	Very high	84 Å²	84	81 Å²	81	37%	0.365	37%	0.373	S	S	.	.			trans	-102.2	142.3	-177.2	-53.4	-174.4	-170.8	160.2	0	110.4	F380 Y384 Y385	F380-K382 PolarHBondContact O-N 2.98Å; K382-Y384 HydrophobicContact CB-CD1 4.06Å; K382-Y384 HydrophobicContact CB-CD2 4.39Å; K382-Y384 HydrophobicContact CB-CE1 3.78Å; K382-Y384 HydrophobicContact CB-CE2 4.13Å; K382-Y384 HydrophobicContact CB-CG 4.39Å; K382-Y384 HydrophobicContact CD-CE1 3.67Å; K382-Y384 HydrophobicContact CD-CE2 3.81Å; K382-Y384 WeakPolarHBondContact CD-OH 3.27Å; K382-Y384 WeakPolarHBondContact CE-OH 3.48Å; K382-Y384 HydrophobicContact CG-CE1 4.34Å; K382-Y384 PolarHBondContact NZ-OH 3.34Å; K382-Y384 PolarHBondContact O-N 2.95Å; K382-Y385 HydrophobicContact CB-CD2 3.82Å; K382-Y385 HydrophobicContact CB-CE2 3.8Å; K382-Y385 HydrophobicContact CB-CG 4.21Å; K382-Y385 HydrophobicContact CD-CE1 4.45Å; K382-Y385 HydrophobicContact CD-CE2 3.91Å; K382-Y385 HydrophobicContact CG-CD2 4.23Å; K382-Y385 HydrophobicContact CG-CE2 3.72Å; K382-Y385 PolarHBondContact NZ-OH 3.33Å; K382-Y385 WeakPolarHBondContact O-CB 3.34Å; K382-Y385 PolarHBondContact O-N 3.4Å
383	R	92.5	Very high	94	Very high	241 Å²	241	79.5 Å²	79.5	91%	0.909	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-59.2	-32.1	-177	-173.4	174.3	-179.8	170.8	0.9	113.5	Y385	R383-Y385 VanDerWaalsContact C-N 3.25Å; R383-Y385 PolarHBondContact O-N 2.81Å
384	Y	91.3	Very high	93.9	Very high	157 Å²	157	77.1 Å²	77.1	62%	0.616	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-79.8	-0.1	179.9	56.9	-103.5	0	0	0	114.2	K382 Y386	K382-Y384 HydrophobicContact CB-CD1 4.06Å; K382-Y384 HydrophobicContact CB-CD2 4.39Å; K382-Y384 HydrophobicContact CB-CE1 3.78Å; K382-Y384 HydrophobicContact CB-CE2 4.13Å; K382-Y384 HydrophobicContact CB-CG 4.39Å; K382-Y384 HydrophobicContact CD-CE1 3.67Å; K382-Y384 HydrophobicContact CD-CE2 3.81Å; K382-Y384 WeakPolarHBondContact CD-OH 3.27Å; K382-Y384 WeakPolarHBondContact CE-OH 3.48Å; K382-Y384 HydrophobicContact CG-CE1 4.34Å; K382-Y384 PolarHBondContact NZ-OH 3.34Å; K382-Y384 PolarHBondContact O-N 2.95Å; Y384-Y386 PolarHBondContact O-N 3.27Å
385	Y	93.2	Very high	93.8	Very high	55 Å²	55	76.5 Å²	76.5	22%	0.216	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-81.4	15	169	-64	-25.1	0	0	0	112.9	K382 R383 P467 F472	K382-Y385 HydrophobicContact CB-CD2 3.82Å; K382-Y385 HydrophobicContact CB-CE2 3.8Å; K382-Y385 HydrophobicContact CB-CG 4.21Å; K382-Y385 HydrophobicContact CD-CE1 4.45Å; K382-Y385 HydrophobicContact CD-CE2 3.91Å; K382-Y385 HydrophobicContact CG-CD2 4.23Å; K382-Y385 HydrophobicContact CG-CE2 3.72Å; K382-Y385 PolarHBondContact NZ-OH 3.33Å; K382-Y385 WeakPolarHBondContact O-CB 3.34Å; K382-Y385 PolarHBondContact O-N 3.4Å; R383-Y385 VanDerWaalsContact C-N 3.25Å; R383-Y385 PolarHBondContact O-N 2.81Å; Y385-P467 HydrophobicContact CD1-CG 4.11Å; Y385-P467 HydrophobicContact CG-CG 4.21Å; Y385-P467 WeakPolarHBondContact O-CD 3.33Å; Y385-F472 AromaticContact CD1-CE1 3.85Å; Y385-F472 HydrophobicContact CD1-CE1 3.85Å; Y385-F472 AromaticContact CD1-CZ 3.82Å; Y385-F472 HydrophobicContact CD1-CZ 3.82Å; Y385-F472 AromaticContact CE1-CE1 3.63Å; Y385-F472 HydrophobicContact CE1-CE1 3.63Å; Y385-F472 AromaticContact CE1-CZ 3.61Å; Y385-F472 HydrophobicContact CE1-CZ 3.61Å
386	Y	93.6	Very high	93.5	Very high	154 Å²	154	72.1 Å²	72.1	60%	0.604	32%	0.322	S	S	*	.			trans	-70.8	130.3	177.4	173	-94.2	0	0	0	111.2	Y384 R388	Y384-Y386 PolarHBondContact O-N 3.27Å; Y386-R388 VanDerWaalsContact CE2-C 3.47Å; Y386-R388 VanDerWaalsContact CE2-O 3.24Å; Y386-R388 WeakPolarHBondContact CE2-O 3.38Å
387	I	91.7	Very high	93.1	Very high	75 Å²	75	72.6 Å²	72.6	39%	0.385	32%	0.323	S	S	.	.			trans	-116.3	-52.7	173.8	-55.4	170	0	0	0	110.9	P467	I387-P467 HydrophobicContact CD1-CB 3.78Å; I387-P467 HydrophobicContact CG1-CB 4.09Å
388	R	91.5	Very high	92.5	Very high	96 Å²	96	79.4 Å²	79.4	36%	0.362	35%	0.347	S	S	.	.	S	Bend	trans	-146	164.2	-173.6	64	175.8	-85.2	159.1	-4.1	110.8	Y386 A390 H391 F465	Y386-R388 VanDerWaalsContact CE2-C 3.47Å; Y386-R388 VanDerWaalsContact CE2-O 3.24Å; Y386-R388 WeakPolarHBondContact CE2-O 3.38Å; R388-A390 PolarHBondContact O-N 3.31Å; R388-H391 PolarHBondContact NH2-NE2 2.95Å; R388-F465 HydrophobicContact CG-CB 3.99Å; R388-F465 HydrophobicContact CG-CD1 4.39Å; R388-F465 HydrophobicContact CG-CD2 3.44Å; R388-F465 VanDerWaalsContact CG-CD2 3.44Å; R388-F465 HydrophobicContact CG-CE2 3.99Å; R388-F465 HydrophobicContact CG-CG 3.68Å
389	P	92.8	Very high	92.2	Very high	44 Å²	44	79.4 Å²	79.4	29%	0.286	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-54.5	138.3	179	-26.6	35.6	0	0	0	112.5	F465	P389-F465 WeakPolarHBondContact O-CE2 3.41Å
390	A	94.3	Very high	92	Very high	35 Å²	35	74.7 Å²	74.7	29%	0.289	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-69.8	144.8	177.9	0	0	0	0	0	110.9	R388 H462 I463 I464	R388-A390 PolarHBondContact O-N 3.31Å; A390-H462 HydrophobicContact CB-CB 4.48Å; A390-I463 VanDerWaalsContact CA-O 3.22Å; A390-I463 WeakPolarHBondContact CA-O 3.37Å; A390-I463 VanDerWaalsContact CB-O 3.31Å; A390-I463 WeakPolarHBondContact CB-O 3.48Å; A390-I464 HydrophobicContact CB-CG1 4.36Å
391	H	95.2	Very high	91.9	Very high	9 Å²	9	77 Å²	77	4%	0.042	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	165.5	166.2	-58.2	171.1	0	0	0	109.7	V289 R388 Y425 H462 I463 F465	V289-H391 HydrophobicContact CG1-CB 3.75Å; R388-H391 PolarHBondContact NH2-NE2 2.95Å; H391-Y425 AromaticContact ND1-CE1 3.94Å; H391-Y425 AromaticContact ND1-CZ 3.88Å; H391-Y425 PolarHBondContact ND1-OH 2.82Å; H391-H462 CarbonylContact O-C 3.48Å; H391-H462 WeakPolarHBondContact O-CA 3.35Å; H391-I463 HydrophobicContact CB-CB 4.09Å; H391-I463 HydrophobicContact CB-CD1 4.23Å; H391-I463 HydrophobicContact CB-CG1 4.5Å; H391-I463 PolarHBondContact N-O 2.74Å; H391-I463 VanDerWaalsContact N-O 3.13Å; H391-I463 PolarHBondContact O-N 3.14Å; H391-F465 AromaticContact CD2-CE2 4Å; H391-F465 AromaticContact CE1-CZ 3.64Å; H391-F465 AromaticContact ND1-CZ 3.79Å; H391-F465 AromaticContact NE2-CE2 3.98Å; H391-F465 AromaticContact NE2-CZ 3.89Å
392	F	95.6	Very high	91.8	Very high	7 Å²	7	75.9 Å²	75.9	3%	0.031	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	136.3	177.7	-174.8	-104.4	0	0	0	110.6	V289 Y290 L292 Y394 P458 P459 F461 H462	V289-F392 CarbonylContact C-O 3.57Å; V289-F392 WeakPolarHBondContact CA-O 3.41Å; Y290-F392 HydrophobicContact CD2-CD1 4.39Å; Y290-F392 PolarHBondContact N-O 2.83Å; Y290-F392 PolarHBondContact O-N 3.43Å; L292-F392 HydrophobicContact CD1-CB 3.68Å; L292-F392 HydrophobicContact CD1-CD1 4.13Å; L292-F392 HydrophobicContact CD1-CD2 3.85Å; L292-F392 HydrophobicContact CD1-CE2 4.48Å; L292-F392 HydrophobicContact CD1-CG 3.63Å; L292-F392 HydrophobicContact CD2-CB 4.39Å; L292-F392 HydrophobicContact CD2-CD1 4.41Å; L292-F392 HydrophobicContact CG-CB 3.71Å; L292-F392 HydrophobicContact CG-CD1 4.46Å; L292-F392 HydrophobicContact CG-CG 4.1Å; F392-Y394 HydrophobicContact CE1-CD2 4.42Å; F392-P458 HydrophobicContact CE1-CB 4.11Å; F392-P458 HydrophobicContact CE1-CG 3.99Å; F392-P458 HydrophobicContact CE2-CG 4.28Å; F392-P458 HydrophobicContact CZ-CB 3.92Å; F392-P458 HydrophobicContact CZ-CG 3.73Å; F392-P459 WeakPolarHBondContact CZ-O 3.26Å; F392-F461 WeakPolarHBondContact CA-O 3.32Å; F392-F461 WeakPolarHBondContact CD2-O 3.32Å; F392-H462 AromaticContact CD2-CE1 3.79Å; F392-H462 AromaticContact CD2-ND1 3.78Å
393	I	95.2	Very high	91.7	Very high	0 Å²	0	71.9 Å²	71.9	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	141.8	178.3	59.8	170.1	0	0	0	112.7	I287 S288 V289 L370 F407 L438 F461 I463	I287-I393 HydrophobicContact CD1-CB 4.3Å; I287-I393 HydrophobicContact CD1-CD1 4.19Å; I287-I393 HydrophobicContact CD1-CG2 3.93Å; S288-I393 VanDerWaalsContact O-CA 3.31Å; S288-I393 WeakPolarHBondContact O-CA 3.48Å; V289-I393 HydrophobicContact CG2-CG2 4.09Å; L370-I393 HydrophobicContact CD2-CD1 3.99Å; I393-F407 HydrophobicContact CD1-CE2 4.13Å; I393-F407 HydrophobicContact CG1-CE2 4.19Å; I393-F407 HydrophobicContact CG1-CZ 4.36Å; I393-F407 WeakPolarHBondContact O-CZ 3.07Å; I393-L438 HydrophobicContact CD1-CD1 4.3Å; I393-L438 HydrophobicContact CD1-CD2 4.39Å; I393-F461 HydrophobicContact CD1-CB 3.92Å; I393-F461 HydrophobicContact CD1-CD2 4.4Å; I393-F461 HydrophobicContact CD1-CG 4.48Å; I393-F461 HydrophobicContact CG1-CB 3.64Å; I393-F461 WeakPolarHBondContact CG1-O 3.31Å; I393-F461 PolarHBondContact N-O 3.41Å; I393-F461 PolarHBondContact O-N 3.3Å; I393-I463 HydrophobicContact CG2-CD1 3.43Å; I393-I463 VanDerWaalsContact CG2-CD1 3.43Å; I393-I463 HydrophobicContact CG2-CG1 3.89Å
394	Y	93.6	Very high	91.7	Very high	56 Å²	56	67 Å²	67	22%	0.22	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	147.8	175.8	-159.1	-100.2	0	0	0	110	S288 F392 P459	S288-Y394 PolarHBondContact N-O 2.69Å; S288-Y394 PolarHBondContact O-N 3.31Å; F392-Y394 HydrophobicContact CE1-CD2 4.42Å; Y394-P459 VanDerWaalsContact CD2-O 3.23Å; Y394-P459 WeakPolarHBondContact CD2-O 3.33Å; Y394-P459 HydrophobicContact CE2-CG 4.3Å; Y394-P459 VanDerWaalsContact CE2-O 3.26Å; Y394-P459 WeakPolarHBondContact CE2-O 3.42Å
395	P	94	Very high	91.8	Very high	14 Å²	14	65.8 Å²	65.8	9%	0.091	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	142.6	-179.8	25.1	-34.2	0	0	0	111.8	R404 F407	P395-R404 HydrophobicContact CB-CB 4.46Å; P395-R404 HydrophobicContact CG-CB 4.45Å; P395-F407 HydrophobicContact CB-CB 3.81Å; P395-F407 HydrophobicContact CB-CD1 4.39Å; P395-F407 HydrophobicContact CB-CD2 4.21Å; P395-F407 HydrophobicContact CB-CG 3.9Å; P395-F407 HydrophobicContact CG-CB 4.09Å; P395-F407 HydrophobicContact CG-CD1 3.88Å; P395-F407 HydrophobicContact CG-CD2 4.49Å; P395-F407 HydrophobicContact CG-CE1 4.41Å; P395-F407 HydrophobicContact CG-CG 3.91Å
396	D	89.5	Confident	91.8	Very high	6 Å²	6	70 Å²	70	3%	0.032	33%	0.33	C	S	.	.			trans	-116.4	87.1	178.4	-170.5	42.4	0	0	0	110.7	R269 R272 G286 S288 K398 S399 I400	R269-D396 IonicContact CZ-OD1 3.48Å; R269-D396 IonicContact NH1-OD1 3.12Å; R269-D396 PolarHBondContact NH1-OD1 2.75Å; R269-D396 IonicContact NH1-OD2 2.63Å; R269-D396 PolarHBondContact NH1-OD2 3.16Å; R269-D396 IonicContact NH2-OD1 2.71Å; R269-D396 PolarHBondContact NH2-OD1 3.47Å; R272-D396 IonicContact NE-OD2 4Å; G286-D396 PolarHBondContact O-N 3.16Å; S288-D396 WeakPolarHBondContact OG-CB 3.47Å; D396-K398 PolarHBondContact O-N 3.42Å; D396-K398 VanDerWaalsContact O-N 3.16Å; D396-S399 WeakPolarHBondContact CB-OG 3.36Å; D396-S399 PolarHBondContact O-N 2.9Å; D396-S399 VanDerWaalsContact O-N 3.15Å; D396-S399 PolarHBondContact O-OG 3.04Å; D396-S399 VanDerWaalsContact OD2-CB 3.31Å; D396-S399 WeakPolarHBondContact OD2-CB 3.45Å; D396-S399 PolarHBondContact OD2-OG 3.24Å; D396-I400 PolarHBondContact O-N 2.88Å
397	E	88.2	Confident	91.8	Very high	71 Å²	71	62.8 Å²	62.8	33%	0.332	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-25.3	-178.5	-156.5	66.9	-171.5	0	0	112.8	S399 I400 H401 G402 S403 R404	E397-S399 VanDerWaalsContact C-N 3.32Å; E397-S399 PolarHBondContact O-N 2.83Å; E397-I400 CarbonylContact O-C 3.51Å; E397-H401 IonicContact OE1-CG 3.32Å; E397-H401 IonicContact OE1-ND1 2.67Å; E397-G402 WeakPolarHBondContact OE1-CA 3.37Å; E397-G402 PolarHBondContact OE1-N 3.29Å; E397-S403 PolarHBondContact OE2-N 3.34Å; E397-S403 VanDerWaalsContact OE2-N 3.17Å; E397-R404 VanDerWaalsContact OE2-CB 3.3Å; E397-R404 WeakPolarHBondContact OE2-CB 3.41Å; E397-R404 PolarHBondContact OE2-N 3.13Å
398	K	85.1	Confident	92	Very high	185 Å²	185	61.9 Å²	61.9	80%	0.804	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-28.2	178.9	-65.2	-171.6	179.5	-173.3	0	113.2	D396	D396-K398 PolarHBondContact O-N 3.42Å; D396-K398 VanDerWaalsContact O-N 3.16Å
399	S	85.5	Confident	92.2	Very high	60 Å²	60	59.6 Å²	59.6	42%	0.42	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-44.7	179.7	48.9	0	0	0	0	112.1	G286 D396 E397	G286-S399 WeakPolarHBondContact CA-OG 3.31Å; D396-S399 WeakPolarHBondContact CB-OG 3.36Å; D396-S399 PolarHBondContact O-N 2.9Å; D396-S399 VanDerWaalsContact O-N 3.15Å; D396-S399 PolarHBondContact O-OG 3.04Å; D396-S399 VanDerWaalsContact OD2-CB 3.31Å; D396-S399 WeakPolarHBondContact OD2-CB 3.45Å; D396-S399 PolarHBondContact OD2-OG 3.24Å; E397-S399 VanDerWaalsContact C-N 3.32Å; E397-S399 PolarHBondContact O-N 2.83Å
400	I	89.9	Confident	92.3	Very high	62 Å²	62	58.8 Å²	58.8	32%	0.318	29%	0.294	S	S	.	.	S	Bend	trans	-136.6	116.6	176.9	-58	-179.6	0	0	0	108.6	T284 D396 E397 S403	T284-I400 HydrophobicContact CG2-CD1 3.99Å; D396-I400 PolarHBondContact O-N 2.88Å; E397-I400 CarbonylContact O-C 3.51Å; I400-S403 WeakPolarHBondContact CB-OG 3.41Å; I400-S403 VanDerWaalsContact O-CB 3.28Å; I400-S403 WeakPolarHBondContact O-CB 3.48Å; I400-S403 PolarHBondContact O-N 3.31Å; I400-S403 PolarHBondContact O-OG 2.74Å
401	H	90.7	Very high	92.4	Very high	163 Å²	163	57.6 Å²	57.6	76%	0.755	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	141.7	176.1	-168.3	-62.6	0	0	0	110.9	E397 S403	E397-H401 IonicContact OE1-CG 3.32Å; E397-H401 IonicContact OE1-ND1 2.67Å; H401-S403 VanDerWaalsContact C-N 3.35Å
402	G	90.1	Very high	92.4	Very high	20 Å²	20	61.6 Å²	61.6	21%	0.206	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.4	-3	-174.3	0	0	0	0	0	114.1	E397 R404 L405 W406	E397-G402 WeakPolarHBondContact OE1-CA 3.37Å; E397-G402 PolarHBondContact OE1-N 3.29Å; G402-R404 PolarHBondContact O-N 2.76Å; G402-L405 PolarHBondContact O-N 3.29Å; G402-W406 PolarHBondContact O-N 3.03Å
403	S	92.8	Very high	92.5	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-63.1	-41.2	-177.1	-65.6	0	0	0	0	112.3	G286 E397 I400 H401 L405 F407	G286-S403 PolarHBondContact N-OG 2.78Å; E397-S403 PolarHBondContact OE2-N 3.34Å; E397-S403 VanDerWaalsContact OE2-N 3.17Å; I400-S403 WeakPolarHBondContact CB-OG 3.41Å; I400-S403 VanDerWaalsContact O-CB 3.28Å; I400-S403 WeakPolarHBondContact O-CB 3.48Å; I400-S403 PolarHBondContact O-N 3.31Å; I400-S403 PolarHBondContact O-OG 2.74Å; H401-S403 VanDerWaalsContact C-N 3.35Å; S403-L405 PolarHBondContact O-N 2.81Å; S403-F407 WeakPolarHBondContact O-CB 3.45Å; S403-F407 PolarHBondContact O-N 2.86Å
404	R	92.4	Very high	92.5	Very high	138 Å²	138	69.7 Å²	69.7	52%	0.521	34%	0.335	S	S	.	.	H	α-helix	trans	-58.6	-48	178.6	-176.8	178.2	178.3	176.6	-1.6	111.5	P395 E397 G402 F407 T408	P395-R404 HydrophobicContact CB-CB 4.46Å; P395-R404 HydrophobicContact CG-CB 4.45Å; E397-R404 VanDerWaalsContact OE2-CB 3.3Å; E397-R404 WeakPolarHBondContact OE2-CB 3.41Å; E397-R404 PolarHBondContact OE2-N 3.13Å; G402-R404 PolarHBondContact O-N 2.76Å; R404-F407 PolarHBondContact O-N 3.41Å; R404-T408 VanDerWaalsContact O-CB 3.31Å; R404-T408 WeakPolarHBondContact O-CB 3.48Å; R404-T408 PolarHBondContact O-N 2.96Å; R404-T408 PolarHBondContact O-OG1 3.2Å
405	L	93	Very high	92.6	Very high	131 Å²	131	69.7 Å²	69.7	69%	0.686	34%	0.339	S	S	*	.	H	α-helix	trans	-60.3	-52.1	-178.1	179.9	65.5	0	0	0	111.5	G402 S403 T408 A409	G402-L405 PolarHBondContact O-N 3.29Å; S403-L405 PolarHBondContact O-N 2.81Å; L405-T408 PolarHBondContact O-N 3.15Å; L405-A409 WeakPolarHBondContact O-CB 3.41Å; L405-A409 PolarHBondContact O-N 2.91Å
406	W	92.3	Very high	92.7	Very high	143 Å²	143	76.3 Å²	76.3	54%	0.542	37%	0.368	S	S	.	.	H	α-helix	trans	-65.4	-41.4	179.9	-83.1	104	0	0	0	112.6	L285 G402 A409 L410	L285-W406 HydrophobicContact CD1-CB 3.97Å; L285-W406 HydrophobicContact CD2-CB 3.43Å; L285-W406 VanDerWaalsContact CD2-CB 3.43Å; L285-W406 HydrophobicContact CD2-CG 3.91Å; L285-W406 HydrophobicContact CG-CB 4.35Å; G402-W406 PolarHBondContact O-N 3.03Å; W406-A409 PolarHBondContact O-N 2.85Å; W406-L410 WeakPolarHBondContact O-CB 3.45Å; W406-L410 PolarHBondContact O-N 3.18Å
407	F	95.4	Very high	93	Very high	4 Å²	4	84.2 Å²	84.2	2%	0.018	40%	0.398	C	S	.	.	H	α-helix	trans	-62.7	-45.5	176.9	-174.5	-77.8	0	0	0	111.3	I287 I393 P395 S403 R404 A409 L410 L411 F461	I287-F407 HydrophobicContact CG2-CD2 4.26Å; I287-F407 HydrophobicContact CG2-CE2 4.37Å; I393-F407 HydrophobicContact CD1-CE2 4.13Å; I393-F407 HydrophobicContact CG1-CE2 4.19Å; I393-F407 HydrophobicContact CG1-CZ 4.36Å; I393-F407 WeakPolarHBondContact O-CZ 3.07Å; P395-F407 HydrophobicContact CB-CB 3.81Å; P395-F407 HydrophobicContact CB-CD1 4.39Å; P395-F407 HydrophobicContact CB-CD2 4.21Å; P395-F407 HydrophobicContact CB-CG 3.9Å; P395-F407 HydrophobicContact CG-CB 4.09Å; P395-F407 HydrophobicContact CG-CD1 3.88Å; P395-F407 HydrophobicContact CG-CD2 4.49Å; P395-F407 HydrophobicContact CG-CE1 4.41Å; P395-F407 HydrophobicContact CG-CG 3.91Å; S403-F407 WeakPolarHBondContact O-CB 3.45Å; S403-F407 PolarHBondContact O-N 2.86Å; R404-F407 PolarHBondContact O-N 3.41Å; F407-A409 VanDerWaalsContact C-N 3.35Å; F407-A409 PolarHBondContact O-N 3.47Å; F407-L410 PolarHBondContact O-N 3.09Å; F407-L411 HydrophobicContact CE1-CD2 4.48Å; F407-L411 WeakPolarHBondContact O-CB 3.43Å; F407-L411 PolarHBondContact O-N 3.37Å; F407-F461 HydrophobicContact CE1-CD2 4.02Å; F407-F461 HydrophobicContact CE1-CE2 4.12Å; F407-F461 AromaticContact CE2-CD2 3.88Å; F407-F461 HydrophobicContact CE2-CD2 3.88Å; F407-F461 HydrophobicContact CE2-CE2 4.25Å; F407-F461 AromaticContact CZ-CD2 3.48Å; F407-F461 HydrophobicContact CZ-CD2 3.48Å; F407-F461 VanDerWaalsContact CZ-CD2 3.48Å; F407-F461 AromaticContact CZ-CE2 3.96Å; F407-F461 HydrophobicContact CZ-CE2 3.96Å
408	T	94.9	Very high	93.3	Very high	56 Å²	56	87.7 Å²	87.7	34%	0.344	41%	0.412	S	S	.	.	H	α-helix	trans	-62.5	-41.9	176	-64.2	0	0	0	0	111.3	R404 L405 L410 L411 N412	R404-T408 VanDerWaalsContact O-CB 3.31Å; R404-T408 WeakPolarHBondContact O-CB 3.48Å; R404-T408 PolarHBondContact O-N 2.96Å; R404-T408 PolarHBondContact O-OG1 3.2Å; L405-T408 PolarHBondContact O-N 3.15Å; T408-L410 PolarHBondContact O-N 3.18Å; T408-L411 PolarHBondContact O-N 3.48Å; T408-N412 WeakPolarHBondContact O-CB 3.29Å; T408-N412 VanDerWaalsContact O-CG 3.24Å; T408-N412 PolarHBondContact O-N 3.16Å; T408-N412 PolarHBondContact O-ND2 3.21Å
409	A	95.5	Very high	93.9	Very high	47 Å²	47	80.1 Å²	80.1	39%	0.388	38%	0.38	S	S	.	.	H	α-helix	trans	-61.1	-44.7	175.2	0	0	0	0	0	111.9	L405 W406 F407 R413	L405-A409 WeakPolarHBondContact O-CB 3.41Å; L405-A409 PolarHBondContact O-N 2.91Å; W406-A409 PolarHBondContact O-N 2.85Å; F407-A409 VanDerWaalsContact C-N 3.35Å; F407-A409 PolarHBondContact O-N 3.47Å; A409-R413 WeakPolarHBondContact O-CB 3.34Å; A409-R413 VanDerWaalsContact O-CG 3.28Å; A409-R413 WeakPolarHBondContact O-CG 3.38Å; A409-R413 PolarHBondContact O-N 3.1Å; A409-R413 VanDerWaalsContact O-N 3.08Å
410	L	95	Very high	94.3	Very high	27 Å²	27	77.4 Å²	77.4	14%	0.141	36%	0.361	C	S	.	.	H	α-helix	trans	-62.2	-46.1	176.6	-177.8	64.7	0	0	0	111.6	F275 L277 F375 W406 F407 T408 R413 C414 F461	F275-L410 HydrophobicContact CE1-CD2 3.72Å; F275-L410 HydrophobicContact CZ-CD2 4.17Å; L277-L410 HydrophobicContact CD2-CD2 4.26Å; F375-L410 HydrophobicContact CE1-CD1 3.83Å; F375-L410 HydrophobicContact CZ-CD1 3.72Å; W406-L410 WeakPolarHBondContact O-CB 3.45Å; W406-L410 PolarHBondContact O-N 3.18Å; F407-L410 PolarHBondContact O-N 3.09Å; T408-L410 PolarHBondContact O-N 3.18Å; L410-R413 PolarHBondContact O-N 2.82Å; L410-C414 WeakPolarHBondContact O-CB 3.49Å; L410-C414 PolarHBondContact O-N 2.98Å; L410-C414 PolarHBondContact O-SG 3.13Å; L410-F461 HydrophobicContact CD2-CE2 4.38Å; L410-F461 HydrophobicContact CD2-CZ 4.21Å; L410-F461 HydrophobicContact CG-CE2 4.43Å; L410-F461 HydrophobicContact CG-CZ 3.94Å
411	L	96.2	Very high	94.6	Very high	10 Å²	10	74.4 Å²	74.4	5%	0.052	35%	0.345	C	S	.	.	H	α-helix	trans	-58.1	-53.1	178.1	179.7	58.8	0	0	0	111.2	F407 T408 R413 C414 L415 P440 P459 G460 F461	F407-L411 HydrophobicContact CE1-CD2 4.48Å; F407-L411 WeakPolarHBondContact O-CB 3.43Å; F407-L411 PolarHBondContact O-N 3.37Å; T408-L411 PolarHBondContact O-N 3.48Å; L411-R413 VanDerWaalsContact C-N 3.3Å; L411-R413 PolarHBondContact O-N 2.63Å; L411-C414 PolarHBondContact O-N 3.38Å; L411-L415 HydrophobicContact CD1-CD1 4.06Å; L411-L415 HydrophobicContact CD1-CG 4.2Å; L411-L415 HydrophobicContact CG-CD1 4.01Å; L411-L415 WeakPolarHBondContact O-CG 3.3Å; L411-L415 PolarHBondContact O-N 3.02Å; L411-P440 HydrophobicContact CD1-CB 3.68Å; L411-P459 HydrophobicContact CD2-CB 4.24Å; L411-G460 VanDerWaalsContact CD1-O 3.24Å; L411-G460 WeakPolarHBondContact CD1-O 3.16Å; L411-F461 HydrophobicContact CB-CE2 3.91Å; L411-F461 HydrophobicContact CB-CZ 4.07Å; L411-F461 HydrophobicContact CD1-CD2 4.36Å; L411-F461 HydrophobicContact CD1-CE1 4.37Å; L411-F461 HydrophobicContact CD1-CE2 3.98Å; L411-F461 HydrophobicContact CD1-CZ 3.99Å
412	N	96.3	Very high	94.9	Very high	93 Å²	93	68.2 Å²	68.2	50%	0.497	32%	0.318	S	S	.	.	H	α-helix	trans	-59.5	-41	-179.5	-71.4	-14.9	0	0	0	111.9	T408 H416	T408-N412 WeakPolarHBondContact O-CB 3.29Å; T408-N412 VanDerWaalsContact O-CG 3.24Å; T408-N412 PolarHBondContact O-N 3.16Å; T408-N412 PolarHBondContact O-ND2 3.21Å; N412-H416 VanDerWaalsContact O-CB 3.31Å; N412-H416 WeakPolarHBondContact O-CB 3.49Å; N412-H416 PolarHBondContact O-N 2.96Å
413	R	96.3	Very high	95.2	Very high	174 Å²	174	67.3 Å²	67.3	66%	0.657	31%	0.308	S	S	*	.	H	α-helix	trans	-69.2	-39.9	177.8	-70.3	-63.3	-175.5	-175	0.4	112.7	A409 L410 L411 R417	A409-R413 WeakPolarHBondContact O-CB 3.34Å; A409-R413 VanDerWaalsContact O-CG 3.28Å; A409-R413 WeakPolarHBondContact O-CG 3.38Å; A409-R413 PolarHBondContact O-N 3.1Å; A409-R413 VanDerWaalsContact O-N 3.08Å; L410-R413 PolarHBondContact O-N 2.82Å; L411-R413 VanDerWaalsContact C-N 3.3Å; L411-R413 PolarHBondContact O-N 2.63Å; R413-R417 WeakPolarHBondContact O-CB 3.42Å; R413-R417 PolarHBondContact O-N 3.29Å; R413-R417 VanDerWaalsContact O-N 3.1Å
414	C	96.5	Very high	95.4	Very high	3 Å²	3	69.8 Å²	69.8	2%	0.02	32%	0.32	C	S	.	.	H	α-helix	trans	-67.3	-40.4	177.3	-66.8	0	0	0	0	111.8	L410 L411 K418 L419 P440 F461	L410-C414 WeakPolarHBondContact O-CB 3.49Å; L410-C414 PolarHBondContact O-N 2.98Å; L410-C414 PolarHBondContact O-SG 3.13Å; L411-C414 PolarHBondContact O-N 3.38Å; C414-K418 WeakPolarHBondContact O-CA 3.28Å; C414-K418 PolarHBondContact O-N 2.9Å; C414-L419 PolarHBondContact O-N 3.29Å; C414-P440 HydrophobicContact CB-CB 3.91Å; C414-P440 HydrophobicContact CB-CG 3.84Å; C414-F461 HydrophobicContact CB-CE1 4.09Å; C414-F461 HydrophobicContact CB-CZ 4.4Å
415	L	95.5	Very high	95.5	Very high	56 Å²	56	63.6 Å²	63.6	29%	0.293	30%	0.297	S	S	.	.	H	α-helix	trans	-61.2	-52.9	174.1	-72.3	171.4	0	0	0	111.3	L411 R417 K418 P440 A442	L411-L415 HydrophobicContact CD1-CD1 4.06Å; L411-L415 HydrophobicContact CD1-CG 4.2Å; L411-L415 HydrophobicContact CG-CD1 4.01Å; L411-L415 WeakPolarHBondContact O-CG 3.3Å; L411-L415 PolarHBondContact O-N 3.02Å; L415-R417 VanDerWaalsContact C-N 3.29Å; L415-R417 PolarHBondContact O-N 2.97Å; L415-K418 PolarHBondContact O-N 3Å; L415-P440 HydrophobicContact CD2-CB 3.81Å; L415-P440 HydrophobicContact CD2-CG 4.14Å; L415-P440 HydrophobicContact CG-CB 3.96Å; L415-A442 HydrophobicContact CD1-CB 3.94Å; L415-A442 HydrophobicContact CD2-CB 4.34Å
416	H	95.7	Very high	95.6	Very high	153 Å²	153	57.4 Å²	57.4	71%	0.708	27%	0.265	S	S	*	.	H	α-helix	trans	-60.3	-38.9	-177.1	-175.1	70.7	0	0	0	112.7	N412	N412-H416 VanDerWaalsContact O-CB 3.31Å; N412-H416 WeakPolarHBondContact O-CB 3.49Å; N412-H416 PolarHBondContact O-N 2.96Å
417	R	95.9	Very high	95.5	Very high	172 Å²	172	52.4 Å²	52.4	65%	0.649	25%	0.248	S	C	*	.	H	α-helix	trans	-91.8	0.6	-178.6	-63	-177.9	68.8	-168	1	114.2	R413 L415 L419	R413-R417 WeakPolarHBondContact O-CB 3.42Å; R413-R417 PolarHBondContact O-N 3.29Å; R413-R417 VanDerWaalsContact O-N 3.1Å; L415-R417 VanDerWaalsContact C-N 3.29Å; L415-R417 PolarHBondContact O-N 2.97Å; R417-L419 VanDerWaalsContact C-N 3.28Å; R417-L419 HydrophobicContact CB-CD1 3.67Å; R417-L419 HydrophobicContact CB-CG 3.67Å; R417-L419 HydrophobicContact CG-CD1 4.47Å; R417-L419 PolarHBondContact O-N 3.17Å
418	K	95.1	Very high	95.3	Very high	144 Å²	144	55.6 Å²	55.6	63%	0.626	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	47.9	-173.6	-59.1	-178	178.7	-178.8	0	112.4	Q378 C414 L415	Q378-K418 WeakPolarHBondContact CG-O 3.5Å; Q378-K418 PolarHBondContact N-O 3.33Å; C414-K418 WeakPolarHBondContact O-CA 3.28Å; C414-K418 PolarHBondContact O-N 2.9Å; L415-K418 PolarHBondContact O-N 3Å
419	L	96.3	Very high	94.9	Very high	27 Å²	27	61 Å²	61	14%	0.141	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	154.1	179.9	-62.5	175.8	0	0	0	111.4	F375 I376 Q378 C414 R417 P440	F375-L419 HydrophobicContact CB-CD1 4.29Å; I376-L419 CarbonylContact O-C 3.57Å; I376-L419 WeakPolarHBondContact O-CA 3.33Å; Q378-L419 PolarHBondContact NE2-O 2.86Å; C414-L419 PolarHBondContact O-N 3.29Å; R417-L419 VanDerWaalsContact C-N 3.28Å; R417-L419 HydrophobicContact CB-CD1 3.67Å; R417-L419 HydrophobicContact CB-CG 3.67Å; R417-L419 HydrophobicContact CG-CD1 4.47Å; R417-L419 PolarHBondContact O-N 3.17Å; L419-P440 WeakPolarHBondContact O-CD 3.5Å; L419-P440 WeakPolarHBondContact O-CG 3.19Å
420	L	95.5	Very high	94.3	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	142.1	166.2	-62.9	171.5	0	0	0	107.7	F375 I376 Q378 L381 L438 L439	F375-L420 CarbonylContact C-O 3.59Å; F375-L420 VanDerWaalsContact CA-O 3.22Å; F375-L420 WeakPolarHBondContact CA-O 3.28Å; I376-L420 HydrophobicContact CG2-CB 3.89Å; I376-L420 HydrophobicContact CG2-CD1 4.35Å; I376-L420 PolarHBondContact N-O 2.92Å; I376-L420 PolarHBondContact O-N 2.98Å; Q378-L420 HydrophobicContact CB-CG 4.28Å; Q378-L420 HydrophobicContact CG-CD1 4.34Å; Q378-L420 HydrophobicContact CG-CD2 3.69Å; Q378-L420 HydrophobicContact CG-CG 3.62Å; L381-L420 HydrophobicContact CB-CD1 3.44Å; L381-L420 VanDerWaalsContact CB-CD1 3.44Å; L381-L420 HydrophobicContact CD2-CD1 3.97Å; L381-L420 HydrophobicContact CD2-CD2 4.36Å; L381-L420 HydrophobicContact CG-CD1 4.27Å; L420-L438 WeakPolarHBondContact CA-O 3.4Å; L420-L439 HydrophobicContact CD2-CB 3.88Å; L420-L439 HydrophobicContact CD2-CD1 3.49Å; L420-L439 VanDerWaalsContact CD2-CD1 3.49Å; L420-L439 HydrophobicContact CD2-CG 4.3Å
421	A	96.5	Very high	93.8	Very high	0 Å²	0	59 Å²	59	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	127.1	169.4	0	0	0	0	0	108.8	L372 G374 F375 A437 L438	L372-A421 HydrophobicContact CD1-CB 3.68Å; G374-A421 CarbonylContact O-C 3.59Å; G374-A421 WeakPolarHBondContact O-CA 3.44Å; F375-A421 HydrophobicContact CD1-CB 3.83Å; F375-A421 HydrophobicContact CE1-CB 3.63Å; A421-A437 CarbonylContact O-C 3.54Å; A421-L438 HydrophobicContact CB-CB 3.92Å; A421-L438 HydrophobicContact CB-CD1 4Å; A421-L438 HydrophobicContact CB-CG 4.18Å; A421-L438 PolarHBondContact N-O 2.87Å; A421-L438 PolarHBondContact O-N 3.37Å
422	I	97	Very high	93.4	Very high	33 Å²	33	60.4 Å²	60.4	17%	0.169	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	131.7	174.4	-59	-55.7	0	0	0	108.2	L373 G374 I376 L435 V436 A437 L466	L373-I422 HydrophobicContact CB-CG2 4.42Å; L373-I422 WeakPolarHBondContact CB-O 3.43Å; L373-I422 HydrophobicContact CD1-CG2 4.17Å; L373-I422 PolarHBondContact N-O 2.62Å; G374-I422 PolarHBondContact N-O 3.39Å; G374-I422 PolarHBondContact O-N 2.79Å; I376-I422 HydrophobicContact CB-CG1 4.37Å; I376-I422 HydrophobicContact CG2-CD1 3.69Å; I376-I422 HydrophobicContact CG2-CG1 3.62Å; I422-L435 HydrophobicContact CG2-CD1 3.75Å; I422-L435 HydrophobicContact CG2-CG 4.43Å; I422-V436 WeakPolarHBondContact CA-O 3.31Å; I422-A437 HydrophobicContact CD1-CB 3.83Å; I422-L466 HydrophobicContact CD1-CD1 4.13Å
423	A	96.1	Very high	93.2	Very high	0 Å²	0	57 Å²	57	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	159.7	-176.5	0	0	0	0	0	112.1	L370 H371 V436	L370-A423 HydrophobicContact CD1-CB 3.7Å; L370-A423 HydrophobicContact CG-CB 4.01Å; H371-A423 CarbonylContact O-C 3.59Å; H371-A423 WeakPolarHBondContact O-CA 3.46Å; H371-A423 VanDerWaalsContact O-CB 3.26Å; H371-A423 WeakPolarHBondContact O-CB 3.26Å; A423-V436 HydrophobicContact CB-CG2 4.04Å; A423-V436 PolarHBondContact N-O 2.89Å; A423-V436 WeakPolarHBondContact O-CG2 3.22Å; A423-V436 PolarHBondContact O-N 2.75Å
424	I	95.7	Very high	93	Very high	52 Å²	52	53 Å²	53	27%	0.267	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	126.6	164.8	-61.2	175	0	0	0	107.7	L370 H371 L373 V426 P433	L370-I424 WeakPolarHBondContact CA-O 3.23Å; H371-I424 HydrophobicContact CB-CB 4.33Å; H371-I424 PolarHBondContact N-O 2.68Å; H371-I424 PolarHBondContact O-N 3.17Å; L373-I424 HydrophobicContact CD1-CD1 4.3Å; L373-I424 HydrophobicContact CD1-CG1 3.88Å; L373-I424 HydrophobicContact CD2-CD1 4.03Å; L373-I424 HydrophobicContact CD2-CG1 4.18Å; L373-I424 HydrophobicContact CG-CG1 4.17Å; I424-V426 HydrophobicContact CG2-CG2 4.4Å; I424-P433 HydrophobicContact CG2-CB 3.44Å; I424-P433 VanDerWaalsContact CG2-CB 3.44Å
425	Y	95.5	Very high	93	Very high	8 Å²	8	55.4 Å²	55.4	3%	0.031	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	124.4	-179	176.3	-116.6	0	0	0	110.7	L273 V289 L370 H391 Q427 R434 V436 I463 F465	L273-Y425 HydrophobicContact CD1-CD2 4.26Å; L273-Y425 HydrophobicContact CD1-CE2 3.48Å; L273-Y425 VanDerWaalsContact CD1-CE2 3.48Å; V289-Y425 HydrophobicContact CG2-CE2 4.42Å; L370-Y425 HydrophobicContact CD1-CD2 3.93Å; L370-Y425 HydrophobicContact CD1-CG 4.38Å; H391-Y425 AromaticContact ND1-CE1 3.94Å; H391-Y425 AromaticContact ND1-CZ 3.88Å; H391-Y425 PolarHBondContact ND1-OH 2.82Å; Y425-Q427 HydrophobicContact CE1-CB 4Å; Y425-Q427 HydrophobicContact CE2-CB 4.42Å; Y425-Q427 WeakPolarHBondContact OH-CB 3.43Å; Y425-Q427 WeakPolarHBondContact OH-CG 3.4Å; Y425-Q427 PolarHBondContact OH-OE1 2.91Å; Y425-R434 PolarHBondContact N-O 2.77Å; Y425-R434 PolarHBondContact O-N 2.86Å; Y425-V436 HydrophobicContact CD1-CG1 4.41Å; Y425-V436 HydrophobicContact CG-CG1 4.35Å; Y425-I463 HydrophobicContact CD2-CD1 4.14Å; Y425-I463 HydrophobicContact CE2-CD1 3.93Å; Y425-F465 AromaticContact CD1-CE1 3.87Å; Y425-F465 HydrophobicContact CD1-CE1 3.87Å; Y425-F465 HydrophobicContact CD1-CZ 4.27Å; Y425-F465 HydrophobicContact CE1-CE1 4.06Å; Y425-F465 HydrophobicContact CE1-CZ 4.06Å
426	V	94.2	Very high	93.1	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	111	173.3	-176.5	0	0	0	0	107.8	A366 V368 G369 I424 P433	A366-V426 HydrophobicContact CB-CG2 3.89Å; V368-V426 HydrophobicContact CG2-CG1 4.23Å; G369-V426 PolarHBondContact N-O 3.19Å; G369-V426 PolarHBondContact O-N 3.34Å; I424-V426 HydrophobicContact CG2-CG2 4.4Å; V426-P433 HydrophobicContact CG2-CB 3.88Å
427	Q	91.7	Very high	93.1	Very high	37 Å²	37	45.5 Å²	45.5	17%	0.173	20%	0.2	C	C	.	.			trans	-83.1	-39.4	-172.9	-177.6	-180	-34	0	0	113.4	A271 L273 Y425	A271-Q427 HydrophobicContact CB-CG 4.2Å; L273-Q427 WeakPolarHBondContact CD2-O 3.43Å; Y425-Q427 HydrophobicContact CE1-CB 4Å; Y425-Q427 HydrophobicContact CE2-CB 4.42Å; Y425-Q427 WeakPolarHBondContact OH-CB 3.43Å; Y425-Q427 WeakPolarHBondContact OH-CG 3.4Å; Y425-Q427 PolarHBondContact OH-OE1 2.91Å
428	R	89.2	Confident	93.2	Very high	72 Å²	72	37.3 Å²	37.3	27%	0.272	17%	0.169	S	C	.	.	S	Bend	trans	-142.9	161.6	179.2	60.9	-179.9	-178	-173.9	1.2	110.4	Q19 V368 Q431	Q19-R428 PolarHBondContact O-NH1 2.93Å; V368-R428 VanDerWaalsContact CG2-C 3.46Å; R428-Q431 HydrophobicContact CG-CB 4.36Å; R428-Q431 VanDerWaalsContact CG-CD 3.48Å; R428-Q431 HydrophobicContact CG-CG 3.69Å; R428-Q431 VanDerWaalsContact NE-NE2 3.19Å; R428-Q431 PolarHBondContact O-N 2.96Å
429	K	86.9	Confident	93.3	Very high	168 Å²	168	32.8 Å²	32.8	73%	0.73	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	143.8	171	-66	-172.6	176.4	-172.6	0	109	V368	V368-K429 HydrophobicContact CG2-CB 4.33Å; V368-K429 HydrophobicContact CG2-CG 3.61Å; V368-K429 VanDerWaalsContact CG2-N 3.3Å
430	G	82.8	Confident	93.3	Very high	3 Å²	3	32 Å²	32	3%	0.031	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	6	-177.4	0	0	0	0	0	115	R363 N364	R363-G430 WeakPolarHBondContact CB-O 3.43Å; R363-G430 VanDerWaalsContact CD-O 3.31Å; R363-G430 WeakPolarHBondContact CD-O 3.25Å; R363-G430 PolarHBondContact NH1-O 2.99Å; R363-G430 VanDerWaalsContact NH1-O 3.13Å; N364-G430 WeakPolarHBondContact OD1-CA 3.37Å; N364-G430 PolarHBondContact OD1-N 2.77Å
431	Q	85.1	Confident	93.3	Very high	29 Å²	29	33.6 Å²	33.6	14%	0.136	16%	0.155	C	C	.	.			trans	-104.7	141.8	173	-82.6	-172.9	-19.7	0	0	112	R428	R428-Q431 HydrophobicContact CG-CB 4.36Å; R428-Q431 VanDerWaalsContact CG-CD 3.48Å; R428-Q431 HydrophobicContact CG-CG 3.69Å; R428-Q431 VanDerWaalsContact NE-NE2 3.19Å; R428-Q431 PolarHBondContact O-N 2.96Å
432	F	87.4	Confident	93.2	Very high	40 Å²	40	35.9 Å²	35.9	18%	0.175	17%	0.174	C	C	.	.			trans	-64.9	140.5	173.2	-73.1	-78.4	0	0	0	111.8	L12 V362 R363 I365 R434	L12-F432 HydrophobicContact CB-CE2 4.22Å; L12-F432 HydrophobicContact CD1-CE2 3.93Å; L12-F432 HydrophobicContact CD1-CZ 3.68Å; L12-F432 HydrophobicContact CD2-CE2 4.42Å; L12-F432 HydrophobicContact CD2-CZ 4.47Å; L12-F432 HydrophobicContact CG-CE2 4.43Å; V362-F432 HydrophobicContact CG1-CE1 4.39Å; V362-F432 HydrophobicContact CG1-CZ 4Å; V362-F432 VanDerWaalsContact O-CE1 3.28Å; V362-F432 WeakPolarHBondContact O-CE1 3.41Å; R363-F432 HydrophobicContact CB-CZ 4.46Å; R363-F432 HydrophobicContact CG-CD2 4.31Å; R363-F432 HydrophobicContact CG-CE2 3.67Å; R363-F432 HydrophobicContact CG-CZ 3.78Å; I365-F432 HydrophobicContact CD1-CD1 3.91Å; I365-F432 HydrophobicContact CD1-CE1 4.05Å; F432-R434 PolarHBondContact O-N 3.47Å
433	P	91.8	Very high	92.8	Very high	22 Å²	22	39.3 Å²	39.3	14%	0.143	19%	0.189	C	C	.	.			trans	-62.9	134.7	173.1	25.2	-31.9	0	0	0	110.9	I365 A366 I424 V426 Y468	I365-P433 HydrophobicContact CB-CG 4.14Å; I365-P433 HydrophobicContact CG2-CG 4.38Å; A366-P433 HydrophobicContact CB-CB 4.17Å; A366-P433 HydrophobicContact CB-CG 4.4Å; I424-P433 HydrophobicContact CG2-CB 3.44Å; I424-P433 VanDerWaalsContact CG2-CB 3.44Å; V426-P433 HydrophobicContact CG2-CB 3.88Å; P433-Y468 PolarHBondContact O-OH 3Å
434	R	93.6	Very high	92.3	Very high	90 Å²	90	44.6 Å²	44.6	34%	0.34	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	137.5	173.1	-62.5	-62.1	-174.4	-171.8	0.3	110.6	D13 Y425 F432 F465	D13-R434 IonicContact OD1-NH2 2.81Å; Y425-R434 PolarHBondContact N-O 2.77Å; Y425-R434 PolarHBondContact O-N 2.86Å; F432-R434 PolarHBondContact O-N 3.47Å; R434-F465 HydrophobicContact CB-CD1 4.27Å
435	L	95.3	Very high	91.4	Very high	53 Å²	53	44.2 Å²	44.2	28%	0.277	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	129.2	170.6	-170.5	68.6	0	0	0	109.5	L373 I422 L466 Y468	L373-L435 HydrophobicContact CD1-CD1 3.76Å; I422-L435 HydrophobicContact CG2-CD1 3.75Å; I422-L435 HydrophobicContact CG2-CG 4.43Å; L435-L466 HydrophobicContact CD2-CB 4.48Å; L435-L466 HydrophobicContact CD2-CD1 4.15Å; L435-L466 HydrophobicContact CG-CB 4.47Å; L435-L466 HydrophobicContact CG-CD1 4.14Å; L435-L466 PolarHBondContact O-N 2.93Å; L435-Y468 PolarHBondContact N-OH 3.33Å
436	V	97	Very high	90.1	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	151.5	-176.8	-58.6	0	0	0	0	112	L370 I422 A423 Y425 L438 I463 I464 F465	L370-V436 HydrophobicContact CD1-CG2 3.92Å; I422-V436 WeakPolarHBondContact CA-O 3.31Å; A423-V436 HydrophobicContact CB-CG2 4.04Å; A423-V436 PolarHBondContact N-O 2.89Å; A423-V436 WeakPolarHBondContact O-CG2 3.22Å; A423-V436 PolarHBondContact O-N 2.75Å; Y425-V436 HydrophobicContact CD1-CG1 4.41Å; Y425-V436 HydrophobicContact CG-CG1 4.35Å; V436-L438 HydrophobicContact CG2-CD2 4.3Å; V436-I463 HydrophobicContact CB-CG2 3.7Å; V436-I463 HydrophobicContact CG1-CG2 3.6Å; V436-I463 HydrophobicContact CG2-CG2 4Å; V436-I464 CarbonylContact C-O 3.57Å; V436-I464 VanDerWaalsContact CA-O 3.26Å; V436-I464 WeakPolarHBondContact CA-O 3.5Å; V436-F465 HydrophobicContact CG1-CD1 4.02Å; V436-F465 HydrophobicContact CG1-CE1 4.34Å
437	A	97.3	Very high	88.3	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.008	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	126.1	167.7	0	0	0	0	0	110.1	L381 A421 I422 L439 H462 I464 L466	L381-A437 HydrophobicContact CD1-CB 4.36Å; A421-A437 CarbonylContact O-C 3.54Å; I422-A437 HydrophobicContact CD1-CB 3.83Å; A437-L439 PolarHBondContact O-N 2.87Å; A437-H462 VanDerWaalsContact O-O 3.09Å; A437-I464 PolarHBondContact N-O 3.27Å; A437-I464 PolarHBondContact O-N 3.41Å; A437-L466 HydrophobicContact CB-CD1 4.15Å; A437-L466 HydrophobicContact CB-CD2 4.03Å; A437-L466 HydrophobicContact CB-CG 4.22Å
438	L	97.4	Very high	86.5	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	104.8	172	-50.3	-175.1	0	0	0	108.8	F275 L370 I393 L420 A421 V436 P440 F461 H462 I463	F275-L438 HydrophobicContact CE1-CD1 4.33Å; F275-L438 HydrophobicContact CE2-CD1 4.27Å; F275-L438 HydrophobicContact CZ-CD1 3.72Å; L370-L438 HydrophobicContact CD1-CD2 4.35Å; L370-L438 HydrophobicContact CD2-CD1 3.72Å; L370-L438 HydrophobicContact CD2-CD2 4.04Å; L370-L438 HydrophobicContact CD2-CG 4.5Å; I393-L438 HydrophobicContact CD1-CD1 4.3Å; I393-L438 HydrophobicContact CD1-CD2 4.39Å; L420-L438 WeakPolarHBondContact CA-O 3.4Å; A421-L438 HydrophobicContact CB-CB 3.92Å; A421-L438 HydrophobicContact CB-CD1 4Å; A421-L438 HydrophobicContact CB-CG 4.18Å; A421-L438 PolarHBondContact N-O 2.87Å; A421-L438 PolarHBondContact O-N 3.37Å; V436-L438 HydrophobicContact CG2-CD2 4.3Å; L438-P440 WeakPolarHBondContact O-CD 3.48Å; L438-F461 HydrophobicContact CB-CB 4.19Å; L438-F461 HydrophobicContact CB-CD1 3.84Å; L438-F461 HydrophobicContact CB-CG 4.29Å; L438-H462 CarbonylContact C-O 3.54Å; L438-H462 VanDerWaalsContact CA-O 3.3Å; L438-H462 WeakPolarHBondContact CA-O 3.35Å; L438-I463 HydrophobicContact CD2-CB 4.42Å; L438-I463 HydrophobicContact CD2-CG1 3.73Å
439	L	96.5	Very high	84.4	Confident	50 Å²	50	61.6 Å²	61.6	26%	0.262	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	115.4	175.3	175.1	72	0	0	0	109.5	Q378 L420 A437 F461 H462 I464	Q378-L439 HydrophobicContact CG-CD1 4.42Å; L420-L439 HydrophobicContact CD2-CB 3.88Å; L420-L439 HydrophobicContact CD2-CD1 3.49Å; L420-L439 VanDerWaalsContact CD2-CD1 3.49Å; L420-L439 HydrophobicContact CD2-CG 4.3Å; A437-L439 PolarHBondContact O-N 2.87Å; L439-F461 CarbonylContact O-C 3.57Å; L439-F461 VanDerWaalsContact O-CA 3.27Å; L439-F461 WeakPolarHBondContact O-CA 3.3Å; L439-H462 HydrophobicContact CB-CB 4.27Å; L439-H462 PolarHBondContact N-O 3.18Å; L439-H462 PolarHBondContact O-N 2.92Å; L439-I464 HydrophobicContact CB-CD1 3.79Å; L439-I464 HydrophobicContact CD2-CD1 3.86Å; L439-I464 HydrophobicContact CG-CD1 4.44Å
440	P	97	Very high	82.4	Confident	9 Å²	9	58 Å²	58	6%	0.058	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	136.8	177.6	29.6	-36.9	0	0	0	111.1	L411 C414 L415 L419 L438 F461	L411-P440 HydrophobicContact CD1-CB 3.68Å; C414-P440 HydrophobicContact CB-CB 3.91Å; C414-P440 HydrophobicContact CB-CG 3.84Å; L415-P440 HydrophobicContact CD2-CB 3.81Å; L415-P440 HydrophobicContact CD2-CG 4.14Å; L415-P440 HydrophobicContact CG-CB 3.96Å; L419-P440 WeakPolarHBondContact O-CD 3.5Å; L419-P440 WeakPolarHBondContact O-CG 3.19Å; L438-P440 WeakPolarHBondContact O-CD 3.48Å; P440-F461 HydrophobicContact CB-CD1 3.91Å; P440-F461 HydrophobicContact CB-CE1 3.64Å; P440-F461 HydrophobicContact CB-CZ 4.4Å; P440-F461 HydrophobicContact CG-CE1 4.46Å
441	Q	94.9	Very high	80.7	Confident	37 Å²	37	60.7 Å²	60.7	17%	0.173	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	124.8	177.5	178.8	167	-90.2	0	0	110.3	I457 P458 P459 G460 H462	Q441-I457 HydrophobicContact CG-CG2 3.52Å; Q441-P458 PolarHBondContact NE2-O 3.43Å; Q441-P459 WeakPolarHBondContact O-CA 3.29Å; Q441-G460 PolarHBondContact N-O 2.99Å; Q441-G460 PolarHBondContact O-N 3.38Å; Q441-G460 VanDerWaalsContact O-N 3.08Å; Q441-H462 PolarHBondContact NE2-NE2 3.35Å; Q441-H462 PolarHBondContact OE1-NE2 2.98Å
442	A	93.9	Very high	79	Confident	47 Å²	47	61 Å²	61	39%	0.388	35%	0.349	S	S	.	.			trans	-78.7	152.8	170.5	0	0	0	0	0	110.5	L415	L415-A442 HydrophobicContact CD1-CB 3.94Å; L415-A442 HydrophobicContact CD2-CB 4.34Å
443	E	90.4	Very high	77.4	Confident	106 Å²	106	67.6 Å²	67.6	50%	0.495	37%	0.373	S	S	.	.			trans	-65.8	138	171	-176.3	163.3	-155.9	0	0	110.5	Q455 I457 P459	E443-Q455 PolarHBondContact OE1-NE2 3.02Å; E443-I457 WeakPolarHBondContact CA-O 3.14Å; E443-P459 HydrophobicContact CB-CB 3.96Å; E443-P459 HydrophobicContact CB-CG 3.97Å; E443-P459 HydrophobicContact CG-CG 4.39Å
444	Q	85.1	Confident	75.9	Confident	110 Å²	110	69.1 Å²	69.1	51%	0.514	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	130.5	165.9	-57.8	-177.5	2	0	0	108.8	T456 I457	Q444-T456 PolarHBondContact O-N 2.67Å; Q444-T456 PolarHBondContact O-OG1 3.08Å; Q444-I457 HydrophobicContact CB-CB 3.9Å; Q444-I457 HydrophobicContact CB-CD1 4.43Å; Q444-I457 HydrophobicContact CB-CG1 4.15Å; Q444-I457 HydrophobicContact CG-CB 4.18Å; Q444-I457 HydrophobicContact CG-CD1 4.25Å; Q444-I457 HydrophobicContact CG-CG1 4.44Å; Q444-I457 PolarHBondContact N-O 3.21Å; Q444-I457 PolarHBondContact O-N 3.11Å; Q444-I457 VanDerWaalsContact O-N 3.16Å; Q444-I457 VanDerWaalsContact OE1-CD1 3.26Å
445	T	77.2	Confident	74.9	Confident	44 Å²	44	69.2 Å²	69.2	27%	0.27	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	147.1	170	43.9	0	0	0	0	108	D447	T445-D447 VanDerWaalsContact C-N 3.35Å; T445-D447 WeakPolarHBondContact CB-OD1 3.25Å; T445-D447 PolarHBondContact O-N 3.26Å; T445-D447 PolarHBondContact OG1-OD1 3.42Å
446	N	67.2	Low	74	Confident	86 Å²	86	69.9 Å²	69.9	46%	0.46	39%	0.393	S	S	.	.			trans	-69.6	98.7	167.2	-81.2	-12.4	0	0	0	107.9	N452 T454 T456	N446-N452 VanDerWaalsContact O-O 3.06Å; N446-T454 PolarHBondContact N-O 3.41Å; N446-T454 VanDerWaalsContact N-O 3.1Å; N446-T456 HydrophobicContact CB-CG2 4.37Å; N446-T456 VanDerWaalsContact ND2-CG2 3.34Å; N446-T456 WeakPolarHBondContact ND2-CG2 3.5Å; N446-T456 WeakPolarHBondContact OD1-CG2 3.42Å
447	D	56.6	Low	73.5	Confident	112 Å²	112	72.2 Å²	72.2	60%	0.599	40%	0.404	S	S	*	.			trans	-87.6	-7.5	-179.1	-67.6	-19.6	0	0	0	112.6	T445	T445-D447 VanDerWaalsContact C-N 3.35Å; T445-D447 WeakPolarHBondContact CB-OD1 3.25Å; T445-D447 PolarHBondContact O-N 3.26Å; T445-D447 PolarHBondContact OG1-OD1 3.42Å
448	D	53.7	Low	73	Confident	167 Å²	167	73.6 Å²	73.6	89%	0.893	41%	0.413	S	S	*	.	S	Bend	trans	-77.7	-20.1	-170	-78.2	-22.3	0	0	0	114.7
449	D	46.3	Very low	72.8	Confident	119 Å²	119	74.7 Å²	74.7	64%	0.636	42%	0.42	S	S	*	.	S	Bend	trans	-110.7	100.2	167.9	-73.6	-35.1	0	0	0	107.3	A451 N452	D449-A451 PolarHBondContact O-N 2.99Å; D449-N452 HydrophobicContact CB-CB 4.33Å; D449-N452 PolarHBondContact O-N 3.41Å
450	G	44.1	Very low	72.8	Confident	92 Å²	92	72.3 Å²	72.3	95%	0.948	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	14.4	-169.9	0	0	0	0	0	118.7
451	A	46.1	Very low	72.8	Confident	61 Å²	61	71.9 Å²	71.9	50%	0.504	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.6	-20.4	173	0	0	0	0	0	114.1	D248 D449 R453	D248-A451 WeakPolarHBondContact OD2-CB 3.24Å; D449-A451 PolarHBondContact O-N 2.99Å; A451-R453 PolarHBondContact O-N 2.88Å
452	N	49.4	Very low	72.8	Confident	36 Å²	36	71.7 Å²	71.7	19%	0.193	40%	0.404	C	S	.	.			trans	-100.5	74	-176.8	-94.4	-31.6	0	0	0	112.2	D248 N446 D449 T454	D248-N452 PolarHBondContact OD2-OD1 3.43Å; N446-N452 VanDerWaalsContact O-O 3.06Å; D449-N452 HydrophobicContact CB-CB 4.33Å; D449-N452 PolarHBondContact O-N 3.41Å; N452-T454 PolarHBondContact O-N 2.69Å; N452-T454 PolarHBondContact O-OG1 2.76Å
453	R	55	Low	73	Confident	178 Å²	178	69.5 Å²	69.5	67%	0.672	39%	0.386	S	S	*	.			trans	-73.6	62.9	170.4	-71.4	-174.1	-177.9	169	1.8	112	A451	A451-R453 PolarHBondContact O-N 2.88Å
454	T	60.9	Low	73.3	Confident	54 Å²	54	66.2 Å²	66.2	33%	0.331	37%	0.371	S	S	.	.			trans	-80.7	125.2	168.4	11.3	0	0	0	0	109.2	N446 N452 T456	N446-T454 PolarHBondContact N-O 3.41Å; N446-T454 VanDerWaalsContact N-O 3.1Å; N452-T454 PolarHBondContact O-N 2.69Å; N452-T454 PolarHBondContact O-OG1 2.76Å; T454-T456 PolarHBondContact O-N 3.15Å
455	Q	71.5	Confident	73.8	Confident	91 Å²	91	61.6 Å²	61.6	43%	0.425	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	114.3	172.8	179.8	179.4	83.2	0	0	108.8	E443 P459	E443-Q455 PolarHBondContact OE1-NE2 3.02Å; Q455-P459 VanDerWaalsContact NE2-CD 3.34Å
456	T	77	Confident	74.7	Confident	68 Å²	68	60.9 Å²	60.9	42%	0.417	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-34	174.3	48.9	0	0	0	0	111.9	Q444 N446 T454	Q444-T456 PolarHBondContact O-N 2.67Å; Q444-T456 PolarHBondContact O-OG1 3.08Å; N446-T456 HydrophobicContact CB-CG2 4.37Å; N446-T456 VanDerWaalsContact ND2-CG2 3.34Å; N446-T456 WeakPolarHBondContact ND2-CG2 3.5Å; N446-T456 WeakPolarHBondContact OD1-CG2 3.42Å; T454-T456 PolarHBondContact O-N 3.15Å
457	I	85.2	Confident	76	Confident	48 Å²	48	58 Å²	58	25%	0.246	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	120.6	-179.6	-57	-167.2	0	0	0	109.5	Q441 E443 Q444	Q441-I457 HydrophobicContact CG-CG2 3.52Å; E443-I457 WeakPolarHBondContact CA-O 3.14Å; Q444-I457 HydrophobicContact CB-CB 3.9Å; Q444-I457 HydrophobicContact CB-CD1 4.43Å; Q444-I457 HydrophobicContact CB-CG1 4.15Å; Q444-I457 HydrophobicContact CG-CB 4.18Å; Q444-I457 HydrophobicContact CG-CD1 4.25Å; Q444-I457 HydrophobicContact CG-CG1 4.44Å; Q444-I457 PolarHBondContact N-O 3.21Å; Q444-I457 PolarHBondContact O-N 3.11Å; Q444-I457 VanDerWaalsContact O-N 3.16Å; Q444-I457 VanDerWaalsContact OE1-CD1 3.26Å
458	P	88.3	Confident	77.7	Confident	30 Å²	30	56.7 Å²	56.7	20%	0.195	32%	0.317	C	S	.	.			trans	-77.4	146	-178.3	30.1	-34.9	0	0	0	112.5	L292 F392 Q441	L292-P458 HydrophobicContact CD1-CG 4.19Å; F392-P458 HydrophobicContact CE1-CB 4.11Å; F392-P458 HydrophobicContact CE1-CG 3.99Å; F392-P458 HydrophobicContact CE2-CG 4.28Å; F392-P458 HydrophobicContact CZ-CB 3.92Å; F392-P458 HydrophobicContact CZ-CG 3.73Å; Q441-P458 PolarHBondContact NE2-O 3.43Å
459	P	92.8	Very high	79.5	Confident	23 Å²	23	52.7 Å²	52.7	15%	0.149	31%	0.307	C	S	.	.	S	Bend	trans	-73.2	135.4	173.1	25.7	-28.4	0	0	0	111.3	F392 Y394 L411 Q441 E443 Q455	F392-P459 WeakPolarHBondContact CZ-O 3.26Å; Y394-P459 VanDerWaalsContact CD2-O 3.23Å; Y394-P459 WeakPolarHBondContact CD2-O 3.33Å; Y394-P459 HydrophobicContact CE2-CG 4.3Å; Y394-P459 VanDerWaalsContact CE2-O 3.26Å; Y394-P459 WeakPolarHBondContact CE2-O 3.42Å; L411-P459 HydrophobicContact CD2-CB 4.24Å; Q441-P459 WeakPolarHBondContact O-CA 3.29Å; E443-P459 HydrophobicContact CB-CB 3.96Å; E443-P459 HydrophobicContact CB-CG 3.97Å; E443-P459 HydrophobicContact CG-CG 4.39Å; Q455-P459 VanDerWaalsContact NE2-CD 3.34Å
460	G	95.1	Very high	81.6	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.3	-156.1	179.7	0	0	0	0	0	113.8	L411 Q441	L411-G460 VanDerWaalsContact CD1-O 3.24Å; L411-G460 WeakPolarHBondContact CD1-O 3.16Å; Q441-G460 PolarHBondContact N-O 2.99Å; Q441-G460 PolarHBondContact O-N 3.38Å; Q441-G460 VanDerWaalsContact O-N 3.08Å
461	F	97.1	Very high	83.8	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	139.9	170.5	-65	-99.3	0	0	0	110.9	F392 I393 F407 L410 L411 C414 L438 L439 P440	F392-F461 WeakPolarHBondContact CA-O 3.32Å; F392-F461 WeakPolarHBondContact CD2-O 3.32Å; I393-F461 HydrophobicContact CD1-CB 3.92Å; I393-F461 HydrophobicContact CD1-CD2 4.4Å; I393-F461 HydrophobicContact CD1-CG 4.48Å; I393-F461 HydrophobicContact CG1-CB 3.64Å; I393-F461 WeakPolarHBondContact CG1-O 3.31Å; I393-F461 PolarHBondContact N-O 3.41Å; I393-F461 PolarHBondContact O-N 3.3Å; F407-F461 HydrophobicContact CE1-CD2 4.02Å; F407-F461 HydrophobicContact CE1-CE2 4.12Å; F407-F461 AromaticContact CE2-CD2 3.88Å; F407-F461 HydrophobicContact CE2-CD2 3.88Å; F407-F461 HydrophobicContact CE2-CE2 4.25Å; F407-F461 AromaticContact CZ-CD2 3.48Å; F407-F461 HydrophobicContact CZ-CD2 3.48Å; F407-F461 VanDerWaalsContact CZ-CD2 3.48Å; F407-F461 AromaticContact CZ-CE2 3.96Å; F407-F461 HydrophobicContact CZ-CE2 3.96Å; L410-F461 HydrophobicContact CD2-CE2 4.38Å; L410-F461 HydrophobicContact CD2-CZ 4.21Å; L410-F461 HydrophobicContact CG-CE2 4.43Å; L410-F461 HydrophobicContact CG-CZ 3.94Å; L411-F461 HydrophobicContact CB-CE2 3.91Å; L411-F461 HydrophobicContact CB-CZ 4.07Å; L411-F461 HydrophobicContact CD1-CD2 4.36Å; L411-F461 HydrophobicContact CD1-CE1 4.37Å; L411-F461 HydrophobicContact CD1-CE2 3.98Å; L411-F461 HydrophobicContact CD1-CZ 3.99Å; C414-F461 HydrophobicContact CB-CE1 4.09Å; C414-F461 HydrophobicContact CB-CZ 4.4Å; L438-F461 HydrophobicContact CB-CB 4.19Å; L438-F461 HydrophobicContact CB-CD1 3.84Å; L438-F461 HydrophobicContact CB-CG 4.29Å; L439-F461 CarbonylContact O-C 3.57Å; L439-F461 VanDerWaalsContact O-CA 3.27Å; L439-F461 WeakPolarHBondContact O-CA 3.3Å; P440-F461 HydrophobicContact CB-CD1 3.91Å; P440-F461 HydrophobicContact CB-CE1 3.64Å; P440-F461 HydrophobicContact CB-CZ 4.4Å; P440-F461 HydrophobicContact CG-CE1 4.46Å
462	H	96.4	Very high	85.9	Confident	34 Å²	34	55 Å²	55	16%	0.157	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	128.9	165.1	-67.7	-76.4	0	0	0	110.1	A390 H391 F392 A437 L438 L439 Q441 I464	A390-H462 HydrophobicContact CB-CB 4.48Å; H391-H462 CarbonylContact O-C 3.48Å; H391-H462 WeakPolarHBondContact O-CA 3.35Å; F392-H462 AromaticContact CD2-CE1 3.79Å; F392-H462 AromaticContact CD2-ND1 3.78Å; A437-H462 VanDerWaalsContact O-O 3.09Å; L438-H462 CarbonylContact C-O 3.54Å; L438-H462 VanDerWaalsContact CA-O 3.3Å; L438-H462 WeakPolarHBondContact CA-O 3.35Å; L439-H462 HydrophobicContact CB-CB 4.27Å; L439-H462 PolarHBondContact N-O 3.18Å; L439-H462 PolarHBondContact O-N 2.92Å; Q441-H462 PolarHBondContact NE2-NE2 3.35Å; Q441-H462 PolarHBondContact OE1-NE2 2.98Å; H462-I464 HydrophobicContact CB-CG1 4.34Å; H462-I464 PolarHBondContact O-N 3.24Å
463	I	96.8	Very high	87.9	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	105.4	167.3	-60.6	178.4	0	0	0	107.6	A390 H391 I393 Y425 V436 L438 F465	A390-I463 VanDerWaalsContact CA-O 3.22Å; A390-I463 WeakPolarHBondContact CA-O 3.37Å; A390-I463 VanDerWaalsContact CB-O 3.31Å; A390-I463 WeakPolarHBondContact CB-O 3.48Å; H391-I463 HydrophobicContact CB-CB 4.09Å; H391-I463 HydrophobicContact CB-CD1 4.23Å; H391-I463 HydrophobicContact CB-CG1 4.5Å; H391-I463 PolarHBondContact N-O 2.74Å; H391-I463 VanDerWaalsContact N-O 3.13Å; H391-I463 PolarHBondContact O-N 3.14Å; I393-I463 HydrophobicContact CG2-CD1 3.43Å; I393-I463 VanDerWaalsContact CG2-CD1 3.43Å; I393-I463 HydrophobicContact CG2-CG1 3.89Å; Y425-I463 HydrophobicContact CD2-CD1 4.14Å; Y425-I463 HydrophobicContact CE2-CD1 3.93Å; V436-I463 HydrophobicContact CB-CG2 3.7Å; V436-I463 HydrophobicContact CG1-CG2 3.6Å; V436-I463 HydrophobicContact CG2-CG2 4Å; L438-I463 HydrophobicContact CD2-CB 4.42Å; L438-I463 HydrophobicContact CD2-CG1 3.73Å; I463-F465 HydrophobicContact CG2-CZ 4.48Å
464	I	96.7	Very high	89.4	Confident	37 Å²	37	63 Å²	63	19%	0.19	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	119.2	175.1	-59.4	174.1	0	0	0	108.1	L381 A390 V436 A437 L439 H462 L466	L381-I464 HydrophobicContact CD1-CG2 4.24Å; L381-I464 HydrophobicContact CD2-CD1 3.57Å; A390-I464 HydrophobicContact CB-CG1 4.36Å; V436-I464 CarbonylContact C-O 3.57Å; V436-I464 VanDerWaalsContact CA-O 3.26Å; V436-I464 WeakPolarHBondContact CA-O 3.5Å; A437-I464 PolarHBondContact N-O 3.27Å; A437-I464 PolarHBondContact O-N 3.41Å; L439-I464 HydrophobicContact CB-CD1 3.79Å; L439-I464 HydrophobicContact CD2-CD1 3.86Å; L439-I464 HydrophobicContact CG-CD1 4.44Å; H462-I464 HydrophobicContact CB-CG1 4.34Å; H462-I464 PolarHBondContact O-N 3.24Å; I464-L466 PolarHBondContact O-N 3.37Å
465	F	95.8	Very high	90.7	Very high	13 Å²	13	66.9 Å²	66.9	6%	0.057	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	125.3	176.9	-63.7	-90.5	0	0	0	110	R388 P389 H391 Y425 R434 V436 I463	R388-F465 HydrophobicContact CG-CB 3.99Å; R388-F465 HydrophobicContact CG-CD1 4.39Å; R388-F465 HydrophobicContact CG-CD2 3.44Å; R388-F465 VanDerWaalsContact CG-CD2 3.44Å; R388-F465 HydrophobicContact CG-CE2 3.99Å; R388-F465 HydrophobicContact CG-CG 3.68Å; P389-F465 WeakPolarHBondContact O-CE2 3.41Å; H391-F465 AromaticContact CD2-CE2 4Å; H391-F465 AromaticContact CE1-CZ 3.64Å; H391-F465 AromaticContact ND1-CZ 3.79Å; H391-F465 AromaticContact NE2-CE2 3.98Å; H391-F465 AromaticContact NE2-CZ 3.89Å; Y425-F465 AromaticContact CD1-CE1 3.87Å; Y425-F465 HydrophobicContact CD1-CE1 3.87Å; Y425-F465 HydrophobicContact CD1-CZ 4.27Å; Y425-F465 HydrophobicContact CE1-CE1 4.06Å; Y425-F465 HydrophobicContact CE1-CZ 4.06Å; R434-F465 HydrophobicContact CB-CD1 4.27Å; V436-F465 HydrophobicContact CG1-CD1 4.02Å; V436-F465 HydrophobicContact CG1-CE1 4.34Å; I463-F465 HydrophobicContact CG2-CZ 4.48Å
466	L	95.7	Very high	91.5	Very high	29 Å²	29	71.7 Å²	71.7	15%	0.152	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-96	140.2	179.8	-62.6	-177	0	0	0	110.6	L381 I422 L435 A437 I464	L381-L466 HydrophobicContact CD1-CD2 3.77Å; I422-L466 HydrophobicContact CD1-CD1 4.13Å; L435-L466 HydrophobicContact CD2-CB 4.48Å; L435-L466 HydrophobicContact CD2-CD1 4.15Å; L435-L466 HydrophobicContact CG-CB 4.47Å; L435-L466 HydrophobicContact CG-CD1 4.14Å; L435-L466 PolarHBondContact O-N 2.93Å; A437-L466 HydrophobicContact CB-CD1 4.15Å; A437-L466 HydrophobicContact CB-CD2 4.03Å; A437-L466 HydrophobicContact CB-CG 4.22Å; I464-L466 PolarHBondContact O-N 3.37Å
467	P	94.7	Very high	91.8	Very high	25 Å²	25	75.2 Å²	75.2	16%	0.162	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-71.8	142.4	-179.7	26.6	-32.9	0	0	0	111	Y385 I387 D471 F472	Y385-P467 HydrophobicContact CD1-CG 4.11Å; Y385-P467 HydrophobicContact CG-CG 4.21Å; Y385-P467 WeakPolarHBondContact O-CD 3.33Å; I387-P467 HydrophobicContact CD1-CB 3.78Å; I387-P467 HydrophobicContact CG1-CB 4.09Å; P467-D471 VanDerWaalsContact CA-OD2 3.31Å; P467-D471 WeakPolarHBondContact CA-OD2 3.45Å; P467-D471 HydrophobicContact CB-CB 3.65Å; P467-F472 HydrophobicContact CB-CE2 3.95Å; P467-F472 HydrophobicContact CB-CZ 4.1Å; P467-F472 HydrophobicContact CG-CE1 4.35Å; P467-F472 HydrophobicContact CG-CE2 3.84Å; P467-F472 HydrophobicContact CG-CZ 3.55Å
468	Y	92.2	Very high	91.8	Very high	86 Å²	86	77.1 Å²	77.1	34%	0.337	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-80.1	172.7	162.7	-71.4	-80.3	0	0	0	110.1	P433 L435 D470 D471 F472	P433-Y468 PolarHBondContact O-OH 3Å; L435-Y468 PolarHBondContact N-OH 3.33Å; Y468-D470 PolarHBondContact O-N 3.06Å; Y468-D471 PolarHBondContact N-OD2 3.43Å; Y468-D471 PolarHBondContact O-N 2.73Å; Y468-F472 VanDerWaalsContact O-CD2 3.26Å; Y468-F472 WeakPolarHBondContact O-CD2 3.42Å
469	A	92.4	Very high	91.5	Very high	82 Å²	82	82.9 Å²	82.9	68%	0.678	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-57	-37	179.1	0	0	0	0	0	111.9	D471 F472	A469-D471 VanDerWaalsContact C-N 3.26Å; A469-D471 PolarHBondContact O-N 3.09Å; A469-F472 PolarHBondContact O-N 2.99Å
470	D	89.7	Confident	90.7	Very high	140 Å²	140	88 Å²	88	75%	0.749	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-70.2	-19.2	-177.3	-49.3	-60.7	0	0	0	113.8	Y468 F472	Y468-D470 PolarHBondContact O-N 3.06Å; D470-F472 VanDerWaalsContact C-N 3.3Å
471	D	90.8	Very high	90	Very high	74 Å²	74	97.3 Å²	97.3	40%	0.396	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-77.6	-19	177.6	-64.5	-52.3	0	0	0	112.2	P467 Y468 A469	P467-D471 VanDerWaalsContact CA-OD2 3.31Å; P467-D471 WeakPolarHBondContact CA-OD2 3.45Å; P467-D471 HydrophobicContact CB-CB 3.65Å; Y468-D471 PolarHBondContact N-OD2 3.43Å; Y468-D471 PolarHBondContact O-N 2.73Å; A469-D471 VanDerWaalsContact C-N 3.26Å; A469-D471 PolarHBondContact O-N 3.09Å
472	F	91	Very high	89.4	Confident	106 Å²	106	105.3 Å²	105.3	47%	0.465	54%	0.541	S	S	.	.			trans	-78.3	133.3	177.5	-68.7	-79.8	0	0	0	110.7	Y385 P467 Y468 A469 D470	Y385-F472 AromaticContact CD1-CE1 3.85Å; Y385-F472 HydrophobicContact CD1-CE1 3.85Å; Y385-F472 AromaticContact CD1-CZ 3.82Å; Y385-F472 HydrophobicContact CD1-CZ 3.82Å; Y385-F472 AromaticContact CE1-CE1 3.63Å; Y385-F472 HydrophobicContact CE1-CE1 3.63Å; Y385-F472 AromaticContact CE1-CZ 3.61Å; Y385-F472 HydrophobicContact CE1-CZ 3.61Å; P467-F472 HydrophobicContact CB-CE2 3.95Å; P467-F472 HydrophobicContact CB-CZ 4.1Å; P467-F472 HydrophobicContact CG-CE1 4.35Å; P467-F472 HydrophobicContact CG-CE2 3.84Å; P467-F472 HydrophobicContact CG-CZ 3.55Å; Y468-F472 VanDerWaalsContact O-CD2 3.26Å; Y468-F472 WeakPolarHBondContact O-CD2 3.42Å; A469-F472 PolarHBondContact O-N 2.99Å; D470-F472 VanDerWaalsContact C-N 3.3Å
473	R	89.9	Confident	89	Confident	209 Å²	209	105.9 Å²	105.9	79%	0.789	55%	0.551	S	S	*	*			trans	-108.7	127.1	177.6	-58.9	-63.5	-176.1	161.7	-2.3	109.4
474	D	88.2	Confident	88.7	Confident	173 Å²	173	109.6 Å²	109.6	93%	0.925	57%	0.571	S	S	*	*			trans	-69.6	131.4	170.6	-67.1	-35.2	0	0	0	109.6
475	I	88	Confident	88.5	Confident	136 Å²	136	115.8 Å²	115.8	70%	0.697	60%	0.599	S	S	*	*			trans	-128	126	-178.5	-55.3	171.1	0	0	0	108.1	I477	I475-I477 HydrophobicContact CG2-CG1 4.47Å; I475-I477 PolarHBondContact O-N 2.88Å
476	E	88.3	Confident	88.2	Confident	192 Å²	192	118.3 Å²	118.3	90%	0.897	62%	0.618	S	S	*	*			trans	-76.6	112.4	169.7	-66	-179.7	-177.6	0	0	109.3
477	I	83.4	Confident	88	Confident	143 Å²	143	118.8 Å²	118.8	73%	0.733	62%	0.62	S	S	*	*			trans	-95.7	119.9	-179.5	-58	172.1	0	0	0	108.5	I475	I475-I477 HydrophobicContact CG2-CG1 4.47Å; I475-I477 PolarHBondContact O-N 2.88Å
478	P	84.8	Confident	87.9	Confident	88 Å²	88	120.2 Å²	120.2	57%	0.571	63%	0.628	S	S	*	*			trans	-66.1	138.8	175	27.3	-33.1	0	0	0	110.5	N480	P478-N480 PolarHBondContact O-N 3.31Å
479	T	81.3	Confident	88	Confident	151 Å²	151	120.2 Å²	120.2	93%	0.926	63%	0.634	S	S	*	*			trans	-72.6	95.6	170.4	43.2	0	0	0	0	109.5
480	N	76.3	Confident	88	Confident	129 Å²	129	118.5 Å²	118.5	69%	0.69	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-95.7	152.8	173.2	-65.5	-21.2	0	0	0	110.7	P478	P478-N480 PolarHBondContact O-N 3.31Å
481	E	79.8	Confident	88.1	Confident	197 Å²	197	112.9 Å²	112.9	92%	0.921	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-63	136.4	171.3	-65.3	-177.3	174.6	0	0	110.6
482	I	85.6	Confident	88.3	Confident	168 Å²	168	113.7 Å²	113.7	86%	0.862	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-75.8	133.8	175.9	-58.3	174.3	0	0	0	108.1
483	A	87.6	Confident	88.4	Confident	46 Å²	46	110.3 Å²	110.3	38%	0.38	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-59.5	141.8	177.9	0	0	0	0	0	111.8	Q487 V488	A483-Q487 VanDerWaalsContact CA-OE1 3.32Å; A483-Q487 HydrophobicContact CB-CB 4.24Å; A483-V488 HydrophobicContact CB-CG2 4.08Å
484	N	90.6	Very high	88.5	Confident	77 Å²	77	102 Å²	102	41%	0.412	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-74.5	165.6	176.8	65.9	22.4	0	0	0	111.7	S486 Q487 V488	N484-S486 VanDerWaalsContact C-N 3.27Å; N484-S486 PolarHBondContact O-N 3.24Å; N484-S486 PolarHBondContact OD1-OG 3.34Å; N484-Q487 PolarHBondContact O-N 3.04Å; N484-Q487 WeakPolarHBondContact OD1-CB 3.08Å; N484-Q487 WeakPolarHBondContact OD1-CG 3.31Å; N484-Q487 PolarHBondContact OD1-N 2.67Å; N484-Q487 PolarHBondContact OD1-OE1 2.87Å; N484-V488 WeakPolarHBondContact O-CG2 3.26Å; N484-V488 PolarHBondContact O-N 3.33Å; N484-V488 VanDerWaalsContact O-N 3.08Å
485	E	92.3	Very high	88.8	Confident	167 Å²	167	98.7 Å²	98.7	78%	0.78	53%	0.529	S	S	*	.	H	α-helix	trans	-59.9	-36.3	-176.8	-66.3	-175.1	166	0	0	112.8	V488 D489	E485-V488 PolarHBondContact O-N 3.45Å; E485-D489 PolarHBondContact O-N 2.81Å
486	S	90.1	Very high	89	Confident	66 Å²	66	101 Å²	101	46%	0.462	53%	0.529	S	S	.	.	H	α-helix	trans	-67.9	-42.1	179.4	58.6	0	0	0	0	112.8	N484 V488 D489 I490	N484-S486 VanDerWaalsContact C-N 3.27Å; N484-S486 PolarHBondContact O-N 3.24Å; N484-S486 PolarHBondContact OD1-OG 3.34Å; S486-V488 VanDerWaalsContact C-N 3.32Å; S486-V488 PolarHBondContact O-N 3.4Å; S486-D489 PolarHBondContact O-N 2.88Å; S486-I490 WeakPolarHBondContact O-CG1 3.36Å; S486-I490 PolarHBondContact O-N 3.41Å; S486-I490 VanDerWaalsContact O-N 3.07Å
487	Q	90.8	Very high	89.1	Confident	39 Å²	39	97.1 Å²	97.1	18%	0.182	51%	0.509	C	S	.	.	H	α-helix	trans	-60	-43.8	172.9	-78.6	164.6	-13.9	0	0	111.2	A483 N484 D489 I490 A491 C557 F558	A483-Q487 VanDerWaalsContact CA-OE1 3.32Å; A483-Q487 HydrophobicContact CB-CB 4.24Å; N484-Q487 PolarHBondContact O-N 3.04Å; N484-Q487 WeakPolarHBondContact OD1-CB 3.08Å; N484-Q487 WeakPolarHBondContact OD1-CG 3.31Å; N484-Q487 PolarHBondContact OD1-N 2.67Å; N484-Q487 PolarHBondContact OD1-OE1 2.87Å; Q487-D489 VanDerWaalsContact C-N 3.34Å; Q487-D489 PolarHBondContact O-N 3.43Å; Q487-I490 PolarHBondContact O-N 2.84Å; Q487-A491 WeakPolarHBondContact O-CB 3.35Å; Q487-A491 PolarHBondContact O-N 3.45Å; Q487-C557 WeakPolarHBondContact CG-SG 3.44Å; Q487-F558 HydrophobicContact CB-CE1 4.35Å; Q487-F558 HydrophobicContact CB-CE2 4.02Å; Q487-F558 HydrophobicContact CB-CZ 3.65Å; Q487-F558 HydrophobicContact CG-CE1 4.16Å; Q487-F558 HydrophobicContact CG-CE2 4.04Å; Q487-F558 HydrophobicContact CG-CZ 3.81Å
488	V	93.6	Very high	89.5	Confident	55 Å²	55	92.6 Å²	92.6	33%	0.333	49%	0.487	S	S	.	.	H	α-helix	trans	-63.5	-40.7	178.5	171	0	0	0	0	111	A483 N484 E485 S486 A491 K492	A483-V488 HydrophobicContact CB-CG2 4.08Å; N484-V488 WeakPolarHBondContact O-CG2 3.26Å; N484-V488 PolarHBondContact O-N 3.33Å; N484-V488 VanDerWaalsContact O-N 3.08Å; E485-V488 PolarHBondContact O-N 3.45Å; S486-V488 VanDerWaalsContact C-N 3.32Å; S486-V488 PolarHBondContact O-N 3.4Å; V488-A491 PolarHBondContact O-N 3.27Å; V488-K492 HydrophobicContact CG1-CD 4.33Å; V488-K492 HydrophobicContact CG1-CG 4.48Å; V488-K492 WeakPolarHBondContact O-CG 3.49Å; V488-K492 PolarHBondContact O-N 3.36Å
489	D	93.7	Very high	89.7	Confident	87 Å²	87	95.4 Å²	95.4	47%	0.465	49%	0.494	S	S	.	.	H	α-helix	trans	-70.7	-37.3	-179.2	-74.8	-17.2	0	0	0	113	E485 S486 Q487 A491 K492 A493	E485-D489 PolarHBondContact O-N 2.81Å; S486-D489 PolarHBondContact O-N 2.88Å; Q487-D489 VanDerWaalsContact C-N 3.34Å; Q487-D489 PolarHBondContact O-N 3.43Å; D489-A491 VanDerWaalsContact C-N 3.33Å; D489-K492 PolarHBondContact O-N 2.95Å; D489-K492 IonicContact OD1-NZ 3Å; D489-K492 PolarHBondContact OD1-NZ 2.85Å; D489-A493 PolarHBondContact O-N 2.87Å
490	I	92.3	Very high	90	Very high	45 Å²	45	92.2 Å²	92.2	23%	0.231	47%	0.474	C	S	.	.	H	α-helix	trans	-61.8	-43.6	170.9	-66.2	166.4	0	0	0	110.3	S486 Q487 K492 A493 M494 A553 F554 C557	S486-I490 WeakPolarHBondContact O-CG1 3.36Å; S486-I490 PolarHBondContact O-N 3.41Å; S486-I490 VanDerWaalsContact O-N 3.07Å; Q487-I490 PolarHBondContact O-N 2.84Å; I490-K492 PolarHBondContact O-N 2.84Å; I490-A493 PolarHBondContact O-N 2.86Å; I490-M494 PolarHBondContact O-N 3.29Å; I490-A553 HydrophobicContact CG2-CB 4.11Å; I490-F554 HydrophobicContact CG2-CB 4.01Å; I490-F554 HydrophobicContact CG2-CD2 4.31Å; I490-C557 HydrophobicContact CD1-CB 3.69Å
491	A	92.8	Very high	90.5	Very high	22 Å²	22	91.5 Å²	91.5	18%	0.182	48%	0.476	C	S	.	.	H	α-helix	trans	-63.1	-41.9	176.3	0	0	0	0	0	112.3	Q487 V488 D489 A493 M494 I495 F554	Q487-A491 WeakPolarHBondContact O-CB 3.35Å; Q487-A491 PolarHBondContact O-N 3.45Å; V488-A491 PolarHBondContact O-N 3.27Å; D489-A491 VanDerWaalsContact C-N 3.33Å; A491-A493 VanDerWaalsContact C-N 3.35Å; A491-A493 PolarHBondContact O-N 2.88Å; A491-M494 PolarHBondContact O-N 2.98Å; A491-I495 VanDerWaalsContact O-CG1 3.28Å; A491-I495 WeakPolarHBondContact O-CG1 3.49Å; A491-I495 PolarHBondContact O-N 3.47Å; A491-F554 HydrophobicContact CB-CD2 4.44Å; A491-F554 HydrophobicContact CB-CE2 4.1Å
492	K	95.2	Very high	90.8	Very high	91 Å²	91	89.1 Å²	89.1	40%	0.396	46%	0.463	S	S	.	.	H	α-helix	trans	-61	-42.2	174.5	-74.3	172.3	-168.1	151.2	0	111.8	V488 D489 I490 I495 R496	V488-K492 HydrophobicContact CG1-CD 4.33Å; V488-K492 HydrophobicContact CG1-CG 4.48Å; V488-K492 WeakPolarHBondContact O-CG 3.49Å; V488-K492 PolarHBondContact O-N 3.36Å; D489-K492 PolarHBondContact O-N 2.95Å; D489-K492 IonicContact OD1-NZ 3Å; D489-K492 PolarHBondContact OD1-NZ 2.85Å; I490-K492 PolarHBondContact O-N 2.84Å; K492-I495 PolarHBondContact O-N 2.95Å; K492-R496 WeakPolarHBondContact O-CG 3.26Å; K492-R496 PolarHBondContact O-N 2.78Å
493	A	93.1	Very high	90.8	Very high	35 Å²	35	85 Å²	85	29%	0.289	45%	0.446	S	S	.	.	H	α-helix	trans	-60.7	-46.2	177.8	0	0	0	0	0	111.1	D489 I490 A491 I495 R496 K497 E550	D489-A493 PolarHBondContact O-N 2.87Å; I490-A493 PolarHBondContact O-N 2.86Å; A491-A493 VanDerWaalsContact C-N 3.35Å; A491-A493 PolarHBondContact O-N 2.88Å; A493-I495 PolarHBondContact O-N 2.87Å; A493-R496 PolarHBondContact O-N 3.46Å; A493-K497 PolarHBondContact O-N 2.98Å; A493-E550 HydrophobicContact CB-CG 4.2Å
494	M	91.4	Very high	90.5	Very high	35 Å²	35	88.2 Å²	88.2	17%	0.172	46%	0.463	C	S	.	.	H	α-helix	trans	-59	-47.6	174.5	-177	-177	66.8	0	0	112.1	I490 A491 R496 K497 L498 E550 L551 F554	I490-M494 PolarHBondContact O-N 3.29Å; A491-M494 PolarHBondContact O-N 2.98Å; M494-R496 VanDerWaalsContact C-N 3.34Å; M494-R496 PolarHBondContact O-N 3.22Å; M494-K497 PolarHBondContact O-N 3.06Å; M494-L498 HydrophobicContact CG-CD1 3.88Å; M494-L498 WeakPolarHBondContact O-CG 3.27Å; M494-L498 PolarHBondContact O-N 2.84Å; M494-L498 VanDerWaalsContact O-N 3.14Å; M494-E550 HydrophobicContact CB-CB 4.13Å; M494-L551 HydrophobicContact SD-CD2 3.77Å; M494-F554 HydrophobicContact CE-CD2 4.31Å; M494-F554 HydrophobicContact CE-CE2 4.37Å; M494-F554 HydrophobicContact SD-CG 4.46Å
495	I	93.1	Very high	90	Very high	104 Å²	104	87.8 Å²	87.8	53%	0.533	48%	0.477	S	S	.	.	H	α-helix	trans	-59.9	-44.1	179.6	-69.8	165.1	0	0	0	111.1	A491 K492 A493 K497 L498 M499	A491-I495 VanDerWaalsContact O-CG1 3.28Å; A491-I495 WeakPolarHBondContact O-CG1 3.49Å; A491-I495 PolarHBondContact O-N 3.47Å; K492-I495 PolarHBondContact O-N 2.95Å; A493-I495 PolarHBondContact O-N 2.87Å; I495-K497 VanDerWaalsContact C-N 3.3Å; I495-K497 PolarHBondContact O-N 2.74Å; I495-L498 PolarHBondContact O-N 2.82Å; I495-M499 WeakPolarHBondContact O-CB 3.24Å; I495-M499 PolarHBondContact O-N 3.46Å
496	R	92.8	Very high	89.6	Confident	184 Å²	184	84.6 Å²	84.6	69%	0.694	46%	0.462	S	S	*	.	H	α-helix	trans	-59.7	-39.3	179	-72.8	174.4	-170.6	160.1	2.8	112.5	K492 A493 M494	K492-R496 WeakPolarHBondContact O-CG 3.26Å; K492-R496 PolarHBondContact O-N 2.78Å; A493-R496 PolarHBondContact O-N 3.46Å; M494-R496 VanDerWaalsContact C-N 3.34Å; M494-R496 PolarHBondContact O-N 3.22Å
497	K	91.1	Very high	89.6	Confident	110 Å²	110	85.4 Å²	85.4	48%	0.478	46%	0.46	S	S	.	.	H	α-helix	trans	-72.3	-28.6	178.6	-67.6	-71.9	-172	166.6	0	113.3	A493 M494 I495 A547 E550	A493-K497 PolarHBondContact O-N 2.98Å; M494-K497 PolarHBondContact O-N 3.06Å; I495-K497 VanDerWaalsContact C-N 3.3Å; I495-K497 PolarHBondContact O-N 2.74Å; K497-A547 HydrophobicContact CB-CB 3.93Å; K497-E550 WeakPolarHBondContact CE-OE1 3.3Å
498	L	91.2	Very high	89.5	Confident	49 Å²	49	88.2 Å²	88.2	26%	0.257	47%	0.473	S	S	.	.	H	α-helix	trans	-95.3	-8.2	-178.3	-63.7	178.3	0	0	0	113.7	M494 I495 V500 F543 A547	M494-L498 HydrophobicContact CG-CD1 3.88Å; M494-L498 WeakPolarHBondContact O-CG 3.27Å; M494-L498 PolarHBondContact O-N 2.84Å; M494-L498 VanDerWaalsContact O-N 3.14Å; I495-L498 PolarHBondContact O-N 2.82Å; L498-V500 PolarHBondContact O-N 2.86Å; L498-F543 HydrophobicContact CD2-CB 4.24Å; L498-F543 HydrophobicContact CD2-CD1 3.85Å; L498-F543 HydrophobicContact CD2-CE1 4.45Å; L498-F543 HydrophobicContact CD2-CG 4.12Å; L498-A547 HydrophobicContact CD2-CB 3.97Å; L498-A547 HydrophobicContact CG-CB 4.21Å
499	M	90.2	Very high	89.4	Confident	147 Å²	147	89 Å²	89	72%	0.724	48%	0.476	S	S	*	.			trans	-63.7	129.4	-179.9	-165.6	171.9	73.9	0	0	111.1	I495	I495-M499 WeakPolarHBondContact O-CB 3.24Å; I495-M499 PolarHBondContact O-N 3.46Å
500	V	86.7	Confident	89.3	Confident	83 Å²	83	86.3 Å²	86.3	50%	0.503	46%	0.463	S	S	.	.			trans	-129.6	145.8	174.6	-68.4	0	0	0	0	109	L498 F502	L498-V500 PolarHBondContact O-N 2.86Å; V500-F502 PolarHBondContact O-N 2.88Å
501	P	87.8	Confident	89.3	Confident	115 Å²	115	88.2 Å²	88.2	75%	0.747	48%	0.477	S	S	*	.			trans	-61.6	131.9	171.4	27.1	-33.2	0	0	0	108.9	Q506	P501-Q506 PolarHBondContact O-OE1 3.19Å
502	F	86.2	Confident	89.2	Confident	146 Å²	146	87.7 Å²	87.7	64%	0.64	47%	0.471	S	S	*	.			trans	-108.8	126.8	179.3	169.1	-103.2	0	0	0	109.6	V500 P504 I507	V500-F502 PolarHBondContact O-N 2.88Å; F502-P504 HydrophobicContact CE1-CG 4.47Å; F502-I507 HydrophobicContact CE2-CD1 4.49Å
503	T	83.7	Confident	89	Confident	81 Å²	81	86.6 Å²	86.6	50%	0.497	47%	0.467	S	S	.	.			trans	-120.2	140.9	167.1	53.5	0	0	0	0	109.7	G505 Q506	T503-G505 PolarHBondContact O-N 3.49Å; T503-G505 VanDerWaalsContact O-N 3.13Å; T503-Q506 VanDerWaalsContact O-CB 3.25Å; T503-Q506 WeakPolarHBondContact O-CB 3.31Å; T503-Q506 PolarHBondContact O-N 3.05Å
504	P	82.1	Confident	88.9	Confident	114 Å²	114	92.2 Å²	92.2	74%	0.74	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-57.8	-29.9	-175.4	-27.4	35.2	0	0	0	114.9	F502 Q506	F502-P504 HydrophobicContact CE1-CG 4.47Å; P504-Q506 VanDerWaalsContact C-N 3.34Å
505	G	80.9	Confident	88.9	Confident	69 Å²	69	93.8 Å²	93.8	71%	0.711	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-83.5	-1.6	179	0	0	0	0	0	115.1	T503	T503-G505 PolarHBondContact O-N 3.49Å; T503-G505 VanDerWaalsContact O-N 3.13Å
506	Q	83.9	Confident	88.6	Confident	99 Å²	99	89.9 Å²	89.9	46%	0.463	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-74	-26.3	-174.5	-171.8	177.4	6.9	0	0	113.7	P501 T503 P504	P501-Q506 PolarHBondContact O-OE1 3.19Å; T503-Q506 VanDerWaalsContact O-CB 3.25Å; T503-Q506 WeakPolarHBondContact O-CB 3.31Å; T503-Q506 PolarHBondContact O-N 3.05Å; P504-Q506 VanDerWaalsContact C-N 3.34Å
507	I	89	Confident	88.4	Confident	84 Å²	84	81.6 Å²	81.6	43%	0.431	44%	0.436	S	S	.	.	S	Bend	trans	-117.2	109.5	-174.8	-55.8	174.9	0	0	0	108.3	F502 T536	F502-I507 HydrophobicContact CE2-CD1 4.49Å; I507-T536 HydrophobicContact CG2-CG2 3.76Å
508	E	89	Confident	88.4	Confident	97 Å²	97	79.9 Å²	79.9	45%	0.453	43%	0.432	S	S	.	.			trans	-81.9	160.2	176.5	-58.6	-176.8	175.2	0	0	111.6	P510 Q513	E508-P510 VanDerWaalsContact O-CD 3.24Å; E508-P510 WeakPolarHBondContact O-CD 3.45Å; E508-Q513 HydrophobicContact CB-CG 4.08Å; E508-Q513 VanDerWaalsContact OE2-CG 3.28Å; E508-Q513 WeakPolarHBondContact OE2-CG 3.28Å; E508-Q513 PolarHBondContact OE2-NE2 2.94Å
509	N	91	Very high	88.2	Confident	72 Å²	72	81.3 Å²	81.3	39%	0.385	44%	0.439	S	S	.	.			trans	-80.8	110.2	174.9	-178.8	-23.8	0	0	0	109.9	T511 L512 Q513	N509-T511 PolarHBondContact O-N 3.32Å; N509-T511 WeakPolarHBondContact OD1-CB 3.4Å; N509-T511 PolarHBondContact OD1-N 3.26Å; N509-L512 HydrophobicContact CB-CB 4.12Å; N509-L512 HydrophobicContact CB-CD1 3.93Å; N509-L512 HydrophobicContact CB-CG 4.16Å; N509-L512 PolarHBondContact O-N 3.32Å; N509-L512 VanDerWaalsContact O-N 3.16Å; N509-L512 PolarHBondContact OD1-N 3.05Å; N509-Q513 WeakPolarHBondContact O-CG 3.26Å; N509-Q513 PolarHBondContact O-N 2.93Å
510	P	92.5	Very high	88	Confident	31 Å²	31	76.7 Å²	76.7	20%	0.201	42%	0.416	C	S	.	.	H	α-helix	trans	-64.8	-29.3	-174.4	26.8	-35.9	0	0	0	112.8	E508 R514 D534 T536	E508-P510 VanDerWaalsContact O-CD 3.24Å; E508-P510 WeakPolarHBondContact O-CD 3.45Å; P510-R514 VanDerWaalsContact O-CB 3.29Å; P510-R514 WeakPolarHBondContact O-CB 3.34Å; P510-R514 PolarHBondContact O-N 3.35Å; P510-D534 HydrophobicContact CB-CB 4.25Å; P510-T536 HydrophobicContact CG-CG2 4.07Å
511	T	92.2	Very high	88.1	Confident	84 Å²	84	73.2 Å²	73.2	52%	0.515	40%	0.396	S	S	.	.	H	α-helix	trans	-68.9	-42.5	178.2	-56.3	0	0	0	0	110.7	L298 N509 F515	L298-T511 HydrophobicContact CD1-CG2 4.18Å; N509-T511 PolarHBondContact O-N 3.32Å; N509-T511 WeakPolarHBondContact OD1-CB 3.4Å; N509-T511 PolarHBondContact OD1-N 3.26Å; T511-F515 WeakPolarHBondContact O-CB 3.47Å; T511-F515 PolarHBondContact O-N 3.48Å
512	L	90.2	Very high	88.1	Confident	12 Å²	12	73.9 Å²	73.9	6%	0.063	39%	0.393	C	S	.	.	H	α-helix	trans	-67.5	-45.1	176.2	-72.8	176.3	0	0	0	111.3	T296 L298 N509 R514 F515 Y516	T296-L512 HydrophobicContact CG2-CD1 3.62Å; L298-L512 HydrophobicContact CD1-CD2 3.71Å; L298-L512 HydrophobicContact CD1-CG 4.47Å; L298-L512 HydrophobicContact CG-CD2 3.84Å; N509-L512 HydrophobicContact CB-CB 4.12Å; N509-L512 HydrophobicContact CB-CD1 3.93Å; N509-L512 HydrophobicContact CB-CG 4.16Å; N509-L512 PolarHBondContact O-N 3.32Å; N509-L512 VanDerWaalsContact O-N 3.16Å; N509-L512 PolarHBondContact OD1-N 3.05Å; L512-R514 VanDerWaalsContact C-N 3.34Å; L512-R514 PolarHBondContact O-N 3.4Å; L512-F515 WeakPolarHBondContact O-CB 3.31Å; L512-F515 PolarHBondContact O-N 3.2Å; L512-F515 VanDerWaalsContact O-N 3.16Å; L512-Y516 HydrophobicContact CB-CD2 4.4Å; L512-Y516 HydrophobicContact CB-CE2 4.25Å; L512-Y516 HydrophobicContact CD2-CE2 4.36Å; L512-Y516 WeakPolarHBondContact O-CD2 3.24Å; L512-Y516 PolarHBondContact O-N 3.5Å
513	Q	90.1	Very high	88.1	Confident	68 Å²	68	69.4 Å²	69.4	32%	0.318	38%	0.383	S	S	.	.	H	α-helix	trans	-61.8	-43	179.7	-68.4	-57.6	-6.9	0	0	112.1	E508 N509 F515 Y516 S517 V532	E508-Q513 HydrophobicContact CB-CG 4.08Å; E508-Q513 VanDerWaalsContact OE2-CG 3.28Å; E508-Q513 WeakPolarHBondContact OE2-CG 3.28Å; E508-Q513 PolarHBondContact OE2-NE2 2.94Å; N509-Q513 WeakPolarHBondContact O-CG 3.26Å; N509-Q513 PolarHBondContact O-N 2.93Å; Q513-F515 PolarHBondContact O-N 3.36Å; Q513-Y516 PolarHBondContact O-N 3.34Å; Q513-S517 WeakPolarHBondContact O-CB 3.23Å; Q513-S517 PolarHBondContact O-N 2.96Å; Q513-V532 HydrophobicContact CB-CG1 3.5Å; Q513-V532 HydrophobicContact CB-CG2 4.31Å
514	R	91.6	Very high	88.1	Confident	152 Å²	152	66.3 Å²	66.3	57%	0.574	36%	0.363	S	S	*	.	H	α-helix	trans	-62.4	-42.7	174	-175.4	177.9	177.1	-177.6	0.1	112.2	P510 L512 S517 L518	P510-R514 VanDerWaalsContact O-CB 3.29Å; P510-R514 WeakPolarHBondContact O-CB 3.34Å; P510-R514 PolarHBondContact O-N 3.35Å; L512-R514 VanDerWaalsContact C-N 3.34Å; L512-R514 PolarHBondContact O-N 3.4Å; R514-S517 PolarHBondContact O-N 3.28Å; R514-L518 HydrophobicContact CG-CD1 4.26Å; R514-L518 WeakPolarHBondContact O-CB 3.46Å; R514-L518 WeakPolarHBondContact O-CG 3.38Å; R514-L518 PolarHBondContact O-N 3.09Å
515	F	91	Very high	88.1	Confident	69 Å²	69	67.8 Å²	67.8	30%	0.303	37%	0.365	S	S	.	.	H	α-helix	trans	-60	-47.9	177.4	174	-94.5	0	0	0	111.7	L298 P299 T511 L512 Q513 L518 L519	L298-F515 HydrophobicContact CD2-CB 4.5Å; L298-F515 HydrophobicContact CD2-CD2 4.11Å; L298-F515 HydrophobicContact CD2-CG 4.29Å; P299-F515 HydrophobicContact CG-CE1 4.04Å; T511-F515 WeakPolarHBondContact O-CB 3.47Å; T511-F515 PolarHBondContact O-N 3.48Å; L512-F515 WeakPolarHBondContact O-CB 3.31Å; L512-F515 PolarHBondContact O-N 3.2Å; L512-F515 VanDerWaalsContact O-N 3.16Å; Q513-F515 PolarHBondContact O-N 3.36Å; F515-L518 PolarHBondContact O-N 3Å; F515-L519 HydrophobicContact CE1-CD2 4.41Å; F515-L519 WeakPolarHBondContact O-CB 3.41Å; F515-L519 PolarHBondContact O-N 3.11Å
516	Y	88	Confident	88.3	Confident	21 Å²	21	68.8 Å²	68.8	8%	0.082	35%	0.347	C	S	.	.	H	α-helix	trans	-69.1	-37.9	179.7	-70.3	-53.9	0	0	0	112.8	L83 H84 P299 L512 Q513 L518 L519 E520	L83-Y516 HydrophobicContact CB-CD1 4.17Å; L83-Y516 HydrophobicContact CB-CE1 4.05Å; L83-Y516 HydrophobicContact CD1-CD1 3.78Å; L83-Y516 HydrophobicContact CD1-CE1 4.44Å; L83-Y516 HydrophobicContact CD1-CG 3.9Å; L83-Y516 HydrophobicContact CD2-CD1 3.56Å; L83-Y516 HydrophobicContact CD2-CE1 4.09Å; L83-Y516 HydrophobicContact CD2-CG 4.43Å; L83-Y516 HydrophobicContact CG-CD1 4.02Å; L83-Y516 HydrophobicContact CG-CE1 4.41Å; H84-Y516 AromaticContact CE1-CE2 4Å; H84-Y516 AromaticContact CE1-CZ 3.94Å; P299-Y516 HydrophobicContact CG-CE1 4.43Å; L512-Y516 HydrophobicContact CB-CD2 4.4Å; L512-Y516 HydrophobicContact CB-CE2 4.25Å; L512-Y516 HydrophobicContact CD2-CE2 4.36Å; L512-Y516 WeakPolarHBondContact O-CD2 3.24Å; L512-Y516 PolarHBondContact O-N 3.5Å; Q513-Y516 PolarHBondContact O-N 3.34Å; Y516-L518 VanDerWaalsContact C-N 3.34Å; Y516-L518 PolarHBondContact O-N 3.06Å; Y516-L519 PolarHBondContact O-N 3.16Å; Y516-E520 WeakPolarHBondContact O-CB 3.43Å; Y516-E520 PolarHBondContact O-N 3.31Å
517	S	88.2	Confident	88.2	Confident	10 Å²	10	73.7 Å²	73.7	7%	0.07	37%	0.37	C	S	.	.	H	α-helix	trans	-62.5	-40.4	174.8	-173.5	0	0	0	0	112.3	Q513 R514 A521 S530	Q513-S517 WeakPolarHBondContact O-CB 3.23Å; Q513-S517 PolarHBondContact O-N 2.96Å; R514-S517 PolarHBondContact O-N 3.28Å; S517-A521 WeakPolarHBondContact O-CB 3.28Å; S517-A521 PolarHBondContact O-N 3.44Å; S517-S530 WeakPolarHBondContact OG-CB 3.4Å; S517-S530 PolarHBondContact OG-N 2.86Å; S517-S530 PolarHBondContact OG-O 3.47Å
518	L	90.4	Very high	87.8	Confident	74 Å²	74	75.1 Å²	75.1	39%	0.387	38%	0.382	S	S	.	.	H	α-helix	trans	-63.1	-45.5	172.7	-77.9	168.2	0	0	0	111.9	R514 F515 Y516 A521 L522 Q529	R514-L518 HydrophobicContact CG-CD1 4.26Å; R514-L518 WeakPolarHBondContact O-CB 3.46Å; R514-L518 WeakPolarHBondContact O-CG 3.38Å; R514-L518 PolarHBondContact O-N 3.09Å; F515-L518 PolarHBondContact O-N 3Å; Y516-L518 VanDerWaalsContact C-N 3.34Å; Y516-L518 PolarHBondContact O-N 3.06Å; L518-A521 PolarHBondContact O-N 2.99Å; L518-L522 WeakPolarHBondContact O-CB 3.47Å; L518-L522 VanDerWaalsContact O-CG 3.3Å; L518-L522 WeakPolarHBondContact O-CG 3.4Å; L518-L522 PolarHBondContact O-N 2.96Å; L518-Q529 HydrophobicContact CD2-CB 4.33Å
519	L	87.9	Confident	87.4	Confident	79 Å²	79	74.4 Å²	74.4	41%	0.414	38%	0.379	S	S	.	.	H	α-helix	trans	-64.5	-41.9	-179.8	-172.5	66.6	0	0	0	111.6	L83 F515 Y516 L522 A523	L83-L519 HydrophobicContact CD2-CD2 3.92Å; F515-L519 HydrophobicContact CE1-CD2 4.41Å; F515-L519 WeakPolarHBondContact O-CB 3.41Å; F515-L519 PolarHBondContact O-N 3.11Å; Y516-L519 PolarHBondContact O-N 3.16Å; L519-L522 PolarHBondContact O-N 3.1Å; L519-A523 VanDerWaalsContact O-CB 3.27Å; L519-A523 WeakPolarHBondContact O-CB 3.11Å; L519-A523 PolarHBondContact O-N 3.31Å
520	E	85.8	Confident	87	Confident	50 Å²	50	74 Å²	74	23%	0.234	38%	0.382	C	S	.	.	H	α-helix	trans	-61.1	-48.3	174.9	-175.8	-173.1	178.3	0	0	110.9	Q79 Y516 L522 A523 L524 R526	Q79-E520 PolarHBondContact NE2-OE1 2.9Å; Y516-E520 WeakPolarHBondContact O-CB 3.43Å; Y516-E520 PolarHBondContact O-N 3.31Å; E520-L522 VanDerWaalsContact C-N 3.33Å; E520-L522 PolarHBondContact O-N 3.39Å; E520-A523 PolarHBondContact O-N 3.24Å; E520-L524 HydrophobicContact CG-CD1 3.63Å; E520-L524 HydrophobicContact CG-CG 4.26Å; E520-L524 WeakPolarHBondContact O-CB 3.22Å; E520-L524 WeakPolarHBondContact O-CG 3.45Å; E520-L524 PolarHBondContact O-N 3.09Å; E520-R526 IonicContact OE1-NH1 2.94Å; E520-R526 PolarHBondContact OE1-NH1 3.38Å
521	A	88.3	Confident	86.6	Confident	10 Å²	10	81.8 Å²	81.8	8%	0.083	42%	0.416	C	S	.	.	H	α-helix	trans	-59.4	-43.9	178.3	0	0	0	0	0	111.8	S517 L518 N525 R526 Q529	S517-A521 WeakPolarHBondContact O-CB 3.28Å; S517-A521 PolarHBondContact O-N 3.44Å; L518-A521 PolarHBondContact O-N 2.99Å; A521-N525 PolarHBondContact O-N 3.18Å; A521-N525 VanDerWaalsContact O-N 3.11Å; A521-R526 HydrophobicContact CB-CB 4.35Å; A521-R526 PolarHBondContact O-N 2.99Å; A521-Q529 HydrophobicContact CB-CB 4.29Å
522	L	88.7	Confident	86.3	Confident	130 Å²	130	80.7 Å²	80.7	68%	0.681	41%	0.408	S	S	*	.	H	α-helix	trans	-64.1	-44.3	175.5	-71.2	172.9	0	0	0	112.2	L518 L519 E520 L524 N525	L518-L522 WeakPolarHBondContact O-CB 3.47Å; L518-L522 VanDerWaalsContact O-CG 3.3Å; L518-L522 WeakPolarHBondContact O-CG 3.4Å; L518-L522 PolarHBondContact O-N 2.96Å; L519-L522 PolarHBondContact O-N 3.1Å; E520-L522 VanDerWaalsContact C-N 3.33Å; E520-L522 PolarHBondContact O-N 3.39Å; L522-L524 VanDerWaalsContact C-N 3.35Å; L522-L524 PolarHBondContact O-N 3.14Å; L522-N525 PolarHBondContact O-N 3.35Å
523	A	85.1	Confident	86.2	Confident	52 Å²	52	84.9 Å²	84.9	43%	0.43	44%	0.435	S	S	.	.	H	α-helix	trans	-68.3	-33	-178.5	0	0	0	0	0	113	S118 L519 E520	S118-A523 WeakPolarHBondContact CB-O 3.49Å; S118-A523 PolarHBondContact OG-O 3.47Å; L519-A523 VanDerWaalsContact O-CB 3.27Å; L519-A523 WeakPolarHBondContact O-CB 3.11Å; L519-A523 PolarHBondContact O-N 3.31Å; E520-A523 PolarHBondContact O-N 3.24Å
524	L	83.6	Confident	86.3	Confident	15 Å²	15	84.2 Å²	84.2	8%	0.079	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	3.1	177.7	-61.6	177.7	0	0	0	113.2	I121 L122 E520 L522 R526	I121-L524 HydrophobicContact CG2-CD2 4.44Å; L122-L524 HydrophobicContact CD1-CD2 4.25Å; L122-L524 HydrophobicContact CD2-CD2 4.04Å; L122-L524 HydrophobicContact CG-CD2 3.85Å; E520-L524 HydrophobicContact CG-CD1 3.63Å; E520-L524 HydrophobicContact CG-CG 4.26Å; E520-L524 WeakPolarHBondContact O-CB 3.22Å; E520-L524 WeakPolarHBondContact O-CG 3.45Å; E520-L524 PolarHBondContact O-N 3.09Å; L522-L524 VanDerWaalsContact C-N 3.35Å; L522-L524 PolarHBondContact O-N 3.14Å; L524-R526 HydrophobicContact CB-CG 4.03Å; L524-R526 VanDerWaalsContact CD1-CZ 3.41Å; L524-R526 PolarHBondContact O-N 3.33Å
525	N	83.5	Confident	86.1	Confident	146 Å²	146	81.4 Å²	81.4	78%	0.781	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	39.6	-174.5	-60.7	-55.5	0	0	0	113.3	A521 L522	A521-N525 PolarHBondContact O-N 3.18Å; A521-N525 VanDerWaalsContact O-N 3.11Å; L522-N525 PolarHBondContact O-N 3.35Å
526	R	85.1	Confident	86.1	Confident	90 Å²	90	81.7 Å²	81.7	34%	0.34	43%	0.434	S	S	.	.			trans	-85.6	137.1	173.8	-65.9	178.7	176.7	161.7	-0	109.4	E125 E520 A521 L524 T528	E125-R526 IonicContact OE1-NH2 3.86Å; E125-R526 PolarHBondContact OE1-NH2 3.34Å; E125-R526 IonicContact OE2-NH2 3.46Å; E125-R526 PolarHBondContact OE2-NH2 3.29Å; E520-R526 IonicContact OE1-NH1 2.94Å; E520-R526 PolarHBondContact OE1-NH1 3.38Å; A521-R526 HydrophobicContact CB-CB 4.35Å; A521-R526 PolarHBondContact O-N 2.99Å; L524-R526 HydrophobicContact CB-CG 4.03Å; L524-R526 VanDerWaalsContact CD1-CZ 3.41Å; L524-R526 PolarHBondContact O-N 3.33Å; R526-T528 VanDerWaalsContact C-N 3.3Å; R526-T528 PolarHBondContact O-N 2.93Å
527	E	80.2	Confident	86.3	Confident	202 Å²	202	86.1 Å²	86.1	94%	0.944	46%	0.458	S	S	*	.	S	Bend	trans	-70.4	-28.7	179.2	-65.3	-176.4	173.4	0	0	112.7
528	T	80.9	Confident	86.3	Confident	113 Å²	113	89.2 Å²	89.2	69%	0.693	48%	0.478	S	S	*	.	S	Bend	trans	-119.4	139.7	-178.6	51.7	0	0	0	0	111	R526	R526-T528 VanDerWaalsContact C-N 3.3Å; R526-T528 PolarHBondContact O-N 2.93Å
529	Q	82	Confident	86.2	Confident	82 Å²	82	93.1 Å²	93.1	38%	0.383	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-78.7	158.6	167.8	64.4	175.2	1.2	0	0	110.4	L518 A521	L518-Q529 HydrophobicContact CD2-CB 4.33Å; A521-Q529 HydrophobicContact CB-CB 4.29Å
530	S	81.2	Confident	86.2	Confident	64 Å²	64	94.8 Å²	94.8	45%	0.448	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-69.3	144	170.1	-54.3	0	0	0	0	110.5	S517 V532	S517-S530 WeakPolarHBondContact OG-CB 3.4Å; S517-S530 PolarHBondContact OG-N 2.86Å; S517-S530 PolarHBondContact OG-O 3.47Å; S530-V532 PolarHBondContact O-N 3.49Å
531	E	84.5	Confident	86.4	Confident	195 Å²	195	94.6 Å²	94.6	91%	0.911	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-71.2	116.3	173.4	-69.9	-169.9	171	0	0	110.1
532	V	86.3	Confident	86.3	Confident	60 Å²	60	95.8 Å²	95.8	36%	0.364	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-91.6	116.7	175.8	177.2	0	0	0	0	109.2	Q513 S530	Q513-V532 HydrophobicContact CB-CG1 3.5Å; Q513-V532 HydrophobicContact CB-CG2 4.31Å; S530-V532 PolarHBondContact O-N 3.49Å
533	V	88.3	Confident	86.2	Confident	101 Å²	101	93.5 Å²	93.5	61%	0.612	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-80.5	123.3	176.3	-178.4	0	0	0	0	109.7	H535	V533-H535 PolarHBondContact O-N 2.9Å; V533-H535 VanDerWaalsContact O-N 3.16Å
534	D	91.2	Very high	86.4	Confident	54 Å²	54	97.8 Å²	97.8	29%	0.289	52%	0.516	S	S	.	.			trans	-78.2	101.8	176.6	-171	-10.2	0	0	0	111.4	P510 T536 L537	P510-D534 HydrophobicContact CB-CB 4.25Å; D534-T536 VanDerWaalsContact CG-OG1 3.29Å; D534-T536 PolarHBondContact O-N 3.32Å; D534-T536 WeakPolarHBondContact OD1-CA 3.49Å; D534-T536 VanDerWaalsContact OD1-CB 3.25Å; D534-T536 WeakPolarHBondContact OD1-CB 3.49Å; D534-T536 WeakPolarHBondContact OD1-CG2 3.33Å; D534-T536 PolarHBondContact OD1-N 2.79Å; D534-T536 PolarHBondContact OD1-OG1 3.42Å; D534-T536 PolarHBondContact OD2-OG1 3.38Å; D534-L537 HydrophobicContact CB-CD1 4.07Å; D534-L537 HydrophobicContact CB-CG 4.19Å; D534-L537 PolarHBondContact O-N 3.08Å
535	H	88.2	Confident	86.7	Confident	93 Å²	93	108 Å²	108	43%	0.431	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.4	-8.1	177	-64	-39.4	0	0	0	114.2	V533 L537	V533-H535 PolarHBondContact O-N 2.9Å; V533-H535 VanDerWaalsContact O-N 3.16Å; H535-L537 VanDerWaalsContact C-N 3.32Å
536	T	91	Very high	87	Confident	75 Å²	75	107.7 Å²	107.7	46%	0.46	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-21	174.8	74.9	0	0	0	0	112.3	I507 P510 D534	I507-T536 HydrophobicContact CG2-CG2 3.76Å; P510-T536 HydrophobicContact CG-CG2 4.07Å; D534-T536 VanDerWaalsContact CG-OG1 3.29Å; D534-T536 PolarHBondContact O-N 3.32Å; D534-T536 WeakPolarHBondContact OD1-CA 3.49Å; D534-T536 VanDerWaalsContact OD1-CB 3.25Å; D534-T536 WeakPolarHBondContact OD1-CB 3.49Å; D534-T536 WeakPolarHBondContact OD1-CG2 3.33Å; D534-T536 PolarHBondContact OD1-N 2.79Å; D534-T536 PolarHBondContact OD1-OG1 3.42Å; D534-T536 PolarHBondContact OD2-OG1 3.38Å
537	L	91.4	Very high	87.1	Confident	114 Å²	114	103.4 Å²	103.4	60%	0.597	53%	0.525	S	S	*	.	S	Bend	trans	-76	133.6	179	-67.2	177.4	0	0	0	111.7	D534 H535 K539	D534-L537 HydrophobicContact CB-CD1 4.07Å; D534-L537 HydrophobicContact CB-CG 4.19Å; D534-L537 PolarHBondContact O-N 3.08Å; H535-L537 VanDerWaalsContact C-N 3.32Å; L537-K539 PolarHBondContact O-N 3.32Å
538	P	88.5	Confident	87.6	Confident	74 Å²	74	98.2 Å²	98.2	48%	0.481	50%	0.503	S	S	.	.			trans	-66.9	134.5	177.8	26	-32.7	0	0	0	111.3	L540 F543	P538-L540 VanDerWaalsContact C-N 3.26Å; P538-L540 HydrophobicContact CB-CD2 4.35Å; P538-L540 HydrophobicContact CG-CD2 4.15Å; P538-L540 PolarHBondContact O-N 3.38Å; P538-F543 HydrophobicContact CB-CE2 3.55Å; P538-F543 HydrophobicContact CB-CZ 3.82Å
539	K	87.9	Confident	88.1	Confident	156 Å²	156	100 Å²	100	68%	0.678	50%	0.504	S	S	*	.			trans	-74.7	75.1	175.5	-65	-178.8	-179	178.5	0	110.8	L537 G541 A542 F543	L537-K539 PolarHBondContact O-N 3.32Å; K539-G541 PolarHBondContact O-N 2.95Å; K539-G541 VanDerWaalsContact O-N 3.12Å; K539-A542 HydrophobicContact CB-CB 3.99Å; K539-A542 WeakPolarHBondContact O-CA 3.35Å; K539-A542 WeakPolarHBondContact O-CB 3.31Å; K539-A542 PolarHBondContact O-N 3.49Å; K539-F543 PolarHBondContact O-N 2.75Å; K539-F543 VanDerWaalsContact O-N 3.13Å
540	L	88	Confident	88.5	Confident	115 Å²	115	97.8 Å²	97.8	60%	0.602	49%	0.493	S	S	*	.	H	α-helix	trans	-52.4	-37.9	-174.8	-62	179.7	0	0	0	113.7	P538 A542 F543 K544	P538-L540 VanDerWaalsContact C-N 3.26Å; P538-L540 HydrophobicContact CB-CD2 4.35Å; P538-L540 HydrophobicContact CG-CD2 4.15Å; P538-L540 PolarHBondContact O-N 3.38Å; L540-A542 VanDerWaalsContact C-N 3.33Å; L540-A542 PolarHBondContact O-N 3.41Å; L540-F543 HydrophobicContact CD2-CD2 4.33Å; L540-F543 PolarHBondContact O-N 3.29Å; L540-K544 PolarHBondContact O-N 2.94Å; L540-K544 VanDerWaalsContact O-N 3.08Å
541	G	89.4	Confident	88.9	Confident	46 Å²	46	97 Å²	97	47%	0.474	48%	0.484	S	S	.	.	H	α-helix	trans	-63.4	-37.2	175.9	0	0	0	0	0	113.1	K539 R545	K539-G541 PolarHBondContact O-N 2.95Å; K539-G541 VanDerWaalsContact O-N 3.12Å; G541-R545 WeakPolarHBondContact O-CG 3.39Å; G541-R545 PolarHBondContact O-N 3.18Å
542	A	87	Confident	89.2	Confident	34 Å²	34	90.6 Å²	90.6	28%	0.281	46%	0.459	S	S	.	.	H	α-helix	trans	-71.4	-36.6	175.9	0	0	0	0	0	111.6	K539 L540 R545 R546	K539-A542 HydrophobicContact CB-CB 3.99Å; K539-A542 WeakPolarHBondContact O-CA 3.35Å; K539-A542 WeakPolarHBondContact O-CB 3.31Å; K539-A542 PolarHBondContact O-N 3.49Å; L540-A542 VanDerWaalsContact C-N 3.33Å; L540-A542 PolarHBondContact O-N 3.41Å; A542-R545 PolarHBondContact O-N 3.2Å; A542-R546 WeakPolarHBondContact O-CB 3.39Å; A542-R546 WeakPolarHBondContact O-CG 3.35Å; A542-R546 PolarHBondContact O-N 2.9Å
543	F	87.7	Confident	89.3	Confident	82 Å²	82	89.4 Å²	89.4	36%	0.36	46%	0.455	S	S	.	.	H	α-helix	trans	-61.5	-49.5	175.9	-66.1	-6.4	0	0	0	111.4	L498 P538 K539 L540 R545 R546 A547	L498-F543 HydrophobicContact CD2-CB 4.24Å; L498-F543 HydrophobicContact CD2-CD1 3.85Å; L498-F543 HydrophobicContact CD2-CE1 4.45Å; L498-F543 HydrophobicContact CD2-CG 4.12Å; P538-F543 HydrophobicContact CB-CE2 3.55Å; P538-F543 HydrophobicContact CB-CZ 3.82Å; K539-F543 PolarHBondContact O-N 2.75Å; K539-F543 VanDerWaalsContact O-N 3.13Å; L540-F543 HydrophobicContact CD2-CD2 4.33Å; L540-F543 PolarHBondContact O-N 3.29Å; F543-R545 VanDerWaalsContact C-N 3.27Å; F543-R545 PolarHBondContact O-N 3.2Å; F543-R546 PolarHBondContact O-N 2.93Å; F543-A547 PolarHBondContact O-N 3Å
544	K	88.8	Confident	89.4	Confident	143 Å²	143	86.9 Å²	86.9	62%	0.622	44%	0.436	S	S	*	.	H	α-helix	trans	-58.6	-38.7	176.1	-72	-176.3	178.5	-176.9	0	112	L540 N548	L540-K544 PolarHBondContact O-N 2.94Å; L540-K544 VanDerWaalsContact O-N 3.08Å; K544-N548 VanDerWaalsContact O-CB 3.29Å; K544-N548 WeakPolarHBondContact O-CB 2.99Å
545	R	89.5	Confident	89.3	Confident	228 Å²	228	89.2 Å²	89.2	86%	0.86	44%	0.443	S	S	*	.	H	α-helix	trans	-69.8	-33.6	178.1	-72.6	175.7	-173.4	176.8	2.6	113.5	G541 A542 F543	G541-R545 WeakPolarHBondContact O-CG 3.39Å; G541-R545 PolarHBondContact O-N 3.18Å; A542-R545 PolarHBondContact O-N 3.2Å; F543-R545 VanDerWaalsContact C-N 3.27Å; F543-R545 PolarHBondContact O-N 3.2Å
546	R	89.5	Confident	89.3	Confident	140 Å²	140	90.8 Å²	90.8	53%	0.528	45%	0.451	S	S	.	.	H	α-helix	trans	-88.8	-34.1	-173.6	-72.4	-178.2	-178	-173.2	0.7	114.6	A542 F543	A542-R546 WeakPolarHBondContact O-CB 3.39Å; A542-R546 WeakPolarHBondContact O-CG 3.35Å; A542-R546 PolarHBondContact O-N 2.9Å; F543-R546 PolarHBondContact O-N 2.93Å
547	A	88.5	Confident	89.1	Confident	0 Å²	0	89 Å²	89	0%	0	44%	0.441	C	S	.	.	H	α-helix	trans	-137.2	30.1	-165.5	0	0	0	0	0	113.2	K497 L498 F543 E549 E550 L551	K497-A547 HydrophobicContact CB-CB 3.93Å; L498-A547 HydrophobicContact CD2-CB 3.97Å; L498-A547 HydrophobicContact CG-CB 4.21Å; F543-A547 PolarHBondContact O-N 3Å; A547-E549 VanDerWaalsContact C-N 3.35Å; A547-E549 PolarHBondContact O-N 3.25Å; A547-E550 VanDerWaalsContact CA-OE2 3.26Å; A547-E550 WeakPolarHBondContact CA-OE2 3.08Å; A547-L551 HydrophobicContact CB-CG 4.48Å; A547-L551 VanDerWaalsContact O-CB 3.29Å; A547-L551 WeakPolarHBondContact O-CB 3.37Å; A547-L551 WeakPolarHBondContact O-CD1 3.38Å; A547-L551 WeakPolarHBondContact O-CG 3.45Å; A547-L551 PolarHBondContact O-N 2.97Å
548	N	90.6	Very high	88.7	Confident	93 Å²	93	87 Å²	87	50%	0.497	43%	0.427	S	S	.	.	H	α-helix	trans	-58.5	-46.8	-175.4	-163.1	47.5	0	0	0	112.4	K544 L551 T552	K544-N548 VanDerWaalsContact O-CB 3.29Å; K544-N548 WeakPolarHBondContact O-CB 2.99Å; N548-L551 PolarHBondContact O-N 3.13Å; N548-T552 PolarHBondContact O-N 3.32Å; N548-T552 PolarHBondContact O-OG1 3.32Å; N548-T552 VanDerWaalsContact O-OG1 3.09Å
549	E	90.7	Very high	88.4	Confident	151 Å²	151	88.9 Å²	88.9	71%	0.706	43%	0.434	S	S	*	.	H	α-helix	trans	-66.8	-42.7	-175.7	-65.3	174.8	-173.3	0	0	111.2	A547 T552 A553	A547-E549 VanDerWaalsContact C-N 3.35Å; A547-E549 PolarHBondContact O-N 3.25Å; E549-T552 VanDerWaalsContact C-OG1 3.31Å; E549-T552 WeakPolarHBondContact CA-OG1 3.45Å; E549-T552 PolarHBondContact O-N 2.88Å; E549-T552 PolarHBondContact O-OG1 3.5Å; E549-A553 WeakPolarHBondContact O-CB 3.37Å; E549-A553 PolarHBondContact O-N 3.43Å
550	E	90.5	Very high	88	Confident	35 Å²	35	85 Å²	85	16%	0.164	42%	0.42	C	S	.	.	H	α-helix	trans	-68.7	-36.6	177.4	-61.7	84.2	168.4	0	0	111.4	A493 M494 K497 A547 A553 F554	A493-E550 HydrophobicContact CB-CG 4.2Å; M494-E550 HydrophobicContact CB-CB 4.13Å; K497-E550 WeakPolarHBondContact CE-OE1 3.3Å; A547-E550 VanDerWaalsContact CA-OE2 3.26Å; A547-E550 WeakPolarHBondContact CA-OE2 3.08Å; E550-A553 PolarHBondContact O-N 3.16Å; E550-F554 VanDerWaalsContact O-CB 3.24Å; E550-F554 WeakPolarHBondContact O-CB 3.47Å; E550-F554 PolarHBondContact O-N 3.38Å
551	L	89.3	Confident	87	Confident	49 Å²	49	85 Å²	85	26%	0.257	42%	0.421	S	S	.	.	H	α-helix	trans	-65.4	-39.4	173.9	-75.7	168.6	0	0	0	111.8	M494 A547 N548 K555	M494-L551 HydrophobicContact SD-CD2 3.77Å; A547-L551 HydrophobicContact CB-CG 4.48Å; A547-L551 VanDerWaalsContact O-CB 3.29Å; A547-L551 WeakPolarHBondContact O-CB 3.37Å; A547-L551 WeakPolarHBondContact O-CD1 3.38Å; A547-L551 WeakPolarHBondContact O-CG 3.45Å; A547-L551 PolarHBondContact O-N 2.97Å; N548-L551 PolarHBondContact O-N 3.13Å; L551-K555 VanDerWaalsContact O-CG 3.3Å; L551-K555 WeakPolarHBondContact O-CG 2.93Å; L551-K555 PolarHBondContact O-N 3.03Å
552	T	90.3	Very high	85.5	Confident	60 Å²	60	89.8 Å²	89.8	37%	0.368	44%	0.435	S	S	.	.	H	α-helix	trans	-67.8	-45.9	174.7	43.4	0	0	0	0	111.4	N548 E549 F554 K555 E556	N548-T552 PolarHBondContact O-N 3.32Å; N548-T552 PolarHBondContact O-OG1 3.32Å; N548-T552 VanDerWaalsContact O-OG1 3.09Å; E549-T552 VanDerWaalsContact C-OG1 3.31Å; E549-T552 WeakPolarHBondContact CA-OG1 3.45Å; E549-T552 PolarHBondContact O-N 2.88Å; E549-T552 PolarHBondContact O-OG1 3.5Å; T552-F554 VanDerWaalsContact C-N 3.29Å; T552-F554 PolarHBondContact O-N 3.03Å; T552-K555 PolarHBondContact O-N 3.49Å; T552-K555 VanDerWaalsContact O-N 3.14Å; T552-E556 WeakPolarHBondContact O-CG 3.45Å; T552-E556 PolarHBondContact O-N 3.3Å
553	A	89.8	Confident	83.8	Confident	34 Å²	34	93.6 Å²	93.6	28%	0.281	45%	0.447	S	S	.	.	H	α-helix	trans	-60.7	-39.5	177.1	0	0	0	0	0	111.8	I490 E549 E550 E556 C557	I490-A553 HydrophobicContact CG2-CB 4.11Å; E549-A553 WeakPolarHBondContact O-CB 3.37Å; E549-A553 PolarHBondContact O-N 3.43Å; E550-A553 PolarHBondContact O-N 3.16Å; A553-E556 PolarHBondContact O-N 2.94Å; A553-C557 VanDerWaalsContact O-CB 3.23Å; A553-C557 WeakPolarHBondContact O-CB 3.47Å; A553-C557 PolarHBondContact O-N 3.34Å
554	F	90	Very high	81.9	Confident	49 Å²	49	94.8 Å²	94.8	22%	0.215	47%	0.466	C	S	.	.	H	α-helix	trans	-63.6	-46	174.8	-172.1	-89.8	0	0	0	111.3	I490 A491 M494 E550 T552 E556 C557 F558 L560	I490-F554 HydrophobicContact CG2-CB 4.01Å; I490-F554 HydrophobicContact CG2-CD2 4.31Å; A491-F554 HydrophobicContact CB-CD2 4.44Å; A491-F554 HydrophobicContact CB-CE2 4.1Å; M494-F554 HydrophobicContact CE-CD2 4.31Å; M494-F554 HydrophobicContact CE-CE2 4.37Å; M494-F554 HydrophobicContact SD-CG 4.46Å; E550-F554 VanDerWaalsContact O-CB 3.24Å; E550-F554 WeakPolarHBondContact O-CB 3.47Å; E550-F554 PolarHBondContact O-N 3.38Å; T552-F554 VanDerWaalsContact C-N 3.29Å; T552-F554 PolarHBondContact O-N 3.03Å; F554-E556 VanDerWaalsContact C-N 3.31Å; F554-E556 PolarHBondContact O-N 3.48Å; F554-C557 PolarHBondContact O-N 3.08Å; F554-F558 HydrophobicContact CD1-CD2 4.12Å; F554-F558 AromaticContact CD2-CD2 3.81Å; F554-F558 HydrophobicContact CD2-CD2 3.81Å; F554-F558 AromaticContact CD2-CE2 3.57Å; F554-F558 HydrophobicContact CD2-CE2 3.57Å; F554-F558 AromaticContact CE1-CD2 3.96Å; F554-F558 HydrophobicContact CE1-CD2 3.96Å; F554-F558 HydrophobicContact CE1-CE2 4.31Å; F554-F558 HydrophobicContact CE1-CG 4.45Å; F554-F558 AromaticContact CE2-CD2 3.64Å; F554-F558 HydrophobicContact CE2-CD2 3.64Å; F554-F558 AromaticContact CE2-CE2 3.18Å; F554-F558 HydrophobicContact CE2-CE2 3.18Å; F554-F558 AromaticContact CE2-CZ 3.88Å; F554-F558 HydrophobicContact CE2-CZ 3.88Å; F554-F558 HydrophobicContact CG-CD2 4.05Å; F554-F558 HydrophobicContact CG-CE2 4.28Å; F554-F558 AromaticContact CZ-CD2 3.71Å; F554-F558 HydrophobicContact CZ-CD2 3.71Å; F554-F558 AromaticContact CZ-CE2 3.6Å; F554-F558 HydrophobicContact CZ-CE2 3.6Å; F554-F558 HydrophobicContact CZ-CG 4.34Å; F554-F558 HydrophobicContact CZ-CZ 4.13Å; F554-F558 VanDerWaalsContact O-CD2 3.31Å; F554-F558 WeakPolarHBondContact O-CD2 3.35Å; F554-F558 PolarHBondContact O-N 3.48Å; F554-F558 VanDerWaalsContact O-N 3.1Å; F554-L560 HydrophobicContact CD1-CD1 4.04Å; F554-L560 HydrophobicContact CE1-CD1 3.88Å
555	K	89.4	Confident	79.9	Confident	102 Å²	102	94.4 Å²	94.4	44%	0.443	48%	0.475	S	S	.	.	H	α-helix	trans	-60.4	-40.9	177	-75.2	175.6	-178.9	-173.2	0	113	L551 T552 N559 L560	L551-K555 VanDerWaalsContact O-CG 3.3Å; L551-K555 WeakPolarHBondContact O-CG 2.93Å; L551-K555 PolarHBondContact O-N 3.03Å; T552-K555 PolarHBondContact O-N 3.49Å; T552-K555 VanDerWaalsContact O-N 3.14Å; K555-N559 PolarHBondContact O-N 2.82Å; K555-N559 VanDerWaalsContact O-N 3.11Å; K555-L560 PolarHBondContact O-N 3.02Å
556	E	87.7	Confident	77.9	Confident	126 Å²	126	91.7 Å²	91.7	59%	0.589	47%	0.47	S	S	*	.	H	α-helix	trans	-68.3	-46.6	178.4	-71.7	172.5	-175.6	0	0	111.4	T552 A553 F554 F558 N559	T552-E556 WeakPolarHBondContact O-CG 3.45Å; T552-E556 PolarHBondContact O-N 3.3Å; A553-E556 PolarHBondContact O-N 2.94Å; F554-E556 VanDerWaalsContact C-N 3.31Å; F554-E556 PolarHBondContact O-N 3.48Å; E556-F558 VanDerWaalsContact C-N 3.28Å; E556-F558 PolarHBondContact O-N 3.07Å; E556-N559 PolarHBondContact O-N 3.1Å; E556-N559 VanDerWaalsContact O-N 3.16Å; E556-N559 PolarHBondContact O-OD1 3.3Å
557	C	86.1	Confident	75.6	Confident	39 Å²	39	94.5 Å²	94.5	26%	0.264	49%	0.486	S	S	.	.	H	α-helix	trans	-65.2	-31.3	-177.5	-166.5	0	0	0	0	113.3	Q487 I490 A553 F554	Q487-C557 WeakPolarHBondContact CG-SG 3.44Å; I490-C557 HydrophobicContact CD1-CB 3.69Å; A553-C557 VanDerWaalsContact O-CB 3.23Å; A553-C557 WeakPolarHBondContact O-CB 3.47Å; A553-C557 PolarHBondContact O-N 3.34Å; F554-C557 PolarHBondContact O-N 3.08Å
558	F	84	Confident	73.1	Confident	70 Å²	70	103.8 Å²	103.8	31%	0.307	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	7.2	177.5	-71.7	-89.2	0	0	0	113.5	Q487 F554 E556 L560	Q487-F558 HydrophobicContact CB-CE1 4.35Å; Q487-F558 HydrophobicContact CB-CE2 4.02Å; Q487-F558 HydrophobicContact CB-CZ 3.65Å; Q487-F558 HydrophobicContact CG-CE1 4.16Å; Q487-F558 HydrophobicContact CG-CE2 4.04Å; Q487-F558 HydrophobicContact CG-CZ 3.81Å; F554-F558 HydrophobicContact CD1-CD2 4.12Å; F554-F558 AromaticContact CD2-CD2 3.81Å; F554-F558 HydrophobicContact CD2-CD2 3.81Å; F554-F558 AromaticContact CD2-CE2 3.57Å; F554-F558 HydrophobicContact CD2-CE2 3.57Å; F554-F558 AromaticContact CE1-CD2 3.96Å; F554-F558 HydrophobicContact CE1-CD2 3.96Å; F554-F558 HydrophobicContact CE1-CE2 4.31Å; F554-F558 HydrophobicContact CE1-CG 4.45Å; F554-F558 AromaticContact CE2-CD2 3.64Å; F554-F558 HydrophobicContact CE2-CD2 3.64Å; F554-F558 AromaticContact CE2-CE2 3.18Å; F554-F558 HydrophobicContact CE2-CE2 3.18Å; F554-F558 AromaticContact CE2-CZ 3.88Å; F554-F558 HydrophobicContact CE2-CZ 3.88Å; F554-F558 HydrophobicContact CG-CD2 4.05Å; F554-F558 HydrophobicContact CG-CE2 4.28Å; F554-F558 AromaticContact CZ-CD2 3.71Å; F554-F558 HydrophobicContact CZ-CD2 3.71Å; F554-F558 AromaticContact CZ-CE2 3.6Å; F554-F558 HydrophobicContact CZ-CE2 3.6Å; F554-F558 HydrophobicContact CZ-CG 4.34Å; F554-F558 HydrophobicContact CZ-CZ 4.13Å; F554-F558 VanDerWaalsContact O-CD2 3.31Å; F554-F558 WeakPolarHBondContact O-CD2 3.35Å; F554-F558 PolarHBondContact O-N 3.48Å; F554-F558 VanDerWaalsContact O-N 3.1Å; E556-F558 VanDerWaalsContact C-N 3.28Å; E556-F558 PolarHBondContact O-N 3.07Å; F558-L560 HydrophobicContact CB-CD1 4.11Å; F558-L560 HydrophobicContact CB-CD2 4.24Å; F558-L560 HydrophobicContact CB-CG 3.77Å; F558-L560 PolarHBondContact O-N 2.95Å; F558-L560 VanDerWaalsContact O-N 3.09Å
559	N	81.7	Confident	70.3	Confident	115 Å²	115	105.1 Å²	105.1	62%	0.615	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	30.5	-179	-71.3	-33.9	0	0	0	115.2	K555 E556 N561 N562	K555-N559 PolarHBondContact O-N 2.82Å; K555-N559 VanDerWaalsContact O-N 3.11Å; E556-N559 PolarHBondContact O-N 3.1Å; E556-N559 VanDerWaalsContact O-N 3.16Å; E556-N559 PolarHBondContact O-OD1 3.3Å; N559-N561 PolarHBondContact O-N 3.18Å; N559-N562 PolarHBondContact O-N 3.06Å
560	L	79	Confident	67.5	Low	75 Å²	75	108.8 Å²	108.8	39%	0.393	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-8.8	-174.7	-63.1	175.2	0	0	0	113.8	F554 K555 F558 N562	F554-L560 HydrophobicContact CD1-CD1 4.04Å; F554-L560 HydrophobicContact CE1-CD1 3.88Å; K555-L560 PolarHBondContact O-N 3.02Å; F558-L560 HydrophobicContact CB-CD1 4.11Å; F558-L560 HydrophobicContact CB-CD2 4.24Å; F558-L560 HydrophobicContact CB-CG 3.77Å; F558-L560 PolarHBondContact O-N 2.95Å; F558-L560 VanDerWaalsContact O-N 3.09Å; L560-N562 VanDerWaalsContact C-N 3.33Å
561	N	67.4	Low	64.7	Low	114 Å²	114	113.2 Å²	113.2	61%	0.61	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-21.1	177.7	-65.9	-24.9	0	0	0	112.9	N559	N559-N561 PolarHBondContact O-N 3.18Å
562	N	57.5	Low	62	Low	146 Å²	146	117 Å²	117	78%	0.781	61%	0.605	S	S	*	*	S	Bend	trans	-101.7	-9.2	-176.9	-74.6	-16.6	0	0	0	113.9	N559 L560 S564	N559-N562 PolarHBondContact O-N 3.06Å; L560-N562 VanDerWaalsContact C-N 3.33Å; N562-S564 PolarHBondContact O-N 3.37Å
563	E	52.6	Low	59.4	Low	115 Å²	115	123.4 Å²	123.4	54%	0.537	63%	0.63	S	S	.	*			trans	-81.2	109.9	176.3	-71.6	-164.5	157	0	0	110.4	V565	E563-V565 PolarHBondContact O-N 3.02Å
564	S	47.6	Very low	56.6	Low	107 Å²	107	126.8 Å²	126.8	75%	0.748	65%	0.652	S	S	*	*			trans	-55.2	107.1	161.2	57.5	0	0	0	0	107.9	N562 F566	N562-S564 PolarHBondContact O-N 3.37Å; S564-F566 PolarHBondContact O-N 3.18Å
565	V	46.5	Very low	53.9	Low	134 Å²	134	130.3 Å²	130.3	81%	0.812	68%	0.677	S	S	*	*			trans	-28.5	110.4	172	-179.3	0	0	0	0	109.7	E563 K567	E563-V565 PolarHBondContact O-N 3.02Å; V565-K567 PolarHBondContact O-N 3.22Å
566	F	47.9	Very low	51	Low	171 Å²	171	136.5 Å²	136.5	75%	0.75	70%	0.7	S	S	*	*			trans	-35.9	102.3	-177.4	-82.8	-98.5	0	0	0	111.5	S564 K568	S564-F566 PolarHBondContact O-N 3.18Å; F566-K568 VanDerWaalsContact C-N 3.33Å; F566-K568 PolarHBondContact O-N 3.13Å
567	K	39.9	Very low	48.2	Very low	199 Å²	199	137.1 Å²	137.1	87%	0.865	71%	0.707	S	S	*	*			trans	-66.5	100.4	161.8	-76.3	-177.4	179.6	176.1	0	105.5	V565 P569	V565-K567 PolarHBondContact O-N 3.22Å; K567-P569 VanDerWaalsContact O-N 3.15Å
568	K	36.1	Very low	45.6	Very low	195 Å²	195	144.6 Å²	144.6	85%	0.848	74%	0.738	S	S	*	*			trans	-40.1	122.5	171	-82.1	-179.2	173.3	179.3	0	109	F566 R570	F566-K568 VanDerWaalsContact C-N 3.33Å; F566-K568 PolarHBondContact O-N 3.13Å; K568-R570 PolarHBondContact O-N 2.96Å
569	P	32	Very low	43.3	Very low	122 Å²	122	150.1 Å²	150.1	79%	0.792	77%	0.765	S	S	*	*			trans	-61.2	130.2	168.5	-10.8	24.7	0	0	0	107.1	K567	K567-P569 VanDerWaalsContact O-N 3.15Å
570	R	32.1	Very low	41.5	Very low	228 Å²	228	151 Å²	151	86%	0.86	78%	0.775	S	S	*	*			trans	-56.8	141.7	166.2	-89.8	178.3	174.3	174.5	-2.4	108.1	K568 T572	K568-R570 PolarHBondContact O-N 2.96Å; R570-T572 PolarHBondContact O-N 3.04Å
571	P	32.7	Very low	40	Very low	128 Å²	128	154.2 Å²	154.2	83%	0.831	79%	0.786	S	S	*	*			trans	-69.3	99.9	177.1	29.4	-30.3	0	0	0	107.9
572	T	32.5	Very low	39.6	Very low	128 Å²	128	152.6 Å²	152.6	79%	0.785	78%	0.782	S	S	*	*			trans	-76.7	119.8	159.5	37.8	0	0	0	0	107.1	R570 S574	R570-T572 PolarHBondContact O-N 3.04Å; T572-S574 PolarHBondContact O-N 3.21Å
573	Q	34	Very low	39.8	Very low	195 Å²	195	147.5 Å²	147.5	91%	0.911	76%	0.758	S	S	*	*			trans	-46.2	106.6	170.6	-70.5	170.6	-17.8	0	0	109.6
574	S	32.6	Very low	40.7	Very low	105 Å²	105	142.7 Å²	142.7	73%	0.734	74%	0.736	S	S	*	*			trans	-91.1	104.4	165.3	45.3	0	0	0	0	108.1	T572 Y576	T572-S574 PolarHBondContact O-N 3.21Å; S574-Y576 PolarHBondContact O-N 2.86Å
575	T	31.6	Very low	41.9	Very low	122 Å²	122	140 Å²	140	75%	0.748	72%	0.717	S	S	*	*			trans	-52.7	119.9	159.7	-13.4	0	0	0	0	108.3	N577	T575-N577 PolarHBondContact O-N 3.22Å
576	Y	29.4	Very low	43.4	Very low	232 Å²	232	139.2 Å²	139.2	91%	0.91	70%	0.704	S	S	*	*			trans	-60.7	97.3	168.2	-84.7	-100	0	0	0	109	S574	S574-Y576 PolarHBondContact O-N 2.86Å
577	N	29.8	Very low	44.8	Very low	140 Å²	140	135.5 Å²	135.5	75%	0.749	70%	0.696	S	S	*	*			trans	-105.7	124.9	158.7	-86.8	-17.8	0	0	0	107.4	T575 E579	T575-N577 PolarHBondContact O-N 3.22Å; N577-E579 PolarHBondContact O-N 2.82Å
578	Q	31.7	Very low	46.6	Very low	195 Å²	195	128.5 Å²	128.5	91%	0.911	67%	0.666	S	S	*	*			trans	-54.6	103.8	173.3	-72.7	169.3	-26.7	0	0	109.6	T580	Q578-T580 PolarHBondContact O-N 2.95Å; Q578-T580 VanDerWaalsContact O-N 3.13Å
579	E	34.7	Very low	48.6	Very low	186 Å²	186	119.3 Å²	119.3	87%	0.869	63%	0.627	S	S	*	*			trans	-70.6	104.2	168.8	-76.4	-176.3	166.3	0	0	108.8	N577 K581	N577-E579 PolarHBondContact O-N 2.82Å; E579-K581 PolarHBondContact O-N 3.3Å
580	T	43.2	Very low	50.9	Low	135 Å²	135	117.7 Å²	117.7	83%	0.828	61%	0.607	S	S	*	*			trans	-61	104.2	160.4	37.4	0	0	0	0	108.6	Q578 C582	Q578-T580 PolarHBondContact O-N 2.95Å; Q578-T580 VanDerWaalsContact O-N 3.13Å; T580-C582 PolarHBondContact O-N 3.28Å
581	K	48.6	Very low	53.3	Low	142 Å²	142	112.9 Å²	112.9	62%	0.617	59%	0.594	S	S	*	*			trans	-45.3	120.1	175.8	-80.7	-177.9	171.7	-179.5	0	111.1	E579 E588	E579-K581 PolarHBondContact O-N 3.3Å; K581-E588 IonicContact NZ-OE1 2.66Å; K581-E588 PolarHBondContact NZ-OE1 2.65Å; K581-E588 IonicContact NZ-OE2 3.21Å
582	C	58.8	Low	55.6	Low	79 Å²	79	107 Å²	107	53%	0.534	56%	0.556	S	S	.	*	S	Bend	trans	-78.6	-25.1	-177.1	-132.3	0	0	0	0	113	T580 E608	T580-C582 PolarHBondContact O-N 3.28Å; C582-E608 PolarHBondContact SG-OE2 3.25Å
583	C	62.2	Low	58	Low	40 Å²	40	102.3 Å²	102.3	27%	0.27	53%	0.527	S	S	.	.	S	Bend	trans	-145.4	151.5	-176.6	-175.9	0	0	0	0	111.1	E608 S612	C583-E608 HydrophobicContact CB-CB 4.45Å; C583-E608 HydrophobicContact CB-CG 4.35Å; C583-S612 PolarHBondContact SG-OG 3.19Å; C583-S612 VanDerWaalsContact SG-OG 3.41Å
584	L	70.3	Confident	60.3	Low	14 Å²	14	101 Å²	101	7%	0.073	52%	0.521	C	S	.	.			trans	-81.5	140.1	168.1	-55.9	167.7	0	0	0	109.8	E588 C589 Y601 V605 T609	L584-E588 HydrophobicContact CB-CB 4.23Å; L584-E588 HydrophobicContact CD2-CB 4.3Å; L584-C589 HydrophobicContact CB-CB 4.37Å; L584-Y601 HydrophobicContact CD1-CD1 4.36Å; L584-Y601 HydrophobicContact CD1-CD2 4.06Å; L584-Y601 HydrophobicContact CD1-CE1 4.27Å; L584-Y601 HydrophobicContact CD1-CE2 3.92Å; L584-Y601 HydrophobicContact CD1-CG 4.26Å; L584-Y601 HydrophobicContact CD2-CD1 4.08Å; L584-Y601 HydrophobicContact CD2-CE1 3.46Å; L584-Y601 VanDerWaalsContact CD2-CE1 3.46Å; L584-Y601 HydrophobicContact CD2-CE2 4.34Å; L584-Y601 HydrophobicContact CG-CE1 4.38Å; L584-V605 HydrophobicContact CG-CG1 4.19Å; L584-T609 HydrophobicContact CB-CG2 3.43Å; L584-T609 VanDerWaalsContact CB-CG2 3.43Å; L584-T609 HydrophobicContact CD1-CG2 4.03Å; L584-T609 HydrophobicContact CG-CG2 3.74Å
585	S	74.2	Confident	62.6	Low	51 Å²	51	99.1 Å²	99.1	36%	0.357	51%	0.508	S	S	.	.			trans	-68.2	161.8	166.2	69	0	0	0	0	110.6	T587 E588 C589	S585-T587 PolarHBondContact O-N 3.22Å; S585-T587 PolarHBondContact OG-OG1 3.12Å; S585-E588 PolarHBondContact N-OE2 3.27Å; S585-E588 PolarHBondContact O-N 3.43Å; S585-E588 WeakPolarHBondContact OG-CB 3.24Å; S585-E588 VanDerWaalsContact OG-CG 3.24Å; S585-E588 WeakPolarHBondContact OG-CG 3.41Å; S585-E588 PolarHBondContact OG-N 3.2Å; S585-C589 WeakPolarHBondContact O-CB 3.4Å; S585-C589 PolarHBondContact O-N 3.26Å
586	E	76.8	Confident	65	Low	116 Å²	116	95.1 Å²	95.1	54%	0.542	49%	0.491	S	S	.	.	H	α-helix	trans	-58.6	-35.2	178.9	-161.7	-166.8	141.3	0	0	112.2	K590 F633	E586-K590 WeakPolarHBondContact O-CG 3.39Å; E586-K590 PolarHBondContact O-N 3.25Å; E586-K590 WeakPolarHBondContact OE1-CE 3.38Å; E586-K590 IonicContact OE1-NZ 3.82Å; E586-K590 PolarHBondContact OE1-NZ 3.04Å; E586-F633 HydrophobicContact CG-CE1 4.19Å; E586-F633 HydrophobicContact CG-CZ 4.27Å
587	T	76.8	Confident	67.7	Low	94 Å²	94	86.4 Å²	86.4	58%	0.577	46%	0.46	S	S	*	.	H	α-helix	trans	-70	-47	176.8	51.3	0	0	0	0	112.3	S585 C589 K590 E591	S585-T587 PolarHBondContact O-N 3.22Å; S585-T587 PolarHBondContact OG-OG1 3.12Å; T587-C589 PolarHBondContact O-N 3.1Å; T587-K590 PolarHBondContact O-N 3.38Å; T587-E591 PolarHBondContact O-N 3.16Å
588	E	78.7	Confident	70.1	Confident	52 Å²	52	79.8 Å²	79.8	24%	0.243	43%	0.425	C	S	.	.	H	α-helix	trans	-61.7	-35	175.3	-73.3	174.1	168.1	0	0	111.4	K581 L584 S585 A592	K581-E588 IonicContact NZ-OE1 2.66Å; K581-E588 PolarHBondContact NZ-OE1 2.65Å; K581-E588 IonicContact NZ-OE2 3.21Å; L584-E588 HydrophobicContact CB-CB 4.23Å; L584-E588 HydrophobicContact CD2-CB 4.3Å; S585-E588 PolarHBondContact N-OE2 3.27Å; S585-E588 PolarHBondContact O-N 3.43Å; S585-E588 WeakPolarHBondContact OG-CB 3.24Å; S585-E588 VanDerWaalsContact OG-CG 3.24Å; S585-E588 WeakPolarHBondContact OG-CG 3.41Å; S585-E588 PolarHBondContact OG-N 3.2Å; E588-A592 VanDerWaalsContact O-CB 3.24Å; E588-A592 WeakPolarHBondContact O-CB 3.41Å; E588-A592 PolarHBondContact O-N 3.33Å
589	C	77.9	Confident	72.6	Confident	2 Å²	2	75.6 Å²	75.6	1%	0.014	41%	0.405	C	S	.	.	H	α-helix	trans	-68.2	-44.6	176.4	-141.7	0	0	0	0	111.2	L584 S585 T587 E591 A592 V593 F633	L584-C589 HydrophobicContact CB-CB 4.37Å; S585-C589 WeakPolarHBondContact O-CB 3.4Å; S585-C589 PolarHBondContact O-N 3.26Å; T587-C589 PolarHBondContact O-N 3.1Å; C589-E591 PolarHBondContact O-N 3Å; C589-A592 PolarHBondContact O-N 3.47Å; C589-V593 VanDerWaalsContact O-CG2 3.26Å; C589-V593 WeakPolarHBondContact O-CG2 3.49Å; C589-V593 PolarHBondContact O-N 3.41Å; C589-F633 HydrophobicContact CB-CE2 3.99Å; C589-F633 HydrophobicContact CB-CZ 4.05Å
590	K	80.5	Confident	74.8	Confident	88 Å²	88	73.5 Å²	73.5	38%	0.383	39%	0.393	S	S	.	.	H	α-helix	trans	-59.4	-45.2	174.2	-78.9	175.2	178.1	163	0	112.2	E586 T587 A592 V593 Q594 F633	E586-K590 WeakPolarHBondContact O-CG 3.39Å; E586-K590 PolarHBondContact O-N 3.25Å; E586-K590 WeakPolarHBondContact OE1-CE 3.38Å; E586-K590 IonicContact OE1-NZ 3.82Å; E586-K590 PolarHBondContact OE1-NZ 3.04Å; T587-K590 PolarHBondContact O-N 3.38Å; K590-A592 VanDerWaalsContact C-N 3.35Å; K590-A592 PolarHBondContact O-N 3.07Å; K590-V593 PolarHBondContact O-N 3.02Å; K590-Q594 WeakPolarHBondContact O-CG 3.35Å; K590-Q594 PolarHBondContact O-N 2.89Å; K590-F633 HydrophobicContact CD-CD1 4.35Å; K590-F633 HydrophobicContact CD-CE1 4.16Å; K590-F633 HydrophobicContact CG-CD1 3.62Å; K590-F633 HydrophobicContact CG-CE1 3.52Å; K590-F633 HydrophobicContact CG-CG 4.39Å; K590-F633 HydrophobicContact CG-CZ 4.18Å
591	E	81.8	Confident	76.7	Confident	126 Å²	126	70.7 Å²	70.7	59%	0.589	37%	0.368	S	S	*	.	H	α-helix	trans	-64.4	-38.6	176.2	-71.8	177.7	-177.9	0	0	112.2	T587 C589 Q594 S595	T587-E591 PolarHBondContact O-N 3.16Å; C589-E591 PolarHBondContact O-N 3Å; E591-Q594 PolarHBondContact O-N 3.02Å; E591-S595 VanDerWaalsContact O-CB 3.29Å; E591-S595 WeakPolarHBondContact O-CB 3.47Å; E591-S595 PolarHBondContact O-N 2.94Å; E591-S595 PolarHBondContact O-OG 3.18Å
592	A	81.9	Confident	78.5	Confident	4 Å²	4	67.9 Å²	67.9	3%	0.033	36%	0.363	C	S	.	.	H	α-helix	trans	-67.7	-32.9	176.5	0	0	0	0	0	113.2	E588 C589 K590 G596 N597 L598 Y601	E588-A592 VanDerWaalsContact O-CB 3.24Å; E588-A592 WeakPolarHBondContact O-CB 3.41Å; E588-A592 PolarHBondContact O-N 3.33Å; C589-A592 PolarHBondContact O-N 3.47Å; K590-A592 VanDerWaalsContact C-N 3.35Å; K590-A592 PolarHBondContact O-N 3.07Å; A592-G596 PolarHBondContact O-N 3.23Å; A592-N597 PolarHBondContact O-N 3.48Å; A592-L598 HydrophobicContact CB-CG 4.25Å; A592-Y601 HydrophobicContact CB-CE2 3.86Å
593	V	83.4	Confident	79.6	Confident	30 Å²	30	67.2 Å²	67.2	18%	0.182	35%	0.353	C	S	.	.	H	α-helix	trans	-66.8	-52.1	171.7	174.8	0	0	0	0	110.2	C589 K590 S595 G596 L598 I629 F633	C589-V593 VanDerWaalsContact O-CG2 3.26Å; C589-V593 WeakPolarHBondContact O-CG2 3.49Å; C589-V593 PolarHBondContact O-N 3.41Å; K590-V593 PolarHBondContact O-N 3.02Å; V593-S595 VanDerWaalsContact C-N 3.33Å; V593-S595 PolarHBondContact O-N 2.93Å; V593-G596 PolarHBondContact O-N 3.15Å; V593-L598 HydrophobicContact CB-CD1 4.18Å; V593-L598 HydrophobicContact CG2-CD1 3.62Å; V593-I629 HydrophobicContact CG2-CG2 4.24Å; V593-F633 HydrophobicContact CG1-CB 4.44Å; V593-F633 HydrophobicContact CG2-CB 4.34Å; V593-F633 HydrophobicContact CG2-CD2 3.73Å; V593-F633 HydrophobicContact CG2-CE2 4.44Å; V593-F633 HydrophobicContact CG2-CG 4.33Å
594	Q	81.5	Confident	80.6	Confident	168 Å²	168	69.4 Å²	69.4	79%	0.785	37%	0.367	S	S	*	.	H	α-helix	trans	-63	-37.3	-177.8	-71.7	178	-1.2	0	0	113	K590 E591 G596	K590-Q594 WeakPolarHBondContact O-CG 3.35Å; K590-Q594 PolarHBondContact O-N 2.89Å; E591-Q594 PolarHBondContact O-N 3.02Å; Q594-G596 VanDerWaalsContact C-N 3.33Å
595	S	80.8	Confident	81.2	Confident	66 Å²	66	69.8 Å²	69.8	46%	0.462	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	1.1	-179.7	63.3	0	0	0	0	114.3	E591 V593 N597	E591-S595 VanDerWaalsContact O-CB 3.29Å; E591-S595 WeakPolarHBondContact O-CB 3.47Å; E591-S595 PolarHBondContact O-N 2.94Å; E591-S595 PolarHBondContact O-OG 3.18Å; V593-S595 VanDerWaalsContact C-N 3.33Å; V593-S595 PolarHBondContact O-N 2.93Å; S595-N597 VanDerWaalsContact CB-ND2 3.31Å; S595-N597 WeakPolarHBondContact CB-ND2 3.32Å; S595-N597 PolarHBondContact O-N 3.44Å; S595-N597 PolarHBondContact O-ND2 2.83Å; S595-N597 PolarHBondContact OG-ND2 2.97Å
596	G	82.4	Confident	81.7	Confident	37 Å²	37	67.4 Å²	67.4	38%	0.381	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	16	-178.7	0	0	0	0	0	114.6	A592 V593 Q594 H599	A592-G596 PolarHBondContact O-N 3.23Å; V593-G596 PolarHBondContact O-N 3.15Å; Q594-G596 VanDerWaalsContact C-N 3.33Å; G596-H599 PolarHBondContact O-CE1 2.79Å; G596-H599 VanDerWaalsContact O-CE1 3.22Å; G596-H599 PolarHBondContact O-ND1 2.68Å
597	N	85.1	Confident	82	Confident	49 Å²	49	66.7 Å²	66.7	26%	0.262	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-91.7	3	-169.8	-78	-49.2	0	0	0	114.7	A592 S595 H599 K600	A592-N597 PolarHBondContact O-N 3.48Å; S595-N597 VanDerWaalsContact CB-ND2 3.31Å; S595-N597 WeakPolarHBondContact CB-ND2 3.32Å; S595-N597 PolarHBondContact O-N 3.44Å; S595-N597 PolarHBondContact O-ND2 2.83Å; S595-N597 PolarHBondContact OG-ND2 2.97Å; N597-H599 PolarHBondContact O-N 3.46Å; N597-K600 HydrophobicContact CB-CD 4.37Å; N597-K600 WeakPolarHBondContact O-CB 3.4Å; N597-K600 PolarHBondContact O-N 2.73Å; N597-K600 VanDerWaalsContact OD1-CE 3.32Å; N597-K600 WeakPolarHBondContact OD1-CE 3.31Å; N597-K600 PolarHBondContact OD1-NZ 3.23Å
598	L	80.8	Confident	82.2	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.005	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-53.2	-29.1	177.6	-84.7	144.5	0	0	0	114.1	A592 V593 K600 Y601 L606 I626 I629 M630	A592-L598 HydrophobicContact CB-CG 4.25Å; V593-L598 HydrophobicContact CB-CD1 4.18Å; V593-L598 HydrophobicContact CG2-CD1 3.62Å; L598-K600 PolarHBondContact O-N 3.35Å; L598-Y601 PolarHBondContact O-N 2.96Å; L598-L606 HydrophobicContact CD2-CD2 3.91Å; L598-I626 HydrophobicContact CB-CG1 4.28Å; L598-I626 HydrophobicContact CB-CG2 3.87Å; L598-I626 HydrophobicContact CD1-CG2 4.41Å; L598-I629 HydrophobicContact CD1-CG2 4.48Å; L598-I629 HydrophobicContact CD2-CB 4.31Å; L598-I629 HydrophobicContact CD2-CD1 4.13Å; L598-I629 HydrophobicContact CD2-CG2 3.84Å; L598-M630 HydrophobicContact CD1-CE 3.92Å; L598-M630 HydrophobicContact CD1-CG 4Å
599	H	83.7	Confident	82.2	Confident	107 Å²	107	63.4 Å²	63.4	50%	0.495	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-65.1	-18.6	177.5	66.6	-86.4	0	0	0	113.9	G596 N597 K622 I626	G596-H599 PolarHBondContact O-CE1 2.79Å; G596-H599 VanDerWaalsContact O-CE1 3.22Å; G596-H599 PolarHBondContact O-ND1 2.68Å; N597-H599 PolarHBondContact O-N 3.46Å; H599-K622 WeakPolarHBondContact O-CE 3.39Å; H599-K622 PolarHBondContact O-NZ 3.14Å; H599-I626 HydrophobicContact CB-CD1 4.48Å
600	K	82.5	Confident	82.5	Confident	143 Å²	143	63.3 Å²	63.3	62%	0.622	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-80.6	-20.3	-179.7	-65.2	179.6	175.9	162.8	0	113.4	N597 L598	N597-K600 HydrophobicContact CB-CD 4.37Å; N597-K600 WeakPolarHBondContact O-CB 3.4Å; N597-K600 PolarHBondContact O-N 2.73Å; N597-K600 VanDerWaalsContact OD1-CE 3.32Å; N597-K600 WeakPolarHBondContact OD1-CE 3.31Å; N597-K600 PolarHBondContact OD1-NZ 3.23Å; L598-K600 PolarHBondContact O-N 3.35Å
601	Y	82.7	Confident	82.6	Confident	76 Å²	76	66 Å²	66	30%	0.298	33%	0.334	S	S	.	.	S	Bend	trans	-78.8	149.8	-180	-64.4	-75.1	0	0	0	112.3	L584 A592 L598 V605 K622	L584-Y601 HydrophobicContact CD1-CD1 4.36Å; L584-Y601 HydrophobicContact CD1-CD2 4.06Å; L584-Y601 HydrophobicContact CD1-CE1 4.27Å; L584-Y601 HydrophobicContact CD1-CE2 3.92Å; L584-Y601 HydrophobicContact CD1-CG 4.26Å; L584-Y601 HydrophobicContact CD2-CD1 4.08Å; L584-Y601 HydrophobicContact CD2-CE1 3.46Å; L584-Y601 VanDerWaalsContact CD2-CE1 3.46Å; L584-Y601 HydrophobicContact CD2-CE2 4.34Å; L584-Y601 HydrophobicContact CG-CE1 4.38Å; A592-Y601 HydrophobicContact CB-CE2 3.86Å; L598-Y601 PolarHBondContact O-N 2.96Å; Y601-V605 HydrophobicContact CD1-CG1 4.22Å; Y601-K622 VanDerWaalsContact O-CE 3.26Å; Y601-K622 WeakPolarHBondContact O-CE 3.23Å; Y601-K622 PolarHBondContact O-NZ 3.44Å
602	T	85.5	Confident	82.5	Confident	83 Å²	83	63.5 Å²	63.5	51%	0.509	33%	0.331	S	S	.	.			trans	-77.4	153.8	177.9	58.8	0	0	0	0	110.4	P604 V605 L606	T602-P604 VanDerWaalsContact C-N 3.31Å; T602-V605 PolarHBondContact O-N 3.45Å; T602-V605 WeakPolarHBondContact OG1-CG2 3.33Å; T602-L606 WeakPolarHBondContact O-CG 3.29Å; T602-L606 PolarHBondContact O-N 3.05Å; T602-L606 VanDerWaalsContact O-N 3.1Å
603	I	82.7	Confident	82.4	Confident	65 Å²	65	64.8 Å²	64.8	33%	0.333	34%	0.337	S	S	.	.	H	α-helix	trans	-55.1	-38.9	-179.9	-62.3	172.4	0	0	0	112.8	L606 R607 K622 I625	I603-L606 PolarHBondContact O-N 3.5Å; I603-R607 HydrophobicContact CG2-CG 4.33Å; I603-R607 WeakPolarHBondContact O-CG 3.26Å; I603-R607 PolarHBondContact O-N 3.25Å; I603-K622 HydrophobicContact CD1-CB 4.16Å; I603-K622 HydrophobicContact CG1-CB 4.01Å; I603-K622 HydrophobicContact CG1-CD 4.08Å; I603-K622 HydrophobicContact CG1-CG 4.15Å; I603-I625 HydrophobicContact CG2-CD1 4.24Å
604	P	82.9	Confident	82.2	Confident	86 Å²	86	66.7 Å²	66.7	56%	0.558	36%	0.362	S	S	*	.	H	α-helix	trans	-58.9	-49.6	175.6	-25.5	36.1	0	0	0	113	T602 L606 R607 E608	T602-P604 VanDerWaalsContact C-N 3.31Å; P604-L606 VanDerWaalsContact C-N 3.32Å; P604-L606 PolarHBondContact O-N 3.01Å; P604-R607 PolarHBondContact O-N 3.48Å; P604-R607 VanDerWaalsContact O-N 3.16Å; P604-E608 PolarHBondContact O-N 2.96Å
605	V	83	Confident	82.1	Confident	22 Å²	22	61.3 Å²	61.3	13%	0.133	34%	0.339	C	S	.	.	H	α-helix	trans	-60.6	-42.6	179.3	176.7	0	0	0	0	110.9	L584 Y601 T602 R607 E608 T609	L584-V605 HydrophobicContact CG-CG1 4.19Å; Y601-V605 HydrophobicContact CD1-CG1 4.22Å; T602-V605 PolarHBondContact O-N 3.45Å; T602-V605 WeakPolarHBondContact OG1-CG2 3.33Å; V605-R607 PolarHBondContact O-N 3.31Å; V605-E608 PolarHBondContact O-N 3.34Å; V605-T609 PolarHBondContact O-N 2.95Å; V605-T609 PolarHBondContact O-OG1 2.99Å; V605-T609 VanDerWaalsContact O-OG1 3.07Å
606	L	84.6	Confident	81.8	Confident	0 Å²	0	67 Å²	67	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-68.7	-29.9	178.6	-66.5	171.9	0	0	0	113.7	L598 T602 I603 P604 T609 I610 K622 I625 I626 I629	L598-L606 HydrophobicContact CD2-CD2 3.91Å; T602-L606 WeakPolarHBondContact O-CG 3.29Å; T602-L606 PolarHBondContact O-N 3.05Å; T602-L606 VanDerWaalsContact O-N 3.1Å; I603-L606 PolarHBondContact O-N 3.5Å; P604-L606 VanDerWaalsContact C-N 3.32Å; P604-L606 PolarHBondContact O-N 3.01Å; L606-T609 VanDerWaalsContact C-OG1 3.3Å; L606-T609 VanDerWaalsContact CA-OG1 3.25Å; L606-T609 WeakPolarHBondContact CA-OG1 3.43Å; L606-T609 PolarHBondContact O-OG1 2.98Å; L606-I610 WeakPolarHBondContact O-CG1 3.26Å; L606-I610 PolarHBondContact O-N 3.3Å; L606-K622 HydrophobicContact CD1-CG 4.16Å; L606-I625 HydrophobicContact CB-CG2 3.5Å; L606-I625 HydrophobicContact CD1-CG2 4.32Å; L606-I625 HydrophobicContact CG-CG2 4.44Å; L606-I626 HydrophobicContact CD1-CD1 4.43Å; L606-I626 HydrophobicContact CD1-CG1 4.02Å; L606-I629 HydrophobicContact CD2-CD1 3.88Å
607	R	83.1	Confident	81.1	Confident	102 Å²	102	68.7 Å²	68.7	39%	0.385	36%	0.355	S	S	.	.	H	α-helix	trans	-74.3	-35.1	174.7	-78	-178.9	176.7	178.1	1.6	111.6	I603 P604 V605 K611 I617 I625	I603-R607 HydrophobicContact CG2-CG 4.33Å; I603-R607 WeakPolarHBondContact O-CG 3.26Å; I603-R607 PolarHBondContact O-N 3.25Å; P604-R607 PolarHBondContact O-N 3.48Å; P604-R607 VanDerWaalsContact O-N 3.16Å; V605-R607 PolarHBondContact O-N 3.31Å; R607-K611 WeakPolarHBondContact O-CG 3.46Å; R607-K611 PolarHBondContact O-N 3.22Å; R607-I617 HydrophobicContact CB-CD1 4.47Å; R607-I625 HydrophobicContact CG-CD1 3.94Å
608	E	81.3	Confident	80.1	Confident	76 Å²	76	71 Å²	71	36%	0.355	38%	0.375	S	S	.	.	H	α-helix	trans	-71.9	-36.9	178.8	-146.5	161.8	169.5	0	0	111.4	C582 C583 P604 V605 K611 S612	C582-E608 PolarHBondContact SG-OE2 3.25Å; C583-E608 HydrophobicContact CB-CB 4.45Å; C583-E608 HydrophobicContact CB-CG 4.35Å; P604-E608 PolarHBondContact O-N 2.96Å; V605-E608 PolarHBondContact O-N 3.34Å; E608-K611 WeakPolarHBondContact O-CB 3.24Å; E608-K611 PolarHBondContact O-N 3.01Å; E608-S612 PolarHBondContact O-N 2.81Å
609	T	79.2	Confident	79.3	Confident	0 Å²	0	72 Å²	72	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-66.4	-37	171.3	44	0	0	0	0	113.8	L584 V605 L606 K611 S612 L613	L584-T609 HydrophobicContact CB-CG2 3.43Å; L584-T609 VanDerWaalsContact CB-CG2 3.43Å; L584-T609 HydrophobicContact CD1-CG2 4.03Å; L584-T609 HydrophobicContact CG-CG2 3.74Å; V605-T609 PolarHBondContact O-N 2.95Å; V605-T609 PolarHBondContact O-OG1 2.99Å; V605-T609 VanDerWaalsContact O-OG1 3.07Å; L606-T609 VanDerWaalsContact C-OG1 3.3Å; L606-T609 VanDerWaalsContact CA-OG1 3.25Å; L606-T609 WeakPolarHBondContact CA-OG1 3.43Å; L606-T609 PolarHBondContact O-OG1 2.98Å; T609-K611 VanDerWaalsContact C-N 3.25Å; T609-K611 PolarHBondContact O-N 2.96Å; T609-S612 WeakPolarHBondContact CA-OG 3.48Å; T609-S612 PolarHBondContact O-N 3.3Å; T609-S612 PolarHBondContact O-OG 3.01Å; T609-L613 WeakPolarHBondContact O-CB 3.39Å; T609-L613 VanDerWaalsContact O-CG 3.25Å; T609-L613 WeakPolarHBondContact O-CG 3.25Å; T609-L613 PolarHBondContact O-N 3.39Å
610	I	83.2	Confident	78.5	Confident	1 Å²	1	71.1 Å²	71.1	1%	0.005	39%	0.389	C	S	.	.	H	α-helix	trans	-60.6	-38.3	171.5	-79.3	-174.2	0	0	0	111.2	L606 G614 L615 I617 I625 K628 I629	L606-I610 WeakPolarHBondContact O-CG1 3.26Å; L606-I610 PolarHBondContact O-N 3.3Å; I610-G614 PolarHBondContact O-N 3.21Å; I610-L615 HydrophobicContact CG2-CB 3.82Å; I610-L615 VanDerWaalsContact CG2-O 3.23Å; I610-L615 WeakPolarHBondContact CG2-O 3.38Å; I610-L615 PolarHBondContact O-N 3.33Å; I610-I617 HydrophobicContact CB-CG1 4.47Å; I610-I617 HydrophobicContact CG2-CG1 3.59Å; I610-I625 HydrophobicContact CD1-CB 4.21Å; I610-I625 HydrophobicContact CD1-CG1 4.33Å; I610-I625 HydrophobicContact CD1-CG2 3.66Å; I610-I625 HydrophobicContact CG1-CG2 4.45Å; I610-K628 HydrophobicContact CD1-CB 4.41Å; I610-I629 HydrophobicContact CD1-CG1 4.32Å; I610-I629 HydrophobicContact CG1-CD1 4.07Å; I610-I629 HydrophobicContact CG1-CG1 3.8Å
611	K	82	Confident	78.4	Confident	143 Å²	143	70.8 Å²	70.8	62%	0.622	39%	0.388	S	S	*	.	H	α-helix	trans	-68.3	-41.6	176.2	-71.3	176.9	-180	-179.7	0	112	R607 E608 T609 L613 G614 I617	R607-K611 WeakPolarHBondContact O-CG 3.46Å; R607-K611 PolarHBondContact O-N 3.22Å; E608-K611 WeakPolarHBondContact O-CB 3.24Å; E608-K611 PolarHBondContact O-N 3.01Å; T609-K611 VanDerWaalsContact C-N 3.25Å; T609-K611 PolarHBondContact O-N 2.96Å; K611-L613 VanDerWaalsContact C-N 3.3Å; K611-L613 PolarHBondContact O-N 3.31Å; K611-G614 PolarHBondContact O-N 3.22Å; K611-G614 VanDerWaalsContact O-N 3.15Å; K611-I617 HydrophobicContact CD-CD1 4.4Å; K611-I617 HydrophobicContact CG-CD1 3.95Å
612	S	81.1	Confident	78.4	Confident	75 Å²	75	70.5 Å²	70.5	52%	0.524	39%	0.388	S	S	.	.	H	α-helix	trans	-67.6	-31	178	67.9	0	0	0	0	112.5	C583 E608 T609 G614	C583-S612 PolarHBondContact SG-OG 3.19Å; C583-S612 VanDerWaalsContact SG-OG 3.41Å; E608-S612 PolarHBondContact O-N 2.81Å; T609-S612 WeakPolarHBondContact CA-OG 3.48Å; T609-S612 PolarHBondContact O-N 3.3Å; T609-S612 PolarHBondContact O-OG 3.01Å; S612-G614 VanDerWaalsContact C-N 3.27Å; S612-G614 PolarHBondContact O-N 2.82Å
613	L	78.8	Confident	78.3	Confident	31 Å²	31	70 Å²	70	16%	0.162	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	2.2	173	-65.6	168.3	0	0	0	113.9	T609 K611 L615 F633	T609-L613 WeakPolarHBondContact O-CB 3.39Å; T609-L613 VanDerWaalsContact O-CG 3.25Å; T609-L613 WeakPolarHBondContact O-CG 3.25Å; T609-L613 PolarHBondContact O-N 3.39Å; K611-L613 VanDerWaalsContact C-N 3.3Å; K611-L613 PolarHBondContact O-N 3.31Å; L613-L615 VanDerWaalsContact C-N 3.27Å; L613-L615 HydrophobicContact CB-CD1 4.23Å; L613-L615 HydrophobicContact CB-CG 4.34Å; L613-L615 PolarHBondContact O-N 2.94Å; L613-F633 HydrophobicContact CD1-CE2 3.95Å; L613-F633 HydrophobicContact CD1-CZ 4.22Å; L613-F633 HydrophobicContact CD2-CE2 4.41Å; L613-F633 HydrophobicContact CD2-CZ 3.84Å
614	G	79.8	Confident	78.3	Confident	69 Å²	69	69.6 Å²	69.6	71%	0.711	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	13.7	177.8	0	0	0	0	0	115.4	I610 K611 S612	I610-G614 PolarHBondContact O-N 3.21Å; K611-G614 PolarHBondContact O-N 3.22Å; K611-G614 VanDerWaalsContact O-N 3.15Å; S612-G614 VanDerWaalsContact C-N 3.27Å; S612-G614 PolarHBondContact O-N 2.82Å
615	L	79	Confident	78.4	Confident	56 Å²	56	65.6 Å²	65.6	29%	0.293	36%	0.36	S	S	.	.			trans	-87.7	144.2	-177.3	-67.5	170.8	0	0	0	111.6	I610 L613 H632	I610-L615 HydrophobicContact CG2-CB 3.82Å; I610-L615 VanDerWaalsContact CG2-O 3.23Å; I610-L615 WeakPolarHBondContact CG2-O 3.38Å; I610-L615 PolarHBondContact O-N 3.33Å; L613-L615 VanDerWaalsContact C-N 3.27Å; L613-L615 HydrophobicContact CB-CD1 4.23Å; L613-L615 HydrophobicContact CB-CG 4.34Å; L613-L615 PolarHBondContact O-N 2.94Å; L615-H632 HydrophobicContact CD1-CB 3.91Å
616	K	74.3	Confident	78.5	Confident	184 Å²	184	65.7 Å²	65.7	80%	0.8	36%	0.36	S	S	*	.			trans	-77.8	125.5	177.2	-71	-177.2	-179.6	176.4	0	111.7	S618 K628	K616-S618 PolarHBondContact O-N 3.38Å; K616-K628 PolarHBondContact O-NZ 2.7Å
617	I	67.5	Low	78.6	Confident	74 Å²	74	71.2 Å²	71.2	38%	0.379	39%	0.385	S	S	.	.			trans	-73.9	104.7	172.3	-55.9	164.8	0	0	0	108.5	R607 I610 K611	R607-I617 HydrophobicContact CB-CD1 4.47Å; I610-I617 HydrophobicContact CB-CG1 4.47Å; I610-I617 HydrophobicContact CG2-CG1 3.59Å; K611-I617 HydrophobicContact CD-CD1 4.4Å; K611-I617 HydrophobicContact CG-CD1 3.95Å
618	S	64.7	Low	78.6	Confident	98 Å²	98	69.3 Å²	69.3	69%	0.685	38%	0.38	S	S	*	.			trans	-115.9	0.3	175.4	71.1	0	0	0	0	113.6	K616 K628	K616-S618 PolarHBondContact O-N 3.38Å; S618-K628 PolarHBondContact OG-NZ 2.95Å
619	A	63.3	Low	78.7	Confident	20 Å²	20	65.7 Å²	65.7	17%	0.165	36%	0.363	C	S	.	.			trans	-129.7	139.4	-171.5	0	0	0	0	0	112.6	D624	A619-D624 HydrophobicContact CB-CB 3.34Å
620	S	68.1	Low	79	Confident	90 Å²	90	68.9 Å²	68.9	63%	0.629	38%	0.379	S	S	*	.			trans	-90.8	-25.2	-179.3	57.7	0	0	0	0	113.1
621	K	80.9	Confident	79	Confident	136 Å²	136	72.2 Å²	72.2	59%	0.591	40%	0.397	S	S	*	.	S	Bend	trans	-83.2	145.6	-177	-63.4	-179.1	-179.1	177	0	111.8	S623 D624 I625	K621-S623 VanDerWaalsContact C-N 3.32Å; K621-S623 PolarHBondContact O-N 3.49Å; K621-D624 PolarHBondContact O-N 2.91Å; K621-I625 WeakPolarHBondContact O-CG1 3.31Å; K621-I625 PolarHBondContact O-N 3.42Å
622	K	82.3	Confident	79.1	Confident	70 Å²	70	67.7 Å²	67.7	30%	0.304	38%	0.377	S	S	.	.	H	α-helix	trans	-62.8	-35.8	178	-176.6	172	169.8	170.8	0	112.5	H599 Y601 I603 L606 I625 I626	H599-K622 WeakPolarHBondContact O-CE 3.39Å; H599-K622 PolarHBondContact O-NZ 3.14Å; Y601-K622 VanDerWaalsContact O-CE 3.26Å; Y601-K622 WeakPolarHBondContact O-CE 3.23Å; Y601-K622 PolarHBondContact O-NZ 3.44Å; I603-K622 HydrophobicContact CD1-CB 4.16Å; I603-K622 HydrophobicContact CG1-CB 4.01Å; I603-K622 HydrophobicContact CG1-CD 4.08Å; I603-K622 HydrophobicContact CG1-CG 4.15Å; L606-K622 HydrophobicContact CD1-CG 4.16Å; K622-I625 PolarHBondContact O-N 3.37Å; K622-I626 HydrophobicContact CG-CD1 4.01Å; K622-I626 VanDerWaalsContact O-CG1 3.31Å; K622-I626 WeakPolarHBondContact O-CG1 3.25Å; K622-I626 PolarHBondContact O-N 2.96Å
623	S	83	Confident	79	Confident	71 Å²	71	65.4 Å²	65.4	50%	0.497	36%	0.358	S	S	.	.	H	α-helix	trans	-56.5	-50	176.1	45.8	0	0	0	0	112.2	K621 I625 I626 E627	K621-S623 VanDerWaalsContact C-N 3.32Å; K621-S623 PolarHBondContact O-N 3.49Å; S623-I625 VanDerWaalsContact C-N 3.29Å; S623-I625 PolarHBondContact O-N 3.17Å; S623-I626 PolarHBondContact O-N 3.4Å; S623-I626 VanDerWaalsContact O-N 3.14Å; S623-E627 PolarHBondContact O-N 3.18Å
624	D	83.5	Confident	78.8	Confident	57 Å²	57	69 Å²	69	31%	0.305	38%	0.381	S	S	.	.	H	α-helix	trans	-70.8	-30.2	-172.4	-49.5	0.2	0	0	0	111.4	A619 K621 K628	A619-D624 HydrophobicContact CB-CB 3.34Å; K621-D624 PolarHBondContact O-N 2.91Å; D624-K628 PolarHBondContact O-N 3.32Å
625	I	84	Confident	78.2	Confident	3 Å²	3	73.3 Å²	73.3	2%	0.015	38%	0.383	C	S	.	.	H	α-helix	trans	-68	-43.7	173.2	-70.1	169.9	0	0	0	110.3	I603 L606 R607 I610 K621 K622 S623 I629	I603-I625 HydrophobicContact CG2-CD1 4.24Å; L606-I625 HydrophobicContact CB-CG2 3.5Å; L606-I625 HydrophobicContact CD1-CG2 4.32Å; L606-I625 HydrophobicContact CG-CG2 4.44Å; R607-I625 HydrophobicContact CG-CD1 3.94Å; I610-I625 HydrophobicContact CD1-CB 4.21Å; I610-I625 HydrophobicContact CD1-CG1 4.33Å; I610-I625 HydrophobicContact CD1-CG2 3.66Å; I610-I625 HydrophobicContact CG1-CG2 4.45Å; K621-I625 WeakPolarHBondContact O-CG1 3.31Å; K621-I625 PolarHBondContact O-N 3.42Å; K622-I625 PolarHBondContact O-N 3.37Å; S623-I625 VanDerWaalsContact C-N 3.29Å; S623-I625 PolarHBondContact O-N 3.17Å; I625-I629 HydrophobicContact CG2-CD1 4.23Å; I625-I629 WeakPolarHBondContact O-CG1 3.49Å; I625-I629 PolarHBondContact O-N 3.41Å
626	I	86.1	Confident	76.9	Confident	24 Å²	24	78.3 Å²	78.3	12%	0.123	41%	0.41	C	S	.	.	H	α-helix	trans	-65.5	-44.8	178.3	-68	168.8	0	0	0	110.6	L598 H599 L606 K622 S623 K628 I629 M630	L598-I626 HydrophobicContact CB-CG1 4.28Å; L598-I626 HydrophobicContact CB-CG2 3.87Å; L598-I626 HydrophobicContact CD1-CG2 4.41Å; H599-I626 HydrophobicContact CB-CD1 4.48Å; L606-I626 HydrophobicContact CD1-CD1 4.43Å; L606-I626 HydrophobicContact CD1-CG1 4.02Å; K622-I626 HydrophobicContact CG-CD1 4.01Å; K622-I626 VanDerWaalsContact O-CG1 3.31Å; K622-I626 WeakPolarHBondContact O-CG1 3.25Å; K622-I626 PolarHBondContact O-N 2.96Å; S623-I626 PolarHBondContact O-N 3.4Å; S623-I626 VanDerWaalsContact O-N 3.14Å; I626-K628 VanDerWaalsContact C-N 3.32Å; I626-K628 PolarHBondContact O-N 3.23Å; I626-I629 PolarHBondContact O-N 3.22Å; I626-M630 HydrophobicContact CG2-CE 3.84Å; I626-M630 HydrophobicContact CG2-CG 4.38Å; I626-M630 HydrophobicContact CG2-SD 4.03Å; I626-M630 WeakPolarHBondContact O-CG 3.43Å; I626-M630 PolarHBondContact O-N 3.45Å
627	E	85.1	Confident	77.1	Confident	116 Å²	116	73 Å²	73	54%	0.542	39%	0.391	S	S	.	.	H	α-helix	trans	-60.2	-40.6	179.3	-169.2	178.4	179.5	0	0	112	S623 M630 N631	S623-E627 PolarHBondContact O-N 3.18Å; E627-M630 PolarHBondContact O-N 2.87Å; E627-N631 WeakPolarHBondContact O-CB 3.27Å; E627-N631 VanDerWaalsContact O-CG 3.23Å; E627-N631 PolarHBondContact O-N 3.17Å; E627-N631 PolarHBondContact O-OD1 3.3Å
628	K	83.6	Confident	77.6	Confident	61 Å²	61	72.9 Å²	72.9	27%	0.265	39%	0.391	S	S	.	.	H	α-helix	trans	-63.6	-40.8	174.2	-83.1	-177.3	171.2	-176.5	0	113.9	I610 K616 S618 D624 I626 M630 H632	I610-K628 HydrophobicContact CD1-CB 4.41Å; K616-K628 PolarHBondContact O-NZ 2.7Å; S618-K628 PolarHBondContact OG-NZ 2.95Å; D624-K628 PolarHBondContact O-N 3.32Å; I626-K628 VanDerWaalsContact C-N 3.32Å; I626-K628 PolarHBondContact O-N 3.23Å; K628-M630 VanDerWaalsContact C-N 3.34Å; K628-H632 PolarHBondContact O-N 3.16Å
629	I	83.1	Confident	78.3	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-66.8	-41.5	177	-65.2	166.5	0	0	0	109.5	V593 L598 L606 I610 I625 I626 H632 F633	V593-I629 HydrophobicContact CG2-CG2 4.24Å; L598-I629 HydrophobicContact CD1-CG2 4.48Å; L598-I629 HydrophobicContact CD2-CB 4.31Å; L598-I629 HydrophobicContact CD2-CD1 4.13Å; L598-I629 HydrophobicContact CD2-CG2 3.84Å; L606-I629 HydrophobicContact CD2-CD1 3.88Å; I610-I629 HydrophobicContact CD1-CG1 4.32Å; I610-I629 HydrophobicContact CG1-CD1 4.07Å; I610-I629 HydrophobicContact CG1-CG1 3.8Å; I625-I629 HydrophobicContact CG2-CD1 4.23Å; I625-I629 WeakPolarHBondContact O-CG1 3.49Å; I625-I629 PolarHBondContact O-N 3.41Å; I626-I629 PolarHBondContact O-N 3.22Å; I629-H632 PolarHBondContact O-N 3.21Å; I629-F633 HydrophobicContact CG2-CD2 4.15Å; I629-F633 HydrophobicContact CG2-CE2 4.07Å; I629-F633 VanDerWaalsContact O-CD2 3.27Å; I629-F633 WeakPolarHBondContact O-CD2 3.33Å
630	M	84.9	Confident	79.2	Confident	68 Å²	68	74.6 Å²	74.6	34%	0.335	39%	0.387	S	S	.	.	H	α-helix	trans	-59.9	-49.7	175	-73.2	179.5	168.5	0	0	111.5	L598 I626 E627 K628 H632 F633 T634	L598-M630 HydrophobicContact CD1-CE 3.92Å; L598-M630 HydrophobicContact CD1-CG 4Å; I626-M630 HydrophobicContact CG2-CE 3.84Å; I626-M630 HydrophobicContact CG2-CG 4.38Å; I626-M630 HydrophobicContact CG2-SD 4.03Å; I626-M630 WeakPolarHBondContact O-CG 3.43Å; I626-M630 PolarHBondContact O-N 3.45Å; E627-M630 PolarHBondContact O-N 2.87Å; K628-M630 VanDerWaalsContact C-N 3.34Å; M630-H632 VanDerWaalsContact C-N 3.3Å; M630-H632 PolarHBondContact O-N 3.3Å; M630-F633 PolarHBondContact O-N 3.12Å; M630-F633 VanDerWaalsContact O-N 3.12Å; M630-T634 PolarHBondContact O-N 3.05Å; M630-T634 PolarHBondContact O-OG1 3.05Å; M630-T634 VanDerWaalsContact O-OG1 3.05Å
631	N	84.4	Confident	79.8	Confident	71 Å²	71	73.6 Å²	73.6	38%	0.38	37%	0.372	S	S	.	.	H	α-helix	trans	-58.8	-39.7	-179.1	-70.5	-8.1	0	0	0	112.6	E627 F633 T634 E635	E627-N631 WeakPolarHBondContact O-CB 3.27Å; E627-N631 VanDerWaalsContact O-CG 3.23Å; E627-N631 PolarHBondContact O-N 3.17Å; E627-N631 PolarHBondContact O-OD1 3.3Å; N631-F633 VanDerWaalsContact C-N 3.27Å; N631-F633 PolarHBondContact O-N 3.25Å; N631-T634 WeakPolarHBondContact CA-OG1 3.48Å; N631-T634 PolarHBondContact O-N 3.44Å; N631-T634 PolarHBondContact O-OG1 2.88Å; N631-E635 WeakPolarHBondContact O-CB 3.47Å; N631-E635 WeakPolarHBondContact O-CG 3.44Å; N631-E635 PolarHBondContact O-N 2.98Å
632	H	83	Confident	79.8	Confident	47 Å²	47	69.5 Å²	69.5	22%	0.218	36%	0.357	C	S	.	.	H	α-helix	trans	-61.3	-32.4	178.5	179.2	-86.9	0	0	0	113.9	L615 K628 I629 M630 N636	L615-H632 HydrophobicContact CD1-CB 3.91Å; K628-H632 PolarHBondContact O-N 3.16Å; I629-H632 PolarHBondContact O-N 3.21Å; M630-H632 VanDerWaalsContact C-N 3.3Å; M630-H632 PolarHBondContact O-N 3.3Å; H632-N636 PolarHBondContact O-ND2 3.2Å; H632-N636 VanDerWaalsContact O-ND2 3.16Å
633	F	80.1	Confident	79.6	Confident	27 Å²	27	69.4 Å²	69.4	12%	0.118	36%	0.361	C	S	.	.	H	α-helix	trans	-99.5	-2.1	179.6	-69	-69	0	0	0	113.8	E586 C589 K590 V593 L613 I629 M630 N631 N636	E586-F633 HydrophobicContact CG-CE1 4.19Å; E586-F633 HydrophobicContact CG-CZ 4.27Å; C589-F633 HydrophobicContact CB-CE2 3.99Å; C589-F633 HydrophobicContact CB-CZ 4.05Å; K590-F633 HydrophobicContact CD-CD1 4.35Å; K590-F633 HydrophobicContact CD-CE1 4.16Å; K590-F633 HydrophobicContact CG-CD1 3.62Å; K590-F633 HydrophobicContact CG-CE1 3.52Å; K590-F633 HydrophobicContact CG-CG 4.39Å; K590-F633 HydrophobicContact CG-CZ 4.18Å; V593-F633 HydrophobicContact CG1-CB 4.44Å; V593-F633 HydrophobicContact CG2-CB 4.34Å; V593-F633 HydrophobicContact CG2-CD2 3.73Å; V593-F633 HydrophobicContact CG2-CE2 4.44Å; V593-F633 HydrophobicContact CG2-CG 4.33Å; L613-F633 HydrophobicContact CD1-CE2 3.95Å; L613-F633 HydrophobicContact CD1-CZ 4.22Å; L613-F633 HydrophobicContact CD2-CE2 4.41Å; L613-F633 HydrophobicContact CD2-CZ 3.84Å; I629-F633 HydrophobicContact CG2-CD2 4.15Å; I629-F633 HydrophobicContact CG2-CE2 4.07Å; I629-F633 VanDerWaalsContact O-CD2 3.27Å; I629-F633 WeakPolarHBondContact O-CD2 3.33Å; M630-F633 PolarHBondContact O-N 3.12Å; M630-F633 VanDerWaalsContact O-N 3.12Å; N631-F633 VanDerWaalsContact C-N 3.27Å; N631-F633 PolarHBondContact O-N 3.25Å; F633-N636 VanDerWaalsContact O-OXT 3.13Å
634	T	75.2	Confident	79.3	Confident	106 Å²	106	69.3 Å²	69.3	65%	0.65	35%	0.351	S	S	*	.	H	α-helix	trans	-97.6	-24.5	166.3	40.7	0	0	0	0	112.8	M630 N631	M630-T634 PolarHBondContact O-N 3.05Å; M630-T634 PolarHBondContact O-OG1 3.05Å; M630-T634 VanDerWaalsContact O-OG1 3.05Å; N631-T634 WeakPolarHBondContact CA-OG1 3.48Å; N631-T634 PolarHBondContact O-N 3.44Å; N631-T634 PolarHBondContact O-OG1 2.88Å
635	E	66.3	Low	79	Confident	161 Å²	161	70.3 Å²	70.3	75%	0.752	36%	0.355	S	S	*	.			trans	-88.7	-15.8	175.9	-69	-179.6	170.1	0	0	113.6	N631	N631-E635 WeakPolarHBondContact O-CB 3.47Å; N631-E635 WeakPolarHBondContact O-CG 3.44Å; N631-E635 PolarHBondContact O-N 2.98Å
636	N	52.3	Low	78.5	Confident	160 Å²	160	76.5 Å²	76.5	86%	0.856	39%	0.385	S	S	*	.			trans	-126.8	0	173.2	-61.6	-60.8	0	0	0	110.4	H632 F633	H632-N636 PolarHBondContact O-ND2 3.2Å; H632-N636 VanDerWaalsContact O-ND2 3.16Å; F633-N636 VanDerWaalsContact O-OXT 3.13Å

Retrieved 636 of 636 residues in 374.6 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).