A0A077Z0F8_TRITR Loading...

DNA-directed RNA polymerase III subunit RPC5

AlphaFold DB , UniProt , Accession A0A077Z0F8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 623 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.7	Very low	59.6	Low	238 Å²	238	165.6 Å²	165.6	100%	1.172	83%	0.834	S	S	*	*				0	95.4	0	-68.2	177.6	160.7	0	0	107.2
2	R	36.4	Very low	61.4	Low	246 Å²	246	162 Å²	162	93%	0.928	83%	0.827	S	S	*	*			trans	-94.7	103.6	-168.5	-72.6	-175.7	-176.6	-179.8	1.5	110.3
3	N	40.3	Very low	63.3	Low	140 Å²	140	154.9 Å²	154.9	75%	0.749	79%	0.791	S	S	*	*			trans	-65.9	123.5	162.1	-77.9	-12.8	0	0	0	108.4	D5	N3-D5 PolarHBondContact O-N 2.7Å
4	N	46.8	Very low	64.9	Low	151 Å²	151	148.7 Å²	148.7	81%	0.807	77%	0.766	S	S	*	*			trans	-81.5	86.4	168.1	-82.1	-14.3	0	0	0	108
5	D	50.6	Low	66.3	Low	147 Å²	147	143.5 Å²	143.5	79%	0.786	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-77.2	123.6	168.2	-73.9	-38.1	0	0	0	109.6	N3	N3-D5 PolarHBondContact O-N 2.7Å
6	N	57.5	Low	67.2	Low	157 Å²	157	142.9 Å²	142.9	84%	0.84	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-69.3	150.3	-173.8	-64.9	-67.5	0	0	0	113
7	D	72.7	Confident	67.9	Low	154 Å²	154	143.1 Å²	143.1	82%	0.824	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-48.6	147.4	177.4	-77.3	-34.3	0	0	0	114.9
8	P	75.6	Confident	68.3	Low	113 Å²	113	136.7 Å²	136.7	73%	0.734	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-70.9	132.1	177.3	28.6	-33.7	0	0	0	112.8	V10	P8-V10 PolarHBondContact O-N 3.1Å
9	I	76.2	Confident	68.3	Low	148 Å²	148	134 Å²	134	76%	0.759	68%	0.681	S	S	*	*			trans	-71.2	113.3	178	-59.2	171.6	0	0	0	110.4
10	V	81.2	Confident	68.3	Low	146 Å²	146	129.4 Å²	129.4	89%	0.885	66%	0.658	S	S	*	*			trans	-80.2	-39.3	-179.4	179.9	0	0	0	0	113.4	P8	P8-V10 PolarHBondContact O-N 3.1Å
11	R	78.7	Confident	68.1	Low	182 Å²	182	133.6 Å²	133.6	69%	0.687	67%	0.668	S	S	*	*			trans	-158.1	129.1	-178.2	-178.2	179.8	-86.3	-178.9	-3.4	111.5	I13	R11-I13 HydrophobicContact CG-CG1 4.08Å
12	T	81.5	Confident	69.3	Low	122 Å²	122	130.7 Å²	130.7	75%	0.748	65%	0.651	S	S	*	*			trans	-93.3	124	170.3	-49.9	0	0	0	0	110.1
13	I	85.4	Confident	70.9	Confident	70 Å²	70	124.4 Å²	124.4	36%	0.359	63%	0.631	S	S	.	*			trans	-113.7	118	177.6	-60.3	175.2	0	0	0	108.6	R11 V15 F98 L103	R11-I13 HydrophobicContact CG-CG1 4.08Å; I13-V15 PolarHBondContact O-N 3.32Å; I13-F98 HydrophobicContact CD1-CE2 4.23Å; I13-F98 HydrophobicContact CG2-CE2 3.89Å; I13-L103 HydrophobicContact CG2-CB 4.07Å
14	P	85.5	Confident	72.5	Confident	68 Å²	68	121.8 Å²	121.8	44%	0.442	62%	0.623	S	S	.	*			trans	-68.4	131.5	175.5	28.2	-35.4	0	0	0	110.8	K101 T102 L103	P14-K101 WeakPolarHBondContact CD-O 3.31Å; P14-T102 HydrophobicContact CG-CG2 3.65Å; P14-L103 PolarHBondContact O-N 3.37Å
15	V	85.9	Confident	74	Confident	71 Å²	71	117.4 Å²	117.4	43%	0.43	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.3	128.7	179.1	-173.6	0	0	0	0	109.7	I13 F17 L103 V105	I13-V15 PolarHBondContact O-N 3.32Å; V15-F17 HydrophobicContact CG1-CE2 4.18Å; V15-F17 HydrophobicContact CG1-CZ 4.1Å; V15-L103 CarbonylContact C-O 3.34Å; V15-L103 WeakPolarHBondContact CA-O 3.43Å; V15-L103 HydrophobicContact CG1-CD2 4.42Å; V15-L103 HydrophobicContact CG2-CB 4.35Å; V15-L103 HydrophobicContact CG2-CD2 4.22Å; V15-V105 HydrophobicContact CG1-CG2 3.67Å
16	R	80.7	Confident	75.6	Confident	133 Å²	133	114 Å²	114	50%	0.502	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.7	125.6	177	-69.5	-179.4	179	172.4	3.1	110	L103 H104 V105	R16-L103 PolarHBondContact N-O 2.79Å; R16-H104 CarbonylContact O-C 3.57Å; R16-H104 WeakPolarHBondContact O-CA 3.35Å; R16-V105 PolarHBondContact O-N 2.72Å
17	F	80.2	Confident	76.9	Confident	147 Å²	147	108.6 Å²	108.6	65%	0.645	55%	0.552	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-91.5	131.1	176.5	-64.8	-82.3	0	0	0	110.8	V15 V105	V15-F17 HydrophobicContact CG1-CE2 4.18Å; V15-F17 HydrophobicContact CG1-CZ 4.1Å; F17-V105 WeakPolarHBondContact CA-O 3.44Å; F17-V105 HydrophobicContact CD1-CB 3.87Å; F17-V105 HydrophobicContact CD1-CG1 3.97Å; F17-V105 HydrophobicContact CE1-CB 4.07Å; F17-V105 HydrophobicContact CE1-CG1 4Å; F17-V105 HydrophobicContact CE1-CG2 4.42Å
18	H	74.7	Confident	77.6	Confident	27 Å²	27	104.4 Å²	104.4	13%	0.125	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	119.8	176.1	-64.4	-68.7	0	0	0	109.7	H104 V105 L213 N215	H18-H104 AromaticContact CD2-ND1 3.79Å; H18-H104 AromaticContact NE2-CE1 3.83Å; H18-H104 AromaticContact NE2-CG 3.7Å; H18-H104 AromaticContact NE2-ND1 2.98Å; H18-H104 PolarHBondContact NE2-ND1 3.05Å; H18-V105 PolarHBondContact N-O 3.3Å; H18-L213 PolarHBondContact CD2-O 3Å; H18-L213 VanDerWaalsContact CD2-O 3.25Å; H18-N215 PolarHBondContact CE1-N 2.9Å; H18-N215 PolarHBondContact CE1-O 3.49Å
19	V	69.2	Low	78.2	Confident	86 Å²	86	103.1 Å²	103.1	52%	0.521	51%	0.513	S	S	.	.			trans	-117.1	107.8	171.7	-177.1	0	0	0	0	106.8	Y21	V19-Y21 HydrophobicContact CG1-CD1 4.42Å; V19-Y21 HydrophobicContact CG1-CD2 4.49Å; V19-Y21 HydrophobicContact CG1-CE1 3.96Å; V19-Y21 HydrophobicContact CG1-CE2 4.03Å
20	D	67.8	Low	78.8	Confident	42 Å²	42	98.8 Å²	98.8	23%	0.225	49%	0.489	C	S	.	.			trans	-105.8	113.4	172.9	-161.5	-24.5	0	0	0	108.4	Q22 K23 N215	D20-Q22 PolarHBondContact O-N 3.16Å; D20-Q22 PolarHBondContact OD1-N 3.5Å; D20-Q22 VanDerWaalsContact OD1-N 3.08Å; D20-K23 HydrophobicContact CB-CB 4.48Å; D20-N215 PolarHBondContact OD2-ND2 3.33Å
21	Y	62.7	Low	78.9	Confident	217 Å²	217	95.7 Å²	95.7	85%	0.851	47%	0.472	S	S	*	.	S	Bend	trans	-75.6	-15.7	-179.3	-62.8	-81.1	0	0	0	112.5	V19	V19-Y21 HydrophobicContact CG1-CD1 4.42Å; V19-Y21 HydrophobicContact CG1-CD2 4.49Å; V19-Y21 HydrophobicContact CG1-CE1 3.96Å; V19-Y21 HydrophobicContact CG1-CE2 4.03Å
22	Q	65.6	Low	79	Confident	178 Å²	178	93.8 Å²	93.8	83%	0.832	47%	0.474	S	S	*	.	S	Bend	trans	-93.1	-19	-176.8	-65.2	-176.9	-17.6	0	0	113	D20	D20-Q22 PolarHBondContact O-N 3.16Å; D20-Q22 PolarHBondContact OD1-N 3.5Å; D20-Q22 VanDerWaalsContact OD1-N 3.08Å
23	K	69.7	Low	78.8	Confident	114 Å²	114	90.2 Å²	90.2	50%	0.496	46%	0.457	S	S	.	.			trans	-124.5	116.2	-175.7	-64.7	178.6	-177.4	173.3	0	110	D20	D20-K23 HydrophobicContact CB-CB 4.48Å
24	S	73.6	Confident	78.3	Confident	85 Å²	85	90.5 Å²	90.5	59%	0.594	47%	0.466	S	S	*	.			trans	-93.8	117.6	173.6	57.2	0	0	0	0	110.8	H26	S24-H26 WeakPolarHBondContact CB-NE2 3.4Å; S24-H26 PolarHBondContact O-CD2 3.09Å; S24-H26 PolarHBondContact OG-NE2 3.49Å
25	L	79.9	Confident	77.1	Confident	59 Å²	59	96.3 Å²	96.3	31%	0.309	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	126.7	174.5	-173.3	63.2	0	0	0	109.8	V95 T106 L108 G109 L213	L25-V95 HydrophobicContact CD2-CB 3.89Å; L25-V95 HydrophobicContact CD2-CG1 4.38Å; L25-V95 HydrophobicContact CD2-CG2 3.8Å; L25-T106 HydrophobicContact CD2-CG2 4.43Å; L25-L108 HydrophobicContact CB-CD2 4.16Å; L25-L108 HydrophobicContact CD2-CD2 3.82Å; L25-L108 HydrophobicContact CG-CD2 3.79Å; L25-G109 PolarHBondContact O-N 3.19Å; L25-L213 HydrophobicContact CD2-CD2 4.06Å
26	H	83.1	Confident	76	Confident	74 Å²	74	96.6 Å²	96.6	34%	0.343	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	138.6	176.8	-59.7	-68.7	0	0	0	110.3	S24 N110	S24-H26 WeakPolarHBondContact CB-NE2 3.4Å; S24-H26 PolarHBondContact O-CD2 3.09Å; S24-H26 PolarHBondContact OG-NE2 3.49Å; H26-N110 WeakPolarHBondContact CA-O 3.44Å; H26-N110 PolarHBondContact CE1-ND2 3.24Å; H26-N110 WeakPolarHBondContact ND1-CB 3.38Å; H26-N110 PolarHBondContact ND1-N 3.36Å; H26-N110 VanDerWaalsContact ND1-N 3.14Å
27	V	85.4	Confident	75.2	Confident	45 Å²	45	99.5 Å²	99.5	27%	0.273	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.5	176.3	173.4	0	0	0	0	108.7	Q29 V95 L108 N110 I111 I112	V27-Q29 HydrophobicContact CG1-CG 4.21Å; V27-V95 HydrophobicContact CG2-CG2 4.28Å; V27-L108 HydrophobicContact CG2-CD1 3.9Å; V27-L108 HydrophobicContact CG2-CD2 3.49Å; V27-L108 VanDerWaalsContact CG2-CD2 3.49Å; V27-L108 HydrophobicContact CG2-CG 4.36Å; V27-N110 PolarHBondContact N-O 3.27Å; V27-I111 HydrophobicContact CB-CG1 4.48Å; V27-I111 WeakPolarHBondContact O-CA 3.37Å; V27-I112 PolarHBondContact O-N 2.71Å
28	L	87.8	Confident	74.2	Confident	65 Å²	65	104.1 Å²	104.1	34%	0.34	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	123.8	175.2	-53.2	-176.5	0	0	0	108.6	F30 L54 L56 I112 M114	L28-F30 HydrophobicContact CB-CE2 4.05Å; L28-F30 HydrophobicContact CB-CZ 4.29Å; L28-L54 HydrophobicContact CD1-CD2 3.93Å; L28-L54 HydrophobicContact CD2-CD2 3.5Å; L28-L54 HydrophobicContact CG-CD2 4.39Å; L28-L56 HydrophobicContact CD1-CD1 4Å; L28-I112 HydrophobicContact CD2-CB 3.85Å; L28-I112 HydrophobicContact CD2-CD1 3.98Å; L28-I112 HydrophobicContact CD2-CG1 4.35Å; L28-I112 HydrophobicContact CD2-CG2 4.37Å; L28-M114 HydrophobicContact CB-CG 4.49Å
29	Q	87.6	Confident	73.7	Confident	87 Å²	87	110.1 Å²	110.1	41%	0.407	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109	136.1	176.3	-67.7	-179.8	-27.2	0	0	109.4	V27 P31 I111 I112 M113 M114	V27-Q29 HydrophobicContact CG1-CG 4.21Å; Q29-P31 WeakPolarHBondContact O-CD 3.5Å; Q29-I111 HydrophobicContact CG-CG2 4.45Å; Q29-I112 PolarHBondContact N-O 2.69Å; Q29-M113 HydrophobicContact CB-CG 4.41Å; Q29-M114 WeakPolarHBondContact O-CB 3.46Å; Q29-M114 PolarHBondContact O-N 3.15Å
30	F	87.6	Confident	73.7	Confident	57 Å²	57	109.1 Å²	109.1	25%	0.25	55%	0.552	C	S	.	*			trans	-117.2	85.6	178	-60.8	-86.5	0	0	0	109.4	L28 L32 A33 L56 F58 L80 M114	L28-F30 HydrophobicContact CB-CE2 4.05Å; L28-F30 HydrophobicContact CB-CZ 4.29Å; F30-L32 PolarHBondContact O-N 3.04Å; F30-L32 VanDerWaalsContact O-N 3.1Å; F30-A33 HydrophobicContact CB-CB 3.75Å; F30-A33 PolarHBondContact O-N 2.93Å; F30-A33 VanDerWaalsContact O-N 3.11Å; F30-L56 HydrophobicContact CE1-CD1 4.41Å; F30-L56 HydrophobicContact CZ-CD1 4.14Å; F30-F58 HydrophobicContact CE1-CE2 4.39Å; F30-F58 HydrophobicContact CE1-CZ 4.08Å; F30-F58 HydrophobicContact CZ-CZ 4.35Å; F30-L80 HydrophobicContact CD1-CD1 3.78Å; F30-L80 HydrophobicContact CE1-CD1 3.8Å; F30-M114 HydrophobicContact CD1-CB 3.62Å; F30-M114 HydrophobicContact CD1-CG 4.01Å; F30-M114 HydrophobicContact CE1-CB 3.66Å; F30-M114 HydrophobicContact CE1-CG 3.6Å; F30-M114 HydrophobicContact CG-CB 4.45Å; F30-M114 HydrophobicContact CZ-CG 4.01Å
31	P	83.7	Confident	74.2	Confident	81 Å²	81	110.3 Å²	110.3	53%	0.526	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.4	-23.1	-173.5	-23.7	34.5	0	0	0	114.5	Q29 M113 M114	Q29-P31 WeakPolarHBondContact O-CD 3.5Å; P31-M113 HydrophobicContact CG-SD 4.36Å; P31-M114 WeakPolarHBondContact CD-O 3.45Å
32	L	81.6	Confident	75.2	Confident	141 Å²	141	101.4 Å²	101.4	74%	0.738	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-4.1	-177.8	-58.4	178.6	0	0	0	113.3	F30 P116	F30-L32 PolarHBondContact O-N 3.04Å; F30-L32 VanDerWaalsContact O-N 3.1Å; L32-P116 HydrophobicContact CD1-CG 3.6Å
33	A	77.6	Confident	76	Confident	48 Å²	48	95.9 Å²	95.9	40%	0.397	51%	0.512	S	S	.	.	S	Bend	trans	-92.5	129.1	177.7	0	0	0	0	0	109.8	F30	F30-A33 HydrophobicContact CB-CB 3.75Å; F30-A33 PolarHBondContact O-N 2.93Å; F30-A33 VanDerWaalsContact O-N 3.11Å
34	S	74.1	Confident	76.7	Confident	76 Å²	76	96.5 Å²	96.5	53%	0.531	51%	0.511	S	S	.	.			trans	-74.9	137.3	173.5	54.1	0	0	0	0	111.1	G36 R37	S34-G36 PolarHBondContact O-N 3.43Å; S34-R37 PolarHBondContact O-N 3.36Å
35	L	61.5	Low	77.4	Confident	189 Å²	189	92.6 Å²	92.6	99%	0.99	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	104.4	170.1	-85	107.2	0	0	0	108.8
36	G	61.2	Low	77.8	Confident	77 Å²	77	90.3 Å²	90.3	79%	0.794	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	135.4	-13.3	179.6	0	0	0	0	0	114.9	S34 R38	S34-G36 PolarHBondContact O-N 3.43Å; G36-R38 PolarHBondContact O-N 2.85Å
37	R	65.6	Low	77.9	Confident	194 Å²	194	88.2 Å²	88.2	73%	0.732	46%	0.464	S	S	*	.	S	Bend	trans	-69	130.1	169	-81.5	-171.2	176.9	-138.4	0.3	109.7	S34 E39	S34-R37 PolarHBondContact O-N 3.36Å; R37-E39 PolarHBondContact O-N 3.42Å
38	R	58.7	Low	77.8	Confident	244 Å²	244	87.1 Å²	87.1	92%	0.921	46%	0.455	S	S	*	.			trans	-61.1	107.7	165.5	-79.2	-173	177	-174.2	0	107.6	G36 I40	G36-R38 PolarHBondContact O-N 2.85Å; R38-I40 PolarHBondContact O-N 3.21Å
39	E	63.3	Low	77	Confident	153 Å²	153	85.6 Å²	85.6	72%	0.715	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-67	119.1	-178.3	-66.5	-176.1	171.3	0	0	109.2	R37	R37-E39 PolarHBondContact O-N 3.42Å
40	I	70.2	Confident	76.1	Confident	66 Å²	66	88.5 Å²	88.5	34%	0.338	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-74.5	131.3	172.3	-60.6	167.9	0	0	0	106.8	R38 F58 P59 V61	R38-I40 PolarHBondContact O-N 3.21Å; I40-F58 WeakPolarHBondContact O-CD1 3.44Å; I40-F58 WeakPolarHBondContact O-CE1 3.29Å; I40-P59 HydrophobicContact CG2-CG 3.65Å; I40-V61 HydrophobicContact CD1-CG2 3.39Å
41	P	77.1	Confident	75.3	Confident	67 Å²	67	90.7 Å²	90.7	44%	0.435	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-56.4	138.7	177.2	22.5	-34.9	0	0	0	111.7	Y203	P41-Y203 WeakPolarHBondContact CA-OH 3.49Å; P41-Y203 HydrophobicContact CB-CE1 3.99Å; P41-Y203 HydrophobicContact CB-CE2 4.05Å; P41-Y203 WeakPolarHBondContact CB-OH 3.33Å
42	P	83.9	Confident	74.9	Confident	30 Å²	30	91 Å²	91	20%	0.195	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-62.6	140.3	171	20.6	-26.9	0	0	0	110.9	L56 H57 F58 I201 Y203	P42-L56 HydrophobicContact CB-CB 4.48Å; P42-H57 CarbonylContact C-O 3.48Å; P42-H57 WeakPolarHBondContact CA-O 3.48Å; P42-H57 VanDerWaalsContact CB-O 3.28Å; P42-H57 WeakPolarHBondContact CB-O 3.5Å; P42-F58 HydrophobicContact CB-CD1 4.25Å; P42-F58 HydrophobicContact CB-CE1 3.97Å; P42-F58 HydrophobicContact CB-CZ 4.13Å; P42-F58 HydrophobicContact CG-CE1 4.25Å; P42-F58 HydrophobicContact CG-CZ 4.43Å; P42-I201 HydrophobicContact CB-CD1 4.13Å; P42-I201 HydrophobicContact CG-CD1 3.96Å; P42-I201 WeakPolarHBondContact O-CD1 3.31Å; P42-Y203 WeakPolarHBondContact CD-OH 3.11Å
43	S	81.9	Confident	75	Confident	61 Å²	61	87 Å²	87	43%	0.427	45%	0.445	S	S	.	.	S	Bend	trans	-74.1	-37.2	175.7	59.2	0	0	0	0	111.8	H57 E77	S43-H57 PolarHBondContact N-O 3.12Å; S43-H57 WeakPolarHBondContact OG-CB 3.41Å; S43-H57 PolarHBondContact OG-O 3.31Å; S43-E77 PolarHBondContact OG-OE1 3.36Å
44	R	86.2	Confident	75.6	Confident	127 Å²	127	85.3 Å²	85.3	48%	0.479	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	144.9	-177.4	-171.3	174.2	67.9	179.1	0.8	111.5	H57	R44-H57 HydrophobicContact CB-CB 4.07Å; R44-H57 PolarHBondContact NH2-CE1 3.28Å; R44-H57 PolarHBondContact NH2-NE2 3.09Å; R44-H57 VanDerWaalsContact NH2-NE2 3.19Å; R44-H57 PolarHBondContact O-N 3.39Å
45	A	88.3	Confident	76.3	Confident	4 Å²	4	82.1 Å²	82.1	3%	0.033	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	132.3	174.9	0	0	0	0	0	110.8	E55 L56 L199 I201	A45-E55 CarbonylContact C-O 3.55Å; A45-E55 WeakPolarHBondContact CA-O 3.5Å; A45-L56 HydrophobicContact CB-CD2 3.51Å; A45-L199 HydrophobicContact CB-CB 3.87Å; A45-L199 HydrophobicContact CB-CD1 4.26Å; A45-L199 PolarHBondContact O-N 2.73Å; A45-I201 HydrophobicContact CB-CD1 3.99Å; A45-I201 HydrophobicContact CB-CG1 4.04Å
46	T	86.9	Confident	77.5	Confident	10 Å²	10	73.7 Å²	73.7	6%	0.061	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	126.6	-179.5	-52	0	0	0	0	109.9	Y48 E55 K196 W197	T46-Y48 HydrophobicContact CG2-CE2 3.94Å; T46-E55 PolarHBondContact N-O 3.18Å; T46-E55 PolarHBondContact O-N 3.02Å; T46-K196 HydrophobicContact CG2-CB 4.31Å; T46-W197 WeakPolarHBondContact CA-O 3.47Å
47	L	85.4	Confident	78.8	Confident	30 Å²	30	71 Å²	71	16%	0.157	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	133.6	176.7	-176	72.9	0	0	0	110.5	K53 L54 W197 L199	L47-K53 WeakPolarHBondContact CA-O 3.32Å; L47-L54 HydrophobicContact CB-CD1 4.48Å; L47-L54 HydrophobicContact CD1-CB 4.39Å; L47-L54 HydrophobicContact CD1-CD1 4.26Å; L47-W197 HydrophobicContact CB-CB 4.43Å; L47-W197 HydrophobicContact CD2-CE3 3.87Å; L47-W197 HydrophobicContact CD2-CZ3 4.3Å; L47-W197 PolarHBondContact N-O 3.4Å; L47-W197 PolarHBondContact O-N 3.46Å; L47-L199 HydrophobicContact CB-CD1 3.98Å; L47-L199 HydrophobicContact CB-CG 4.24Å
48	Y	83.6	Confident	79.7	Confident	22 Å²	22	63.4 Å²	63.4	9%	0.086	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	115.5	178.1	-64	-104.8	0	0	0	109.4	T46 K50 H52 K53 E55 E194 K196	T46-Y48 HydrophobicContact CG2-CE2 3.94Å; Y48-K50 PolarHBondContact O-N 3.31Å; Y48-H52 VanDerWaalsContact O-CA 3.24Å; Y48-H52 WeakPolarHBondContact O-CA 3.47Å; Y48-H52 PolarHBondContact O-N 3.35Å; Y48-K53 HydrophobicContact CD2-CB 4.14Å; Y48-K53 HydrophobicContact CD2-CD 4.24Å; Y48-K53 HydrophobicContact CD2-CG 4.37Å; Y48-K53 WeakPolarHBondContact CD2-O 3.47Å; Y48-K53 HydrophobicContact CG-CB 4.32Å; Y48-K53 PolarHBondContact N-O 2.98Å; Y48-E55 HydrophobicContact CD2-CG 4.25Å; Y48-E55 HydrophobicContact CE2-CB 4.39Å; Y48-E55 HydrophobicContact CE2-CG 3.54Å; Y48-E55 WeakPolarHBondContact CE2-OE2 3.38Å; Y48-E55 VanDerWaalsContact OH-CD 3.32Å; Y48-E55 PolarHBondContact OH-OE2 3.4Å; Y48-E194 VanDerWaalsContact CD1-OE2 3.23Å; Y48-E194 WeakPolarHBondContact CD1-OE2 3.21Å; Y48-K196 HydrophobicContact CD1-CG 4.21Å; Y48-K196 HydrophobicContact CE1-CD 4.11Å; Y48-K196 HydrophobicContact CE1-CG 4.12Å
49	A	71.7	Confident	80.8	Confident	33 Å²	33	54.2 Å²	54.2	27%	0.273	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-36.6	-167.1	0	0	0	0	0	114.8	K195 W197	A49-K195 HydrophobicContact CB-CB 4.23Å; A49-K195 WeakPolarHBondContact CB-O 3.35Å; A49-K195 PolarHBondContact N-O 3.29Å; A49-W197 HydrophobicContact CB-CZ2 4.4Å
50	K	67.3	Low	81.1	Confident	148 Å²	148	51.1 Å²	51.1	64%	0.643	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-40.2	-174.4	-169.8	179.1	179.5	-174.6	0	112.9	Y48	Y48-K50 PolarHBondContact O-N 3.31Å
51	H	70.8	Confident	80.7	Confident	104 Å²	104	51.8 Å²	51.8	48%	0.481	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-2.2	-174.3	-61.2	-60.8	0	0	0	113.4	K53 E194	H51-K53 HydrophobicContact CB-CB 4.41Å; H51-K53 PolarHBondContact O-N 3.16Å; H51-E194 IonicContact CD2-OE1 2.8Å; H51-E194 PolarHBondContact CD2-OE1 3.4Å; H51-E194 IonicContact NE2-OE1 3.41Å
52	H	76.4	Confident	79.7	Confident	86 Å²	86	53.6 Å²	53.6	40%	0.398	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	26.8	-170.1	-66	-70.7	0	0	0	113.1	Y48 L54 P84	Y48-H52 VanDerWaalsContact O-CA 3.24Å; Y48-H52 WeakPolarHBondContact O-CA 3.47Å; Y48-H52 PolarHBondContact O-N 3.35Å; H52-L54 PolarHBondContact O-N 3.01Å; H52-P84 HydrophobicContact CB-CG 3.72Å; H52-P84 VanDerWaalsContact O-CD 3.31Å; H52-P84 WeakPolarHBondContact O-CD 3.29Å
53	K	84.3	Confident	78	Confident	59 Å²	59	61.4 Å²	61.4	26%	0.257	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	129.8	177.2	-174.6	-168.6	-172.7	-163	0	108.2	L47 Y48 H51 E55 G82 I83	L47-K53 WeakPolarHBondContact CA-O 3.32Å; Y48-K53 HydrophobicContact CD2-CB 4.14Å; Y48-K53 HydrophobicContact CD2-CD 4.24Å; Y48-K53 HydrophobicContact CD2-CG 4.37Å; Y48-K53 WeakPolarHBondContact CD2-O 3.47Å; Y48-K53 HydrophobicContact CG-CB 4.32Å; Y48-K53 PolarHBondContact N-O 2.98Å; H51-K53 HydrophobicContact CB-CB 4.41Å; H51-K53 PolarHBondContact O-N 3.16Å; K53-E55 VanDerWaalsContact CE-OE1 3.23Å; K53-E55 WeakPolarHBondContact CE-OE1 3.2Å; K53-E55 IonicContact NZ-OE1 2.68Å; K53-E55 PolarHBondContact NZ-OE1 3.5Å; K53-G82 WeakPolarHBondContact CA-O 3.43Å; K53-I83 HydrophobicContact CG-CG1 4.18Å
54	L	88.2	Confident	76.3	Confident	12 Å²	12	68.3 Å²	68.3	6%	0.063	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	131.1	177.7	-177.8	67.7	0	0	0	109.5	L28 L47 H52 L56 T81 G82 I112 M114 L199	L28-L54 HydrophobicContact CD1-CD2 3.93Å; L28-L54 HydrophobicContact CD2-CD2 3.5Å; L28-L54 HydrophobicContact CG-CD2 4.39Å; L47-L54 HydrophobicContact CB-CD1 4.48Å; L47-L54 HydrophobicContact CD1-CB 4.39Å; L47-L54 HydrophobicContact CD1-CD1 4.26Å; H52-L54 PolarHBondContact O-N 3.01Å; L54-L56 HydrophobicContact CD1-CD2 4.34Å; L54-L56 HydrophobicContact CD2-CD1 4.49Å; L54-L56 HydrophobicContact CD2-CD2 4.35Å; L54-L56 HydrophobicContact CD2-CG 4.31Å; L54-L56 HydrophobicContact CG-CD2 4.28Å; L54-L56 HydrophobicContact CG-CG 4.3Å; L54-T81 WeakPolarHBondContact O-CA 3.48Å; L54-G82 PolarHBondContact N-O 3.42Å; L54-G82 PolarHBondContact O-N 3.15Å; L54-I112 HydrophobicContact CB-CD1 4.21Å; L54-I112 HydrophobicContact CD2-CD1 4.28Å; L54-M114 HydrophobicContact CD2-SD 4.26Å; L54-L199 HydrophobicContact CD1-CD1 3.73Å
55	E	88.9	Confident	74	Confident	8 Å²	8	68.2 Å²	68.2	4%	0.037	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	124.2	175.3	-54.8	-168.3	152.7	0	0	109	A45 T46 Y48 K53 L80 T81 K117	A45-E55 CarbonylContact C-O 3.55Å; A45-E55 WeakPolarHBondContact CA-O 3.5Å; T46-E55 PolarHBondContact N-O 3.18Å; T46-E55 PolarHBondContact O-N 3.02Å; Y48-E55 HydrophobicContact CD2-CG 4.25Å; Y48-E55 HydrophobicContact CE2-CB 4.39Å; Y48-E55 HydrophobicContact CE2-CG 3.54Å; Y48-E55 WeakPolarHBondContact CE2-OE2 3.38Å; Y48-E55 VanDerWaalsContact OH-CD 3.32Å; Y48-E55 PolarHBondContact OH-OE2 3.4Å; K53-E55 VanDerWaalsContact CE-OE1 3.23Å; K53-E55 WeakPolarHBondContact CE-OE1 3.2Å; K53-E55 IonicContact NZ-OE1 2.68Å; K53-E55 PolarHBondContact NZ-OE1 3.5Å; E55-L80 WeakPolarHBondContact CA-O 3.49Å; E55-T81 HydrophobicContact CB-CG2 4.06Å; E55-T81 HydrophobicContact CG-CG2 3.56Å; E55-K117 WeakPolarHBondContact OE1-CE 3.29Å; E55-K117 IonicContact OE1-NZ 3.18Å; E55-K117 PolarHBondContact OE1-NZ 3.38Å; E55-K117 IonicContact OE2-NZ 3.21Å; E55-K117 PolarHBondContact OE2-NZ 2.9Å
56	L	88.5	Confident	71.9	Confident	12 Å²	12	75.7 Å²	75.7	6%	0.063	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	128.8	178.2	-63.5	-176.8	0	0	0	109.4	L28 F30 P42 A45 L54 F58 C79 L80 M114	L28-L56 HydrophobicContact CD1-CD1 4Å; F30-L56 HydrophobicContact CE1-CD1 4.41Å; F30-L56 HydrophobicContact CZ-CD1 4.14Å; P42-L56 HydrophobicContact CB-CB 4.48Å; A45-L56 HydrophobicContact CB-CD2 3.51Å; L54-L56 HydrophobicContact CD1-CD2 4.34Å; L54-L56 HydrophobicContact CD2-CD1 4.49Å; L54-L56 HydrophobicContact CD2-CD2 4.35Å; L54-L56 HydrophobicContact CD2-CG 4.31Å; L54-L56 HydrophobicContact CG-CD2 4.28Å; L54-L56 HydrophobicContact CG-CG 4.3Å; L56-F58 HydrophobicContact CB-CD2 4.37Å; L56-F58 HydrophobicContact CB-CE2 3.59Å; L56-F58 HydrophobicContact CB-CZ 4.17Å; L56-F58 HydrophobicContact CD1-CE2 4.3Å; L56-F58 HydrophobicContact CD1-CZ 4.17Å; L56-C79 WeakPolarHBondContact O-CA 3.46Å; L56-L80 PolarHBondContact N-O 3.18Å; L56-L80 PolarHBondContact O-N 3.33Å; L56-M114 HydrophobicContact CB-CE 3.97Å; L56-M114 HydrophobicContact CD1-CE 3.88Å; L56-M114 HydrophobicContact CD1-SD 4.47Å; L56-M114 HydrophobicContact CG-CE 3.75Å
57	H	87.6	Confident	69.9	Low	21 Å²	21	82.9 Å²	82.9	10%	0.097	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	127.7	176.7	-70.8	-107.1	0	0	0	109.3	P42 S43 R44 E77	P42-H57 CarbonylContact C-O 3.48Å; P42-H57 WeakPolarHBondContact CA-O 3.48Å; P42-H57 VanDerWaalsContact CB-O 3.28Å; P42-H57 WeakPolarHBondContact CB-O 3.5Å; S43-H57 PolarHBondContact N-O 3.12Å; S43-H57 WeakPolarHBondContact OG-CB 3.41Å; S43-H57 PolarHBondContact OG-O 3.31Å; R44-H57 HydrophobicContact CB-CB 4.07Å; R44-H57 PolarHBondContact NH2-CE1 3.28Å; R44-H57 PolarHBondContact NH2-NE2 3.09Å; R44-H57 VanDerWaalsContact NH2-NE2 3.19Å; R44-H57 PolarHBondContact O-N 3.39Å; H57-E77 IonicContact CG-OE2 3.72Å; H57-E77 IonicContact ND1-OE2 3.85Å; H57-E77 PolarHBondContact ND1-OE2 2.94Å
58	F	84.6	Confident	67.9	Low	34 Å²	34	89.3 Å²	89.3	15%	0.149	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	135.4	177.6	-67.7	-90.2	0	0	0	109.7	F30 I40 P42 L56 E77 Q78 L80	F30-F58 HydrophobicContact CE1-CE2 4.39Å; F30-F58 HydrophobicContact CE1-CZ 4.08Å; F30-F58 HydrophobicContact CZ-CZ 4.35Å; I40-F58 WeakPolarHBondContact O-CD1 3.44Å; I40-F58 WeakPolarHBondContact O-CE1 3.29Å; P42-F58 HydrophobicContact CB-CD1 4.25Å; P42-F58 HydrophobicContact CB-CE1 3.97Å; P42-F58 HydrophobicContact CB-CZ 4.13Å; P42-F58 HydrophobicContact CG-CE1 4.25Å; P42-F58 HydrophobicContact CG-CZ 4.43Å; L56-F58 HydrophobicContact CB-CD2 4.37Å; L56-F58 HydrophobicContact CB-CE2 3.59Å; L56-F58 HydrophobicContact CB-CZ 4.17Å; L56-F58 HydrophobicContact CD1-CE2 4.3Å; L56-F58 HydrophobicContact CD1-CZ 4.17Å; F58-E77 CarbonylContact O-C 3.39Å; F58-E77 VanDerWaalsContact O-CA 3.28Å; F58-E77 WeakPolarHBondContact O-CA 3.47Å; F58-Q78 PolarHBondContact N-O 3.5Å; F58-Q78 PolarHBondContact O-N 3.41Å; F58-L80 HydrophobicContact CD2-CD1 3.93Å; F58-L80 HydrophobicContact CD2-CG 3.91Å; F58-L80 HydrophobicContact CE2-CB 4.2Å; F58-L80 HydrophobicContact CE2-CD1 3.52Å; F58-L80 HydrophobicContact CE2-CG 3.85Å; F58-L80 HydrophobicContact CZ-CD1 4.31Å
59	P	80.8	Confident	65.8	Low	51 Å²	51	97.5 Å²	97.5	33%	0.331	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	134.1	173.2	28.9	-31.9	0	0	0	109.7	I40	I40-P59 HydrophobicContact CG2-CG 3.65Å
60	M	70	Confident	64.4	Low	88 Å²	88	101.7 Å²	101.7	43%	0.433	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-82.1	124.7	172	-83.5	-167	-78.4	0	0	109.6	A62 R75 R76 Q78	M60-A62 PolarHBondContact O-N 3.39Å; M60-R75 HydrophobicContact CE-CB 3.5Å; M60-R75 WeakPolarHBondContact CE-O 3.48Å; M60-R76 PolarHBondContact N-O 2.9Å; M60-Q78 HydrophobicContact CG-CB 4.13Å
61	V	62.8	Low	63.2	Low	81 Å²	81	100.5 Å²	100.5	49%	0.491	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-79.7	116.9	171.2	-176.3	0	0	0	0	107.2	I40 R63	I40-V61 HydrophobicContact CD1-CG2 3.39Å; V61-R63 HydrophobicContact CB-CG 4.38Å; V61-R63 HydrophobicContact CG1-CG 3.85Å; V61-R63 PolarHBondContact O-N 2.9Å
62	A	55.9	Low	62	Low	104 Å²	104	101.9 Å²	101.9	86%	0.86	52%	0.515	S	S	*	.			trans	-57.2	105.2	170.5	0	0	0	0	0	108.5	M60	M60-A62 PolarHBondContact O-N 3.39Å
63	R	48.4	Very low	60.6	Low	194 Å²	194	106.5 Å²	106.5	73%	0.732	54%	0.537	S	S	*	.			trans	-125.8	114	173.1	-66.5	-162.9	-159.6	-174.2	5.1	108.5	V61	V61-R63 HydrophobicContact CB-CG 4.38Å; V61-R63 HydrophobicContact CG1-CG 3.85Å; V61-R63 PolarHBondContact O-N 2.9Å
64	Y	44.9	Very low	59	Low	207 Å²	207	110.9 Å²	110.9	81%	0.812	56%	0.561	S	S	*	*			trans	72.7	124.5	170.6	-67.6	-86.6	0	0	0	117.6
65	S	38.5	Very low	57.4	Low	124 Å²	124	116.9 Å²	116.9	87%	0.867	58%	0.583	S	S	*	*			trans	-111.7	29.5	-161	-29.9	0	0	0	0	111.9
66	E	44.4	Very low	56.3	Low	162 Å²	162	126.5 Å²	126.5	76%	0.757	62%	0.619	S	S	*	*			trans	-116.1	4.1	-163.2	-75	169.1	-179.1	0	0	115
67	L	45.3	Very low	55.5	Low	160 Å²	160	129.7 Å²	129.7	84%	0.838	63%	0.634	S	S	*	*	S	Bend	trans	-136.5	112.7	176	-67.7	169.5	0	0	0	110.6
68	E	42.8	Very low	55.1	Low	165 Å²	165	133 Å²	133	77%	0.771	65%	0.649	S	S	*	*			trans	91.2	102.7	154.5	-58.8	177.5	-178.2	0	0	118.4	E70	E68-E70 PolarHBondContact O-N 2.96Å; E68-E70 VanDerWaalsContact O-N 3.11Å
69	E	40.3	Very low	55.1	Low	194 Å²	194	132.6 Å²	132.6	91%	0.907	65%	0.65	S	S	*	*			trans	-62.9	85.2	160.1	-63.2	177	154.7	0	0	110.7
70	E	42.4	Very low	55.4	Low	121 Å²	121	131.2 Å²	131.2	57%	0.565	64%	0.64	S	S	*	*			trans	-140.7	141.2	168.4	-81.1	-68.1	160.1	0	0	109.2	E68 F72	E68-E70 PolarHBondContact O-N 2.96Å; E68-E70 VanDerWaalsContact O-N 3.11Å; E70-F72 HydrophobicContact CB-CD2 3.57Å; E70-F72 HydrophobicContact CB-CE1 4.22Å; E70-F72 HydrophobicContact CB-CE2 3.06Å; E70-F72 HydrophobicContact CB-CG 4.37Å; E70-F72 HydrophobicContact CB-CZ 3.41Å; E70-F72 VanDerWaalsContact CB-CZ 3.41Å; E70-F72 HydrophobicContact CG-CE2 3.85Å; E70-F72 HydrophobicContact CG-CZ 3.88Å; E70-F72 PolarHBondContact O-N 2.99Å
71	P	40.8	Very low	56.3	Low	123 Å²	123	128.1 Å²	128.1	80%	0.799	63%	0.626	S	S	*	*			trans	-78.2	68.7	-172.9	34.1	-32.6	0	0	0	109.7
72	F	45.9	Very low	57.4	Low	133 Å²	133	124.4 Å²	124.4	58%	0.583	60%	0.604	S	S	*	*			trans	-89.9	119.1	173.9	-57.1	-59.1	0	0	0	109.2	E70 I74	E70-F72 HydrophobicContact CB-CD2 3.57Å; E70-F72 HydrophobicContact CB-CE1 4.22Å; E70-F72 HydrophobicContact CB-CE2 3.06Å; E70-F72 HydrophobicContact CB-CG 4.37Å; E70-F72 HydrophobicContact CB-CZ 3.41Å; E70-F72 VanDerWaalsContact CB-CZ 3.41Å; E70-F72 HydrophobicContact CG-CE2 3.85Å; E70-F72 HydrophobicContact CG-CZ 3.88Å; E70-F72 PolarHBondContact O-N 2.99Å; F72-I74 PolarHBondContact O-N 3.32Å
73	E	47.8	Very low	58.7	Low	184 Å²	184	124.9 Å²	124.9	86%	0.86	59%	0.591	S	S	*	*			trans	-48.3	103	170	-152.6	168.8	-153.9	0	0	109.3	R75	E73-R75 PolarHBondContact O-N 3.33Å
74	I	50.6	Low	60.2	Low	151 Å²	151	116.3 Å²	116.3	77%	0.774	56%	0.56	S	S	*	*			trans	-58.6	102.2	-166.9	-58.8	167.6	0	0	0	108.9	F72 R76	F72-I74 PolarHBondContact O-N 3.32Å; I74-R76 PolarHBondContact O-N 2.86Å; I74-R76 VanDerWaalsContact O-N 3.12Å
75	R	54	Low	61.5	Low	138 Å²	138	111.6 Å²	111.6	52%	0.521	54%	0.544	S	S	.	.			trans	-64.8	116.7	173.6	-99.6	-174.7	171.9	-174.1	-6.4	108.5	M60 E73 P120	M60-R75 HydrophobicContact CE-CB 3.5Å; M60-R75 WeakPolarHBondContact CE-O 3.48Å; E73-R75 PolarHBondContact O-N 3.33Å; R75-P120 VanDerWaalsContact CZ-CD 3.41Å; R75-P120 VanDerWaalsContact NH2-CG 3.34Å
76	R	65	Low	62.3	Low	210 Å²	210	109 Å²	109	79%	0.792	54%	0.537	S	S	*	.			trans	-84.5	-15.5	176.1	-61.7	-177.1	-174.7	171.2	1.1	113.1	M60 I74	M60-R76 PolarHBondContact N-O 2.9Å; I74-R76 PolarHBondContact O-N 2.86Å; I74-R76 VanDerWaalsContact O-N 3.12Å
77	E	73.3	Confident	62.9	Low	78 Å²	78	103.6 Å²	103.6	36%	0.364	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	144.5	-175.2	-60.3	-168.9	149	0	0	113.1	S43 H57 F58	S43-E77 PolarHBondContact OG-OE1 3.36Å; H57-E77 IonicContact CG-OE2 3.72Å; H57-E77 IonicContact ND1-OE2 3.85Å; H57-E77 PolarHBondContact ND1-OE2 2.94Å; F58-E77 CarbonylContact O-C 3.39Å; F58-E77 VanDerWaalsContact O-CA 3.28Å; F58-E77 WeakPolarHBondContact O-CA 3.47Å
78	Q	79.3	Confident	63.3	Low	90 Å²	90	102.2 Å²	102.2	42%	0.421	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.1	170.3	-174.8	176.8	13.9	0	0	109.6	F58 M60 L80	F58-Q78 PolarHBondContact N-O 3.5Å; F58-Q78 PolarHBondContact O-N 3.41Å; M60-Q78 HydrophobicContact CG-CB 4.13Å; Q78-L80 HydrophobicContact CG-CD2 4.47Å
79	C	84.1	Confident	63.9	Low	26 Å²	26	98.9 Å²	98.9	18%	0.176	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	120.1	178.1	-172.7	0	0	0	0	110.6	L56 K117	L56-C79 WeakPolarHBondContact O-CA 3.46Å; C79-K117 HydrophobicContact CB-CD 4.38Å; C79-K117 PolarHBondContact O-N 3.1Å; C79-K117 VanDerWaalsContact O-N 3.12Å
80	L	87.5	Confident	65	Low	22 Å²	22	94.4 Å²	94.4	12%	0.115	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	136.5	168.6	-57.3	-172.2	0	0	0	109.2	F30 E55 L56 F58 Q78 M114 R115 P116	F30-L80 HydrophobicContact CD1-CD1 3.78Å; F30-L80 HydrophobicContact CE1-CD1 3.8Å; E55-L80 WeakPolarHBondContact CA-O 3.49Å; L56-L80 PolarHBondContact N-O 3.18Å; L56-L80 PolarHBondContact O-N 3.33Å; F58-L80 HydrophobicContact CD2-CD1 3.93Å; F58-L80 HydrophobicContact CD2-CG 3.91Å; F58-L80 HydrophobicContact CE2-CB 4.2Å; F58-L80 HydrophobicContact CE2-CD1 3.52Å; F58-L80 HydrophobicContact CE2-CG 3.85Å; F58-L80 HydrophobicContact CZ-CD1 4.31Å; Q78-L80 HydrophobicContact CG-CD2 4.47Å; L80-M114 VanDerWaalsContact C-CE 3.49Å; L80-M114 HydrophobicContact CB-CB 4.41Å; L80-M114 HydrophobicContact CB-CE 3.72Å; L80-M114 VanDerWaalsContact O-CE 3.22Å; L80-M114 WeakPolarHBondContact O-CE 3.41Å; L80-R115 CarbonylContact C-O 3.52Å; L80-R115 WeakPolarHBondContact CA-O 3.29Å; L80-P116 HydrophobicContact CD2-CB 4.01Å; L80-P116 HydrophobicContact CD2-CG 3.88Å
81	T	88.3	Confident	66	Low	24 Å²	24	94.4 Å²	94.4	15%	0.147	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	141.3	177.6	61.2	0	0	0	0	112.1	L54 E55 R115 K117	L54-T81 WeakPolarHBondContact O-CA 3.48Å; E55-T81 HydrophobicContact CB-CG2 4.06Å; E55-T81 HydrophobicContact CG-CG2 3.56Å; T81-R115 PolarHBondContact N-O 3.06Å; T81-R115 PolarHBondContact O-N 2.93Å; T81-R115 VanDerWaalsContact O-O 3.11Å; T81-K117 HydrophobicContact CG2-CD 3.52Å; T81-K117 HydrophobicContact CG2-CG 3.66Å
82	G	86.5	Confident	67.5	Low	3 Å²	3	92 Å²	92	3%	0.031	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	150.3	177.7	0	0	0	0	0	111.9	K53 L54 M113	K53-G82 WeakPolarHBondContact CA-O 3.43Å; L54-G82 PolarHBondContact N-O 3.42Å; L54-G82 PolarHBondContact O-N 3.15Å; G82-M113 WeakPolarHBondContact CA-O 3.47Å
83	I	83	Confident	69	Low	114 Å²	114	91.2 Å²	91.2	59%	0.585	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	137.7	172.6	-59	173.1	0	0	0	105.9	K53	K53-I83 HydrophobicContact CG-CG1 4.18Å
84	P	79.6	Confident	70.6	Confident	13 Å²	13	85.7 Å²	85.7	8%	0.084	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	144.8	178.4	28	-37.2	0	0	0	110.6	H52 G86 N110 I111 I112	H52-P84 HydrophobicContact CB-CG 3.72Å; H52-P84 VanDerWaalsContact O-CD 3.31Å; H52-P84 WeakPolarHBondContact O-CD 3.29Å; P84-G86 PolarHBondContact O-N 2.85Å; P84-G86 VanDerWaalsContact O-N 3.08Å; P84-N110 HydrophobicContact CB-CB 3.79Å; P84-I111 WeakPolarHBondContact CA-O 3.37Å; P84-I112 HydrophobicContact CB-CG1 4.09Å
85	F	72	Confident	72.2	Confident	108 Å²	108	80.5 Å²	80.5	47%	0.474	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-56.9	118.7	170.3	-85.4	-78.1	0	0	0	110.3	R90 I111 M113	F85-R90 PolarHBondContact O-NE 3.47Å; F85-R90 PolarHBondContact O-NH2 2.88Å; F85-I111 HydrophobicContact CD2-CG2 4.37Å; F85-I111 PolarHBondContact N-O 3.28Å; F85-M113 HydrophobicContact CD2-CG 4.29Å; F85-M113 HydrophobicContact CE1-CE 4.19Å; F85-M113 HydrophobicContact CE2-CE 3.8Å; F85-M113 HydrophobicContact CE2-CG 3.42Å; F85-M113 VanDerWaalsContact CE2-CG 3.42Å; F85-M113 HydrophobicContact CE2-SD 3.62Å; F85-M113 HydrophobicContact CZ-CE 3.32Å; F85-M113 HydrophobicContact CZ-CG 4.01Å; F85-M113 HydrophobicContact CZ-SD 3.62Å
86	G	56.1	Low	73.8	Confident	70 Å²	70	76.3 Å²	76.3	72%	0.722	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-80.8	126.6	168.9	0	0	0	0	0	109.4	P84	P84-G86 PolarHBondContact O-N 2.85Å; P84-G86 VanDerWaalsContact O-N 3.08Å
87	G	56.1	Low	74.8	Confident	48 Å²	48	69.6 Å²	69.6	50%	0.495	40%	0.399	S	S	.	.	S	Bend	trans	142.7	158.6	177.6	0	0	0	0	0	113.4	N89	G87-N89 PolarHBondContact O-N 3.01Å
88	V	53.8	Low	75.4	Confident	131 Å²	131	71.1 Å²	71.1	79%	0.794	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-55.4	-3.5	-174.2	-154.1	0	0	0	0	114.6	R90	V88-R90 PolarHBondContact O-N 3.25Å
89	N	55.2	Low	75.5	Confident	96 Å²	96	69.6 Å²	69.6	51%	0.513	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-74.8	-15.1	-177.1	-83	-10.8	0	0	0	115.2	G87 L91 C92 Y93	G87-N89 PolarHBondContact O-N 3.01Å; N89-L91 PolarHBondContact O-N 2.75Å; N89-C92 WeakPolarHBondContact O-CB 3.47Å; N89-C92 PolarHBondContact O-N 2.84Å; N89-Y93 HydrophobicContact CB-CD2 4.47Å; N89-Y93 HydrophobicContact CB-CE2 3.92Å; N89-Y93 WeakPolarHBondContact O-CD2 3.49Å
90	R	63.6	Low	75.5	Confident	99 Å²	99	78.9 Å²	78.9	37%	0.374	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-58.4	-35.8	179.8	-61.4	179.8	-172.3	-179.4	0.5	112.6	F85 V88 C92 N110	F85-R90 PolarHBondContact O-NE 3.47Å; F85-R90 PolarHBondContact O-NH2 2.88Å; V88-R90 PolarHBondContact O-N 3.25Å; R90-C92 PolarHBondContact O-N 3.28Å; R90-N110 PolarHBondContact NE-OD1 3.37Å; R90-N110 PolarHBondContact NH1-OD1 3.28Å
91	L	64.3	Low	75.3	Confident	122 Å²	122	85.3 Å²	85.3	64%	0.639	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-80.2	-1.3	-179.9	-60.9	175	0	0	0	113.9	N89	N89-L91 PolarHBondContact O-N 2.75Å
92	C	71.5	Confident	75.1	Confident	71 Å²	71	85.4 Å²	85.4	48%	0.48	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-103	-10.8	-178.6	-62.9	0	0	0	0	112.8	N89 R90	N89-C92 WeakPolarHBondContact O-CB 3.47Å; N89-C92 PolarHBondContact O-N 2.84Å; R90-C92 PolarHBondContact O-N 3.28Å
93	Y	78.3	Confident	75.2	Confident	118 Å²	118	87.8 Å²	87.8	46%	0.463	47%	0.467	S	S	.	.			trans	-116	139	-177.4	-61	-69.3	0	0	0	111.3	N89 I111	N89-Y93 HydrophobicContact CB-CD2 4.47Å; N89-Y93 HydrophobicContact CB-CE2 3.92Å; N89-Y93 WeakPolarHBondContact O-CD2 3.49Å; Y93-I111 HydrophobicContact CD2-CD1 3.44Å; Y93-I111 VanDerWaalsContact CD2-CD1 3.44Å; Y93-I111 HydrophobicContact CE2-CD1 4.03Å; Y93-I111 HydrophobicContact CG-CD1 3.78Å
94	S	81.2	Confident	75.3	Confident	67 Å²	67	82.9 Å²	82.9	47%	0.469	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	151.2	178.4	58.2	0	0	0	0	110	V105 T106	S94-V105 VanDerWaalsContact CB-CG1 3.49Å; S94-V105 WeakPolarHBondContact OG-CG1 3.18Å; S94-T106 WeakPolarHBondContact CA-O 3.35Å; S94-T106 WeakPolarHBondContact CB-O 3.37Å
95	V	84.4	Confident	75.5	Confident	43 Å²	43	83.1 Å²	83.1	26%	0.261	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	121.3	175.1	172.1	0	0	0	0	109.2	L25 V27 V105 T106 L108 L213	L25-V95 HydrophobicContact CD2-CB 3.89Å; L25-V95 HydrophobicContact CD2-CG1 4.38Å; L25-V95 HydrophobicContact CD2-CG2 3.8Å; V27-V95 HydrophobicContact CG2-CG2 4.28Å; V95-V105 WeakPolarHBondContact O-CA 3.36Å; V95-T106 PolarHBondContact N-O 3.3Å; V95-T106 PolarHBondContact O-N 3.26Å; V95-L108 HydrophobicContact CG2-CD1 4.09Å; V95-L108 HydrophobicContact CG2-CD2 3.57Å; V95-L108 HydrophobicContact CG2-CG 3.99Å; V95-L213 HydrophobicContact CG1-CD2 4.34Å
96	G	86	Confident	76	Confident	49 Å²	49	78.6 Å²	78.6	51%	0.505	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	117.6	173.8	0	0	0	0	0	111	H104	G96-H104 CarbonylContact C-O 3.57Å; G96-H104 WeakPolarHBondContact CA-O 3.39Å
97	Y	86.1	Confident	77.1	Confident	70 Å²	70	79 Å²	79	28%	0.275	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	114.7	174	-179.7	-110.3	0	0	0	110.1	K99 H104 L213 C214	Y97-K99 HydrophobicContact CD1-CB 4.04Å; Y97-K99 HydrophobicContact CE1-CB 3.59Å; Y97-K99 HydrophobicContact CE1-CD 3.7Å; Y97-K99 HydrophobicContact CE1-CG 4.21Å; Y97-H104 PolarHBondContact N-O 3.48Å; Y97-H104 WeakPolarHBondContact O-CB 3.46Å; Y97-H104 PolarHBondContact O-N 2.69Å; Y97-L213 HydrophobicContact CD1-CB 4.12Å; Y97-L213 HydrophobicContact CD2-CD1 3.83Å; Y97-L213 HydrophobicContact CE2-CD1 4.46Å; Y97-L213 HydrophobicContact CG-CB 4.08Å; Y97-L213 HydrophobicContact CG-CD1 3.91Å; Y97-C214 WeakPolarHBondContact CD1-SG 3.41Å; Y97-C214 VanDerWaalsContact CE1-SG 3.58Å
98	F	86.1	Confident	78.2	Confident	109 Å²	109	77.5 Å²	77.5	48%	0.478	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	109.9	-178	-170	-107.6	0	0	0	110.5	I13 L103	I13-F98 HydrophobicContact CD1-CE2 4.23Å; I13-F98 HydrophobicContact CG2-CE2 3.89Å; F98-L103 HydrophobicContact CD2-CB 4.45Å
99	K	82.7	Confident	79.3	Confident	59 Å²	59	72.5 Å²	72.5	26%	0.257	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	129.3	179.5	-179	169	173.1	-178.2	0	110.5	Y97 K101 T102	Y97-K99 HydrophobicContact CD1-CB 4.04Å; Y97-K99 HydrophobicContact CE1-CB 3.59Å; Y97-K99 HydrophobicContact CE1-CD 3.7Å; Y97-K99 HydrophobicContact CE1-CG 4.21Å; K99-K101 VanDerWaalsContact C-N 3.34Å; K99-K101 PolarHBondContact O-N 3.33Å; K99-T102 PolarHBondContact N-O 3.27Å; K99-T102 PolarHBondContact O-N 3.15Å; K99-T102 VanDerWaalsContact O-O 3.07Å; K99-T102 PolarHBondContact O-OG1 3.09Å
100	R	83	Confident	80.5	Confident	220 Å²	220	68.5 Å²	68.5	83%	0.83	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	48.7	175.3	-63.3	179.2	176.9	168.4	-3.2	113.4	T102	R100-T102 PolarHBondContact O-N 3.05Å
101	K	83.2	Confident	81.5	Confident	158 Å²	158	65 Å²	65	69%	0.687	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	13.8	-177.5	-53.1	178.7	178.7	177.7	0	114.9	P14 K99	P14-K101 WeakPolarHBondContact CD-O 3.31Å; K99-K101 VanDerWaalsContact C-N 3.34Å; K99-K101 PolarHBondContact O-N 3.33Å
102	T	84.9	Confident	82.6	Confident	25 Å²	25	59.6 Å²	59.6	15%	0.153	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	137.3	175.3	70.8	0	0	0	0	109.8	P14 K99 R100 H104	P14-T102 HydrophobicContact CG-CG2 3.65Å; K99-T102 PolarHBondContact N-O 3.27Å; K99-T102 PolarHBondContact O-N 3.15Å; K99-T102 VanDerWaalsContact O-O 3.07Å; K99-T102 PolarHBondContact O-OG1 3.09Å; R100-T102 PolarHBondContact O-N 3.05Å; T102-H104 PolarHBondContact OG1-NE2 2.94Å
103	L	87.6	Confident	83.3	Confident	53 Å²	53	58.4 Å²	58.4	28%	0.277	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	117.7	177.1	-179.3	64.5	0	0	0	109.1	I13 P14 V15 R16 F98 V105	I13-L103 HydrophobicContact CG2-CB 4.07Å; P14-L103 PolarHBondContact O-N 3.37Å; V15-L103 CarbonylContact C-O 3.34Å; V15-L103 WeakPolarHBondContact CA-O 3.43Å; V15-L103 HydrophobicContact CG1-CD2 4.42Å; V15-L103 HydrophobicContact CG2-CB 4.35Å; V15-L103 HydrophobicContact CG2-CD2 4.22Å; R16-L103 PolarHBondContact N-O 2.79Å; F98-L103 HydrophobicContact CD2-CB 4.45Å; L103-V105 HydrophobicContact CD2-CG2 4.25Å; L103-V105 HydrophobicContact CG-CG2 4.1Å
104	H	85	Confident	83.8	Confident	11 Å²	11	53 Å²	53	5%	0.051	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	123.3	174.4	-65.2	-71.8	0	0	0	109.5	R16 H18 G96 Y97 T102 C214	R16-H104 CarbonylContact O-C 3.57Å; R16-H104 WeakPolarHBondContact O-CA 3.35Å; H18-H104 AromaticContact CD2-ND1 3.79Å; H18-H104 AromaticContact NE2-CE1 3.83Å; H18-H104 AromaticContact NE2-CG 3.7Å; H18-H104 AromaticContact NE2-ND1 2.98Å; H18-H104 PolarHBondContact NE2-ND1 3.05Å; G96-H104 CarbonylContact C-O 3.57Å; G96-H104 WeakPolarHBondContact CA-O 3.39Å; Y97-H104 PolarHBondContact N-O 3.48Å; Y97-H104 WeakPolarHBondContact O-CB 3.46Å; Y97-H104 PolarHBondContact O-N 2.69Å; T102-H104 PolarHBondContact OG1-NE2 2.94Å; H104-C214 PolarHBondContact CD2-SG 2.83Å
105	V	85.3	Confident	84	Confident	18 Å²	18	57.2 Å²	57.2	11%	0.109	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	117.1	-177.6	-179	0	0	0	0	109	V15 R16 F17 H18 S94 V95 L103	V15-V105 HydrophobicContact CG1-CG2 3.67Å; R16-V105 PolarHBondContact O-N 2.72Å; F17-V105 WeakPolarHBondContact CA-O 3.44Å; F17-V105 HydrophobicContact CD1-CB 3.87Å; F17-V105 HydrophobicContact CD1-CG1 3.97Å; F17-V105 HydrophobicContact CE1-CB 4.07Å; F17-V105 HydrophobicContact CE1-CG1 4Å; F17-V105 HydrophobicContact CE1-CG2 4.42Å; H18-V105 PolarHBondContact N-O 3.3Å; S94-V105 VanDerWaalsContact CB-CG1 3.49Å; S94-V105 WeakPolarHBondContact OG-CG1 3.18Å; V95-V105 WeakPolarHBondContact O-CA 3.36Å; L103-V105 HydrophobicContact CD2-CG2 4.25Å; L103-V105 HydrophobicContact CG-CG2 4.1Å
106	T	81.5	Confident	84.1	Confident	13 Å²	13	57.8 Å²	57.8	8%	0.08	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	134.4	179.3	-54.9	0	0	0	0	110.2	L25 S94 V95 L213	L25-T106 HydrophobicContact CD2-CG2 4.43Å; S94-T106 WeakPolarHBondContact CA-O 3.35Å; S94-T106 WeakPolarHBondContact CB-O 3.37Å; V95-T106 PolarHBondContact N-O 3.3Å; V95-T106 PolarHBondContact O-N 3.26Å; T106-L213 PolarHBondContact OG1-O 3.01Å
107	N	80.1	Confident	83.6	Confident	79 Å²	79	59.2 Å²	59.2	42%	0.422	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	146.1	-179	-166.3	12.4	0	0	0	112
108	L	79.1	Confident	82.6	Confident	16 Å²	16	59.8 Å²	59.8	8%	0.084	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	135.8	177.4	-74.6	176	0	0	0	111.5	L25 V27 V95 I111	L25-L108 HydrophobicContact CB-CD2 4.16Å; L25-L108 HydrophobicContact CD2-CD2 3.82Å; L25-L108 HydrophobicContact CG-CD2 3.79Å; V27-L108 HydrophobicContact CG2-CD1 3.9Å; V27-L108 HydrophobicContact CG2-CD2 3.49Å; V27-L108 VanDerWaalsContact CG2-CD2 3.49Å; V27-L108 HydrophobicContact CG2-CG 4.36Å; V95-L108 HydrophobicContact CG2-CD1 4.09Å; V95-L108 HydrophobicContact CG2-CD2 3.57Å; V95-L108 HydrophobicContact CG2-CG 3.99Å; L108-I111 HydrophobicContact CD1-CG1 4.41Å
109	G	77.4	Confident	81.1	Confident	26 Å²	26	56.9 Å²	56.9	27%	0.268	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	-60.1	172.2	0	0	0	0	0	111.5	L25	L25-G109 PolarHBondContact O-N 3.19Å
110	N	79.4	Confident	79.9	Confident	12 Å²	12	56.6 Å²	56.6	6%	0.064	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	151.3	179.5	-63.3	-50.9	0	0	0	111.9	H26 V27 P84 R90 I112	H26-N110 WeakPolarHBondContact CA-O 3.44Å; H26-N110 PolarHBondContact CE1-ND2 3.24Å; H26-N110 WeakPolarHBondContact ND1-CB 3.38Å; H26-N110 PolarHBondContact ND1-N 3.36Å; H26-N110 VanDerWaalsContact ND1-N 3.14Å; V27-N110 PolarHBondContact N-O 3.27Å; P84-N110 HydrophobicContact CB-CB 3.79Å; R90-N110 PolarHBondContact NE-OD1 3.37Å; R90-N110 PolarHBondContact NH1-OD1 3.28Å; N110-I112 HydrophobicContact CB-CG1 4.35Å
111	I	84.5	Confident	78.6	Confident	27 Å²	27	53 Å²	53	14%	0.138	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	121.6	167.4	-56.1	172.9	0	0	0	106.9	V27 Q29 P84 F85 Y93 L108	V27-I111 HydrophobicContact CB-CG1 4.48Å; V27-I111 WeakPolarHBondContact O-CA 3.37Å; Q29-I111 HydrophobicContact CG-CG2 4.45Å; P84-I111 WeakPolarHBondContact CA-O 3.37Å; F85-I111 HydrophobicContact CD2-CG2 4.37Å; F85-I111 PolarHBondContact N-O 3.28Å; Y93-I111 HydrophobicContact CD2-CD1 3.44Å; Y93-I111 VanDerWaalsContact CD2-CD1 3.44Å; Y93-I111 HydrophobicContact CE2-CD1 4.03Å; Y93-I111 HydrophobicContact CG-CD1 3.78Å; L108-I111 HydrophobicContact CD1-CG1 4.41Å
112	I	86.7	Confident	77.3	Confident	7 Å²	7	51.2 Å²	51.2	4%	0.036	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	122.9	-174.4	-57.8	173.4	0	0	0	108.4	V27 L28 Q29 L54 P84 N110 M114	V27-I112 PolarHBondContact O-N 2.71Å; L28-I112 HydrophobicContact CD2-CB 3.85Å; L28-I112 HydrophobicContact CD2-CD1 3.98Å; L28-I112 HydrophobicContact CD2-CG1 4.35Å; L28-I112 HydrophobicContact CD2-CG2 4.37Å; Q29-I112 PolarHBondContact N-O 2.69Å; L54-I112 HydrophobicContact CB-CD1 4.21Å; L54-I112 HydrophobicContact CD2-CD1 4.28Å; P84-I112 HydrophobicContact CB-CG1 4.09Å; N110-I112 HydrophobicContact CB-CG1 4.35Å; I112-M114 HydrophobicContact CG2-SD 3.86Å
113	M	87.7	Confident	76	Confident	47 Å²	47	52.3 Å²	52.3	23%	0.232	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	119.2	169.7	-65.9	-158.4	-55.6	0	0	110.1	Q29 P31 G82 F85	Q29-M113 HydrophobicContact CB-CG 4.41Å; P31-M113 HydrophobicContact CG-SD 4.36Å; G82-M113 WeakPolarHBondContact CA-O 3.47Å; F85-M113 HydrophobicContact CD2-CG 4.29Å; F85-M113 HydrophobicContact CE1-CE 4.19Å; F85-M113 HydrophobicContact CE2-CE 3.8Å; F85-M113 HydrophobicContact CE2-CG 3.42Å; F85-M113 VanDerWaalsContact CE2-CG 3.42Å; F85-M113 HydrophobicContact CE2-SD 3.62Å; F85-M113 HydrophobicContact CZ-CE 3.32Å; F85-M113 HydrophobicContact CZ-CG 4.01Å; F85-M113 HydrophobicContact CZ-SD 3.62Å
114	M	87.9	Confident	74.6	Confident	4 Å²	4	56.1 Å²	56.1	2%	0.02	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	125.7	177.5	-61.3	-57.6	-60.7	0	0	109.6	L28 Q29 F30 P31 L54 L56 L80 I112	L28-M114 HydrophobicContact CB-CG 4.49Å; Q29-M114 WeakPolarHBondContact O-CB 3.46Å; Q29-M114 PolarHBondContact O-N 3.15Å; F30-M114 HydrophobicContact CD1-CB 3.62Å; F30-M114 HydrophobicContact CD1-CG 4.01Å; F30-M114 HydrophobicContact CE1-CB 3.66Å; F30-M114 HydrophobicContact CE1-CG 3.6Å; F30-M114 HydrophobicContact CG-CB 4.45Å; F30-M114 HydrophobicContact CZ-CG 4.01Å; P31-M114 WeakPolarHBondContact CD-O 3.45Å; L54-M114 HydrophobicContact CD2-SD 4.26Å; L56-M114 HydrophobicContact CB-CE 3.97Å; L56-M114 HydrophobicContact CD1-CE 3.88Å; L56-M114 HydrophobicContact CD1-SD 4.47Å; L56-M114 HydrophobicContact CG-CE 3.75Å; L80-M114 VanDerWaalsContact C-CE 3.49Å; L80-M114 HydrophobicContact CB-CB 4.41Å; L80-M114 HydrophobicContact CB-CE 3.72Å; L80-M114 VanDerWaalsContact O-CE 3.22Å; L80-M114 WeakPolarHBondContact O-CE 3.41Å; I112-M114 HydrophobicContact CG2-SD 3.86Å
115	R	85.9	Confident	73.5	Confident	156 Å²	156	63 Å²	63	59%	0.589	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	145.5	175.8	-66.3	-174.4	178.4	176.5	-1.1	110.3	L80 T81 K117	L80-R115 CarbonylContact C-O 3.52Å; L80-R115 WeakPolarHBondContact CA-O 3.29Å; T81-R115 PolarHBondContact N-O 3.06Å; T81-R115 PolarHBondContact O-N 2.93Å; T81-R115 VanDerWaalsContact O-O 3.11Å; R115-K117 PolarHBondContact O-N 3.01Å
116	P	85.2	Confident	72.3	Confident	55 Å²	55	68.4 Å²	68.4	36%	0.357	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	134.1	170.6	-19.8	31.4	0	0	0	110	L32 L80	L32-P116 HydrophobicContact CD1-CG 3.6Å; L80-P116 HydrophobicContact CD2-CB 4.01Å; L80-P116 HydrophobicContact CD2-CG 3.88Å
117	K	77.3	Confident	71.3	Confident	79 Å²	79	72 Å²	72	34%	0.343	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-62	135.5	166	-106.7	169.3	176.1	162.1	0	108.4	E55 C79 T81 R115 S119	E55-K117 WeakPolarHBondContact OE1-CE 3.29Å; E55-K117 IonicContact OE1-NZ 3.18Å; E55-K117 PolarHBondContact OE1-NZ 3.38Å; E55-K117 IonicContact OE2-NZ 3.21Å; E55-K117 PolarHBondContact OE2-NZ 2.9Å; C79-K117 HydrophobicContact CB-CD 4.38Å; C79-K117 PolarHBondContact O-N 3.1Å; C79-K117 VanDerWaalsContact O-N 3.12Å; T81-K117 HydrophobicContact CG2-CD 3.52Å; T81-K117 HydrophobicContact CG2-CG 3.66Å; R115-K117 PolarHBondContact O-N 3.01Å; K117-S119 PolarHBondContact O-N 3.31Å
118	P	63.9	Low	70.6	Confident	81 Å²	81	74.6 Å²	74.6	53%	0.526	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-55.8	142.1	169.5	23.9	-30.6	0	0	0	109.1	E122	P118-E122 HydrophobicContact CB-CG 4.38Å; P118-E122 WeakPolarHBondContact CB-OE2 3.47Å; P118-E122 WeakPolarHBondContact CG-OE2 3.01Å
119	S	55.2	Low	69.8	Low	49 Å²	49	77.3 Å²	77.3	34%	0.343	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-66.2	167.4	-169.8	79.9	0	0	0	0	110.6	K117 F121 E122	K117-S119 PolarHBondContact O-N 3.31Å; S119-F121 PolarHBondContact O-N 3.11Å; S119-F121 WeakPolarHBondContact OG-CB 3.48Å; S119-F121 VanDerWaalsContact OG-CD2 3.3Å; S119-F121 WeakPolarHBondContact OG-CD2 3.41Å; S119-F121 PolarHBondContact OG-N 3.45Å; S119-E122 PolarHBondContact O-N 2.86Å; S119-E122 VanDerWaalsContact O-N 3.12Å
120	P	57.8	Low	68.9	Low	52 Å²	52	82.2 Å²	82.2	34%	0.338	41%	0.413	S	S	.	.	H	α-helix	trans	-67.4	0.4	179.4	31	-19.6	0	0	0	111.4	R75 E122 A123 K124	R75-P120 VanDerWaalsContact CZ-CD 3.41Å; R75-P120 VanDerWaalsContact NH2-CG 3.34Å; P120-E122 VanDerWaalsContact C-N 3.3Å; P120-A123 PolarHBondContact O-N 3.35Å; P120-K124 VanDerWaalsContact O-CB 3.3Å; P120-K124 WeakPolarHBondContact O-CB 3.33Å; P120-K124 WeakPolarHBondContact O-CG 3.46Å; P120-K124 PolarHBondContact O-N 2.96Å
121	F	54.9	Low	67.9	Low	146 Å²	146	88.1 Å²	88.1	64%	0.64	44%	0.44	S	S	*	.	H	α-helix	trans	-61.1	-38.4	167.6	-82.8	-93.2	0	0	0	111.8	S119 K124 K125	S119-F121 PolarHBondContact O-N 3.11Å; S119-F121 WeakPolarHBondContact OG-CB 3.48Å; S119-F121 VanDerWaalsContact OG-CD2 3.3Å; S119-F121 WeakPolarHBondContact OG-CD2 3.41Å; S119-F121 PolarHBondContact OG-N 3.45Å; F121-K124 PolarHBondContact O-N 3.2Å; F121-K125 WeakPolarHBondContact O-CB 3.44Å; F121-K125 PolarHBondContact O-N 3.36Å
122	E	56.9	Low	66.5	Low	119 Å²	119	88.5 Å²	88.5	56%	0.556	45%	0.45	S	S	*	.	H	α-helix	trans	-68	-43.1	174.4	-79.4	-175.3	175.4	0	0	110.9	P118 S119 P120 K124 K125 Q126	P118-E122 HydrophobicContact CB-CG 4.38Å; P118-E122 WeakPolarHBondContact CB-OE2 3.47Å; P118-E122 WeakPolarHBondContact CG-OE2 3.01Å; S119-E122 PolarHBondContact O-N 2.86Å; S119-E122 VanDerWaalsContact O-N 3.12Å; P120-E122 VanDerWaalsContact C-N 3.3Å; E122-K124 PolarHBondContact O-N 2.7Å; E122-K125 PolarHBondContact O-N 2.87Å; E122-Q126 VanDerWaalsContact O-CB 3.22Å; E122-Q126 WeakPolarHBondContact O-CB 3.5Å; E122-Q126 PolarHBondContact O-N 3.19Å
123	A	57.6	Low	65	Low	48 Å²	48	90.6 Å²	90.6	40%	0.397	47%	0.468	S	S	.	.	H	α-helix	trans	-62.7	-41.2	175.4	0	0	0	0	0	112.3	P120 Q126 N127	P120-A123 PolarHBondContact O-N 3.35Å; A123-Q126 PolarHBondContact O-N 2.92Å; A123-N127 WeakPolarHBondContact O-CB 3.1Å; A123-N127 PolarHBondContact O-N 3.39Å; A123-N127 PolarHBondContact O-OD1 3.29Å
124	K	57.8	Low	63.3	Low	134 Å²	134	91.4 Å²	91.4	58%	0.583	48%	0.479	S	S	*	.	H	α-helix	trans	-67.3	-40.5	175.2	-77.9	-176.2	178	-174.5	0	111.8	P120 F121 E122 N127 Q128	P120-K124 VanDerWaalsContact O-CB 3.3Å; P120-K124 WeakPolarHBondContact O-CB 3.33Å; P120-K124 WeakPolarHBondContact O-CG 3.46Å; P120-K124 PolarHBondContact O-N 2.96Å; F121-K124 PolarHBondContact O-N 3.2Å; E122-K124 PolarHBondContact O-N 2.7Å; K124-N127 PolarHBondContact O-N 3.49Å; K124-Q128 WeakPolarHBondContact O-CB 3.19Å; K124-Q128 WeakPolarHBondContact O-CG 3.4Å; K124-Q128 PolarHBondContact O-N 2.87Å
125	K	62.3	Low	61.6	Low	155 Å²	155	94.8 Å²	94.8	67%	0.674	50%	0.503	S	S	*	.	H	α-helix	trans	-68.3	-36.3	177.3	-164.1	175.3	-174.3	179.4	0	111.6	F121 E122 S129	F121-K125 WeakPolarHBondContact O-CB 3.44Å; F121-K125 PolarHBondContact O-N 3.36Å; E122-K125 PolarHBondContact O-N 2.87Å; K125-S129 WeakPolarHBondContact O-CB 3.39Å; K125-S129 PolarHBondContact O-N 3.17Å; K125-S129 PolarHBondContact O-OG 3.34Å
126	Q	60.2	Low	60.1	Low	131 Å²	131	92.7 Å²	92.7	61%	0.612	50%	0.503	S	S	*	.	H	α-helix	trans	-69.7	-39.6	174.5	-158.3	169.4	20.8	0	0	111.5	E122 A123 S129 Q130	E122-Q126 VanDerWaalsContact O-CB 3.22Å; E122-Q126 WeakPolarHBondContact O-CB 3.5Å; E122-Q126 PolarHBondContact O-N 3.19Å; A123-Q126 PolarHBondContact O-N 2.92Å; Q126-S129 WeakPolarHBondContact CA-OG 3.27Å; Q126-S129 PolarHBondContact O-N 3.03Å; Q126-S129 PolarHBondContact O-OG 3.37Å; Q126-Q130 WeakPolarHBondContact O-CB 3.42Å; Q126-Q130 PolarHBondContact O-N 2.89Å
127	N	60.7	Low	58.5	Low	90 Å²	90	96.1 Å²	96.1	48%	0.481	52%	0.517	S	S	.	.	H	α-helix	trans	-65.7	-44.7	172.3	-71.2	-5.3	0	0	0	111.9	A123 K124 S129 Q130 E131	A123-N127 WeakPolarHBondContact O-CB 3.1Å; A123-N127 PolarHBondContact O-N 3.39Å; A123-N127 PolarHBondContact O-OD1 3.29Å; K124-N127 PolarHBondContact O-N 3.49Å; N127-S129 VanDerWaalsContact C-N 3.34Å; N127-S129 PolarHBondContact O-N 3.16Å; N127-Q130 PolarHBondContact O-N 3.28Å; N127-E131 WeakPolarHBondContact O-CG 3.21Å; N127-E131 PolarHBondContact O-N 2.98Å
128	Q	63.9	Low	57.4	Low	132 Å²	132	98.2 Å²	98.2	62%	0.617	53%	0.531	S	S	*	.	H	α-helix	trans	-63.8	-36.7	176.8	-79.4	177.1	-8	0	0	112.7	K124 E131 G132	K124-Q128 WeakPolarHBondContact O-CB 3.19Å; K124-Q128 WeakPolarHBondContact O-CG 3.4Å; K124-Q128 PolarHBondContact O-N 2.87Å; Q128-E131 PolarHBondContact O-N 2.89Å; Q128-G132 PolarHBondContact O-N 3.2Å
129	S	62.5	Low	56.7	Low	74 Å²	74	96.7 Å²	96.7	52%	0.517	52%	0.523	S	S	.	.	H	α-helix	trans	-73.9	-30.7	175.6	40.6	0	0	0	0	112.6	K125 Q126 N127 A133	K125-S129 WeakPolarHBondContact O-CB 3.39Å; K125-S129 PolarHBondContact O-N 3.17Å; K125-S129 PolarHBondContact O-OG 3.34Å; Q126-S129 WeakPolarHBondContact CA-OG 3.27Å; Q126-S129 PolarHBondContact O-N 3.03Å; Q126-S129 PolarHBondContact O-OG 3.37Å; N127-S129 VanDerWaalsContact C-N 3.34Å; N127-S129 PolarHBondContact O-N 3.16Å; S129-A133 VanDerWaalsContact O-CB 3.25Å; S129-A133 WeakPolarHBondContact O-CB 3.42Å; S129-A133 PolarHBondContact O-N 2.96Å
130	Q	59	Low	56.2	Low	129 Å²	129	98.8 Å²	98.8	60%	0.603	53%	0.53	S	S	*	.	H	α-helix	trans	-70.3	-38.4	168.9	-89.1	-176.6	-21.5	0	0	113.1	Q126 N127 S134	Q126-Q130 WeakPolarHBondContact O-CB 3.42Å; Q126-Q130 PolarHBondContact O-N 2.89Å; N127-Q130 PolarHBondContact O-N 3.28Å; Q130-S134 VanDerWaalsContact O-CB 3.26Å; Q130-S134 WeakPolarHBondContact O-CB 3.34Å; Q130-S134 PolarHBondContact O-N 3.44Å; Q130-S134 PolarHBondContact O-OG 3.44Å
131	E	57.7	Low	55.6	Low	136 Å²	136	99.1 Å²	99.1	64%	0.636	54%	0.537	S	S	*	.	H	α-helix	trans	-67.5	-42.2	174.6	-77.6	179.6	167.4	0	0	111.5	N127 Q128 S134 S135	N127-E131 WeakPolarHBondContact O-CG 3.21Å; N127-E131 PolarHBondContact O-N 2.98Å; Q128-E131 PolarHBondContact O-N 2.89Å; E131-S134 PolarHBondContact O-N 2.73Å; E131-S135 VanDerWaalsContact O-CB 3.28Å; E131-S135 WeakPolarHBondContact O-CB 3.5Å; E131-S135 PolarHBondContact O-N 3.15Å
132	G	56.1	Low	55.2	Low	34 Å²	34	95.2 Å²	95.2	35%	0.351	53%	0.532	S	S	.	.	H	α-helix	trans	-64.2	-41.3	174	0	0	0	0	0	113.2	Q128 S135 L136	Q128-G132 PolarHBondContact O-N 3.2Å; G132-S135 PolarHBondContact O-N 3.39Å; G132-L136 PolarHBondContact O-N 3.47Å
133	A	54.4	Low	54.7	Low	51 Å²	51	99 Å²	99	42%	0.421	54%	0.541	S	S	.	.	H	α-helix	trans	-67.4	-36.4	174.2	0	0	0	0	0	112.3	S129 L137	S129-A133 VanDerWaalsContact O-CB 3.25Å; S129-A133 WeakPolarHBondContact O-CB 3.42Å; S129-A133 PolarHBondContact O-N 2.96Å; A133-L137 VanDerWaalsContact O-CG 3.25Å; A133-L137 WeakPolarHBondContact O-CG 3.39Å; A133-L137 PolarHBondContact O-N 3.49Å; A133-L137 VanDerWaalsContact O-N 3.15Å
134	S	52.9	Low	53.9	Low	65 Å²	65	105.3 Å²	105.3	46%	0.455	56%	0.562	S	S	.	*	H	α-helix	trans	-71.7	-34.9	175.7	-58.9	0	0	0	0	111.9	Q130 E131 L137 L138	Q130-S134 VanDerWaalsContact O-CB 3.26Å; Q130-S134 WeakPolarHBondContact O-CB 3.34Å; Q130-S134 PolarHBondContact O-N 3.44Å; Q130-S134 PolarHBondContact O-OG 3.44Å; E131-S134 PolarHBondContact O-N 2.73Å; S134-L137 PolarHBondContact O-N 3.41Å; S134-L138 WeakPolarHBondContact O-CB 3.24Å; S134-L138 WeakPolarHBondContact O-CD1 3.35Å; S134-L138 VanDerWaalsContact O-CG 3.28Å; S134-L138 WeakPolarHBondContact O-CG 3.31Å; S134-L138 PolarHBondContact O-N 2.96Å
135	S	51.9	Low	53.3	Low	74 Å²	74	103.6 Å²	103.6	52%	0.517	57%	0.567	S	S	.	*	H	α-helix	trans	-65.9	-40.5	173.7	168.2	0	0	0	0	112.4	E131 G132 L138 S139	E131-S135 VanDerWaalsContact O-CB 3.28Å; E131-S135 WeakPolarHBondContact O-CB 3.5Å; E131-S135 PolarHBondContact O-N 3.15Å; G132-S135 PolarHBondContact O-N 3.39Å; S135-L138 PolarHBondContact O-N 3.26Å; S135-S139 PolarHBondContact O-N 3.35Å; S135-S139 PolarHBondContact O-OG 3.31Å
136	L	55.1	Low	52.3	Low	112 Å²	112	100.1 Å²	100.1	59%	0.586	57%	0.568	S	S	*	*	H	α-helix	trans	-65.6	-40.8	174.8	-80.2	164.6	0	0	0	112.3	G132 L138 S139 D140	G132-L136 PolarHBondContact O-N 3.47Å; L136-L138 VanDerWaalsContact C-N 3.31Å; L136-L138 PolarHBondContact O-N 3.28Å; L136-S139 WeakPolarHBondContact CA-OG 3.41Å; L136-S139 PolarHBondContact O-N 3.15Å; L136-S139 PolarHBondContact O-OG 3.01Å; L136-D140 PolarHBondContact O-N 3.11Å
137	L	51.6	Low	51.3	Low	127 Å²	127	101 Å²	101	67%	0.665	58%	0.582	S	S	*	*	H	α-helix	trans	-67.9	-29.9	175.2	-69.5	170.9	0	0	0	112.8	A133 S134 A141	A133-L137 VanDerWaalsContact O-CG 3.25Å; A133-L137 WeakPolarHBondContact O-CG 3.39Å; A133-L137 PolarHBondContact O-N 3.49Å; A133-L137 VanDerWaalsContact O-N 3.15Å; S134-L137 PolarHBondContact O-N 3.41Å; L137-A141 WeakPolarHBondContact O-CB 3.29Å; L137-A141 PolarHBondContact O-N 3Å
138	L	53.5	Low	50	Low	123 Å²	123	100 Å²	100	64%	0.644	59%	0.592	S	S	*	*	H	α-helix	trans	-74.6	-35.5	172.8	-77.7	159.9	0	0	0	112	S134 S135 L136 A142	S134-L138 WeakPolarHBondContact O-CB 3.24Å; S134-L138 WeakPolarHBondContact O-CD1 3.35Å; S134-L138 VanDerWaalsContact O-CG 3.28Å; S134-L138 WeakPolarHBondContact O-CG 3.31Å; S134-L138 PolarHBondContact O-N 2.96Å; S135-L138 PolarHBondContact O-N 3.26Å; L136-L138 VanDerWaalsContact C-N 3.31Å; L136-L138 PolarHBondContact O-N 3.28Å; L138-A142 WeakPolarHBondContact O-CB 3.35Å; L138-A142 PolarHBondContact O-N 2.99Å; L138-A142 VanDerWaalsContact O-N 3.09Å
139	S	49.7	Very low	48.4	Very low	49 Å²	49	97.5 Å²	97.5	34%	0.343	60%	0.602	S	S	.	*	H	α-helix	trans	-71.9	-32.3	176.4	56.6	0	0	0	0	113.5	S135 L136 R143	S135-S139 PolarHBondContact O-N 3.35Å; S135-S139 PolarHBondContact O-OG 3.31Å; L136-S139 WeakPolarHBondContact CA-OG 3.41Å; L136-S139 PolarHBondContact O-N 3.15Å; L136-S139 PolarHBondContact O-OG 3.01Å; S139-R143 WeakPolarHBondContact O-CG 3.24Å; S139-R143 PolarHBondContact O-N 2.87Å
140	D	43.3	Very low	47	Very low	94 Å²	94	98 Å²	98	50%	0.503	61%	0.61	S	S	.	*	H	α-helix	trans	-74.4	-36.3	175.8	-74.6	-18.9	0	0	0	111.6	L136 A142 R143	L136-D140 PolarHBondContact O-N 3.11Å; D140-A142 VanDerWaalsContact C-N 3.35Å; D140-A142 PolarHBondContact O-N 3.26Å; D140-R143 PolarHBondContact O-N 3.12Å
141	A	45	Very low	45.7	Very low	58 Å²	58	101.1 Å²	101.1	48%	0.479	62%	0.622	S	S	.	*	H	α-helix	trans	-69.1	-30.2	173.5	0	0	0	0	0	113.2	L137	L137-A141 WeakPolarHBondContact O-CB 3.29Å; L137-A141 PolarHBondContact O-N 3Å
142	A	47.6	Very low	44.6	Very low	65 Å²	65	101.1 Å²	101.1	54%	0.537	63%	0.631	S	S	.	*	H	α-helix	trans	-76.6	-25.4	176.4	0	0	0	0	0	113.2	L138 D140	L138-A142 WeakPolarHBondContact O-CB 3.35Å; L138-A142 PolarHBondContact O-N 2.99Å; L138-A142 VanDerWaalsContact O-N 3.09Å; D140-A142 VanDerWaalsContact C-N 3.35Å; D140-A142 PolarHBondContact O-N 3.26Å
143	R	45.6	Very low	43.6	Very low	199 Å²	199	104.2 Å²	104.2	75%	0.751	65%	0.654	S	S	*	*	H	α-helix	trans	-76.8	-28.8	178.8	-85.6	177.8	142.7	166.5	-4.8	113.8	S139 D140 S145	S139-R143 WeakPolarHBondContact O-CG 3.24Å; S139-R143 PolarHBondContact O-N 2.87Å; D140-R143 PolarHBondContact O-N 3.12Å; R143-S145 VanDerWaalsContact C-N 3.29Å; R143-S145 PolarHBondContact O-N 2.57Å
144	E	41.2	Very low	42.5	Very low	179 Å²	179	107 Å²	107	84%	0.836	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-12.5	174.6	-72.5	-173.9	157.7	0	0	113.5
145	S	45	Very low	41.6	Very low	98 Å²	98	109.1 Å²	109.1	69%	0.685	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	5.7	-179.4	-61.5	0	0	0	0	114.5	R143 V147	R143-S145 VanDerWaalsContact C-N 3.29Å; R143-S145 PolarHBondContact O-N 2.57Å; S145-V147 PolarHBondContact O-N 3.08Å
146	A	40.5	Very low	40.6	Very low	82 Å²	82	110 Å²	110	68%	0.678	70%	0.696	S	S	*	*			trans	-88.3	8	-172.4	0	0	0	0	0	115.5
147	V	40.3	Very low	39.4	Very low	151 Å²	151	109.4 Å²	109.4	92%	0.915	70%	0.702	S	S	*	*	S	Bend	trans	-108.4	77.4	173.9	-173.6	0	0	0	0	108.9	S145	S145-V147 PolarHBondContact O-N 3.08Å
148	G	32.5	Very low	38.6	Very low	68 Å²	68	112.5 Å²	112.5	70%	0.701	71%	0.71	S	S	*	*	S	Bend	trans	174.7	111	179.3	0	0	0	0	0	112.1
149	G	31.7	Very low	37.7	Very low	79 Å²	79	111.6 Å²	111.6	81%	0.814	71%	0.709	S	S	*	*			trans	-54.4	140.2	-169.3	0	0	0	0	0	117.9
150	A	31.6	Very low	37.3	Very low	84 Å²	84	115.9 Å²	115.9	69%	0.694	72%	0.724	S	S	*	*				61	119.7	122	0	0	0	0	0	121.3
151	K	32.3	Very low	37.1	Very low	196 Å²	196	121 Å²	121	85%	0.852	74%	0.742	S	S	*	*			trans	73.4	133.8	146.8	-57.2	171.7	-178.3	-179.3	0	114.2
152	T	34	Very low	36.8	Very low	135 Å²	135	123.4 Å²	123.4	83%	0.828	75%	0.751	S	S	*	*			cis	-158.8	150.5	31.5	35.5	0	0	0	0	108.9
153	A	36.3	Very low	37	Very low	99 Å²	99	129.6 Å²	129.6	82%	0.818	76%	0.76	S	S	*	*			trans	-65.8	137.8	167.9	0	0	0	0	0	111.8
154	S	30.7	Very low	36.7	Very low	110 Å²	110	124.6 Å²	124.6	77%	0.769	75%	0.752	S	S	*	*				-179.6	148.6	121.5	64.8	0	0	0	0	111.4
155	S	34.6	Very low	36.8	Very low	110 Å²	110	125.5 Å²	125.5	77%	0.769	75%	0.747	S	S	*	*			trans	-8.9	129.5	165.7	54.5	0	0	0	0	117.9
156	A	29.6	Very low	36.7	Very low	91 Å²	91	129.2 Å²	129.2	75%	0.752	75%	0.751	S	S	*	*				155.4	148.2	116.9	0	0	0	0	0	112.7
157	S	30.2	Very low	36.7	Very low	100 Å²	100	130.1 Å²	130.1	70%	0.699	76%	0.759	S	S	*	*			trans	75.5	109.9	171.5	75.8	0	0	0	0	116.8	V159	S157-V159 VanDerWaalsContact C-N 3.31Å; S157-V159 PolarHBondContact O-N 3.44Å
158	K	35	Very low	36.7	Very low	192 Å²	192	133.8 Å²	133.8	84%	0.835	76%	0.756	S	S	*	*			trans	-62.5	89.4	166.2	-176.4	179	-178.6	-177	0	108.2	E160	K158-E160 PolarHBondContact O-N 2.89Å; K158-E160 VanDerWaalsContact O-N 3.17Å
159	V	35.3	Very low	37.2	Very low	105 Å²	105	138.3 Å²	138.3	64%	0.636	76%	0.763	S	S	*	*			trans	-75.5	100.3	171	-178.5	0	0	0	0	107.3	S157 F161	S157-V159 VanDerWaalsContact C-N 3.31Å; S157-V159 PolarHBondContact O-N 3.44Å; V159-F161 PolarHBondContact O-N 3.24Å
160	E	41.9	Very low	37.6	Very low	139 Å²	139	143.9 Å²	143.9	65%	0.65	77%	0.765	S	S	*	*			trans	-64.5	116	166.1	-85.5	-174.6	167.6	0	0	108.6	K158 V162	K158-E160 PolarHBondContact O-N 2.89Å; K158-E160 VanDerWaalsContact O-N 3.17Å; E160-V162 VanDerWaalsContact C-N 3.26Å; E160-V162 PolarHBondContact O-N 3.39Å
161	F	37.6	Very low	38.1	Very low	200 Å²	200	150.7 Å²	150.7	88%	0.877	77%	0.773	S	S	*	*			trans	-67.3	88.8	167.8	-87.7	-88.1	0	0	0	109.2	V159 R163	V159-F161 PolarHBondContact O-N 3.24Å; F161-R163 VanDerWaalsContact C-N 3.33Å; F161-R163 PolarHBondContact O-N 3.31Å
162	V	40.3	Very low	38.4	Very low	110 Å²	110	151.3 Å²	151.3	67%	0.667	78%	0.776	S	S	*	*			trans	-74	91	168.8	-176.4	0	0	0	0	107.9	E160 V164	E160-V162 VanDerWaalsContact C-N 3.26Å; E160-V162 PolarHBondContact O-N 3.39Å; V162-V164 VanDerWaalsContact C-N 3.32Å; V162-V164 HydrophobicContact CG1-CG2 3.83Å; V162-V164 PolarHBondContact O-N 2.98Å
163	R	51	Low	39	Very low	195 Å²	195	150.8 Å²	150.8	74%	0.736	77%	0.772	S	S	*	*			trans	-73.9	89.4	169.7	-173.9	-178.5	-88	177.7	-8	108.6	F161 R165	F161-R163 VanDerWaalsContact C-N 3.33Å; F161-R163 PolarHBondContact O-N 3.31Å; R163-R165 VanDerWaalsContact C-N 3.33Å; R163-R165 HydrophobicContact CG-CG 4.16Å; R163-R165 PolarHBondContact O-N 3.06Å
164	V	38.7	Very low	39.2	Very low	94 Å²	94	150.8 Å²	150.8	57%	0.57	77%	0.773	S	S	*	*			trans	-68.1	92	169.7	-172.3	0	0	0	0	108.4	V162 F166	V162-V164 VanDerWaalsContact C-N 3.32Å; V162-V164 HydrophobicContact CG1-CG2 3.83Å; V162-V164 PolarHBondContact O-N 2.98Å; V164-F166 HydrophobicContact CB-CE2 4.42Å; V164-F166 HydrophobicContact CG1-CD2 4.15Å; V164-F166 HydrophobicContact CG1-CE1 4.24Å; V164-F166 HydrophobicContact CG1-CE2 3.8Å; V164-F166 HydrophobicContact CG1-CZ 3.85Å; V164-F166 PolarHBondContact O-N 3.4Å; V164-F166 VanDerWaalsContact O-N 3.17Å
165	R	44.8	Very low	40	Very low	198 Å²	198	154 Å²	154	75%	0.747	77%	0.773	S	S	*	*			trans	-77.9	94.8	166.2	-76.3	-172.5	172.8	168.3	0.1	107.6	R163 A167	R163-R165 VanDerWaalsContact C-N 3.33Å; R163-R165 HydrophobicContact CG-CG 4.16Å; R163-R165 PolarHBondContact O-N 3.06Å; R165-A167 PolarHBondContact O-N 3.07Å; R165-A167 VanDerWaalsContact O-N 3.13Å
166	F	41.1	Very low	40.5	Very low	175 Å²	175	154.3 Å²	154.3	77%	0.768	77%	0.769	S	S	*	*			trans	-55.5	121.5	159.9	-66.1	-80.5	0	0	0	107.5	V164 R168	V164-F166 HydrophobicContact CB-CE2 4.42Å; V164-F166 HydrophobicContact CG1-CD2 4.15Å; V164-F166 HydrophobicContact CG1-CE1 4.24Å; V164-F166 HydrophobicContact CG1-CE2 3.8Å; V164-F166 HydrophobicContact CG1-CZ 3.85Å; V164-F166 PolarHBondContact O-N 3.4Å; V164-F166 VanDerWaalsContact O-N 3.17Å; F166-R168 PolarHBondContact O-N 3.06Å
167	A	41.4	Very low	41.3	Very low	101 Å²	101	160.1 Å²	160.1	84%	0.835	77%	0.772	S	S	*	*			trans	-61.8	90.4	172.8	0	0	0	0	0	107.8	R165 L169	R165-A167 PolarHBondContact O-N 3.07Å; R165-A167 VanDerWaalsContact O-N 3.13Å; A167-L169 VanDerWaalsContact C-N 3.35Å; A167-L169 PolarHBondContact O-N 3.02Å
168	R	40.2	Very low	41.9	Very low	229 Å²	229	158.4 Å²	158.4	86%	0.864	76%	0.758	S	S	*	*			trans	-62.3	105.8	164.4	-89.2	-177.6	165.4	166.1	-2.8	105.4	F166 K170	F166-R168 PolarHBondContact O-N 3.06Å; R168-K170 VanDerWaalsContact C-N 3.31Å; R168-K170 PolarHBondContact O-N 2.79Å
169	L	43.1	Very low	42.8	Very low	162 Å²	162	157.4 Å²	157.4	85%	0.848	76%	0.759	S	S	*	*			trans	-47.3	103.3	164.8	-171.3	71.6	0	0	0	106	A167 R171	A167-L169 VanDerWaalsContact C-N 3.35Å; A167-L169 PolarHBondContact O-N 3.02Å; L169-R171 VanDerWaalsContact C-N 3.3Å; L169-R171 PolarHBondContact O-N 2.71Å
170	K	39.3	Very low	43.2	Very low	197 Å²	197	160.7 Å²	160.7	86%	0.857	77%	0.766	S	S	*	*			trans	-61.3	99.8	178.6	-73.8	-172.5	179	176.2	0	105.5	R168 K172	R168-K170 VanDerWaalsContact C-N 3.31Å; R168-K170 PolarHBondContact O-N 2.79Å; K170-K172 PolarHBondContact O-N 2.83Å
171	R	43.4	Very low	43.2	Very low	226 Å²	226	156.9 Å²	156.9	85%	0.853	75%	0.75	S	S	*	*			trans	-53	126.8	167.1	-77.8	-175.6	177.8	132.6	-0	105.8	L169 T173	L169-R171 VanDerWaalsContact C-N 3.3Å; L169-R171 PolarHBondContact O-N 2.71Å; R171-T173 PolarHBondContact O-N 3.12Å
172	K	39	Very low	43.7	Very low	210 Å²	210	152.4 Å²	152.4	91%	0.913	74%	0.739	S	S	*	*			trans	-56.7	84.7	-178.7	-64.6	175.8	179.4	175.5	0	109.3	K170 A174	K170-K172 PolarHBondContact O-N 2.83Å; K172-A174 PolarHBondContact O-N 2.98Å
173	T	45.9	Very low	43.8	Very low	123 Å²	123	153.2 Å²	153.2	76%	0.755	74%	0.739	S	S	*	*			trans	-62.7	127.7	151.7	46	0	0	0	0	104.9	R171 K175	R171-T173 PolarHBondContact O-N 3.12Å; T173-K175 PolarHBondContact O-N 2.8Å
174	A	40.7	Very low	43.4	Very low	100 Å²	100	146.4 Å²	146.4	83%	0.826	72%	0.722	S	S	*	*			trans	-63.3	77.8	-179.9	0	0	0	0	0	109.5	K172 V176	K172-A174 PolarHBondContact O-N 2.98Å; A174-V176 PolarHBondContact O-N 3.26Å; A174-V176 VanDerWaalsContact O-N 3.14Å
175	K	46.1	Very low	43.7	Very low	177 Å²	177	147.3 Å²	147.3	77%	0.77	73%	0.732	S	S	*	*			trans	-73.1	102.3	165.6	-143.1	177.7	-176	-169.8	0	103.9	T173 R177	T173-K175 PolarHBondContact O-N 2.8Å; K175-R177 VanDerWaalsContact C-N 3.31Å; K175-R177 PolarHBondContact O-N 3.49Å
176	V	46.7	Very low	43.7	Very low	116 Å²	116	142 Å²	142	70%	0.703	73%	0.726	S	S	*	*			trans	-55.6	101.8	170.5	175.5	0	0	0	0	105.8	A174 T178	A174-V176 PolarHBondContact O-N 3.26Å; A174-V176 VanDerWaalsContact O-N 3.14Å; V176-T178 HydrophobicContact CG1-CG2 4.26Å; V176-T178 PolarHBondContact O-N 3.49Å
177	R	45.3	Very low	43.7	Very low	214 Å²	214	139.8 Å²	139.8	81%	0.808	72%	0.722	S	S	*	*			trans	-66.8	103.2	170.1	-76.1	-179.8	171	170	-5	105.8	K175	K175-R177 VanDerWaalsContact C-N 3.31Å; K175-R177 PolarHBondContact O-N 3.49Å
178	T	43.6	Very low	43.6	Very low	64 Å²	64	140.8 Å²	140.8	39%	0.393	71%	0.713	S	S	.	*			trans	-75.2	147	169.3	73.9	0	0	0	0	107.4	V176 F180 D181	V176-T178 HydrophobicContact CG1-CG2 4.26Å; V176-T178 PolarHBondContact O-N 3.49Å; T178-F180 PolarHBondContact O-N 3.38Å; T178-F180 PolarHBondContact OG1-N 3.44Å; T178-D181 PolarHBondContact N-OD2 3.07Å; T178-D181 VanDerWaalsContact N-OD2 3.13Å; T178-D181 PolarHBondContact O-N 3.3Å; T178-D181 VanDerWaalsContact O-N 3.08Å; T178-D181 PolarHBondContact OG1-N 3.42Å; T178-D181 PolarHBondContact OG1-OD1 2.92Å
179	I	53.7	Low	43.4	Very low	170 Å²	170	137 Å²	137	87%	0.872	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	-8.2	173.5	-56.9	167.1	0	0	0	111
180	F	43.2	Very low	43.1	Very low	175 Å²	175	137.8 Å²	137.8	77%	0.768	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	3.7	-176.7	-59.4	-77.6	0	0	0	114.2	T178 T182	T178-F180 PolarHBondContact O-N 3.38Å; T178-F180 PolarHBondContact OG1-N 3.44Å; F180-T182 VanDerWaalsContact C-N 3.27Å; F180-T182 PolarHBondContact O-N 2.95Å
181	D	42.7	Very low	43.1	Very low	59 Å²	59	135 Å²	135	32%	0.316	69%	0.694	S	S	.	*			trans	-71.4	85.7	175.1	-70.1	-16.8	0	0	0	109.5	T178 D183 S184	T178-D181 PolarHBondContact N-OD2 3.07Å; T178-D181 VanDerWaalsContact N-OD2 3.13Å; T178-D181 PolarHBondContact O-N 3.3Å; T178-D181 VanDerWaalsContact O-N 3.08Å; T178-D181 PolarHBondContact OG1-N 3.42Å; T178-D181 PolarHBondContact OG1-OD1 2.92Å; D181-D183 PolarHBondContact O-N 2.96Å; D181-S184 PolarHBondContact O-N 3.3Å
182	T	47.9	Very low	42.7	Very low	105 Å²	105	129.3 Å²	129.3	64%	0.644	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-56.1	-30.7	175.7	44.8	0	0	0	0	112	F180 S184 S185 S186	F180-T182 VanDerWaalsContact C-N 3.27Å; F180-T182 PolarHBondContact O-N 2.95Å; T182-S184 VanDerWaalsContact C-N 3.26Å; T182-S184 PolarHBondContact O-N 3.49Å; T182-S185 PolarHBondContact O-N 3.41Å; T182-S186 PolarHBondContact O-OG 2.99Å
183	D	42.6	Very low	42.8	Very low	127 Å²	127	127.8 Å²	127.8	68%	0.679	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-72.5	-17.6	-177.2	-64	-1.9	0	0	0	113.2	D181	D181-D183 PolarHBondContact O-N 2.96Å
184	S	42	Very low	43.1	Very low	53 Å²	53	124.2 Å²	124.2	37%	0.371	66%	0.659	S	S	.	*	G	3₁₀ helix	trans	-97.6	-7	-178.4	-58.6	0	0	0	0	113.7	D181 T182	D181-S184 PolarHBondContact O-N 3.3Å; T182-S184 VanDerWaalsContact C-N 3.26Å; T182-S184 PolarHBondContact O-N 3.49Å
185	S	45.7	Very low	43.9	Very low	112 Å²	112	127 Å²	127	78%	0.783	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	-14.7	-173.4	-172.2	0	0	0	0	114.6	T182	T182-S185 PolarHBondContact O-N 3.41Å
186	S	44.6	Very low	45.2	Very low	88 Å²	88	123.7 Å²	123.7	62%	0.615	64%	0.638	S	S	*	*	S	Bend	trans	-114.4	-27.9	-178.4	50.8	0	0	0	0	115.1	T182	T182-S186 PolarHBondContact O-OG 2.99Å
187	D	40.1	Very low	46.7	Very low	128 Å²	128	125 Å²	125	68%	0.684	63%	0.631	S	S	*	*	S	Bend	trans	-126	-10	-164	-63.3	-60.3	0	0	0	115.5	E189	D187-E189 VanDerWaalsContact C-N 3.33Å; D187-E189 PolarHBondContact O-N 3.48Å
188	D	40	Very low	48.4	Very low	122 Å²	122	120.6 Å²	120.6	65%	0.652	62%	0.624	S	S	*	*	S	Bend	trans	-82.6	74	171.8	-88.6	-20	0	0	0	110.4
189	E	35.6	Very low	50.1	Low	150 Å²	150	121.1 Å²	121.1	70%	0.701	62%	0.624	S	S	*	*			trans	166.5	97.8	141.8	-91.7	170.8	-166	0	0	110.1	D187 Y191	D187-E189 VanDerWaalsContact C-N 3.33Å; D187-E189 PolarHBondContact O-N 3.48Å; E189-Y191 VanDerWaalsContact C-N 3.35Å; E189-Y191 PolarHBondContact O-N 3.41Å
190	L	36.5	Very low	51.3	Low	177 Å²	177	121.2 Å²	121.2	93%	0.927	62%	0.618	S	S	*	*			trans	-52.6	103.3	152.1	-122.2	86.7	0	0	0	108
191	Y	40.1	Very low	53	Low	139 Å²	139	115.4 Å²	115.4	55%	0.545	59%	0.594	S	S	.	*			trans	-17.8	129.2	177.2	-65.4	-103	0	0	0	118.1	E189 E194	E189-Y191 VanDerWaalsContact C-N 3.35Å; E189-Y191 PolarHBondContact O-N 3.41Å; Y191-E194 HydrophobicContact CD1-CB 3.98Å; Y191-E194 HydrophobicContact CD1-CG 3.86Å; Y191-E194 HydrophobicContact CE1-CB 3.81Å; Y191-E194 HydrophobicContact CE1-CG 3.63Å; Y191-E194 WeakPolarHBondContact CE1-OE2 3.38Å
192	P	34.1	Very low	54.3	Low	107 Å²	107	117.7 Å²	117.7	70%	0.695	61%	0.606	S	S	*	*	S	Bend	trans	-117.3	105.3	130.5	22.9	-6.6	0	0	0	109.3
193	M	41.8	Very low	55.3	Low	177 Å²	177	119.6 Å²	119.6	87%	0.872	60%	0.603	S	S	*	*			trans	67.3	59.2	163	-56.1	-72.6	171.4	0	0	117.3	K195	M193-K195 PolarHBondContact O-N 3.15Å; M193-K195 VanDerWaalsContact O-N 3.16Å
194	E	52.1	Low	56.1	Low	48 Å²	48	116.9 Å²	116.9	22%	0.224	59%	0.591	C	S	.	*			trans	-61.5	120.5	154.8	-79.3	-161.1	140.7	0	0	108.7	Y48 H51 Y191 K196	Y48-E194 VanDerWaalsContact CD1-OE2 3.23Å; Y48-E194 WeakPolarHBondContact CD1-OE2 3.21Å; H51-E194 IonicContact CD2-OE1 2.8Å; H51-E194 PolarHBondContact CD2-OE1 3.4Å; H51-E194 IonicContact NE2-OE1 3.41Å; Y191-E194 HydrophobicContact CD1-CB 3.98Å; Y191-E194 HydrophobicContact CD1-CG 3.86Å; Y191-E194 HydrophobicContact CE1-CB 3.81Å; Y191-E194 HydrophobicContact CE1-CG 3.63Å; Y191-E194 WeakPolarHBondContact CE1-OE2 3.38Å; E194-K196 PolarHBondContact O-N 2.92Å
195	K	57.7	Low	56.8	Low	158 Å²	158	121.2 Å²	121.2	69%	0.687	61%	0.61	S	S	*	*			trans	-63.2	99.7	171.8	-77.2	-176	178.9	178.7	0	108.7	A49 M193	A49-K195 HydrophobicContact CB-CB 4.23Å; A49-K195 WeakPolarHBondContact CB-O 3.35Å; A49-K195 PolarHBondContact N-O 3.29Å; M193-K195 PolarHBondContact O-N 3.15Å; M193-K195 VanDerWaalsContact O-N 3.16Å
196	K	73.5	Confident	57.4	Low	108 Å²	108	118.2 Å²	118.2	47%	0.47	60%	0.597	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.5	125.6	171.5	-63.1	-178.8	-172.7	-173.3	0	108.4	T46 Y48 E194	T46-K196 HydrophobicContact CG2-CB 4.31Å; Y48-K196 HydrophobicContact CD1-CG 4.21Å; Y48-K196 HydrophobicContact CE1-CD 4.11Å; Y48-K196 HydrophobicContact CE1-CG 4.12Å; E194-K196 PolarHBondContact O-N 2.92Å
197	W	77.4	Confident	58.2	Low	143 Å²	143	122.6 Å²	122.6	54%	0.542	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.2	115.8	173.2	-61.3	-14.1	0	0	0	108.7	T46 L47 A49 L199	T46-W197 WeakPolarHBondContact CA-O 3.47Å; L47-W197 HydrophobicContact CB-CB 4.43Å; L47-W197 HydrophobicContact CD2-CE3 3.87Å; L47-W197 HydrophobicContact CD2-CZ3 4.3Å; L47-W197 PolarHBondContact N-O 3.4Å; L47-W197 PolarHBondContact O-N 3.46Å; A49-W197 HydrophobicContact CB-CZ2 4.4Å; W197-L199 PolarHBondContact O-N 2.79Å
198	N	81.7	Confident	59.2	Low	123 Å²	123	122.1 Å²	122.1	66%	0.658	60%	0.598	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.4	114.6	169.2	-66.5	-44.4	0	0	0	107.7
199	L	80.2	Confident	60.5	Low	75 Å²	75	120.3 Å²	120.3	39%	0.393	59%	0.588	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85	131.3	-176.5	-64.2	170.9	0	0	0	109.3	A45 L47 L54 W197	A45-L199 HydrophobicContact CB-CB 3.87Å; A45-L199 HydrophobicContact CB-CD1 4.26Å; A45-L199 PolarHBondContact O-N 2.73Å; L47-L199 HydrophobicContact CB-CD1 3.98Å; L47-L199 HydrophobicContact CB-CG 4.24Å; L54-L199 HydrophobicContact CD1-CD1 3.73Å; W197-L199 PolarHBondContact O-N 2.79Å
200	K	78.5	Confident	62	Low	171 Å²	171	114.2 Å²	114.2	74%	0.743	56%	0.562	S	S	*	*			trans	-76.4	128.4	167.9	-168.4	-174.5	178.3	-155.3	0	108.7	D202	K200-D202 WeakPolarHBondContact CE-OD1 3.39Å; K200-D202 IonicContact NZ-OD1 2.73Å; K200-D202 PolarHBondContact NZ-OD1 2.75Å; K200-D202 IonicContact NZ-OD2 3.33Å
201	I	77.1	Confident	63.5	Low	54 Å²	54	109.4 Å²	109.4	28%	0.277	54%	0.54	S	S	.	.			trans	-98	102.2	-178.5	-55.9	158.1	0	0	0	107.9	P42 A45 Y203	P42-I201 HydrophobicContact CB-CD1 4.13Å; P42-I201 HydrophobicContact CG-CD1 3.96Å; P42-I201 WeakPolarHBondContact O-CD1 3.31Å; A45-I201 HydrophobicContact CB-CD1 3.99Å; A45-I201 HydrophobicContact CB-CG1 4.04Å; I201-Y203 HydrophobicContact CG2-CE1 4.29Å; I201-Y203 HydrophobicContact CG2-CE2 3.89Å; I201-Y203 WeakPolarHBondContact CG2-OH 3.34Å
202	D	70.2	Confident	64.8	Low	107 Å²	107	105.8 Å²	105.8	57%	0.572	54%	0.535	S	S	*	.			trans	-103.6	127.2	175.8	-70.9	-26.8	0	0	0	109.9	K200 T204	K200-D202 WeakPolarHBondContact CE-OD1 3.39Å; K200-D202 IonicContact NZ-OD1 2.73Å; K200-D202 PolarHBondContact NZ-OD1 2.75Å; K200-D202 IonicContact NZ-OD2 3.33Å; D202-T204 PolarHBondContact O-N 2.88Å
203	Y	68.9	Low	66.5	Low	145 Å²	145	101.6 Å²	101.6	57%	0.569	51%	0.506	S	S	*	.			trans	-89.1	103.4	175.5	-62.9	-81.2	0	0	0	109.5	P41 P42 I201 N205	P41-Y203 WeakPolarHBondContact CA-OH 3.49Å; P41-Y203 HydrophobicContact CB-CE1 3.99Å; P41-Y203 HydrophobicContact CB-CE2 4.05Å; P41-Y203 WeakPolarHBondContact CB-OH 3.33Å; P42-Y203 WeakPolarHBondContact CD-OH 3.11Å; I201-Y203 HydrophobicContact CG2-CE1 4.29Å; I201-Y203 HydrophobicContact CG2-CE2 3.89Å; I201-Y203 WeakPolarHBondContact CG2-OH 3.34Å; Y203-N205 PolarHBondContact O-N 3.49Å
204	T	59.3	Low	67.7	Low	70 Å²	70	93.7 Å²	93.7	43%	0.429	47%	0.468	S	S	.	.			trans	-88.7	110.9	175.8	55.4	0	0	0	0	111.7	D202 H208	D202-T204 PolarHBondContact O-N 2.88Å; T204-H208 HydrophobicContact CG2-CB 3.75Å
205	N	57.7	Low	68.2	Low	143 Å²	143	94.4 Å²	94.4	77%	0.765	47%	0.474	S	S	*	.			trans	-55.9	147.4	162.9	-74.5	-19.3	0	0	0	110.1	Y203 K207 H208	Y203-N205 PolarHBondContact O-N 3.49Å; N205-K207 PolarHBondContact O-N 3.22Å; N205-H208 PolarHBondContact O-N 2.56Å
206	G	58.9	Low	68	Low	50 Å²	50	93 Å²	93	52%	0.515	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-9.9	-162	0	0	0	0	0	119.8	S210	G206-S210 PolarHBondContact O-N 3.46Å
207	K	60.1	Low	66.8	Low	180 Å²	180	90.9 Å²	90.9	78%	0.783	49%	0.493	S	S	*	.	H	α-helix	trans	-66.1	-46.7	174.7	-65.8	-176.5	-179.9	178.6	0	112.5	N205 S210	N205-K207 PolarHBondContact O-N 3.22Å; K207-S210 PolarHBondContact O-N 3.06Å; K207-S210 PolarHBondContact O-OG 3.43Å
208	H	62.1	Low	65.5	Low	117 Å²	117	95.4 Å²	95.4	54%	0.542	51%	0.51	S	S	.	.	H	α-helix	trans	-73.3	-30.1	179.3	-75.2	-85.9	0	0	0	113.1	T204 N205 S210 T211 C212	T204-H208 HydrophobicContact CG2-CB 3.75Å; N205-H208 PolarHBondContact O-N 2.56Å; H208-S210 PolarHBondContact O-N 2.95Å; H208-T211 WeakPolarHBondContact O-CB 3.36Å; H208-T211 PolarHBondContact O-N 3.11Å; H208-C212 PolarHBondContact O-N 2.96Å; H208-C212 PolarHBondContact O-SG 3.47Å
209	L	67.9	Low	63.8	Low	84 Å²	84	97.9 Å²	97.9	44%	0.44	52%	0.517	S	S	.	.	H	α-helix	trans	-55.5	-41.2	170.9	-84.8	165.9	0	0	0	110.7	T211 C212 L213	L209-T211 VanDerWaalsContact C-N 3.3Å; L209-T211 PolarHBondContact O-N 3.26Å; L209-C212 PolarHBondContact O-N 2.95Å; L209-L213 HydrophobicContact CD2-CD1 4.3Å; L209-L213 VanDerWaalsContact O-CB 3.3Å; L209-L213 WeakPolarHBondContact O-CB 3.41Å; L209-L213 VanDerWaalsContact O-CG 3.29Å; L209-L213 WeakPolarHBondContact O-CG 3.5Å; L209-L213 PolarHBondContact O-N 3.42Å
210	S	66.2	Low	62.2	Low	23 Å²	23	100.8 Å²	100.8	16%	0.161	53%	0.533	C	S	.	.	H	α-helix	trans	-67.1	-30.6	177.7	85.4	0	0	0	0	113.1	G206 K207 H208 C214	G206-S210 PolarHBondContact O-N 3.46Å; K207-S210 PolarHBondContact O-N 3.06Å; K207-S210 PolarHBondContact O-OG 3.43Å; H208-S210 PolarHBondContact O-N 2.95Å; S210-C214 WeakPolarHBondContact O-CA 3.45Å; S210-C214 WeakPolarHBondContact O-CB 3.41Å; S210-C214 PolarHBondContact O-N 3.5Å
211	T	68.9	Low	60.6	Low	75 Å²	75	102.5 Å²	102.5	46%	0.46	54%	0.541	S	S	.	.	H	α-helix	trans	-74	-39.2	174.8	-48.8	0	0	0	0	111.8	H208 L209	H208-T211 WeakPolarHBondContact O-CB 3.36Å; H208-T211 PolarHBondContact O-N 3.11Å; L209-T211 VanDerWaalsContact C-N 3.3Å; L209-T211 PolarHBondContact O-N 3.26Å
212	C	66.4	Low	59.5	Low	64 Å²	64	107.7 Å²	107.7	43%	0.432	56%	0.557	S	S	.	*	H	α-helix	trans	-74.2	-30.9	179.1	-66.8	0	0	0	0	113.1	H208 L209	H208-C212 PolarHBondContact O-N 2.96Å; H208-C212 PolarHBondContact O-SG 3.47Å; L209-C212 PolarHBondContact O-N 2.95Å
213	L	70.2	Confident	58.4	Low	18 Å²	18	105.1 Å²	105.1	9%	0.094	55%	0.547	C	S	.	.	H	α-helix	trans	-96.8	-20.4	-178.5	-61.6	171.3	0	0	0	113	H18 L25 V95 Y97 T106 L209	H18-L213 PolarHBondContact CD2-O 3Å; H18-L213 VanDerWaalsContact CD2-O 3.25Å; L25-L213 HydrophobicContact CD2-CD2 4.06Å; V95-L213 HydrophobicContact CG1-CD2 4.34Å; Y97-L213 HydrophobicContact CD1-CB 4.12Å; Y97-L213 HydrophobicContact CD2-CD1 3.83Å; Y97-L213 HydrophobicContact CE2-CD1 4.46Å; Y97-L213 HydrophobicContact CG-CB 4.08Å; Y97-L213 HydrophobicContact CG-CD1 3.91Å; T106-L213 PolarHBondContact OG1-O 3.01Å; L209-L213 HydrophobicContact CD2-CD1 4.3Å; L209-L213 VanDerWaalsContact O-CB 3.3Å; L209-L213 WeakPolarHBondContact O-CB 3.41Å; L209-L213 VanDerWaalsContact O-CG 3.29Å; L209-L213 WeakPolarHBondContact O-CG 3.5Å; L209-L213 PolarHBondContact O-N 3.42Å
214	C	65.9	Low	57.8	Low	12 Å²	12	103.5 Å²	103.5	8%	0.081	56%	0.555	C	S	.	*			trans	-122.6	92.2	175.7	-47.7	0	0	0	0	109.8	Y97 H104 S210 S216	Y97-C214 WeakPolarHBondContact CD1-SG 3.41Å; Y97-C214 VanDerWaalsContact CE1-SG 3.58Å; H104-C214 PolarHBondContact CD2-SG 2.83Å; S210-C214 WeakPolarHBondContact O-CA 3.45Å; S210-C214 WeakPolarHBondContact O-CB 3.41Å; S210-C214 PolarHBondContact O-N 3.5Å; C214-S216 VanDerWaalsContact C-N 3.3Å; C214-S216 PolarHBondContact O-N 2.94Å
215	N	62.6	Low	57.6	Low	63 Å²	63	103.4 Å²	103.4	34%	0.337	56%	0.561	S	S	.	*			trans	-73.9	88.6	166.6	-94.4	-13.3	0	0	0	108.7	H18 D20 G217	H18-N215 PolarHBondContact CE1-N 2.9Å; H18-N215 PolarHBondContact CE1-O 3.49Å; D20-N215 PolarHBondContact OD2-ND2 3.33Å; N215-G217 PolarHBondContact O-N 3.25Å
216	S	54	Low	57.5	Low	127 Å²	127	101.3 Å²	101.3	89%	0.888	55%	0.547	S	S	*	.			trans	-76.7	7	175.9	54.5	0	0	0	0	113.8	C214	C214-S216 VanDerWaalsContact C-N 3.3Å; C214-S216 PolarHBondContact O-N 2.94Å
217	G	49	Very low	57.3	Low	65 Å²	65	105 Å²	105	67%	0.67	55%	0.546	S	S	*	.	S	Bend	trans	-110.3	-9.2	-159.4	0	0	0	0	0	119.1	N215	N215-G217 PolarHBondContact O-N 3.25Å
218	R	49	Very low	57.1	Low	237 Å²	237	99.1 Å²	99.1	89%	0.894	53%	0.53	S	S	*	.			trans	-146.7	95.5	177.8	-77.9	-173.7	176.8	171.6	-2.4	111.3	N220	R218-N220 PolarHBondContact O-N 2.79Å
219	Q	47	Very low	56.8	Low	175 Å²	175	95.3 Å²	95.3	82%	0.818	52%	0.52	S	S	*	.			trans	-75.5	100.4	166.6	-67.3	-145.8	8.6	0	0	109.3	K221	Q219-K221 PolarHBondContact O-N 3.38Å
220	N	46.3	Very low	56.2	Low	137 Å²	137	95.2 Å²	95.2	73%	0.733	52%	0.522	S	S	*	.			trans	-68.7	113.9	155	-87.9	-13.6	0	0	0	106.9	R218 R222	R218-N220 PolarHBondContact O-N 2.79Å; N220-R222 PolarHBondContact O-N 3.06Å
221	K	44.2	Very low	55.6	Low	206 Å²	206	96.9 Å²	96.9	90%	0.896	54%	0.537	S	S	*	.			trans	-66.8	51.7	179.2	-63.7	-179.5	178.3	178.6	0	112.7	Q219	Q219-K221 PolarHBondContact O-N 3.38Å
222	R	54.6	Low	54.7	Low	163 Å²	163	96.7 Å²	96.7	62%	0.615	54%	0.539	S	S	*	.			trans	-84.3	124.7	166.1	-75	-169.4	-178.3	165.6	-0.2	108.5	N220 E226 Y227	N220-R222 PolarHBondContact O-N 3.06Å; R222-E226 WeakPolarHBondContact CB-OE2 3.37Å; R222-E226 WeakPolarHBondContact CG-OE2 3.43Å; R222-Y227 HydrophobicContact CB-CE2 3.8Å
223	S	47.5	Very low	54	Low	53 Å²	53	102.2 Å²	102.2	37%	0.371	55%	0.551	S	S	.	*			trans	-64.6	146.3	-175.2	67.6	0	0	0	0	110.5	A225 E226	S223-A225 PolarHBondContact O-N 3.44Å; S223-E226 PolarHBondContact O-N 3.35Å
224	P	56.5	Low	53.1	Low	112 Å²	112	104.5 Å²	104.5	73%	0.727	57%	0.567	S	S	*	*	H	α-helix	trans	-53.4	-25.4	172.8	-26.4	34.5	0	0	0	113.5	Y227 A228	P224-Y227 PolarHBondContact O-N 3.24Å; P224-A228 PolarHBondContact O-N 2.93Å
225	A	54.3	Low	52.2	Low	68 Å²	68	110.7 Å²	110.7	56%	0.562	60%	0.595	S	S	*	*	H	α-helix	trans	-65.8	-36.2	175.9	0	0	0	0	0	113.1	S223 A228 A229	S223-A225 PolarHBondContact O-N 3.44Å; A225-A228 PolarHBondContact O-N 3.06Å; A225-A229 WeakPolarHBondContact O-CB 3.38Å; A225-A229 PolarHBondContact O-N 2.85Å
226	E	55.4	Low	51.4	Low	98 Å²	98	111.4 Å²	111.4	46%	0.458	60%	0.598	S	S	.	*	H	α-helix	trans	-67.2	-40.3	175.1	-73.9	176.4	-179.6	0	0	111.4	R222 S223 A229 V230	R222-E226 WeakPolarHBondContact CB-OE2 3.37Å; R222-E226 WeakPolarHBondContact CG-OE2 3.43Å; S223-E226 PolarHBondContact O-N 3.35Å; E226-A229 PolarHBondContact O-N 3.06Å; E226-V230 WeakPolarHBondContact O-CB 3.23Å; E226-V230 VanDerWaalsContact O-CG2 3.24Å; E226-V230 WeakPolarHBondContact O-CG2 3.42Å; E226-V230 PolarHBondContact O-N 3.19Å
227	Y	55.1	Low	51.2	Low	129 Å²	129	108.4 Å²	108.4	51%	0.506	58%	0.581	S	S	.	*	H	α-helix	trans	-67.1	-38.9	175.9	-70.5	-75.9	0	0	0	112.2	R222 P224 A231	R222-Y227 HydrophobicContact CB-CE2 3.8Å; P224-Y227 PolarHBondContact O-N 3.24Å; Y227-A231 WeakPolarHBondContact O-CB 3.45Å; Y227-A231 PolarHBondContact O-N 2.89Å
228	A	55.3	Low	51.1	Low	55 Å²	55	111.7 Å²	111.7	46%	0.455	57%	0.573	S	S	.	*	H	α-helix	trans	-64.4	-45.5	174	0	0	0	0	0	111.5	P224 A225 V230 A231 S232	P224-A228 PolarHBondContact O-N 2.93Å; A225-A228 PolarHBondContact O-N 3.06Å; A228-V230 VanDerWaalsContact C-N 3.34Å; A228-V230 PolarHBondContact O-N 2.85Å; A228-A231 PolarHBondContact O-N 2.8Å; A228-S232 PolarHBondContact O-N 3.24Å; A228-S232 PolarHBondContact O-OG 3.3Å
229	A	55.7	Low	50.9	Low	38 Å²	38	103.8 Å²	103.8	31%	0.314	55%	0.554	S	S	.	*	H	α-helix	trans	-63.2	-38.2	177.9	0	0	0	0	0	112.7	A225 E226 R233	A225-A229 WeakPolarHBondContact O-CB 3.38Å; A225-A229 PolarHBondContact O-N 2.85Å; E226-A229 PolarHBondContact O-N 3.06Å; A229-R233 VanDerWaalsContact O-CG 3.3Å; A229-R233 WeakPolarHBondContact O-CG 3.4Å; A229-R233 PolarHBondContact O-N 3.44Å
230	V	56.6	Low	51.1	Low	82 Å²	82	101 Å²	101	50%	0.497	54%	0.544	S	S	.	.	H	α-helix	trans	-71.4	-39.9	174.6	173.3	0	0	0	0	111.1	E226 A228 R233 C234	E226-V230 WeakPolarHBondContact O-CB 3.23Å; E226-V230 VanDerWaalsContact O-CG2 3.24Å; E226-V230 WeakPolarHBondContact O-CG2 3.42Å; E226-V230 PolarHBondContact O-N 3.19Å; A228-V230 VanDerWaalsContact C-N 3.34Å; A228-V230 PolarHBondContact O-N 2.85Å; V230-R233 PolarHBondContact O-N 2.89Å; V230-C234 WeakPolarHBondContact O-CB 3.47Å; V230-C234 PolarHBondContact O-N 3.39Å; V230-C234 PolarHBondContact O-SG 2.73Å
231	A	52.3	Low	51	Low	57 Å²	57	97.4 Å²	97.4	47%	0.471	54%	0.539	S	S	.	.	H	α-helix	trans	-63.2	-43	176.3	0	0	0	0	0	111.8	Y227 A228 R233 C234 H235	Y227-A231 WeakPolarHBondContact O-CB 3.45Å; Y227-A231 PolarHBondContact O-N 2.89Å; A228-A231 PolarHBondContact O-N 2.8Å; A231-R233 PolarHBondContact O-N 3.47Å; A231-C234 PolarHBondContact O-N 2.92Å; A231-H235 VanDerWaalsContact O-CB 3.31Å; A231-H235 WeakPolarHBondContact O-CB 3.44Å; A231-H235 PolarHBondContact O-N 2.97Å
232	S	51.8	Low	51.3	Low	72 Å²	72	95.5 Å²	95.5	50%	0.503	53%	0.531	S	S	.	.	H	α-helix	trans	-60.3	-44.6	174	-56.3	0	0	0	0	111.5	A228 I236	A228-S232 PolarHBondContact O-N 3.24Å; A228-S232 PolarHBondContact O-OG 3.3Å; S232-I236 VanDerWaalsContact O-CD1 3.27Å; S232-I236 WeakPolarHBondContact O-CD1 3Å; S232-I236 WeakPolarHBondContact O-CG1 3.17Å; S232-I236 PolarHBondContact O-N 2.89Å
233	R	51.8	Low	50.7	Low	180 Å²	180	92.9 Å²	92.9	68%	0.679	54%	0.537	S	S	*	.	H	α-helix	trans	-64.6	-42.3	176.7	-72.4	-179.7	-135.9	-171.6	2.4	112.7	A229 V230 A231 A237	A229-R233 VanDerWaalsContact O-CG 3.3Å; A229-R233 WeakPolarHBondContact O-CG 3.4Å; A229-R233 PolarHBondContact O-N 3.44Å; V230-R233 PolarHBondContact O-N 2.89Å; A231-R233 PolarHBondContact O-N 3.47Å; R233-A237 PolarHBondContact O-N 3.46Å; R233-A237 VanDerWaalsContact O-N 3.08Å
234	C	49.3	Very low	50.5	Low	65 Å²	65	96.4 Å²	96.4	44%	0.439	55%	0.549	S	S	.	.	H	α-helix	trans	-72.8	-33.9	-179.6	-73.5	0	0	0	0	113	V230 A231 I236 A237 R238	V230-C234 WeakPolarHBondContact O-CB 3.47Å; V230-C234 PolarHBondContact O-N 3.39Å; V230-C234 PolarHBondContact O-SG 2.73Å; A231-C234 PolarHBondContact O-N 2.92Å; C234-I236 VanDerWaalsContact C-N 3.34Å; C234-A237 PolarHBondContact O-N 3.28Å; C234-R238 WeakPolarHBondContact O-CB 3.24Å; C234-R238 PolarHBondContact O-N 2.61Å
235	H	48.7	Very low	49.7	Very low	142 Å²	142	99.9 Å²	99.9	66%	0.657	56%	0.555	S	S	*	*	H	α-helix	trans	-68.8	-37.9	178.6	-151.1	-31.7	0	0	0	111.1	A231 S239	A231-H235 VanDerWaalsContact O-CB 3.31Å; A231-H235 WeakPolarHBondContact O-CB 3.44Å; A231-H235 PolarHBondContact O-N 2.97Å; H235-S239 PolarHBondContact O-N 3.33Å; H235-S239 VanDerWaalsContact O-N 3.11Å; H235-S239 PolarHBondContact O-OG 3.34Å
236	I	45.4	Very low	48.7	Very low	78 Å²	78	100.3 Å²	100.3	40%	0.4	57%	0.566	S	S	.	*	H	α-helix	trans	-64.8	-46.1	172.3	-65.7	165.4	0	0	0	110.3	S232 C234 R238 S239 I240 L262	S232-I236 VanDerWaalsContact O-CD1 3.27Å; S232-I236 WeakPolarHBondContact O-CD1 3Å; S232-I236 WeakPolarHBondContact O-CG1 3.17Å; S232-I236 PolarHBondContact O-N 2.89Å; C234-I236 VanDerWaalsContact C-N 3.34Å; I236-R238 PolarHBondContact O-N 3.01Å; I236-S239 PolarHBondContact O-N 3.35Å; I236-S239 PolarHBondContact O-OG 3.27Å; I236-S239 VanDerWaalsContact O-OG 3.08Å; I236-I240 HydrophobicContact CG2-CD1 3.71Å; I236-I240 VanDerWaalsContact O-CD1 3.26Å; I236-I240 WeakPolarHBondContact O-CD1 3.37Å; I236-I240 WeakPolarHBondContact O-CG1 3.44Å; I236-I240 PolarHBondContact O-N 3.1Å; I236-I240 VanDerWaalsContact O-N 3.15Å; I236-L262 HydrophobicContact CD1-CD1 4.44Å
237	A	49.7	Very low	47.5	Very low	64 Å²	64	105.4 Å²	105.4	53%	0.529	59%	0.587	S	S	.	*	H	α-helix	trans	-64.5	-36.3	178	0	0	0	0	0	113.5	R233 C234 G241	R233-A237 PolarHBondContact O-N 3.46Å; R233-A237 VanDerWaalsContact O-N 3.08Å; C234-A237 PolarHBondContact O-N 3.28Å; A237-G241 PolarHBondContact O-N 3.44Å; A237-G241 VanDerWaalsContact O-N 3.12Å
238	R	47.6	Very low	46.6	Very low	134 Å²	134	109.2 Å²	109.2	51%	0.506	61%	0.606	S	S	.	*	H	α-helix	trans	-77	-29.9	179.3	-99.9	179.2	-178.6	155.4	-1.7	114.3	C234 I236 K242	C234-R238 WeakPolarHBondContact O-CB 3.24Å; C234-R238 PolarHBondContact O-N 2.61Å; I236-R238 PolarHBondContact O-N 3.01Å; R238-K242 WeakPolarHBondContact O-CG 3.31Å
239	S	44.6	Very low	45.4	Very low	71 Å²	71	115.7 Å²	115.7	50%	0.497	62%	0.624	S	S	.	*	H	α-helix	trans	-73.9	-35	172.5	42	0	0	0	0	111.4	H235 I236 K242	H235-S239 PolarHBondContact O-N 3.33Å; H235-S239 VanDerWaalsContact O-N 3.11Å; H235-S239 PolarHBondContact O-OG 3.34Å; I236-S239 PolarHBondContact O-N 3.35Å; I236-S239 PolarHBondContact O-OG 3.27Å; I236-S239 VanDerWaalsContact O-OG 3.08Å; S239-K242 PolarHBondContact O-N 2.68Å
240	I	50	Low	44.3	Very low	117 Å²	117	122.5 Å²	122.5	60%	0.6	65%	0.65	S	S	*	*	H	α-helix	trans	-65.6	-37.6	173.3	-65.2	165.2	0	0	0	111.5	I236 K242	I236-I240 HydrophobicContact CG2-CD1 3.71Å; I236-I240 VanDerWaalsContact O-CD1 3.26Å; I236-I240 WeakPolarHBondContact O-CD1 3.37Å; I236-I240 WeakPolarHBondContact O-CG1 3.44Å; I236-I240 PolarHBondContact O-N 3.1Å; I236-I240 VanDerWaalsContact O-N 3.15Å; I240-K242 PolarHBondContact O-N 3.05Å
241	G	45.4	Very low	43	Very low	61 Å²	61	128 Å²	128	63%	0.629	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-9.2	-179.7	0	0	0	0	0	116.7	A237	A237-G241 PolarHBondContact O-N 3.44Å; A237-G241 VanDerWaalsContact O-N 3.12Å
242	K	48.8	Very low	42.1	Very low	167 Å²	167	131 Å²	131	73%	0.726	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	-0	-175.1	-75.5	-176.2	178.1	-173.4	0	115.2	R238 S239 I240 M244	R238-K242 WeakPolarHBondContact O-CG 3.31Å; S239-K242 PolarHBondContact O-N 2.68Å; I240-K242 PolarHBondContact O-N 3.05Å; K242-M244 PolarHBondContact O-N 3.32Å
243	S	43.4	Very low	41.3	Very low	107 Å²	107	136.3 Å²	136.3	75%	0.748	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	20.8	-177.6	-167.7	0	0	0	0	114.6
244	M	42.5	Very low	40.9	Very low	127 Å²	127	137 Å²	137	63%	0.626	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	6.3	-172.5	-77.8	-79.8	-75.3	0	0	114.7	K242 F295	K242-M244 PolarHBondContact O-N 3.32Å; M244-F295 HydrophobicContact CE-CE1 4.06Å; M244-F295 HydrophobicContact SD-CE1 4.21Å
245	H	39.4	Very low	40.3	Very low	186 Å²	186	136.3 Å²	136.3	86%	0.861	70%	0.703	S	S	*	*	S	Bend	trans	-140.2	119.4	177.3	-79.2	53.5	0	0	0	111.2
246	G	33.2	Very low	39.8	Very low	76 Å²	76	135.3 Å²	135.3	78%	0.784	70%	0.699	S	S	*	*			trans	107.4	106	159.5	0	0	0	0	0	115.3	F248	G246-F248 PolarHBondContact O-N 2.97Å; G246-F248 VanDerWaalsContact O-N 3.1Å
247	K	31.4	Very low	39.6	Very low	206 Å²	206	140 Å²	140	90%	0.896	72%	0.716	S	S	*	*			trans	-51.6	106.3	165.6	-62.1	171.1	178.1	176.9	0	110.3
248	F	35.1	Very low	39.3	Very low	209 Å²	209	144 Å²	144	92%	0.917	72%	0.724	S	S	*	*			trans	-144.9	122.1	155.3	-109.1	-86.6	0	0	0	108.8	G246	G246-F248 PolarHBondContact O-N 2.97Å; G246-F248 VanDerWaalsContact O-N 3.1Å
249	K	31.6	Very low	39.1	Very low	191 Å²	191	142.1 Å²	142.1	83%	0.83	72%	0.723	S	S	*	*			trans	-64.7	148.2	-179	-70	177	173.6	-178.7	0	110.2
250	E	30.9	Very low	38.9	Very low	181 Å²	181	141.1 Å²	141.1	85%	0.846	71%	0.712	S	S	*	*	S	Bend	trans	80.7	125.8	152.6	-121.3	147	-176.8	0	0	117.3
251	K	30.7	Very low	38.5	Very low	197 Å²	197	140 Å²	140	86%	0.857	71%	0.707	S	S	*	*			trans	95.9	55.7	170.2	-50.5	-179.1	-176.7	-178	0	118.5
252	V	33.7	Very low	38.6	Very low	121 Å²	121	141.7 Å²	141.7	73%	0.733	70%	0.701	S	S	*	*			trans	-142.7	68.7	157.9	-168.4	0	0	0	0	110.6	A255	V252-A255 HydrophobicContact CG1-CB 4.44Å
253	F	34.9	Very low	38.1	Very low	183 Å²	183	135.5 Å²	135.5	80%	0.803	68%	0.676	S	S	*	*			trans	-105.3	7.3	-179.3	-112.6	-80.9	0	0	0	114.7
254	Q	41.9	Very low	38.2	Very low	194 Å²	194	136 Å²	136	91%	0.907	66%	0.664	S	S	*	*	S	Bend	trans	-114.7	-7.8	-175.8	-69.7	-164.6	6.4	0	0	116
255	A	36.9	Very low	38.4	Very low	51 Å²	51	132.7 Å²	132.7	42%	0.421	66%	0.657	S	S	.	*	S	Bend	trans	-89.1	-9.1	-176.3	0	0	0	0	0	115	V252 K257	V252-A255 HydrophobicContact CG1-CB 4.44Å; A255-K257 PolarHBondContact O-N 2.98Å
256	E	39.1	Very low	38.6	Very low	121 Å²	121	125.4 Å²	125.4	57%	0.565	63%	0.627	S	S	*	*	H	α-helix	trans	-65.9	-36.1	-172.2	-70.2	-178.9	149.1	0	0	113.2	H258 L260	E256-H258 PolarHBondContact O-N 3.22Å; E256-L260 HydrophobicContact CB-CD1 4.48Å; E256-L260 VanDerWaalsContact O-CB 3.32Å; E256-L260 WeakPolarHBondContact O-CB 3.32Å; E256-L260 VanDerWaalsContact O-CD1 3.27Å; E256-L260 WeakPolarHBondContact O-CD1 3.23Å; E256-L260 WeakPolarHBondContact O-CG 3.49Å; E256-L260 PolarHBondContact O-N 3.05Å; E256-L260 VanDerWaalsContact O-N 3.09Å
257	K	41.1	Very low	39	Very low	176 Å²	176	125.2 Å²	125.2	77%	0.765	61%	0.607	S	S	*	*	H	α-helix	trans	-65.6	-31.1	-173.2	-71.1	-175.3	178	179.8	0	114.7	A255	A255-K257 PolarHBondContact O-N 2.98Å
258	H	43.1	Very low	39.9	Very low	148 Å²	148	126 Å²	126	69%	0.685	60%	0.604	S	S	*	*	H	α-helix	trans	-89.1	-29.9	-176.2	-129.2	-44.2	0	0	0	113.1	E256 N261 L262	E256-H258 PolarHBondContact O-N 3.22Å; H258-N261 PolarHBondContact O-N 3.31Å; H258-L262 PolarHBondContact O-N 2.95Å
259	I	43.8	Very low	40.8	Very low	94 Å²	94	118.7 Å²	118.7	48%	0.482	58%	0.579	S	S	.	*	H	α-helix	trans	-69.7	-38.7	173.3	-63	169.7	0	0	0	109.7	N261 L262 L263	I259-N261 VanDerWaalsContact C-N 3.26Å; I259-N261 PolarHBondContact O-N 3.23Å; I259-L262 PolarHBondContact O-N 2.93Å; I259-L263 HydrophobicContact CG2-CD1 3.61Å; I259-L263 HydrophobicContact CG2-CG 4.47Å; I259-L263 WeakPolarHBondContact O-CD1 3.39Å; I259-L263 WeakPolarHBondContact O-CG 3.25Å; I259-L263 PolarHBondContact O-N 2.83Å
260	L	39.7	Very low	42.1	Very low	51 Å²	51	113.9 Å²	113.9	27%	0.267	57%	0.569	S	S	.	*	H	α-helix	trans	-52.4	-38.4	170.1	-92.1	158	0	0	0	113.5	E256 K264 Y299	E256-L260 HydrophobicContact CB-CD1 4.48Å; E256-L260 VanDerWaalsContact O-CB 3.32Å; E256-L260 WeakPolarHBondContact O-CB 3.32Å; E256-L260 VanDerWaalsContact O-CD1 3.27Å; E256-L260 WeakPolarHBondContact O-CD1 3.23Å; E256-L260 WeakPolarHBondContact O-CG 3.49Å; E256-L260 PolarHBondContact O-N 3.05Å; E256-L260 VanDerWaalsContact O-N 3.09Å; L260-K264 WeakPolarHBondContact O-CB 3.29Å; L260-K264 VanDerWaalsContact O-CG 3.24Å; L260-K264 WeakPolarHBondContact O-CG 3.41Å; L260-K264 PolarHBondContact O-N 2.78Å; L260-Y299 HydrophobicContact CD2-CD1 3.1Å; L260-Y299 HydrophobicContact CD2-CD2 4.4Å; L260-Y299 HydrophobicContact CD2-CE1 3.38Å; L260-Y299 HydrophobicContact CD2-CG 3.66Å; L260-Y299 HydrophobicContact CG-CD1 4.16Å; L260-Y299 HydrophobicContact CG-CE1 4.17Å
261	N	42.1	Very low	43.6	Very low	93 Å²	93	107.5 Å²	107.5	50%	0.497	55%	0.547	S	S	.	.	H	α-helix	trans	-78.5	-31	-178.8	-72.3	-16.4	0	0	0	113.4	H258 I259 A265	H258-N261 PolarHBondContact O-N 3.31Å; I259-N261 VanDerWaalsContact C-N 3.26Å; I259-N261 PolarHBondContact O-N 3.23Å; N261-A265 PolarHBondContact O-N 2.93Å
262	L	46.4	Very low	45.1	Very low	97 Å²	97	101.7 Å²	101.7	51%	0.508	53%	0.525	S	S	.	.	H	α-helix	trans	-77.2	-34.3	175.2	-77.9	169.6	0	0	0	112.1	I236 H258 I259 A265 S266	I236-L262 HydrophobicContact CD1-CD1 4.44Å; H258-L262 PolarHBondContact O-N 2.95Å; I259-L262 PolarHBondContact O-N 2.93Å; L262-A265 WeakPolarHBondContact O-CB 3.46Å; L262-A265 PolarHBondContact O-N 2.81Å; L262-S266 PolarHBondContact O-N 2.98Å
263	L	39.6	Very low	46.7	Very low	37 Å²	37	97.1 Å²	97.1	19%	0.194	50%	0.496	C	S	.	.	H	α-helix	trans	-70.2	-37.9	171.4	-69.9	151.6	0	0	0	111.6	I259 A265 S266 M267 P297 Y299	I259-L263 HydrophobicContact CG2-CD1 3.61Å; I259-L263 HydrophobicContact CG2-CG 4.47Å; I259-L263 WeakPolarHBondContact O-CD1 3.39Å; I259-L263 WeakPolarHBondContact O-CG 3.25Å; I259-L263 PolarHBondContact O-N 2.83Å; L263-A265 PolarHBondContact O-N 3.23Å; L263-S266 PolarHBondContact O-N 2.77Å; L263-M267 VanDerWaalsContact O-CB 3.3Å; L263-M267 WeakPolarHBondContact O-CB 3.47Å; L263-M267 WeakPolarHBondContact O-CG 3.22Å; L263-M267 PolarHBondContact O-N 3.18Å; L263-P297 HydrophobicContact CD1-CB 4.45Å; L263-P297 HydrophobicContact CD1-CG 3.64Å; L263-P297 HydrophobicContact CD2-CG 4.35Å; L263-Y299 WeakPolarHBondContact CB-OH 3.36Å; L263-Y299 HydrophobicContact CD1-CE1 4.25Å; L263-Y299 WeakPolarHBondContact CD1-OH 3.5Å
264	K	44.6	Very low	48.3	Very low	117 Å²	117	91 Å²	91	51%	0.509	47%	0.47	S	S	.	.	H	α-helix	trans	-55.9	-30.4	168.1	-81.7	175.7	179.9	-178.5	0	113.1	L260 M267	L260-K264 WeakPolarHBondContact O-CB 3.29Å; L260-K264 VanDerWaalsContact O-CG 3.24Å; L260-K264 WeakPolarHBondContact O-CG 3.41Å; L260-K264 PolarHBondContact O-N 2.78Å; K264-M267 HydrophobicContact CG-CE 4.24Å
265	A	46.4	Very low	49.7	Very low	58 Å²	58	87.2 Å²	87.2	48%	0.479	45%	0.452	S	S	.	.	H	α-helix	trans	-81.9	-34.6	176.7	0	0	0	0	0	113.3	N261 L262 L263	N261-A265 PolarHBondContact O-N 2.93Å; L262-A265 WeakPolarHBondContact O-CB 3.46Å; L262-A265 PolarHBondContact O-N 2.81Å; L263-A265 PolarHBondContact O-N 3.23Å
266	S	44.7	Very low	51.4	Low	32 Å²	32	88.5 Å²	88.5	22%	0.224	45%	0.449	C	S	.	.	H	α-helix	trans	-79.3	-23.6	176.9	94.5	0	0	0	0	113.4	L262 L263 R268	L262-S266 PolarHBondContact O-N 2.98Å; L263-S266 PolarHBondContact O-N 2.77Å; S266-R268 PolarHBondContact O-N 3.43Å
267	M	41.9	Very low	53.2	Low	73 Å²	73	82.8 Å²	82.8	36%	0.36	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-0.1	178.6	-75.9	-168.8	-44.8	0	0	114.6	L263 K264 S269 Y299 I300	L263-M267 VanDerWaalsContact O-CB 3.3Å; L263-M267 WeakPolarHBondContact O-CB 3.47Å; L263-M267 WeakPolarHBondContact O-CG 3.22Å; L263-M267 PolarHBondContact O-N 3.18Å; K264-M267 HydrophobicContact CG-CE 4.24Å; M267-S269 VanDerWaalsContact C-N 3.34Å; M267-Y299 HydrophobicContact CE-CD2 4.32Å; M267-Y299 HydrophobicContact CE-CE2 3.45Å; M267-Y299 VanDerWaalsContact CE-CE2 3.45Å; M267-Y299 HydrophobicContact SD-CE2 3.71Å; M267-I300 HydrophobicContact SD-CD1 3.49Å; M267-I300 WeakPolarHBondContact SD-CD1 3.32Å; M267-I300 HydrophobicContact SD-CG1 3.74Å
268	R	49	Very low	54.8	Low	222 Å²	222	75.9 Å²	75.9	84%	0.838	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-7.3	176.2	-71.6	-175.6	178.3	145.3	-1.7	114.1	S266	S266-R268 PolarHBondContact O-N 3.43Å
269	S	54.6	Low	56.3	Low	56 Å²	56	74.3 Å²	74.3	39%	0.392	39%	0.39	S	S	.	.			trans	-119	114.8	174.3	-170.9	0	0	0	0	109.6	M267 A271 L272	M267-S269 VanDerWaalsContact C-N 3.34Å; S269-A271 PolarHBondContact O-N 3.11Å; S269-L272 PolarHBondContact O-N 2.94Å
270	S	58.9	Low	57.9	Low	89 Å²	89	71.6 Å²	71.6	62%	0.622	38%	0.377	S	S	*	.	H	α-helix	trans	-54.4	-38	179.9	57.9	0	0	0	0	112.2	L272 F273 E274	S270-L272 VanDerWaalsContact C-N 3.32Å; S270-L272 PolarHBondContact O-N 3.41Å; S270-F273 PolarHBondContact O-N 3.17Å; S270-E274 PolarHBondContact O-N 2.77Å; S270-E274 VanDerWaalsContact O-N 3.07Å
271	A	62.6	Low	59.5	Low	47 Å²	47	69.2 Å²	69.2	39%	0.388	36%	0.364	S	S	.	.	H	α-helix	trans	-59.4	-37.8	-179.3	0	0	0	0	0	113.4	S269 F273 E274 E275	S269-A271 PolarHBondContact O-N 3.11Å; A271-F273 VanDerWaalsContact C-N 3.3Å; A271-F273 PolarHBondContact O-N 3.4Å; A271-E274 PolarHBondContact O-N 3.01Å; A271-E275 WeakPolarHBondContact O-CG 3.42Å; A271-E275 PolarHBondContact O-N 3.49Å
272	L	62.3	Low	60.8	Low	75 Å²	75	72.7 Å²	72.7	39%	0.393	37%	0.37	S	S	.	.	H	α-helix	trans	-69.6	-32.1	179	-67.1	178.8	0	0	0	111.6	S269 S270 Q276	S269-L272 PolarHBondContact O-N 2.94Å; S270-L272 VanDerWaalsContact C-N 3.32Å; S270-L272 PolarHBondContact O-N 3.41Å; L272-Q276 WeakPolarHBondContact O-CB 3.33Å; L272-Q276 VanDerWaalsContact O-CG 3.22Å; L272-Q276 WeakPolarHBondContact O-CG 3.47Å; L272-Q276 PolarHBondContact O-N 3.26Å
273	F	66.1	Low	61.4	Low	26 Å²	26	70.7 Å²	70.7	11%	0.114	36%	0.362	C	S	.	.	H	α-helix	trans	-72.9	-42.7	177.9	-167.7	-115.9	0	0	0	110.8	S270 A271 E275 Q276 M277 I300 V304 V305 A308	S270-F273 PolarHBondContact O-N 3.17Å; A271-F273 VanDerWaalsContact C-N 3.3Å; A271-F273 PolarHBondContact O-N 3.4Å; F273-E275 PolarHBondContact O-N 3.17Å; F273-Q276 WeakPolarHBondContact O-CB 3.45Å; F273-Q276 PolarHBondContact O-N 2.95Å; F273-M277 HydrophobicContact CD1-CG 4.38Å; F273-M277 HydrophobicContact CE1-CG 4.23Å; F273-M277 HydrophobicContact CE1-SD 4.43Å; F273-M277 HydrophobicContact CZ-CG 4.42Å; F273-M277 HydrophobicContact CZ-SD 4.12Å; F273-M277 VanDerWaalsContact O-CG 3.27Å; F273-M277 WeakPolarHBondContact O-CG 3.14Å; F273-M277 PolarHBondContact O-N 3.31Å; F273-I300 HydrophobicContact CE2-CD1 4.2Å; F273-I300 HydrophobicContact CZ-CG2 4.48Å; F273-V304 HydrophobicContact CE1-CG1 4.33Å; F273-V305 HydrophobicContact CZ-CG2 4.27Å; F273-A308 HydrophobicContact CD1-CB 3.37Å; F273-A308 HydrophobicContact CE1-CB 3.33Å
274	E	69.7	Low	62.4	Low	55 Å²	55	74.3 Å²	74.3	26%	0.257	38%	0.381	S	S	.	.	H	α-helix	trans	-58.2	-45.5	172.6	-69.7	168.5	-133.9	0	0	112	S270 A271 Q276 M277 L278 V312	S270-E274 PolarHBondContact O-N 2.77Å; S270-E274 VanDerWaalsContact O-N 3.07Å; A271-E274 PolarHBondContact O-N 3.01Å; E274-Q276 VanDerWaalsContact C-N 3.33Å; E274-Q276 PolarHBondContact O-N 3.11Å; E274-M277 PolarHBondContact O-N 3.28Å; E274-L278 WeakPolarHBondContact O-CB 3.48Å; E274-L278 WeakPolarHBondContact O-CG 3.4Å; E274-L278 PolarHBondContact O-N 3.44Å; E274-V312 HydrophobicContact CB-CG1 4.18Å; E274-V312 HydrophobicContact CG-CG1 4.49Å
275	E	71.6	Confident	63.5	Low	114 Å²	114	74.4 Å²	74.4	53%	0.533	38%	0.382	S	S	.	.	H	α-helix	trans	-62.1	-39.1	174.9	-76.8	-175.7	-178	0	0	112.4	A271 F273 L278 N279	A271-E275 WeakPolarHBondContact O-CG 3.42Å; A271-E275 PolarHBondContact O-N 3.49Å; F273-E275 PolarHBondContact O-N 3.17Å; E275-L278 PolarHBondContact O-N 3.13Å; E275-N279 WeakPolarHBondContact O-CB 3.4Å; E275-N279 PolarHBondContact O-N 2.62Å; E275-N279 PolarHBondContact O-ND2 2.95Å
276	Q	72	Confident	65.3	Low	78 Å²	78	72.2 Å²	72.2	36%	0.364	36%	0.362	S	S	.	.	H	α-helix	trans	-63	-43.6	173.7	-77.8	176.2	-13.6	0	0	111.4	L272 F273 E274 N279 I280	L272-Q276 WeakPolarHBondContact O-CB 3.33Å; L272-Q276 VanDerWaalsContact O-CG 3.22Å; L272-Q276 WeakPolarHBondContact O-CG 3.47Å; L272-Q276 PolarHBondContact O-N 3.26Å; F273-Q276 WeakPolarHBondContact O-CB 3.45Å; F273-Q276 PolarHBondContact O-N 2.95Å; E274-Q276 VanDerWaalsContact C-N 3.33Å; E274-Q276 PolarHBondContact O-N 3.11Å; Q276-N279 PolarHBondContact O-N 3.48Å; Q276-I280 VanDerWaalsContact O-CG1 3.29Å; Q276-I280 WeakPolarHBondContact O-CG1 3.36Å; Q276-I280 PolarHBondContact O-N 2.82Å
277	M	76.4	Confident	67.2	Low	1 Å²	1	71.3 Å²	71.3	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-64.3	-40.6	176.6	-64.8	-57.6	-66.5	0	0	111.7	F273 E274 N279 I280 L281 I292 I296 V305 A308 L309 V312	F273-M277 HydrophobicContact CD1-CG 4.38Å; F273-M277 HydrophobicContact CE1-CG 4.23Å; F273-M277 HydrophobicContact CE1-SD 4.43Å; F273-M277 HydrophobicContact CZ-CG 4.42Å; F273-M277 HydrophobicContact CZ-SD 4.12Å; F273-M277 VanDerWaalsContact O-CG 3.27Å; F273-M277 WeakPolarHBondContact O-CG 3.14Å; F273-M277 PolarHBondContact O-N 3.31Å; E274-M277 PolarHBondContact O-N 3.28Å; M277-N279 VanDerWaalsContact C-N 3.31Å; M277-N279 PolarHBondContact O-N 3.29Å; M277-I280 PolarHBondContact O-N 3.08Å; M277-I280 HydrophobicContact SD-CD1 4.29Å; M277-L281 WeakPolarHBondContact O-CB 3.16Å; M277-L281 WeakPolarHBondContact O-CG 3.36Å; M277-L281 PolarHBondContact O-N 3.22Å; M277-I292 HydrophobicContact CE-CG2 3.77Å; M277-I296 HydrophobicContact CE-CD1 4.11Å; M277-I296 HydrophobicContact SD-CD1 3.57Å; M277-I296 VanDerWaalsContact SD-CD1 3.57Å; M277-I296 HydrophobicContact SD-CG1 4.5Å; M277-V305 HydrophobicContact CE-CG1 4Å; M277-A308 HydrophobicContact CG-CB 4.16Å; M277-L309 HydrophobicContact CE-CB 3.82Å; M277-L309 HydrophobicContact CE-CD1 3.51Å; M277-L309 HydrophobicContact CE-CD2 4.38Å; M277-L309 HydrophobicContact CE-CG 4.08Å; M277-V312 HydrophobicContact CB-CG2 3.68Å
278	L	74.4	Confident	69.5	Low	30 Å²	30	72.9 Å²	72.9	16%	0.157	36%	0.356	C	S	.	.	H	α-helix	trans	-63	-35.2	173.2	-75.8	168.3	0	0	0	112.9	E274 E275 L281 V312 K322 Y326	E274-L278 WeakPolarHBondContact O-CB 3.48Å; E274-L278 WeakPolarHBondContact O-CG 3.4Å; E274-L278 PolarHBondContact O-N 3.44Å; E275-L278 PolarHBondContact O-N 3.13Å; L278-L281 CarbonylContact O-C 3.48Å; L278-L281 VanDerWaalsContact O-O 3.07Å; L278-V312 HydrophobicContact CD1-CG1 4.29Å; L278-V312 HydrophobicContact CD2-CB 3.78Å; L278-V312 HydrophobicContact CD2-CG1 4.06Å; L278-V312 HydrophobicContact CG-CB 3.96Å; L278-V312 HydrophobicContact CG-CG1 3.74Å; L278-K322 HydrophobicContact CD2-CD 4.34Å; L278-K322 HydrophobicContact CD2-CG 4.45Å; L278-Y326 HydrophobicContact CD1-CD1 3.99Å; L278-Y326 HydrophobicContact CD1-CE1 3.92Å; L278-Y326 HydrophobicContact CD2-CD1 3.76Å; L278-Y326 HydrophobicContact CD2-CD2 3.64Å; L278-Y326 HydrophobicContact CD2-CE1 4.16Å; L278-Y326 HydrophobicContact CD2-CE2 4.1Å; L278-Y326 HydrophobicContact CD2-CG 3.49Å; L278-Y326 VanDerWaalsContact CD2-CG 3.49Å
279	N	74.7	Confident	71.3	Confident	115 Å²	115	62.7 Å²	62.7	62%	0.615	32%	0.318	S	S	*	.	H	α-helix	trans	-75.1	-31.9	177.3	-77.3	-36.3	0	0	0	112.6	E275 Q276 M277 R282	E275-N279 WeakPolarHBondContact O-CB 3.4Å; E275-N279 PolarHBondContact O-N 2.62Å; E275-N279 PolarHBondContact O-ND2 2.95Å; Q276-N279 PolarHBondContact O-N 3.48Å; M277-N279 VanDerWaalsContact C-N 3.31Å; M277-N279 PolarHBondContact O-N 3.29Å; N279-R282 WeakPolarHBondContact O-CG 3.45Å
280	I	77.2	Confident	72.8	Confident	38 Å²	38	64.4 Å²	64.4	20%	0.195	32%	0.32	C	S	.	.	H	α-helix	trans	-68.9	-47.1	172	-68.2	164.6	0	0	0	109.5	Q276 M277 R282 L287 I292 F295 I296	Q276-I280 VanDerWaalsContact O-CG1 3.29Å; Q276-I280 WeakPolarHBondContact O-CG1 3.36Å; Q276-I280 PolarHBondContact O-N 2.82Å; M277-I280 PolarHBondContact O-N 3.08Å; M277-I280 HydrophobicContact SD-CD1 4.29Å; I280-R282 PolarHBondContact O-N 3.23Å; I280-L287 HydrophobicContact CG2-CD1 4.01Å; I280-I292 HydrophobicContact CG2-CG1 4.41Å; I280-I292 HydrophobicContact CG2-CG2 4.47Å; I280-F295 HydrophobicContact CD1-CB 4.05Å; I280-F295 HydrophobicContact CG1-CB 4.28Å; I280-F295 HydrophobicContact CG2-CD2 3.9Å; I280-F295 HydrophobicContact CG2-CG 4.46Å; I280-I296 HydrophobicContact CD1-CG1 4.08Å
281	L	73.2	Confident	74	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.005	30%	0.302	C	S	.	.	S	Bend	trans	-74.6	65.2	172.6	-65.3	178.2	0	0	0	111.2	M277 L278 L287 I292 L309 V312 W320 K322	M277-L281 WeakPolarHBondContact O-CB 3.16Å; M277-L281 WeakPolarHBondContact O-CG 3.36Å; M277-L281 PolarHBondContact O-N 3.22Å; L278-L281 CarbonylContact O-C 3.48Å; L278-L281 VanDerWaalsContact O-O 3.07Å; L281-L287 HydrophobicContact CD2-CD1 4.35Å; L281-I292 HydrophobicContact CD2-CD1 4.04Å; L281-L309 HydrophobicContact CD1-CD1 3.78Å; L281-L309 HydrophobicContact CD2-CD1 4.4Å; L281-L309 HydrophobicContact CG-CD1 4.3Å; L281-V312 HydrophobicContact CD1-CG2 3.83Å; L281-W320 HydrophobicContact CD2-CB 4.37Å; L281-K322 HydrophobicContact CB-CB 4.16Å; L281-K322 HydrophobicContact CB-CD 4.44Å; L281-K322 WeakPolarHBondContact O-CD 3.35Å
282	R	69.9	Low	75.1	Confident	166 Å²	166	60.4 Å²	60.4	63%	0.626	28%	0.284	S	S	*	.			trans	-57.1	145.8	171.8	-67.2	-171.3	-177.4	177.6	0.2	110.2	N279 I280 D284 K285	N279-R282 WeakPolarHBondContact O-CG 3.45Å; I280-R282 PolarHBondContact O-N 3.23Å; R282-D284 PolarHBondContact O-N 3.17Å; R282-K285 PolarHBondContact O-N 3.49Å
283	V	60	Low	76.1	Confident	55 Å²	55	59.1 Å²	59.1	33%	0.333	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-36.5	-172.9	176.5	0	0	0	0	112.9	V327	V283-V327 HydrophobicContact CG1-CG1 3.76Å; V283-V327 HydrophobicContact CG1-CG2 4.25Å; V283-V327 HydrophobicContact CG2-CG2 4.45Å
284	D	59.8	Low	76.9	Confident	112 Å²	112	62 Å²	62	60%	0.599	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	0.7	-172.7	-48.6	-35.9	0	0	0	114.5	R282	R282-D284 PolarHBondContact O-N 3.17Å
285	K	68.6	Low	77.4	Confident	119 Å²	119	64.3 Å²	64.3	52%	0.517	31%	0.306	S	S	.	.			trans	-119.9	112.4	-171.7	-65.5	-165.9	177.7	-169.9	0	112.3	R282 L287	R282-K285 PolarHBondContact O-N 3.49Å; K285-L287 HydrophobicContact CB-CD2 3.99Å; K285-L287 HydrophobicContact CB-CG 4.11Å; K285-L287 HydrophobicContact CD-CD2 4.37Å
286	I	83.3	Confident	77.8	Confident	12 Å²	12	59.3 Å²	59.3	6%	0.062	28%	0.283	C	S	.	.			trans	-81.5	117.6	160.5	-57.6	171.3	0	0	0	107.1	L319 V321 I384 L395 T397	I286-L319 HydrophobicContact CG2-CB 3.46Å; I286-L319 VanDerWaalsContact CG2-CB 3.46Å; I286-L319 HydrophobicContact CG2-CD1 3.7Å; I286-L319 HydrophobicContact CG2-CG 4.09Å; I286-V321 HydrophobicContact CG1-CG2 4.11Å; I286-V321 HydrophobicContact CG2-CG2 4.02Å; I286-I384 HydrophobicContact CD1-CG2 3.69Å; I286-I384 WeakPolarHBondContact CD1-O 3.29Å; I286-L395 HydrophobicContact CD1-CD2 3.83Å; I286-T397 PolarHBondContact O-OG1 3.42Å
287	L	85.9	Confident	78	Confident	14 Å²	14	57.6 Å²	57.6	7%	0.073	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-113.3	147.4	-172.4	-64.3	177	0	0	0	111.8	I280 L281 K285 E291 I292 W320	I280-L287 HydrophobicContact CG2-CD1 4.01Å; L281-L287 HydrophobicContact CD2-CD1 4.35Å; K285-L287 HydrophobicContact CB-CD2 3.99Å; K285-L287 HydrophobicContact CB-CG 4.11Å; K285-L287 HydrophobicContact CD-CD2 4.37Å; L287-E291 WeakPolarHBondContact CA-OE2 3.15Å; L287-E291 HydrophobicContact CD2-CB 4.5Å; L287-E291 WeakPolarHBondContact CD2-OE2 3.28Å; L287-I292 HydrophobicContact CB-CD1 4.12Å; L287-I292 HydrophobicContact CB-CG1 3.85Å; L287-I292 HydrophobicContact CD1-CG1 4.05Å; L287-W320 PolarHBondContact N-O 2.69Å; L287-W320 PolarHBondContact O-N 3.25Å
288	R	88.7	Confident	78	Confident	105 Å²	105	66.1 Å²	66.1	40%	0.396	32%	0.319	S	S	.	.			trans	-76.5	153.9	166.6	-68.7	174.3	-72.7	-172.4	0.6	109.9	E290 E291 I292 L319 T397 D400	R288-E290 PolarHBondContact O-N 3.33Å; R288-E291 HydrophobicContact CB-CG 4.12Å; R288-E291 IonicContact CZ-OE1 2.98Å; R288-E291 VanDerWaalsContact CZ-OE1 3.26Å; R288-E291 PolarHBondContact N-OE2 2.97Å; R288-E291 IonicContact NE-OE1 3.95Å; R288-E291 PolarHBondContact NE-OE1 3.13Å; R288-E291 IonicContact NH2-OE1 2.68Å; R288-E291 PolarHBondContact NH2-OE1 3.27Å; R288-E291 WeakPolarHBondContact O-CB 3.21Å; R288-E291 PolarHBondContact O-N 3.08Å; R288-E291 VanDerWaalsContact O-N 3.11Å; R288-I292 PolarHBondContact O-N 2.97Å; R288-I292 VanDerWaalsContact O-N 3.09Å; R288-L319 HydrophobicContact CB-CD2 4.49Å; R288-L319 HydrophobicContact CG-CD2 3.5Å; R288-L319 VanDerWaalsContact CG-CD2 3.5Å; R288-T397 HydrophobicContact CG-CG2 4.39Å; R288-D400 HydrophobicContact CG-CB 4.17Å
289	F	87.6	Confident	78.2	Confident	8 Å²	8	68.3 Å²	68.3	4%	0.035	33%	0.325	C	S	.	.	H	α-helix	trans	-61.3	-36.5	177.4	-179.2	-106.7	0	0	0	112.1	E291 I292 R293 D302 V305 L306 L309 F403 F407	F289-E291 VanDerWaalsContact C-N 3.27Å; F289-E291 PolarHBondContact O-N 3.41Å; F289-I292 PolarHBondContact O-N 3.05Å; F289-R293 VanDerWaalsContact O-CB 3.27Å; F289-R293 WeakPolarHBondContact O-CB 3.3Å; F289-R293 PolarHBondContact O-N 3.13Å; F289-D302 HydrophobicContact CZ-CB 4.18Å; F289-V305 HydrophobicContact CE2-CG1 4.05Å; F289-L306 HydrophobicContact CD2-CD2 3.76Å; F289-L306 HydrophobicContact CE2-CD1 4.38Å; F289-L306 HydrophobicContact CE2-CD2 3.36Å; F289-L306 HydrophobicContact CE2-CG 3.7Å; F289-L306 HydrophobicContact CZ-CD1 4.17Å; F289-L306 HydrophobicContact CZ-CD2 3.98Å; F289-L306 HydrophobicContact CZ-CG 3.95Å; F289-L309 HydrophobicContact CD2-CD2 4.13Å; F289-L309 HydrophobicContact CE2-CD2 4.44Å; F289-F403 HydrophobicContact CB-CD2 3.34Å; F289-F403 HydrophobicContact CB-CE2 3.56Å; F289-F403 HydrophobicContact CB-CG 4.42Å; F289-F403 HydrophobicContact CD1-CD2 4.17Å; F289-F403 HydrophobicContact CD1-CE2 4.06Å; F289-F403 HydrophobicContact CD2-CD2 4.47Å; F289-F403 AromaticContact CD2-CE2 3.82Å; F289-F403 HydrophobicContact CD2-CE2 3.82Å; F289-F403 AromaticContact CG-CD2 3.76Å; F289-F403 HydrophobicContact CG-CD2 3.76Å; F289-F403 AromaticContact CG-CE2 3.53Å; F289-F403 HydrophobicContact CG-CE2 3.53Å; F289-F407 AromaticContact CD1-CE2 3.93Å; F289-F407 HydrophobicContact CD1-CE2 3.93Å; F289-F407 AromaticContact CE1-CE2 3.64Å; F289-F407 HydrophobicContact CE1-CE2 3.64Å; F289-F407 HydrophobicContact CE1-CZ 4.03Å; F289-F407 HydrophobicContact CZ-CE2 4.29Å; F289-F407 HydrophobicContact CZ-CZ 4.48Å
290	E	84.9	Confident	78.3	Confident	93 Å²	93	63.5 Å²	63.5	44%	0.435	30%	0.3	S	S	.	.	H	α-helix	trans	-62.1	-35.3	176.4	-59.6	-167.4	152.2	0	0	112.3	R288 R293 S294 R406	R288-E290 PolarHBondContact O-N 3.33Å; E290-R293 PolarHBondContact O-N 3.4Å; E290-S294 PolarHBondContact O-N 3.47Å; E290-R406 IonicContact OE1-CZ 3.75Å; E290-R406 VanDerWaalsContact OE1-CZ 3.24Å; E290-R406 IonicContact OE1-NH1 3.39Å; E290-R406 PolarHBondContact OE1-NH1 2.87Å; E290-R406 IonicContact OE1-NH2 3.15Å; E290-R406 PolarHBondContact OE1-NH2 3.33Å
291	E	85.2	Confident	78.6	Confident	52 Å²	52	66.9 Å²	66.9	24%	0.243	32%	0.318	C	S	.	.	H	α-helix	trans	-68.6	-45.8	175.5	-65.3	169.2	167.1	0	0	110.5	L287 R288 F289 R293 S294 F295	L287-E291 WeakPolarHBondContact CA-OE2 3.15Å; L287-E291 HydrophobicContact CD2-CB 4.5Å; L287-E291 WeakPolarHBondContact CD2-OE2 3.28Å; R288-E291 HydrophobicContact CB-CG 4.12Å; R288-E291 IonicContact CZ-OE1 2.98Å; R288-E291 VanDerWaalsContact CZ-OE1 3.26Å; R288-E291 PolarHBondContact N-OE2 2.97Å; R288-E291 IonicContact NE-OE1 3.95Å; R288-E291 PolarHBondContact NE-OE1 3.13Å; R288-E291 IonicContact NH2-OE1 2.68Å; R288-E291 PolarHBondContact NH2-OE1 3.27Å; R288-E291 WeakPolarHBondContact O-CB 3.21Å; R288-E291 PolarHBondContact O-N 3.08Å; R288-E291 VanDerWaalsContact O-N 3.11Å; F289-E291 VanDerWaalsContact C-N 3.27Å; F289-E291 PolarHBondContact O-N 3.41Å; E291-R293 VanDerWaalsContact C-N 3.3Å; E291-R293 PolarHBondContact O-N 3.42Å; E291-S294 WeakPolarHBondContact O-CB 3.34Å; E291-S294 PolarHBondContact O-N 3.47Å; E291-S294 PolarHBondContact O-OG 2.75Å; E291-F295 WeakPolarHBondContact O-CD2 3.23Å; E291-F295 WeakPolarHBondContact O-CE2 3.5Å; E291-F295 PolarHBondContact O-N 3.46Å
292	I	85.4	Confident	79.2	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-59.4	-44.9	175.1	-63.9	170.7	0	0	0	110.1	M277 I280 L281 L287 R288 F289 S294 F295 I296 V305 L309 W320	M277-I292 HydrophobicContact CE-CG2 3.77Å; I280-I292 HydrophobicContact CG2-CG1 4.41Å; I280-I292 HydrophobicContact CG2-CG2 4.47Å; L281-I292 HydrophobicContact CD2-CD1 4.04Å; L287-I292 HydrophobicContact CB-CD1 4.12Å; L287-I292 HydrophobicContact CB-CG1 3.85Å; L287-I292 HydrophobicContact CD1-CG1 4.05Å; R288-I292 PolarHBondContact O-N 2.97Å; R288-I292 VanDerWaalsContact O-N 3.09Å; F289-I292 PolarHBondContact O-N 3.05Å; I292-S294 VanDerWaalsContact C-N 3.25Å; I292-S294 PolarHBondContact O-N 3.25Å; I292-F295 PolarHBondContact O-N 3.47Å; I292-F295 VanDerWaalsContact O-N 3.1Å; I292-I296 HydrophobicContact CG2-CD1 3.86Å; I292-I296 WeakPolarHBondContact O-CG1 3.31Å; I292-I296 PolarHBondContact O-N 2.85Å; I292-V305 HydrophobicContact CG2-CG1 4.45Å; I292-L309 HydrophobicContact CD1-CD1 3.93Å; I292-L309 HydrophobicContact CD1-CD2 3.83Å; I292-W320 HydrophobicContact CD1-CB 3.68Å; I292-W320 HydrophobicContact CD1-CG 3.95Å
293	R	83.1	Confident	79.9	Confident	47 Å²	47	68.6 Å²	68.6	18%	0.177	33%	0.333	C	S	.	.	H	α-helix	trans	-63.1	-31.9	179.5	-171.6	61.8	177.8	102	-8.4	112.5	F289 E290 E291 F295 I296 P297 Q298 I300 D302	F289-R293 VanDerWaalsContact O-CB 3.27Å; F289-R293 WeakPolarHBondContact O-CB 3.3Å; F289-R293 PolarHBondContact O-N 3.13Å; E290-R293 PolarHBondContact O-N 3.4Å; E291-R293 VanDerWaalsContact C-N 3.3Å; E291-R293 PolarHBondContact O-N 3.42Å; R293-F295 VanDerWaalsContact C-N 3.28Å; R293-F295 PolarHBondContact O-N 3.37Å; R293-I296 PolarHBondContact NH1-O 3.18Å; R293-I296 PolarHBondContact O-N 3.17Å; R293-P297 PolarHBondContact NH1-O 3.48Å; R293-Q298 PolarHBondContact NH2-O 2.93Å; R293-I300 PolarHBondContact NH2-O 2.98Å; R293-D302 IonicContact CZ-OD1 2.77Å; R293-D302 IonicContact NE-OD1 2.75Å; R293-D302 PolarHBondContact NE-OD1 3.26Å; R293-D302 IonicContact NH2-OD1 2.81Å; R293-D302 PolarHBondContact NH2-OD1 3.07Å
294	S	83.5	Confident	81.1	Confident	88 Å²	88	69.6 Å²	69.6	62%	0.615	34%	0.339	S	S	*	.	H	α-helix	trans	-67.5	-26.2	176.1	79.3	0	0	0	0	113.7	E290 E291 I292	E290-S294 PolarHBondContact O-N 3.47Å; E291-S294 WeakPolarHBondContact O-CB 3.34Å; E291-S294 PolarHBondContact O-N 3.47Å; E291-S294 PolarHBondContact O-OG 2.75Å; I292-S294 VanDerWaalsContact C-N 3.25Å; I292-S294 PolarHBondContact O-N 3.25Å
295	F	80.3	Confident	82.3	Confident	102 Å²	102	64.2 Å²	64.2	45%	0.447	31%	0.31	S	S	.	.	H	α-helix	trans	-82.7	-18.2	174.7	-63.2	-65.9	0	0	0	112.7	M244 I280 E291 I292 R293	M244-F295 HydrophobicContact CE-CE1 4.06Å; M244-F295 HydrophobicContact SD-CE1 4.21Å; I280-F295 HydrophobicContact CD1-CB 4.05Å; I280-F295 HydrophobicContact CG1-CB 4.28Å; I280-F295 HydrophobicContact CG2-CD2 3.9Å; I280-F295 HydrophobicContact CG2-CG 4.46Å; E291-F295 WeakPolarHBondContact O-CD2 3.23Å; E291-F295 WeakPolarHBondContact O-CE2 3.5Å; E291-F295 PolarHBondContact O-N 3.46Å; I292-F295 PolarHBondContact O-N 3.47Å; I292-F295 VanDerWaalsContact O-N 3.1Å; R293-F295 VanDerWaalsContact C-N 3.28Å; R293-F295 PolarHBondContact O-N 3.37Å
296	I	80.1	Confident	83.2	Confident	10 Å²	10	58.6 Å²	58.6	5%	0.051	29%	0.286	C	S	.	.	S	Bend	trans	-101.3	130.1	-175.6	-60.8	171.7	0	0	0	109.1	M277 I280 I292 R293 I300 V305	M277-I296 HydrophobicContact CE-CD1 4.11Å; M277-I296 HydrophobicContact SD-CD1 3.57Å; M277-I296 VanDerWaalsContact SD-CD1 3.57Å; M277-I296 HydrophobicContact SD-CG1 4.5Å; I280-I296 HydrophobicContact CD1-CG1 4.08Å; I292-I296 HydrophobicContact CG2-CD1 3.86Å; I292-I296 WeakPolarHBondContact O-CG1 3.31Å; I292-I296 PolarHBondContact O-N 2.85Å; R293-I296 PolarHBondContact NH1-O 3.18Å; R293-I296 PolarHBondContact O-N 3.17Å; I296-I300 HydrophobicContact CG2-CB 4.06Å; I296-I300 HydrophobicContact CG2-CD1 3.7Å; I296-I300 HydrophobicContact CG2-CG1 4.31Å; I296-I300 HydrophobicContact CG2-CG2 4.45Å; I296-V305 HydrophobicContact CD1-CB 4.25Å; I296-V305 HydrophobicContact CD1-CG1 3.36Å; I296-V305 HydrophobicContact CD1-CG2 3.88Å; I296-V305 HydrophobicContact CG2-CG2 3.96Å
297	P	75.6	Confident	83.4	Confident	42 Å²	42	64.8 Å²	64.8	27%	0.273	31%	0.312	S	S	.	.			trans	-52.4	142	177.8	-25.2	30.9	0	0	0	114.1	L263 R293 Y299 I300	L263-P297 HydrophobicContact CD1-CB 4.45Å; L263-P297 HydrophobicContact CD1-CG 3.64Å; L263-P297 HydrophobicContact CD2-CG 4.35Å; R293-P297 PolarHBondContact NH1-O 3.48Å; P297-Y299 HydrophobicContact CB-CD1 3.54Å; P297-Y299 HydrophobicContact CB-CE1 3.02Å; P297-Y299 HydrophobicContact CG-CE1 3.81Å; P297-Y299 PolarHBondContact O-N 3.3Å; P297-Y299 VanDerWaalsContact O-N 3.14Å; P297-I300 PolarHBondContact O-N 2.91Å
298	Q	77.2	Confident	83.3	Confident	180 Å²	180	64.4 Å²	64.4	84%	0.841	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-24.8	-172.4	-71.7	-176.7	5.1	0	0	115.2	R293 I300	R293-Q298 PolarHBondContact NH2-O 2.93Å; Q298-I300 PolarHBondContact O-N 3.37Å
299	Y	77.5	Confident	83.3	Confident	75 Å²	75	59.4 Å²	59.4	29%	0.294	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-8.2	-177.8	66	-95.3	0	0	0	114.3	L260 L263 M267 P297	L260-Y299 HydrophobicContact CD2-CD1 3.1Å; L260-Y299 HydrophobicContact CD2-CD2 4.4Å; L260-Y299 HydrophobicContact CD2-CE1 3.38Å; L260-Y299 HydrophobicContact CD2-CG 3.66Å; L260-Y299 HydrophobicContact CG-CD1 4.16Å; L260-Y299 HydrophobicContact CG-CE1 4.17Å; L263-Y299 WeakPolarHBondContact CB-OH 3.36Å; L263-Y299 HydrophobicContact CD1-CE1 4.25Å; L263-Y299 WeakPolarHBondContact CD1-OH 3.5Å; M267-Y299 HydrophobicContact CE-CD2 4.32Å; M267-Y299 HydrophobicContact CE-CE2 3.45Å; M267-Y299 VanDerWaalsContact CE-CE2 3.45Å; M267-Y299 HydrophobicContact SD-CE2 3.71Å; P297-Y299 HydrophobicContact CB-CD1 3.54Å; P297-Y299 HydrophobicContact CB-CE1 3.02Å; P297-Y299 HydrophobicContact CG-CE1 3.81Å; P297-Y299 PolarHBondContact O-N 3.3Å; P297-Y299 VanDerWaalsContact O-N 3.14Å
300	I	78.5	Confident	83.4	Confident	14 Å²	14	60.4 Å²	60.4	7%	0.072	30%	0.297	C	S	.	.	S	Bend	trans	-85.7	124.6	176.2	-57.9	179.9	0	0	0	108	M267 F273 R293 I296 P297 Q298 V304 V305	M267-I300 HydrophobicContact SD-CD1 3.49Å; M267-I300 WeakPolarHBondContact SD-CD1 3.32Å; M267-I300 HydrophobicContact SD-CG1 3.74Å; F273-I300 HydrophobicContact CE2-CD1 4.2Å; F273-I300 HydrophobicContact CZ-CG2 4.48Å; R293-I300 PolarHBondContact NH2-O 2.98Å; I296-I300 HydrophobicContact CG2-CB 4.06Å; I296-I300 HydrophobicContact CG2-CD1 3.7Å; I296-I300 HydrophobicContact CG2-CG1 4.31Å; I296-I300 HydrophobicContact CG2-CG2 4.45Å; P297-I300 PolarHBondContact O-N 2.91Å; Q298-I300 PolarHBondContact O-N 3.37Å; I300-V304 HydrophobicContact CG2-CB 4.19Å; I300-V304 HydrophobicContact CG2-CG1 4.33Å; I300-V305 HydrophobicContact CB-CG2 4.46Å; I300-V305 HydrophobicContact CG2-CG2 3.74Å
301	D	82.7	Confident	83.4	Confident	110 Å²	110	59.8 Å²	59.8	59%	0.588	30%	0.295	S	S	*	.			trans	-61.1	136.9	178	-66.2	-35.2	0	0	0	111.2	F303 V304 V305	D301-F303 PolarHBondContact O-N 3.05Å; D301-F303 VanDerWaalsContact O-N 3.11Å; D301-V304 HydrophobicContact CB-CG2 4.25Å; D301-V304 PolarHBondContact O-N 3.35Å; D301-V305 PolarHBondContact O-N 2.93Å
302	D	85.2	Confident	83.5	Confident	53 Å²	53	57.3 Å²	57.3	28%	0.283	28%	0.283	S	S	.	.	H	α-helix	trans	-55.4	-33.5	179.9	-70.5	4.5	0	0	0	111.6	F289 R293 V304 V305 L306 F407	F289-D302 HydrophobicContact CZ-CB 4.18Å; R293-D302 IonicContact CZ-OD1 2.77Å; R293-D302 IonicContact NE-OD1 2.75Å; R293-D302 PolarHBondContact NE-OD1 3.26Å; R293-D302 IonicContact NH2-OD1 2.81Å; R293-D302 PolarHBondContact NH2-OD1 3.07Å; D302-V304 PolarHBondContact O-N 3.16Å; D302-V305 WeakPolarHBondContact O-CB 3.49Å; D302-V305 PolarHBondContact O-N 3.47Å; D302-L306 HydrophobicContact CB-CD1 4.43Å; D302-L306 VanDerWaalsContact O-CB 3.31Å; D302-L306 WeakPolarHBondContact O-CB 3.18Å; D302-L306 WeakPolarHBondContact O-CD1 3.27Å; D302-L306 WeakPolarHBondContact O-CG 3.22Å; D302-L306 PolarHBondContact O-N 2.85Å; D302-F407 HydrophobicContact CB-CE1 4.42Å; D302-F407 HydrophobicContact CB-CZ 4.1Å
303	F	84.8	Confident	83.6	Confident	149 Å²	149	57.3 Å²	57.3	65%	0.654	28%	0.283	S	S	*	.	H	α-helix	trans	-62.9	-36.9	176.3	-67.8	-77.6	0	0	0	113.7	D301 L306 K307	D301-F303 PolarHBondContact O-N 3.05Å; D301-F303 VanDerWaalsContact O-N 3.11Å; F303-L306 PolarHBondContact O-N 2.79Å; F303-K307 WeakPolarHBondContact O-CB 3.27Å; F303-K307 PolarHBondContact O-N 3.44Å
304	V	84.5	Confident	84	Confident	76 Å²	76	55.3 Å²	55.3	46%	0.461	28%	0.276	S	S	.	.	H	α-helix	trans	-70.4	-43.2	177.7	178.5	0	0	0	0	109.7	F273 I300 D301 D302 L306 K307 A308	F273-V304 HydrophobicContact CE1-CG1 4.33Å; I300-V304 HydrophobicContact CG2-CB 4.19Å; I300-V304 HydrophobicContact CG2-CG1 4.33Å; D301-V304 HydrophobicContact CB-CG2 4.25Å; D301-V304 PolarHBondContact O-N 3.35Å; D302-V304 PolarHBondContact O-N 3.16Å; V304-L306 VanDerWaalsContact C-N 3.34Å; V304-L306 PolarHBondContact O-N 3.43Å; V304-K307 PolarHBondContact O-N 2.86Å; V304-A308 PolarHBondContact O-N 3.5Å; V304-A308 VanDerWaalsContact O-N 3.17Å
305	V	85.7	Confident	84.4	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-58.1	-49.1	174	179	0	0	0	0	110.3	F273 M277 F289 I292 I296 I300 D301 D302 K307 A308 L309	F273-V305 HydrophobicContact CZ-CG2 4.27Å; M277-V305 HydrophobicContact CE-CG1 4Å; F289-V305 HydrophobicContact CE2-CG1 4.05Å; I292-V305 HydrophobicContact CG2-CG1 4.45Å; I296-V305 HydrophobicContact CD1-CB 4.25Å; I296-V305 HydrophobicContact CD1-CG1 3.36Å; I296-V305 HydrophobicContact CD1-CG2 3.88Å; I296-V305 HydrophobicContact CG2-CG2 3.96Å; I300-V305 HydrophobicContact CB-CG2 4.46Å; I300-V305 HydrophobicContact CG2-CG2 3.74Å; D301-V305 PolarHBondContact O-N 2.93Å; D302-V305 WeakPolarHBondContact O-CB 3.49Å; D302-V305 PolarHBondContact O-N 3.47Å; V305-K307 PolarHBondContact O-N 2.54Å; V305-A308 PolarHBondContact O-N 2.85Å; V305-L309 WeakPolarHBondContact O-CB 3.48Å; V305-L309 PolarHBondContact O-N 3.28Å
306	L	88.2	Confident	84.7	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-64.5	-40.1	-177.4	-72.5	163.1	0	0	0	112	F289 D302 F303 V304 L309 E310 W320 F403 F407 I410	F289-L306 HydrophobicContact CD2-CD2 3.76Å; F289-L306 HydrophobicContact CE2-CD1 4.38Å; F289-L306 HydrophobicContact CE2-CD2 3.36Å; F289-L306 HydrophobicContact CE2-CG 3.7Å; F289-L306 HydrophobicContact CZ-CD1 4.17Å; F289-L306 HydrophobicContact CZ-CD2 3.98Å; F289-L306 HydrophobicContact CZ-CG 3.95Å; D302-L306 HydrophobicContact CB-CD1 4.43Å; D302-L306 VanDerWaalsContact O-CB 3.31Å; D302-L306 WeakPolarHBondContact O-CB 3.18Å; D302-L306 WeakPolarHBondContact O-CD1 3.27Å; D302-L306 WeakPolarHBondContact O-CG 3.22Å; D302-L306 PolarHBondContact O-N 2.85Å; F303-L306 PolarHBondContact O-N 2.79Å; V304-L306 VanDerWaalsContact C-N 3.34Å; V304-L306 PolarHBondContact O-N 3.43Å; L306-L309 PolarHBondContact O-N 3.09Å; L306-E310 WeakPolarHBondContact O-CG 3.13Å; L306-E310 PolarHBondContact O-N 3.06Å; L306-W320 HydrophobicContact CD2-CZ2 3.88Å; L306-F403 HydrophobicContact CD2-CE2 3.82Å; L306-F403 HydrophobicContact CD2-CZ 3.7Å; L306-F407 HydrophobicContact CD1-CD1 3.65Å; L306-F407 HydrophobicContact CD1-CD2 4.16Å; L306-F407 HydrophobicContact CD1-CE1 3.61Å; L306-F407 HydrophobicContact CD1-CE2 4.13Å; L306-F407 HydrophobicContact CD1-CG 3.93Å; L306-F407 HydrophobicContact CD1-CZ 3.86Å; L306-I410 HydrophobicContact CB-CD1 3.69Å; L306-I410 HydrophobicContact CD1-CD1 3.45Å; L306-I410 VanDerWaalsContact CD1-CD1 3.45Å; L306-I410 HydrophobicContact CD2-CD1 4.07Å; L306-I410 HydrophobicContact CG-CD1 3.9Å
307	K	86.4	Confident	85	Confident	141 Å²	141	50.5 Å²	50.5	61%	0.613	24%	0.242	S	C	*	.	H	α-helix	trans	-61.2	-47.8	176.4	-171.6	-179.9	177.7	-174.6	0	111.8	F303 V304 V305 L309 E310 E311	F303-K307 WeakPolarHBondContact O-CB 3.27Å; F303-K307 PolarHBondContact O-N 3.44Å; V304-K307 PolarHBondContact O-N 2.86Å; V305-K307 PolarHBondContact O-N 2.54Å; K307-L309 VanDerWaalsContact C-N 3.3Å; K307-L309 PolarHBondContact O-N 3.09Å; K307-E310 PolarHBondContact O-N 3.13Å; K307-E311 PolarHBondContact O-N 3.35Å
308	A	85.1	Confident	85.5	Confident	7 Å²	7	48.9 Å²	48.9	6%	0.058	23%	0.232	C	C	.	.	H	α-helix	trans	-66.4	-35.4	176.4	0	0	0	0	0	112	F273 M277 V304 V305 E310 E311 V312	F273-A308 HydrophobicContact CD1-CB 3.37Å; F273-A308 HydrophobicContact CE1-CB 3.33Å; M277-A308 HydrophobicContact CG-CB 4.16Å; V304-A308 PolarHBondContact O-N 3.5Å; V304-A308 VanDerWaalsContact O-N 3.17Å; V305-A308 PolarHBondContact O-N 2.85Å; A308-E310 VanDerWaalsContact C-N 3.34Å; A308-E310 PolarHBondContact O-N 2.89Å; A308-E311 WeakPolarHBondContact O-CB 3.24Å; A308-E311 PolarHBondContact O-N 2.94Å; A308-E311 VanDerWaalsContact O-N 3.15Å; A308-V312 WeakPolarHBondContact O-CG2 3.43Å; A308-V312 PolarHBondContact O-N 3.12Å
309	L	87.8	Confident	86.1	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-67.2	-33.9	179.4	-169.9	59	0	0	0	112.3	M277 L281 F289 I292 V305 L306 K307 E311 V312 G313 W320	M277-L309 HydrophobicContact CE-CB 3.82Å; M277-L309 HydrophobicContact CE-CD1 3.51Å; M277-L309 HydrophobicContact CE-CD2 4.38Å; M277-L309 HydrophobicContact CE-CG 4.08Å; L281-L309 HydrophobicContact CD1-CD1 3.78Å; L281-L309 HydrophobicContact CD2-CD1 4.4Å; L281-L309 HydrophobicContact CG-CD1 4.3Å; F289-L309 HydrophobicContact CD2-CD2 4.13Å; F289-L309 HydrophobicContact CE2-CD2 4.44Å; I292-L309 HydrophobicContact CD1-CD1 3.93Å; I292-L309 HydrophobicContact CD1-CD2 3.83Å; V305-L309 WeakPolarHBondContact O-CB 3.48Å; V305-L309 PolarHBondContact O-N 3.28Å; L306-L309 PolarHBondContact O-N 3.09Å; K307-L309 VanDerWaalsContact C-N 3.3Å; K307-L309 PolarHBondContact O-N 3.09Å; L309-E311 VanDerWaalsContact C-N 3.3Å; L309-V312 HydrophobicContact CD1-CG2 4.39Å; L309-V312 PolarHBondContact O-N 3.39Å; L309-G313 CarbonylContact O-C 3.51Å; L309-G313 VanDerWaalsContact O-CA 3.28Å; L309-G313 WeakPolarHBondContact O-CA 3.42Å; L309-G313 PolarHBondContact O-N 2.88Å; L309-W320 HydrophobicContact CB-CH2 4.27Å; L309-W320 HydrophobicContact CB-CZ2 4.5Å; L309-W320 HydrophobicContact CB-CZ3 4.32Å; L309-W320 HydrophobicContact CD1-CB 4.46Å; L309-W320 HydrophobicContact CD1-CD2 4.15Å; L309-W320 HydrophobicContact CD1-CE3 4.11Å; L309-W320 HydrophobicContact CD1-CG 4.33Å; L309-W320 HydrophobicContact CD2-CB 4.45Å; L309-W320 HydrophobicContact CD2-CD2 3.33Å; L309-W320 HydrophobicContact CD2-CE3 3.91Å; L309-W320 HydrophobicContact CD2-CG 3.59Å; L309-W320 HydrophobicContact CD2-CH2 4.15Å; L309-W320 HydrophobicContact CD2-CZ2 3.66Å; L309-W320 HydrophobicContact CD2-CZ3 4.27Å; L309-W320 HydrophobicContact CG-CD2 3.49Å; L309-W320 VanDerWaalsContact CG-CD2 3.49Å; L309-W320 HydrophobicContact CG-CE3 3.49Å; L309-W320 VanDerWaalsContact CG-CE3 3.49Å; L309-W320 HydrophobicContact CG-CG 4.06Å; L309-W320 HydrophobicContact CG-CH2 3.91Å; L309-W320 HydrophobicContact CG-CZ2 3.96Å; L309-W320 HydrophobicContact CG-CZ3 3.69Å
310	E	88.9	Confident	86.7	Confident	28 Å²	28	36.7 Å²	36.7	13%	0.131	18%	0.178	C	C	.	.	H	α-helix	trans	-68.1	-27.3	171.3	-71.9	-174.4	160.9	0	0	113.7	L306 K307 A308 W320 K323 I410 R413	L306-E310 WeakPolarHBondContact O-CG 3.13Å; L306-E310 PolarHBondContact O-N 3.06Å; K307-E310 PolarHBondContact O-N 3.13Å; A308-E310 VanDerWaalsContact C-N 3.34Å; A308-E310 PolarHBondContact O-N 2.89Å; E310-W320 HydrophobicContact CG-CH2 3.77Å; E310-W320 HydrophobicContact CG-CZ3 4.37Å; E310-K323 VanDerWaalsContact O-CE 3.24Å; E310-K323 WeakPolarHBondContact O-CE 3.5Å; E310-K323 PolarHBondContact O-NZ 2.91Å; E310-I410 WeakPolarHBondContact OE1-CG2 3.37Å; E310-R413 VanDerWaalsContact CD-CZ 3.48Å; E310-R413 IonicContact OE1-CZ 2.88Å; E310-R413 IonicContact OE1-NE 2.69Å; E310-R413 PolarHBondContact OE1-NE 3.01Å; E310-R413 IonicContact OE1-NH2 2.95Å; E310-R413 PolarHBondContact OE1-NH2 3.37Å; E310-R413 IonicContact OE2-CZ 3.24Å; E310-R413 IonicContact OE2-NE 2.71Å; E310-R413 PolarHBondContact OE2-NE 3.2Å; E310-R413 VanDerWaalsContact OE2-NE 3.15Å; E310-R413 IonicContact OE2-NH1 3.17Å; E310-R413 IonicContact OE2-NH2 2.75Å; E310-R413 PolarHBondContact OE2-NH2 3.14Å
311	E	86.2	Confident	87.2	Confident	81 Å²	81	36.2 Å²	36.2	38%	0.379	18%	0.176	S	C	.	.	H	α-helix	trans	-73.3	-39.8	175.6	-71.6	173.9	175.6	0	0	110.9	K307 A308 L309 K323	K307-E311 PolarHBondContact O-N 3.35Å; A308-E311 WeakPolarHBondContact O-CB 3.24Å; A308-E311 PolarHBondContact O-N 2.94Å; A308-E311 VanDerWaalsContact O-N 3.15Å; L309-E311 VanDerWaalsContact C-N 3.3Å; E311-K323 WeakPolarHBondContact O-CD 3.27Å; E311-K323 VanDerWaalsContact O-CE 3.31Å; E311-K323 WeakPolarHBondContact O-CE 3.46Å; E311-K323 PolarHBondContact O-NZ 3.45Å
312	V	86.2	Confident	87.5	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-97.4	-22.1	-175.4	-57.6	0	0	0	0	115	E274 M277 L278 L281 A308 L309 K323 Y326	E274-V312 HydrophobicContact CB-CG1 4.18Å; E274-V312 HydrophobicContact CG-CG1 4.49Å; M277-V312 HydrophobicContact CB-CG2 3.68Å; L278-V312 HydrophobicContact CD1-CG1 4.29Å; L278-V312 HydrophobicContact CD2-CB 3.78Å; L278-V312 HydrophobicContact CD2-CG1 4.06Å; L278-V312 HydrophobicContact CG-CB 3.96Å; L278-V312 HydrophobicContact CG-CG1 3.74Å; L281-V312 HydrophobicContact CD1-CG2 3.83Å; A308-V312 WeakPolarHBondContact O-CG2 3.43Å; A308-V312 PolarHBondContact O-N 3.12Å; L309-V312 HydrophobicContact CD1-CG2 4.39Å; L309-V312 PolarHBondContact O-N 3.39Å; V312-K323 PolarHBondContact O-N 3.31Å; V312-K323 VanDerWaalsContact O-N 3.09Å; V312-Y326 HydrophobicContact CB-CE2 4.39Å
313	G	88.9	Confident	87.7	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	168.6	-171	0	0	0	0	0	113.5	L309 V321 K323	L309-G313 CarbonylContact O-C 3.51Å; L309-G313 VanDerWaalsContact O-CA 3.28Å; L309-G313 WeakPolarHBondContact O-CA 3.42Å; L309-G313 PolarHBondContact O-N 2.88Å; G313-V321 CarbonylContact C-O 3.56Å; G313-V321 WeakPolarHBondContact CA-O 3.4Å; G313-K323 WeakPolarHBondContact O-CE 3.28Å
314	V	90.6	Very high	87.9	Confident	5 Å²	5	25.3 Å²	25.3	3%	0.03	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	144	175.4	-162.8	0	0	0	0	108.8	V321 K323 W418	V314-V321 PolarHBondContact N-O 3.26Å; V314-V321 PolarHBondContact O-N 3.14Å; V314-K323 HydrophobicContact CG2-CB 4.45Å; V314-K323 HydrophobicContact CG2-CD 4.37Å; V314-K323 HydrophobicContact CG2-CG 3.4Å; V314-W418 HydrophobicContact CB-CZ2 4.02Å; V314-W418 HydrophobicContact CG1-CD2 4.5Å; V314-W418 VanDerWaalsContact CG1-CE2 3.42Å; V314-W418 HydrophobicContact CG1-CH2 4.17Å; V314-W418 HydrophobicContact CG1-CZ2 3.23Å
315	L	91.2	Very high	88	Confident	12 Å²	12	27 Å²	27	6%	0.063	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	128.7	178.4	-169.1	77	0	0	0	110.8	L319 W320 F403 A411 Q414 W418	L315-L319 CarbonylContact C-O 3.5Å; L315-L319 WeakPolarHBondContact CA-O 3.45Å; L315-W320 HydrophobicContact CB-CZ3 4.49Å; L315-W320 HydrophobicContact CD1-CD2 3.96Å; L315-W320 HydrophobicContact CD1-CG 4.2Å; L315-W320 HydrophobicContact CD1-CZ2 4.18Å; L315-F403 HydrophobicContact CD1-CD1 3.68Å; L315-F403 HydrophobicContact CD1-CE1 3.56Å; L315-F403 HydrophobicContact CD1-CZ 4.32Å; L315-F403 HydrophobicContact CD2-CD1 3.87Å; L315-F403 HydrophobicContact CD2-CE1 3.61Å; L315-F403 HydrophobicContact CG-CD1 4.41Å; L315-F403 HydrophobicContact CG-CE1 4.24Å; L315-A411 HydrophobicContact CD2-CB 4.29Å; L315-Q414 HydrophobicContact CB-CB 3.94Å; L315-Q414 HydrophobicContact CB-CG 3.72Å; L315-Q414 HydrophobicContact CD2-CB 4.31Å; L315-Q414 HydrophobicContact CD2-CG 4.36Å; L315-W418 PolarHBondContact O-NE1 3.23Å
316	V	88.5	Confident	87.9	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	109.7	176.6	-176.5	0	0	0	0	108.8	G318 L319 V321 L353 L395 W418	V316-G318 VanDerWaalsContact C-N 3.3Å; V316-G318 PolarHBondContact O-N 3.19Å; V316-L319 PolarHBondContact N-O 2.91Å; V316-L319 WeakPolarHBondContact O-CB 3.18Å; V316-L319 PolarHBondContact O-N 3.26Å; V316-V321 HydrophobicContact CB-CG2 4.32Å; V316-V321 HydrophobicContact CG2-CG2 4.15Å; V316-L353 HydrophobicContact CG2-CB 4.22Å; V316-L353 HydrophobicContact CG2-CD2 4.28Å; V316-L395 HydrophobicContact CG1-CD1 4.27Å; V316-W418 HydrophobicContact CG2-CZ2 3.85Å
317	R	85	Confident	87.6	Confident	86 Å²	86	30.5 Å²	30.5	33%	0.325	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	46.5	-178.2	-61.3	-168.5	63.8	-159.3	6.3	114.1	L319 Y356 P360 P399 D400	R317-L319 PolarHBondContact O-N 2.83Å; R317-Y356 WeakPolarHBondContact CD-O 3.46Å; R317-Y356 WeakPolarHBondContact CG-O 3.48Å; R317-P360 VanDerWaalsContact NH1-CA 3.33Å; R317-P360 VanDerWaalsContact NH1-CB 3.27Å; R317-P399 HydrophobicContact CB-CB 3.94Å; R317-P399 WeakPolarHBondContact O-CA 3.41Å; R317-D400 PolarHBondContact O-N 2.94Å; R317-D400 VanDerWaalsContact O-N 3.15Å
318	G	86.5	Confident	87.3	Confident	7 Å²	7	24 Å²	24	7%	0.072	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	-6.5	-179.7	0	0	0	0	0	115.2	V316 D400	V316-G318 VanDerWaalsContact C-N 3.3Å; V316-G318 PolarHBondContact O-N 3.19Å; G318-D400 WeakPolarHBondContact CA-O 3.25Å
319	L	89.4	Confident	86.7	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	145.3	179.5	-58.3	170	0	0	0	111.5	I286 R288 L315 V316 R317 L395 T397 D400	I286-L319 HydrophobicContact CG2-CB 3.46Å; I286-L319 VanDerWaalsContact CG2-CB 3.46Å; I286-L319 HydrophobicContact CG2-CD1 3.7Å; I286-L319 HydrophobicContact CG2-CG 4.09Å; R288-L319 HydrophobicContact CB-CD2 4.49Å; R288-L319 HydrophobicContact CG-CD2 3.5Å; R288-L319 VanDerWaalsContact CG-CD2 3.5Å; L315-L319 CarbonylContact C-O 3.5Å; L315-L319 WeakPolarHBondContact CA-O 3.45Å; V316-L319 PolarHBondContact N-O 2.91Å; V316-L319 WeakPolarHBondContact O-CB 3.18Å; V316-L319 PolarHBondContact O-N 3.26Å; R317-L319 PolarHBondContact O-N 2.83Å; L319-L395 HydrophobicContact CD1-CD1 4.41Å; L319-T397 HydrophobicContact CD1-CG2 4.39Å; L319-T397 HydrophobicContact CD2-CG2 3.97Å; L319-D400 HydrophobicContact CD2-CB 4.09Å
320	W	90.3	Very high	85.4	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	127.5	178	-74.4	97.1	0	0	0	111.2	L281 L287 I292 L306 L309 E310 L315 F403 I410	L281-W320 HydrophobicContact CD2-CB 4.37Å; L287-W320 PolarHBondContact N-O 2.69Å; L287-W320 PolarHBondContact O-N 3.25Å; I292-W320 HydrophobicContact CD1-CB 3.68Å; I292-W320 HydrophobicContact CD1-CG 3.95Å; L306-W320 HydrophobicContact CD2-CZ2 3.88Å; L309-W320 HydrophobicContact CB-CH2 4.27Å; L309-W320 HydrophobicContact CB-CZ2 4.5Å; L309-W320 HydrophobicContact CB-CZ3 4.32Å; L309-W320 HydrophobicContact CD1-CB 4.46Å; L309-W320 HydrophobicContact CD1-CD2 4.15Å; L309-W320 HydrophobicContact CD1-CE3 4.11Å; L309-W320 HydrophobicContact CD1-CG 4.33Å; L309-W320 HydrophobicContact CD2-CB 4.45Å; L309-W320 HydrophobicContact CD2-CD2 3.33Å; L309-W320 HydrophobicContact CD2-CE3 3.91Å; L309-W320 HydrophobicContact CD2-CG 3.59Å; L309-W320 HydrophobicContact CD2-CH2 4.15Å; L309-W320 HydrophobicContact CD2-CZ2 3.66Å; L309-W320 HydrophobicContact CD2-CZ3 4.27Å; L309-W320 HydrophobicContact CG-CD2 3.49Å; L309-W320 VanDerWaalsContact CG-CD2 3.49Å; L309-W320 HydrophobicContact CG-CE3 3.49Å; L309-W320 VanDerWaalsContact CG-CE3 3.49Å; L309-W320 HydrophobicContact CG-CG 4.06Å; L309-W320 HydrophobicContact CG-CH2 3.91Å; L309-W320 HydrophobicContact CG-CZ2 3.96Å; L309-W320 HydrophobicContact CG-CZ3 3.69Å; E310-W320 HydrophobicContact CG-CH2 3.77Å; E310-W320 HydrophobicContact CG-CZ3 4.37Å; L315-W320 HydrophobicContact CB-CZ3 4.49Å; L315-W320 HydrophobicContact CD1-CD2 3.96Å; L315-W320 HydrophobicContact CD1-CG 4.2Å; L315-W320 HydrophobicContact CD1-CZ2 4.18Å; W320-F403 AromaticContact CE2-CZ 3.96Å; W320-F403 HydrophobicContact CZ2-CE1 4.31Å; W320-F403 AromaticContact CZ2-CZ 3.8Å; W320-F403 HydrophobicContact CZ2-CZ 3.8Å; W320-F403 AromaticContact NE1-CE2 3.66Å; W320-F403 AromaticContact NE1-CZ 3.54Å; W320-I410 HydrophobicContact CH2-CG2 4.38Å; W320-I410 HydrophobicContact CZ2-CG2 4.25Å
321	V	89.6	Confident	84	Confident	4 Å²	4	34.6 Å²	34.6	2%	0.024	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	135.1	179.7	-171.4	0	0	0	0	109.3	I286 G313 V314 V316 K323 L353	I286-V321 HydrophobicContact CG1-CG2 4.11Å; I286-V321 HydrophobicContact CG2-CG2 4.02Å; G313-V321 CarbonylContact C-O 3.56Å; G313-V321 WeakPolarHBondContact CA-O 3.4Å; V314-V321 PolarHBondContact N-O 3.26Å; V314-V321 PolarHBondContact O-N 3.14Å; V316-V321 HydrophobicContact CB-CG2 4.32Å; V316-V321 HydrophobicContact CG2-CG2 4.15Å; V321-K323 PolarHBondContact O-N 3.37Å; V321-L353 HydrophobicContact CB-CD2 4.45Å; V321-L353 HydrophobicContact CG1-CD1 4.09Å; V321-L353 HydrophobicContact CG1-CD2 3.97Å; V321-L353 HydrophobicContact CG2-CD2 4.25Å
322	K	89.4	Confident	82.7	Confident	29 Å²	29	34.2 Å²	34.2	13%	0.126	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	131.4	174.6	-175.3	163.9	169	-179.7	0	111.4	L278 L281 Y326 V327 R349	L278-K322 HydrophobicContact CD2-CD 4.34Å; L278-K322 HydrophobicContact CD2-CG 4.45Å; L281-K322 HydrophobicContact CB-CB 4.16Å; L281-K322 HydrophobicContact CB-CD 4.44Å; L281-K322 WeakPolarHBondContact O-CD 3.35Å; K322-Y326 WeakPolarHBondContact CE-O 3.46Å; K322-Y326 PolarHBondContact NZ-O 2.91Å; K322-V327 HydrophobicContact CB-CG2 4.22Å; K322-V327 HydrophobicContact CD-CG2 4.08Å; K322-V327 HydrophobicContact CG-CG2 3.97Å; K322-R349 PolarHBondContact O-NH1 3.48Å; K322-R349 PolarHBondContact O-NH2 3.31Å
323	K	89.5	Confident	81.3	Confident	52 Å²	52	42.3 Å²	42.3	23%	0.226	22%	0.216	C	C	.	.			trans	-55.1	143.1	176.5	-75.2	173.5	-176.8	176	0	110.8	E310 E311 V312 G313 V314 V321 E325 Y326	E310-K323 VanDerWaalsContact O-CE 3.24Å; E310-K323 WeakPolarHBondContact O-CE 3.5Å; E310-K323 PolarHBondContact O-NZ 2.91Å; E311-K323 WeakPolarHBondContact O-CD 3.27Å; E311-K323 VanDerWaalsContact O-CE 3.31Å; E311-K323 WeakPolarHBondContact O-CE 3.46Å; E311-K323 PolarHBondContact O-NZ 3.45Å; V312-K323 PolarHBondContact O-N 3.31Å; V312-K323 VanDerWaalsContact O-N 3.09Å; G313-K323 WeakPolarHBondContact O-CE 3.28Å; V314-K323 HydrophobicContact CG2-CB 4.45Å; V314-K323 HydrophobicContact CG2-CD 4.37Å; V314-K323 HydrophobicContact CG2-CG 3.4Å; V321-K323 PolarHBondContact O-N 3.37Å; K323-E325 PolarHBondContact O-N 3.24Å; K323-Y326 HydrophobicContact CB-CD2 3.86Å; K323-Y326 HydrophobicContact CB-CE2 4.21Å; K323-Y326 HydrophobicContact CD-CE2 4.28Å; K323-Y326 PolarHBondContact O-N 3.5Å; K323-Y326 VanDerWaalsContact O-N 3.14Å
324	S	88.6	Confident	79.9	Confident	2 Å²	2	47 Å²	47	1%	0.014	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-63.1	-27.3	-175	-62.1	0	0	0	0	114.2	Y326 V327 F328 R349 D350	S324-Y326 VanDerWaalsContact C-N 3.28Å; S324-Y326 PolarHBondContact O-N 3.48Å; S324-V327 PolarHBondContact O-N 2.98Å; S324-V327 VanDerWaalsContact O-N 3.17Å; S324-F328 WeakPolarHBondContact O-CD2 3.47Å; S324-F328 PolarHBondContact O-N 2.98Å; S324-F328 VanDerWaalsContact O-N 3.09Å; S324-R349 WeakPolarHBondContact OG-CD 3.49Å; S324-R349 VanDerWaalsContact OG-CG 3.3Å; S324-R349 WeakPolarHBondContact OG-CG 3.24Å; S324-R349 PolarHBondContact OG-NH1 3.42Å; S324-R349 VanDerWaalsContact OG-NH1 3.09Å; S324-D350 WeakPolarHBondContact CB-OD1 3.23Å; S324-D350 PolarHBondContact OG-OD1 3.15Å
325	E	85.6	Confident	78.6	Confident	111 Å²	111	49 Å²	49	52%	0.519	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-59.9	-35.4	174.5	-65.8	171.2	-165	0	0	113.3	K323	K323-E325 PolarHBondContact O-N 3.24Å
326	Y	83.9	Confident	77.2	Confident	70 Å²	70	55 Å²	55	28%	0.275	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-88.4	-9.9	178.7	-58.4	-72.5	0	0	0	113.9	L278 V312 K322 K323 S324	L278-Y326 HydrophobicContact CD1-CD1 3.99Å; L278-Y326 HydrophobicContact CD1-CE1 3.92Å; L278-Y326 HydrophobicContact CD2-CD1 3.76Å; L278-Y326 HydrophobicContact CD2-CD2 3.64Å; L278-Y326 HydrophobicContact CD2-CE1 4.16Å; L278-Y326 HydrophobicContact CD2-CE2 4.1Å; L278-Y326 HydrophobicContact CD2-CG 3.49Å; L278-Y326 VanDerWaalsContact CD2-CG 3.49Å; V312-Y326 HydrophobicContact CB-CE2 4.39Å; K322-Y326 WeakPolarHBondContact CE-O 3.46Å; K322-Y326 PolarHBondContact NZ-O 2.91Å; K323-Y326 HydrophobicContact CB-CD2 3.86Å; K323-Y326 HydrophobicContact CB-CE2 4.21Å; K323-Y326 HydrophobicContact CD-CE2 4.28Å; K323-Y326 PolarHBondContact O-N 3.5Å; K323-Y326 VanDerWaalsContact O-N 3.14Å; S324-Y326 VanDerWaalsContact C-N 3.28Å; S324-Y326 PolarHBondContact O-N 3.48Å
327	V	82.5	Confident	75.9	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.024	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-40.7	175	169.2	0	0	0	0	110.8	V283 K322 S324 T329 R349	V283-V327 HydrophobicContact CG1-CG1 3.76Å; V283-V327 HydrophobicContact CG1-CG2 4.25Å; V283-V327 HydrophobicContact CG2-CG2 4.45Å; K322-V327 HydrophobicContact CB-CG2 4.22Å; K322-V327 HydrophobicContact CD-CG2 4.08Å; K322-V327 HydrophobicContact CG-CG2 3.97Å; S324-V327 PolarHBondContact O-N 2.98Å; S324-V327 VanDerWaalsContact O-N 3.17Å; V327-T329 PolarHBondContact O-N 3.32Å; V327-R349 VanDerWaalsContact CG2-CZ 3.48Å; V327-R349 VanDerWaalsContact CG2-NH1 3.29Å
328	F	79.1	Confident	75.1	Confident	5 Å²	5	57.2 Å²	57.2	2%	0.022	31%	0.31	C	S	.	.	S	Bend	trans	-95.9	68.5	172.7	-56.4	-75.3	0	0	0	108.6	S324 W335 R342 L345 I346 R349 L380	S324-F328 WeakPolarHBondContact O-CD2 3.47Å; S324-F328 PolarHBondContact O-N 2.98Å; S324-F328 VanDerWaalsContact O-N 3.09Å; F328-W335 AromaticContact CD1-CD1 3.49Å; F328-W335 VanDerWaalsContact CD1-CD1 3.49Å; F328-W335 AromaticContact CD1-CD2 3.97Å; F328-W335 HydrophobicContact CD1-CD2 3.97Å; F328-W335 AromaticContact CD1-CE2 3.52Å; F328-W335 AromaticContact CD1-CG 3.82Å; F328-W335 HydrophobicContact CD1-CG 3.82Å; F328-W335 HydrophobicContact CD1-CZ2 4.08Å; F328-W335 AromaticContact CD1-NE1 3.29Å; F328-W335 VanDerWaalsContact CD1-NE1 3.29Å; F328-W335 AromaticContact CE1-CD1 3.98Å; F328-W335 AromaticContact CE1-CD2 3.65Å; F328-W335 HydrophobicContact CE1-CD2 3.65Å; F328-W335 AromaticContact CE1-CE2 3.23Å; F328-W335 HydrophobicContact CE1-CE3 4.37Å; F328-W335 AromaticContact CE1-CG 3.97Å; F328-W335 HydrophobicContact CE1-CG 3.97Å; F328-W335 HydrophobicContact CE1-CH2 4.07Å; F328-W335 AromaticContact CE1-CZ2 3.42Å; F328-W335 HydrophobicContact CE1-CZ2 3.42Å; F328-W335 VanDerWaalsContact CE1-CZ2 3.42Å; F328-W335 AromaticContact CE1-NE1 3.56Å; F328-W335 HydrophobicContact CZ-CZ2 4.15Å; F328-R342 HydrophobicContact CB-CG 4.25Å; F328-R342 PolarHBondContact O-NE 2.91Å; F328-R342 PolarHBondContact O-NH2 3.14Å; F328-L345 HydrophobicContact CD1-CB 4.21Å; F328-L345 HydrophobicContact CD1-CD1 4.24Å; F328-L345 HydrophobicContact CD2-CB 4.45Å; F328-L345 HydrophobicContact CE1-CB 3.96Å; F328-L345 HydrophobicContact CE1-CD1 4.18Å; F328-L345 HydrophobicContact CE2-CB 4.2Å; F328-L345 HydrophobicContact CG-CB 4.47Å; F328-L345 HydrophobicContact CZ-CB 3.98Å; F328-I346 HydrophobicContact CB-CG1 4.24Å; F328-I346 HydrophobicContact CD2-CG1 3.71Å; F328-I346 HydrophobicContact CG-CG1 4.33Å; F328-R349 HydrophobicContact CE2-CB 3.98Å; F328-R349 HydrophobicContact CE2-CG 4.42Å; F328-L380 HydrophobicContact CE1-CD2 4.35Å; F328-L380 HydrophobicContact CZ-CD2 3.66Å
329	T	73.4	Confident	74.2	Confident	60 Å²	60	63 Å²	63	37%	0.368	35%	0.35	S	S	.	.			trans	-74.5	141.6	168	41.4	0	0	0	0	109.5	V327 D331 D332	V327-T329 PolarHBondContact O-N 3.32Å; T329-D331 PolarHBondContact O-N 3.19Å; T329-D332 PolarHBondContact O-N 3.19Å
330	G	60.4	Low	73.6	Confident	52 Å²	52	64 Å²	64	54%	0.536	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-16.4	-170.5	0	0	0	0	0	115.7
331	D	59.7	Low	73.3	Confident	146 Å²	146	67.8 Å²	67.8	78%	0.781	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-14.6	-175	-60.8	-29.3	0	0	0	114.1	T329 K333	T329-D331 PolarHBondContact O-N 3.19Å; D331-K333 PolarHBondContact O-N 3.43Å; D331-K333 VanDerWaalsContact O-N 3.16Å
332	D	57.9	Low	73	Confident	73 Å²	73	73.9 Å²	73.9	39%	0.39	40%	0.402	S	S	.	.			trans	-79.8	104.5	-176.9	-78.1	-22.8	0	0	0	111.5	T329 T334	T329-D332 PolarHBondContact O-N 3.19Å; D332-T334 PolarHBondContact O-N 3.47Å; D332-T334 VanDerWaalsContact O-N 3.07Å
333	K	58	Low	72.8	Confident	169 Å²	169	75.3 Å²	75.3	74%	0.735	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-10.2	178.9	-62.8	-176.2	-179.7	-178.6	0	114.5	D331 W335 Q336	D331-K333 PolarHBondContact O-N 3.43Å; D331-K333 VanDerWaalsContact O-N 3.16Å; K333-W335 VanDerWaalsContact C-N 3.3Å; K333-W335 PolarHBondContact O-N 2.79Å; K333-Q336 PolarHBondContact O-N 3.23Å
334	T	58.9	Low	72.7	Confident	100 Å²	100	75.5 Å²	75.5	61%	0.613	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-35.6	-174.5	49.5	0	0	0	0	112.5	D332	D332-T334 PolarHBondContact O-N 3.47Å; D332-T334 VanDerWaalsContact O-N 3.07Å
335	W	64.4	Low	72.7	Confident	46 Å²	46	75.6 Å²	75.6	17%	0.174	42%	0.421	C	S	.	.	S	Bend	trans	-93.5	-13.8	-175.8	-44.5	114.3	0	0	0	113.5	F328 K333 G337 W338 L345	F328-W335 AromaticContact CD1-CD1 3.49Å; F328-W335 VanDerWaalsContact CD1-CD1 3.49Å; F328-W335 AromaticContact CD1-CD2 3.97Å; F328-W335 HydrophobicContact CD1-CD2 3.97Å; F328-W335 AromaticContact CD1-CE2 3.52Å; F328-W335 AromaticContact CD1-CG 3.82Å; F328-W335 HydrophobicContact CD1-CG 3.82Å; F328-W335 HydrophobicContact CD1-CZ2 4.08Å; F328-W335 AromaticContact CD1-NE1 3.29Å; F328-W335 VanDerWaalsContact CD1-NE1 3.29Å; F328-W335 AromaticContact CE1-CD1 3.98Å; F328-W335 AromaticContact CE1-CD2 3.65Å; F328-W335 HydrophobicContact CE1-CD2 3.65Å; F328-W335 AromaticContact CE1-CE2 3.23Å; F328-W335 HydrophobicContact CE1-CE3 4.37Å; F328-W335 AromaticContact CE1-CG 3.97Å; F328-W335 HydrophobicContact CE1-CG 3.97Å; F328-W335 HydrophobicContact CE1-CH2 4.07Å; F328-W335 AromaticContact CE1-CZ2 3.42Å; F328-W335 HydrophobicContact CE1-CZ2 3.42Å; F328-W335 VanDerWaalsContact CE1-CZ2 3.42Å; F328-W335 AromaticContact CE1-NE1 3.56Å; F328-W335 HydrophobicContact CZ-CZ2 4.15Å; K333-W335 VanDerWaalsContact C-N 3.3Å; K333-W335 PolarHBondContact O-N 2.79Å; W335-G337 PolarHBondContact O-N 3.43Å; W335-G337 VanDerWaalsContact O-N 3.11Å; W335-W338 HydrophobicContact CB-CE3 3.84Å; W335-W338 HydrophobicContact CB-CZ3 4.07Å; W335-W338 HydrophobicContact CD2-CE3 4.25Å; W335-W338 HydrophobicContact CD2-CH2 4.03Å; W335-W338 AromaticContact CD2-CZ3 3.58Å; W335-W338 HydrophobicContact CD2-CZ3 3.58Å; W335-W338 HydrophobicContact CE3-CD2 4.42Å; W335-W338 AromaticContact CE3-CE3 3.68Å; W335-W338 HydrophobicContact CE3-CE3 3.68Å; W335-W338 AromaticContact CE3-CH2 2.89Å; W335-W338 HydrophobicContact CE3-CH2 2.89Å; W335-W338 AromaticContact CE3-CZ2 3.6Å; W335-W338 HydrophobicContact CE3-CZ2 3.6Å; W335-W338 AromaticContact CE3-CZ3 2.85Å; W335-W338 HydrophobicContact CE3-CZ3 2.85Å; W335-W338 HydrophobicContact CG-CE3 4.42Å; W335-W338 HydrophobicContact CG-CZ3 4.15Å; W335-W338 HydrophobicContact CH2-CH2 4.03Å; W335-W338 HydrophobicContact CH2-CZ3 4.39Å; W335-W338 HydrophobicContact CZ3-CE3 4.49Å; W335-W338 AromaticContact CZ3-CH2 2.89Å; W335-W338 HydrophobicContact CZ3-CH2 2.89Å; W335-W338 AromaticContact CZ3-CZ2 3.65Å; W335-W338 HydrophobicContact CZ3-CZ2 3.65Å; W335-W338 AromaticContact CZ3-CZ3 3.36Å; W335-W338 HydrophobicContact CZ3-CZ3 3.36Å; W335-W338 PolarHBondContact O-N 3.36Å; W335-W338 VanDerWaalsContact O-N 3.14Å; W335-L345 HydrophobicContact CB-CD1 3.91Å; W335-L345 HydrophobicContact CG-CD1 4.47Å
336	Q	60.8	Low	72.8	Confident	137 Å²	137	71.5 Å²	71.5	64%	0.64	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-15.2	178.1	-68.7	-179.8	-7.4	0	0	113	K333 W338	K333-Q336 PolarHBondContact O-N 3.23Å; Q336-W338 VanDerWaalsContact C-N 3.29Å; Q336-W338 PolarHBondContact O-N 3.09Å
337	G	61.4	Low	73.1	Confident	72 Å²	72	69.7 Å²	69.7	74%	0.742	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-8.9	175.9	0	0	0	0	0	114.7	W335	W335-G337 PolarHBondContact O-N 3.43Å; W335-G337 VanDerWaalsContact O-N 3.11Å
338	W	67.5	Low	73.5	Confident	62 Å²	62	69.5 Å²	69.5	24%	0.235	40%	0.396	C	S	.	.	S	Bend	trans	-96.2	143.7	178.7	-58.5	-40.9	0	0	0	111.5	W335 Q336 T340 L345 V376 S379	W335-W338 HydrophobicContact CB-CE3 3.84Å; W335-W338 HydrophobicContact CB-CZ3 4.07Å; W335-W338 HydrophobicContact CD2-CE3 4.25Å; W335-W338 HydrophobicContact CD2-CH2 4.03Å; W335-W338 AromaticContact CD2-CZ3 3.58Å; W335-W338 HydrophobicContact CD2-CZ3 3.58Å; W335-W338 HydrophobicContact CE3-CD2 4.42Å; W335-W338 AromaticContact CE3-CE3 3.68Å; W335-W338 HydrophobicContact CE3-CE3 3.68Å; W335-W338 AromaticContact CE3-CH2 2.89Å; W335-W338 HydrophobicContact CE3-CH2 2.89Å; W335-W338 AromaticContact CE3-CZ2 3.6Å; W335-W338 HydrophobicContact CE3-CZ2 3.6Å; W335-W338 AromaticContact CE3-CZ3 2.85Å; W335-W338 HydrophobicContact CE3-CZ3 2.85Å; W335-W338 HydrophobicContact CG-CE3 4.42Å; W335-W338 HydrophobicContact CG-CZ3 4.15Å; W335-W338 HydrophobicContact CH2-CH2 4.03Å; W335-W338 HydrophobicContact CH2-CZ3 4.39Å; W335-W338 HydrophobicContact CZ3-CE3 4.49Å; W335-W338 AromaticContact CZ3-CH2 2.89Å; W335-W338 HydrophobicContact CZ3-CH2 2.89Å; W335-W338 AromaticContact CZ3-CZ2 3.65Å; W335-W338 HydrophobicContact CZ3-CZ2 3.65Å; W335-W338 AromaticContact CZ3-CZ3 3.36Å; W335-W338 HydrophobicContact CZ3-CZ3 3.36Å; W335-W338 PolarHBondContact O-N 3.36Å; W335-W338 VanDerWaalsContact O-N 3.14Å; Q336-W338 VanDerWaalsContact C-N 3.29Å; Q336-W338 PolarHBondContact O-N 3.09Å; W338-T340 PolarHBondContact O-N 3.11Å; W338-L345 HydrophobicContact CE3-CD1 3.77Å; W338-L345 HydrophobicContact CE3-CD2 3.63Å; W338-L345 HydrophobicContact CE3-CG 4.34Å; W338-L345 HydrophobicContact CH2-CD2 4.44Å; W338-L345 HydrophobicContact CZ3-CD1 3.93Å; W338-L345 HydrophobicContact CZ3-CD2 3.41Å; W338-L345 VanDerWaalsContact CZ3-CD2 3.41Å; W338-L345 HydrophobicContact CZ3-CG 4.33Å; W338-V376 HydrophobicContact CB-CG2 4.21Å; W338-V376 HydrophobicContact CD2-CG1 3.85Å; W338-V376 HydrophobicContact CD2-CG2 4.2Å; W338-V376 HydrophobicContact CE3-CG1 3.81Å; W338-V376 HydrophobicContact CG-CG1 4.32Å; W338-V376 HydrophobicContact CG-CG2 3.88Å; W338-V376 HydrophobicContact CH2-CG1 3.81Å; W338-V376 HydrophobicContact CZ2-CG1 4.11Å; W338-V376 HydrophobicContact CZ3-CG1 3.74Å; W338-S379 WeakPolarHBondContact CZ2-OG 3.47Å
339	S	67.6	Low	74.1	Confident	129 Å²	129	69.5 Å²	69.5	90%	0.902	40%	0.396	S	S	*	.	S	Bend	trans	-71.2	30.5	175.2	-165.3	0	0	0	0	112.8
340	T	76.5	Confident	74.9	Confident	20 Å²	20	67.3 Å²	67.3	12%	0.123	38%	0.382	C	S	.	.	S	Bend	trans	-131.1	140.2	-166.9	-49.1	0	0	0	0	110.9	W338 Q344 M372	W338-T340 PolarHBondContact O-N 3.11Å; T340-Q344 HydrophobicContact CG2-CB 3.46Å; T340-Q344 VanDerWaalsContact CG2-CB 3.46Å; T340-Q344 HydrophobicContact CG2-CG 4.26Å; T340-M372 HydrophobicContact CG2-CE 3.36Å; T340-M372 HydrophobicContact CG2-CG 4.08Å; T340-M372 HydrophobicContact CG2-SD 4.34Å
341	T	84	Confident	76.3	Confident	80 Å²	80	65.1 Å²	65.1	49%	0.491	36%	0.358	S	S	.	.			trans	-73.6	153.1	-177.4	63.6	0	0	0	0	111.7	A343 Q344 L345	T341-A343 PolarHBondContact O-N 2.77Å; T341-Q344 WeakPolarHBondContact O-CB 3.23Å; T341-Q344 PolarHBondContact O-N 3.23Å; T341-Q344 VanDerWaalsContact O-N 3.08Å; T341-Q344 WeakPolarHBondContact OG1-CB 3.46Å; T341-Q344 VanDerWaalsContact OG1-CD 3.28Å; T341-Q344 VanDerWaalsContact OG1-CG 3.22Å; T341-Q344 WeakPolarHBondContact OG1-CG 3.31Å; T341-Q344 PolarHBondContact OG1-N 2.61Å; T341-Q344 PolarHBondContact OG1-OE1 3.13Å; T341-L345 PolarHBondContact O-N 3.05Å; T341-L345 VanDerWaalsContact O-N 3.07Å
342	R	83.8	Confident	77.7	Confident	132 Å²	132	58.2 Å²	58.2	50%	0.498	32%	0.321	S	S	.	.	H	α-helix	trans	-53.7	-41.5	175	-178.3	-177.2	178.1	-157.6	-2.4	112.2	F328 L345 I346	F328-R342 HydrophobicContact CB-CG 4.25Å; F328-R342 PolarHBondContact O-NE 2.91Å; F328-R342 PolarHBondContact O-NH2 3.14Å; R342-L345 PolarHBondContact O-N 3Å; R342-I346 HydrophobicContact CG-CD1 3.96Å; R342-I346 WeakPolarHBondContact O-CG1 3.48Å; R342-I346 PolarHBondContact O-N 3.38Å
343	A	85.9	Confident	79.3	Confident	59 Å²	59	54.8 Å²	54.8	49%	0.488	30%	0.303	S	S	.	.	H	α-helix	trans	-62.6	-42.2	178	0	0	0	0	0	111.8	T341 L345 I346 N347	T341-A343 PolarHBondContact O-N 2.77Å; A343-L345 VanDerWaalsContact C-N 3.35Å; A343-L345 PolarHBondContact O-N 2.81Å; A343-I346 PolarHBondContact O-N 3.47Å; A343-N347 WeakPolarHBondContact O-CB 3.3Å; A343-N347 PolarHBondContact O-N 2.98Å; A343-N347 PolarHBondContact O-OD1 3.07Å
344	Q	87	Confident	80.8	Confident	56 Å²	56	46.8 Å²	46.8	26%	0.262	27%	0.268	S	S	.	.	H	α-helix	trans	-63	-39.4	175.1	-75.9	167.3	-50	0	0	112.2	T340 T341 N347 A348 Y371 M372	T340-Q344 HydrophobicContact CG2-CB 3.46Å; T340-Q344 VanDerWaalsContact CG2-CB 3.46Å; T340-Q344 HydrophobicContact CG2-CG 4.26Å; T341-Q344 WeakPolarHBondContact O-CB 3.23Å; T341-Q344 PolarHBondContact O-N 3.23Å; T341-Q344 VanDerWaalsContact O-N 3.08Å; T341-Q344 WeakPolarHBondContact OG1-CB 3.46Å; T341-Q344 VanDerWaalsContact OG1-CD 3.28Å; T341-Q344 VanDerWaalsContact OG1-CG 3.22Å; T341-Q344 WeakPolarHBondContact OG1-CG 3.31Å; T341-Q344 PolarHBondContact OG1-N 2.61Å; T341-Q344 PolarHBondContact OG1-OE1 3.13Å; Q344-N347 PolarHBondContact O-N 2.79Å; Q344-A348 WeakPolarHBondContact O-CB 3.19Å; Q344-A348 PolarHBondContact O-N 2.97Å; Q344-Y371 HydrophobicContact CB-CE1 3.82Å; Q344-Y371 HydrophobicContact CG-CE1 3.89Å; Q344-M372 HydrophobicContact CB-CE 4Å; Q344-M372 WeakPolarHBondContact O-CE 3.38Å
345	L	88	Confident	82.2	Confident	5 Å²	5	42 Å²	42	3%	0.026	24%	0.239	C	C	.	.	H	α-helix	trans	-65.5	-42.8	176	-69.9	170.9	0	0	0	112.8	F328 W335 W338 T341 R342 A343 A348 R349 M372 V376 L380	F328-L345 HydrophobicContact CD1-CB 4.21Å; F328-L345 HydrophobicContact CD1-CD1 4.24Å; F328-L345 HydrophobicContact CD2-CB 4.45Å; F328-L345 HydrophobicContact CE1-CB 3.96Å; F328-L345 HydrophobicContact CE1-CD1 4.18Å; F328-L345 HydrophobicContact CE2-CB 4.2Å; F328-L345 HydrophobicContact CG-CB 4.47Å; F328-L345 HydrophobicContact CZ-CB 3.98Å; W335-L345 HydrophobicContact CB-CD1 3.91Å; W335-L345 HydrophobicContact CG-CD1 4.47Å; W338-L345 HydrophobicContact CE3-CD1 3.77Å; W338-L345 HydrophobicContact CE3-CD2 3.63Å; W338-L345 HydrophobicContact CE3-CG 4.34Å; W338-L345 HydrophobicContact CH2-CD2 4.44Å; W338-L345 HydrophobicContact CZ3-CD1 3.93Å; W338-L345 HydrophobicContact CZ3-CD2 3.41Å; W338-L345 VanDerWaalsContact CZ3-CD2 3.41Å; W338-L345 HydrophobicContact CZ3-CG 4.33Å; T341-L345 PolarHBondContact O-N 3.05Å; T341-L345 VanDerWaalsContact O-N 3.07Å; R342-L345 PolarHBondContact O-N 3Å; A343-L345 VanDerWaalsContact C-N 3.35Å; A343-L345 PolarHBondContact O-N 2.81Å; L345-A348 PolarHBondContact O-N 3.26Å; L345-R349 WeakPolarHBondContact O-CB 3.45Å; L345-R349 PolarHBondContact O-N 3.2Å; L345-M372 HydrophobicContact CD2-CE 3.67Å; L345-M372 HydrophobicContact CD2-SD 4.07Å; L345-M372 HydrophobicContact CG-CE 4.2Å; L345-V376 HydrophobicContact CD2-CG1 3.58Å; L345-L380 HydrophobicContact CD2-CD1 4.5Å
346	I	89.2	Confident	83.4	Confident	24 Å²	24	39.9 Å²	39.9	12%	0.123	23%	0.23	C	C	.	.	H	α-helix	trans	-60.7	-49.8	175.2	-71.1	168	0	0	0	109.9	F328 R342 A343 A348 R349 D350	F328-I346 HydrophobicContact CB-CG1 4.24Å; F328-I346 HydrophobicContact CD2-CG1 3.71Å; F328-I346 HydrophobicContact CG-CG1 4.33Å; R342-I346 HydrophobicContact CG-CD1 3.96Å; R342-I346 WeakPolarHBondContact O-CG1 3.48Å; R342-I346 PolarHBondContact O-N 3.38Å; A343-I346 PolarHBondContact O-N 3.47Å; I346-A348 PolarHBondContact O-N 3.3Å; I346-R349 PolarHBondContact O-N 3.19Å; I346-D350 WeakPolarHBondContact O-CB 3.13Å; I346-D350 PolarHBondContact O-N 2.69Å
347	N	90.3	Very high	84.7	Confident	32 Å²	32	35 Å²	35	17%	0.171	21%	0.208	C	C	.	.	H	α-helix	trans	-64.7	-39.4	-179.7	-69.6	-5.7	0	0	0	112.2	A343 Q344 D350 F351 Y371 F429	A343-N347 WeakPolarHBondContact O-CB 3.3Å; A343-N347 PolarHBondContact O-N 2.98Å; A343-N347 PolarHBondContact O-OD1 3.07Å; Q344-N347 PolarHBondContact O-N 2.79Å; N347-D350 PolarHBondContact O-N 3.29Å; N347-F351 VanDerWaalsContact O-CB 3.29Å; N347-F351 WeakPolarHBondContact O-CB 3.49Å; N347-F351 PolarHBondContact O-N 3.11Å; N347-Y371 PolarHBondContact ND2-OH 2.79Å; N347-F429 HydrophobicContact CB-CZ 4.47Å
348	A	90.3	Very high	85.8	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.4	-44	175.6	0	0	0	0	0	112	Q344 L345 I346 F351 I352 M372 W377 L380	Q344-A348 WeakPolarHBondContact O-CB 3.19Å; Q344-A348 PolarHBondContact O-N 2.97Å; L345-A348 PolarHBondContact O-N 3.26Å; I346-A348 PolarHBondContact O-N 3.3Å; A348-F351 WeakPolarHBondContact O-CB 3.27Å; A348-F351 PolarHBondContact O-N 3.05Å; A348-I352 WeakPolarHBondContact O-CG1 3.38Å; A348-I352 PolarHBondContact O-N 3.16Å; A348-M372 HydrophobicContact CB-CE 3.65Å; A348-M372 HydrophobicContact CB-SD 4.14Å; A348-W377 HydrophobicContact CB-CE3 4.08Å; A348-W377 HydrophobicContact CB-CH2 3.47Å; A348-W377 VanDerWaalsContact CB-CH2 3.47Å; A348-W377 HydrophobicContact CB-CZ2 4.09Å; A348-W377 HydrophobicContact CB-CZ3 3.48Å; A348-W377 VanDerWaalsContact CB-CZ3 3.48Å; A348-W377 WeakPolarHBondContact O-CZ3 3.12Å; A348-L380 HydrophobicContact CB-CD1 3.62Å
349	R	90.8	Very high	86.7	Confident	6 Å²	6	35.7 Å²	35.7	2%	0.023	19%	0.192	C	C	.	.	H	α-helix	trans	-63.5	-45.2	176	-175.7	167.4	-174.4	-105.6	3.3	111.5	K322 S324 V327 F328 L345 I346 F351 I352 L353 I384	K322-R349 PolarHBondContact O-NH1 3.48Å; K322-R349 PolarHBondContact O-NH2 3.31Å; S324-R349 WeakPolarHBondContact OG-CD 3.49Å; S324-R349 VanDerWaalsContact OG-CG 3.3Å; S324-R349 WeakPolarHBondContact OG-CG 3.24Å; S324-R349 PolarHBondContact OG-NH1 3.42Å; S324-R349 VanDerWaalsContact OG-NH1 3.09Å; V327-R349 VanDerWaalsContact CG2-CZ 3.48Å; V327-R349 VanDerWaalsContact CG2-NH1 3.29Å; F328-R349 HydrophobicContact CE2-CB 3.98Å; F328-R349 HydrophobicContact CE2-CG 4.42Å; L345-R349 WeakPolarHBondContact O-CB 3.45Å; L345-R349 PolarHBondContact O-N 3.2Å; I346-R349 PolarHBondContact O-N 3.19Å; R349-F351 VanDerWaalsContact C-N 3.29Å; R349-F351 PolarHBondContact O-N 3.03Å; R349-I352 PolarHBondContact O-N 3.02Å; R349-L353 WeakPolarHBondContact O-CG 3.35Å; R349-L353 PolarHBondContact O-N 2.91Å; R349-I384 HydrophobicContact CG-CD1 3.76Å
350	D	90.7	Very high	87.5	Confident	14 Å²	14	33 Å²	33	8%	0.075	17%	0.172	C	C	.	.	H	α-helix	trans	-65.2	-34.2	178	-79.1	10.1	0	0	0	111.8	S324 I346 N347 L353 Y354 R421 F425	S324-D350 WeakPolarHBondContact CB-OD1 3.23Å; S324-D350 PolarHBondContact OG-OD1 3.15Å; I346-D350 WeakPolarHBondContact O-CB 3.13Å; I346-D350 PolarHBondContact O-N 2.69Å; N347-D350 PolarHBondContact O-N 3.29Å; D350-L353 PolarHBondContact O-N 3.42Å; D350-Y354 WeakPolarHBondContact O-CB 3.47Å; D350-Y354 PolarHBondContact O-N 3.03Å; D350-R421 IonicContact OD2-CZ 2.73Å; D350-R421 IonicContact OD2-NH1 3.24Å; D350-R421 PolarHBondContact OD2-NH1 3.45Å; D350-F425 HydrophobicContact CB-CE1 3.92Å; D350-F425 HydrophobicContact CB-CZ 3.87Å
351	F	89.8	Confident	88	Confident	5 Å²	5	34.5 Å²	34.5	2%	0.022	18%	0.178	C	C	.	.	H	α-helix	trans	-64.5	-41.8	172.6	179.3	-108.8	0	0	0	112.8	N347 A348 R349 Y354 G355 V367 W377 F425 F429 V432 I438	N347-F351 VanDerWaalsContact O-CB 3.29Å; N347-F351 WeakPolarHBondContact O-CB 3.49Å; N347-F351 PolarHBondContact O-N 3.11Å; A348-F351 WeakPolarHBondContact O-CB 3.27Å; A348-F351 PolarHBondContact O-N 3.05Å; R349-F351 VanDerWaalsContact C-N 3.29Å; R349-F351 PolarHBondContact O-N 3.03Å; F351-Y354 PolarHBondContact O-N 2.91Å; F351-G355 PolarHBondContact O-N 2.93Å; F351-V367 HydrophobicContact CE1-CG1 4.46Å; F351-V367 HydrophobicContact CE1-CG2 4.33Å; F351-W377 AromaticContact CD1-CH2 3.89Å; F351-W377 HydrophobicContact CD1-CH2 3.89Å; F351-W377 HydrophobicContact CD1-CZ3 4.17Å; F351-F425 HydrophobicContact CB-CD1 4.23Å; F351-F425 HydrophobicContact CB-CE1 4.32Å; F351-F425 HydrophobicContact CD2-CB 4.26Å; F351-F425 HydrophobicContact CD2-CD1 4.3Å; F351-F425 HydrophobicContact CD2-CG 4.3Å; F351-F429 HydrophobicContact CB-CD2 4.12Å; F351-F429 HydrophobicContact CB-CE2 3.54Å; F351-F429 HydrophobicContact CB-CZ 3.8Å; F351-F429 AromaticContact CD2-CD2 3.6Å; F351-F429 HydrophobicContact CD2-CD2 3.6Å; F351-F429 AromaticContact CD2-CE2 3.94Å; F351-F429 HydrophobicContact CD2-CE2 3.94Å; F351-F429 HydrophobicContact CD2-CG 4.1Å; F351-F429 HydrophobicContact CE2-CB 4.34Å; F351-F429 HydrophobicContact CE2-CD2 4.16Å; F351-F429 HydrophobicContact CE2-CG 4.29Å; F351-F429 AromaticContact CG-CD2 3.82Å; F351-F429 HydrophobicContact CG-CD2 3.82Å; F351-F429 HydrophobicContact CG-CE1 4.48Å; F351-F429 AromaticContact CG-CE2 3.76Å; F351-F429 HydrophobicContact CG-CE2 3.76Å; F351-F429 HydrophobicContact CG-CG 4.24Å; F351-F429 HydrophobicContact CG-CZ 4.09Å; F351-V432 HydrophobicContact CD2-CG2 4.4Å; F351-V432 HydrophobicContact CE2-CG2 3.44Å; F351-V432 VanDerWaalsContact CE2-CG2 3.44Å; F351-V432 HydrophobicContact CZ-CG2 4.13Å; F351-I438 HydrophobicContact CZ-CD1 4.38Å
352	I	89.9	Confident	88.3	Confident	1 Å²	1	31 Å²	31	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-45.9	174.1	-69.1	163.7	0	0	0	110.6	A348 R349 Y354 G355 Y356 L362 W377 L380 F381	A348-I352 WeakPolarHBondContact O-CG1 3.38Å; A348-I352 PolarHBondContact O-N 3.16Å; R349-I352 PolarHBondContact O-N 3.02Å; I352-Y354 PolarHBondContact O-N 3.39Å; I352-G355 PolarHBondContact O-N 3Å; I352-Y356 HydrophobicContact CG2-CD2 3.72Å; I352-Y356 HydrophobicContact CG2-CE2 3.41Å; I352-Y356 VanDerWaalsContact CG2-CE2 3.41Å; I352-Y356 VanDerWaalsContact O-CD2 3.23Å; I352-Y356 WeakPolarHBondContact O-CD2 3.44Å; I352-Y356 PolarHBondContact O-N 3.36Å; I352-L362 HydrophobicContact CG2-CD1 4.32Å; I352-L362 WeakPolarHBondContact O-CD1 3.41Å; I352-W377 HydrophobicContact CD1-CE3 3.92Å; I352-W377 HydrophobicContact CD1-CZ3 4.01Å; I352-W377 HydrophobicContact CG1-CE3 4.26Å; I352-W377 HydrophobicContact CG1-CZ3 3.96Å; I352-L380 HydrophobicContact CD1-CB 3.61Å; I352-L380 HydrophobicContact CD1-CD1 4.38Å; I352-F381 HydrophobicContact CD1-CD1 4.46Å; I352-F381 HydrophobicContact CD1-CD2 4.33Å; I352-F381 HydrophobicContact CD1-CE1 4.44Å; I352-F381 HydrophobicContact CD1-CE2 4.3Å; I352-F381 HydrophobicContact CD1-CG 4.4Å; I352-F381 HydrophobicContact CD1-CZ 4.36Å; I352-F381 HydrophobicContact CG1-CE1 4.11Å; I352-F381 HydrophobicContact CG1-CE2 4.34Å; I352-F381 HydrophobicContact CG1-CZ 3.98Å; I352-F381 HydrophobicContact CG2-CD1 4.07Å; I352-F381 HydrophobicContact CG2-CE1 3.8Å; I352-F381 HydrophobicContact CG2-CZ 4.47Å
353	L	91	Very high	88.4	Confident	2 Å²	2	26.6 Å²	26.6	1%	0.01	15%	0.146	C	C	.	.	H	α-helix	trans	-63	-41.7	178.5	-66.6	176.3	0	0	0	111.9	V316 V321 R349 D350 Y356 M357 I384 W418	V316-L353 HydrophobicContact CG2-CB 4.22Å; V316-L353 HydrophobicContact CG2-CD2 4.28Å; V321-L353 HydrophobicContact CB-CD2 4.45Å; V321-L353 HydrophobicContact CG1-CD1 4.09Å; V321-L353 HydrophobicContact CG1-CD2 3.97Å; V321-L353 HydrophobicContact CG2-CD2 4.25Å; R349-L353 WeakPolarHBondContact O-CG 3.35Å; R349-L353 PolarHBondContact O-N 2.91Å; D350-L353 PolarHBondContact O-N 3.42Å; L353-Y356 PolarHBondContact O-N 3.07Å; L353-M357 PolarHBondContact O-N 2.74Å; L353-M357 VanDerWaalsContact O-N 3.16Å; L353-I384 HydrophobicContact CD2-CD1 4.22Å; L353-I384 HydrophobicContact CD2-CG2 3.89Å; L353-W418 HydrophobicContact CB-CH2 3.74Å; L353-W418 HydrophobicContact CB-CZ2 4.18Å; L353-W418 HydrophobicContact CD1-CH2 4.48Å
354	Y	89.8	Confident	88.3	Confident	1 Å²	1	25.1 Å²	25.1	0%	0.004	13%	0.13	C	C	.	.	H	α-helix	trans	-61.4	-42.6	172.4	175.2	-100.9	0	0	0	111.9	D350 F351 I352 Y356 M357 K358 W418 T422 F425 G436	D350-Y354 WeakPolarHBondContact O-CB 3.47Å; D350-Y354 PolarHBondContact O-N 3.03Å; F351-Y354 PolarHBondContact O-N 2.91Å; I352-Y354 PolarHBondContact O-N 3.39Å; Y354-Y356 VanDerWaalsContact C-N 3.29Å; Y354-Y356 PolarHBondContact O-N 3.24Å; Y354-M357 WeakPolarHBondContact O-CB 3.15Å; Y354-M357 PolarHBondContact O-N 3.26Å; Y354-K358 HydrophobicContact CE1-CG 4.32Å; Y354-K358 PolarHBondContact O-N 2.68Å; Y354-K358 WeakPolarHBondContact OH-CE 3.45Å; Y354-W418 HydrophobicContact CD2-CE3 4.27Å; Y354-T422 WeakPolarHBondContact CE2-OG1 3.27Å; Y354-T422 PolarHBondContact OH-OG1 3.47Å; Y354-F425 HydrophobicContact CD1-CD2 4Å; Y354-F425 HydrophobicContact CD1-CE2 4.41Å; Y354-F425 HydrophobicContact CD2-CD2 4.12Å; Y354-F425 AromaticContact CD2-CE2 4Å; Y354-F425 HydrophobicContact CD2-CE2 4Å; Y354-F425 AromaticContact CG-CD2 3.78Å; Y354-F425 HydrophobicContact CG-CD2 3.78Å; Y354-F425 AromaticContact CG-CE2 3.75Å; Y354-F425 HydrophobicContact CG-CE2 3.75Å; Y354-G436 PolarHBondContact OH-O 3.45Å
355	G	88.7	Confident	87.9	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-60.4	-39.7	176.1	0	0	0	0	0	112.4	F351 I352 M357 K358 K359 I438	F351-G355 PolarHBondContact O-N 2.93Å; I352-G355 PolarHBondContact O-N 3Å; G355-M357 PolarHBondContact O-N 2.77Å; G355-K358 PolarHBondContact O-N 3.45Å; G355-K359 PolarHBondContact O-N 3.2Å; G355-I438 VanDerWaalsContact CA-CD1 3.49Å
356	Y	89.2	Confident	87.5	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-67.2	-23.6	175	-79.2	-54.6	0	0	0	113.8	R317 I352 L353 Y354 K359 L362 F381 S385 W393 L395	R317-Y356 WeakPolarHBondContact CD-O 3.46Å; R317-Y356 WeakPolarHBondContact CG-O 3.48Å; I352-Y356 HydrophobicContact CG2-CD2 3.72Å; I352-Y356 HydrophobicContact CG2-CE2 3.41Å; I352-Y356 VanDerWaalsContact CG2-CE2 3.41Å; I352-Y356 VanDerWaalsContact O-CD2 3.23Å; I352-Y356 WeakPolarHBondContact O-CD2 3.44Å; I352-Y356 PolarHBondContact O-N 3.36Å; L353-Y356 PolarHBondContact O-N 3.07Å; Y354-Y356 VanDerWaalsContact C-N 3.29Å; Y354-Y356 PolarHBondContact O-N 3.24Å; Y356-K359 CarbonylContact C-O 3.38Å; Y356-K359 WeakPolarHBondContact CA-O 3.45Å; Y356-K359 VanDerWaalsContact O-O 3.13Å; Y356-L362 HydrophobicContact CD1-CD1 4.09Å; Y356-L362 HydrophobicContact CD1-CG 4.08Å; Y356-L362 HydrophobicContact CD2-CD1 4Å; Y356-L362 HydrophobicContact CE1-CB 4.23Å; Y356-L362 HydrophobicContact CE1-CD1 4.06Å; Y356-L362 HydrophobicContact CE1-CG 3.96Å; Y356-L362 HydrophobicContact CE2-CD1 4.02Å; Y356-L362 HydrophobicContact CG-CD1 4.03Å; Y356-L362 HydrophobicContact CG-CG 4.5Å; Y356-F381 HydrophobicContact CE2-CE1 4.44Å; Y356-S385 WeakPolarHBondContact OH-CB 3.29Å; Y356-S385 PolarHBondContact OH-OG 2.78Å; Y356-W393 VanDerWaalsContact CE1-O 3.24Å; Y356-W393 WeakPolarHBondContact CE1-O 3.31Å; Y356-W393 VanDerWaalsContact OH-C 3.3Å; Y356-W393 WeakPolarHBondContact OH-CB 3.35Å; Y356-W393 PolarHBondContact OH-O 3.09Å; Y356-L395 HydrophobicContact CD1-CD1 4.35Å; Y356-L395 HydrophobicContact CD1-CD2 4.08Å; Y356-L395 HydrophobicContact CD1-CG 3.71Å; Y356-L395 HydrophobicContact CD2-CD2 3.35Å; Y356-L395 HydrophobicContact CD2-CG 3.96Å; Y356-L395 HydrophobicContact CE1-CD2 4.4Å; Y356-L395 HydrophobicContact CE1-CG 4.11Å; Y356-L395 HydrophobicContact CE2-CD2 3.7Å; Y356-L395 HydrophobicContact CE2-CG 4.31Å; Y356-L395 HydrophobicContact CG-CD1 4.13Å; Y356-L395 HydrophobicContact CG-CD2 3.57Å; Y356-L395 HydrophobicContact CG-CG 3.65Å
357	M	87.2	Confident	87.1	Confident	34 Å²	34	30 Å²	30	17%	0.167	15%	0.146	C	C	.	.	H	α-helix	trans	-68.1	-40.5	172.4	-163.6	-172.8	-143.9	0	0	111.8	L353 Y354 G355 Q415 W418	L353-M357 PolarHBondContact O-N 2.74Å; L353-M357 VanDerWaalsContact O-N 3.16Å; Y354-M357 WeakPolarHBondContact O-CB 3.15Å; Y354-M357 PolarHBondContact O-N 3.26Å; G355-M357 PolarHBondContact O-N 2.77Å; M357-Q415 VanDerWaalsContact CE-CD 3.48Å; M357-W418 HydrophobicContact CE-CB 3.94Å; M357-W418 HydrophobicContact CE-CG 3.78Å; M357-W418 HydrophobicContact SD-CB 3.51Å; M357-W418 VanDerWaalsContact SD-CB 3.51Å; M357-W418 HydrophobicContact SD-CD2 4.44Å; M357-W418 HydrophobicContact SD-CG 3.58Å; M357-W418 VanDerWaalsContact SD-CG 3.58Å
358	K	85.3	Confident	86.6	Confident	103 Å²	103	29 Å²	29	45%	0.448	14%	0.141	S	C	.	.	H	α-helix	trans	-85.4	-34.9	-177	-61.5	-62.5	-176.4	-175.7	0	113.1	Y354 G355	Y354-K358 HydrophobicContact CE1-CG 4.32Å; Y354-K358 PolarHBondContact O-N 2.68Å; Y354-K358 WeakPolarHBondContact OH-CE 3.45Å; G355-K358 PolarHBondContact O-N 3.45Å
359	K	85.5	Confident	86	Confident	46 Å²	46	32.8 Å²	32.8	20%	0.2	17%	0.167	C	C	.	.			trans	-130.8	140.1	-177.2	-63.7	178	-172.4	165.1	0	110.8	G355 Y356 I361 L362 E366 I438	G355-K359 PolarHBondContact O-N 3.2Å; Y356-K359 CarbonylContact C-O 3.38Å; Y356-K359 WeakPolarHBondContact CA-O 3.45Å; Y356-K359 VanDerWaalsContact O-O 3.13Å; K359-I361 PolarHBondContact O-N 2.98Å; K359-L362 HydrophobicContact CB-CD2 4.3Å; K359-E366 IonicContact NZ-OE1 3.6Å; K359-E366 PolarHBondContact NZ-OE1 3.41Å; K359-E366 IonicContact NZ-OE2 2.7Å; K359-E366 PolarHBondContact NZ-OE2 2.99Å; K359-I438 PolarHBondContact NZ-O 3.49Å
360	P	85.2	Confident	85.4	Confident	73 Å²	73	37.1 Å²	37.1	47%	0.474	20%	0.199	S	C	.	.	S	Bend	trans	-68.2	-23.8	178	28.3	-35.8	0	0	0	113.5	R317	R317-P360 VanDerWaalsContact NH1-CA 3.33Å; R317-P360 VanDerWaalsContact NH1-CB 3.27Å
361	I	87.4	Confident	85	Confident	51 Å²	51	38.5 Å²	38.5	26%	0.262	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	131.6	-175.3	-55.8	177.8	0	0	0	107.2	K359 K391 W393	K359-I361 PolarHBondContact O-N 2.98Å; I361-K391 HydrophobicContact CD1-CB 3.99Å; I361-K391 HydrophobicContact CD1-CD 4.18Å; I361-K391 HydrophobicContact CG2-CB 4.28Å; I361-K391 WeakPolarHBondContact CG2-O 3.27Å; I361-W393 WeakPolarHBondContact CA-O 3.39Å
362	L	88.4	Confident	84.7	Confident	7 Å²	7	38.5 Å²	38.5	4%	0.037	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	135.9	176	-69	178.1	0	0	0	110.2	I352 Y356 K359 F381 W393 I438	I352-L362 HydrophobicContact CG2-CD1 4.32Å; I352-L362 WeakPolarHBondContact O-CD1 3.41Å; Y356-L362 HydrophobicContact CD1-CD1 4.09Å; Y356-L362 HydrophobicContact CD1-CG 4.08Å; Y356-L362 HydrophobicContact CD2-CD1 4Å; Y356-L362 HydrophobicContact CE1-CB 4.23Å; Y356-L362 HydrophobicContact CE1-CD1 4.06Å; Y356-L362 HydrophobicContact CE1-CG 3.96Å; Y356-L362 HydrophobicContact CE2-CD1 4.02Å; Y356-L362 HydrophobicContact CG-CD1 4.03Å; Y356-L362 HydrophobicContact CG-CG 4.5Å; K359-L362 HydrophobicContact CB-CD2 4.3Å; L362-F381 HydrophobicContact CB-CE1 3.93Å; L362-F381 HydrophobicContact CB-CZ 4.22Å; L362-F381 HydrophobicContact CD1-CE1 4.09Å; L362-F381 HydrophobicContact CD1-CZ 4.48Å; L362-W393 PolarHBondContact N-O 3.36Å; L362-W393 PolarHBondContact O-N 3.47Å; L362-I438 HydrophobicContact CD2-CD1 4.42Å
363	S	86.1	Confident	84.4	Confident	39 Å²	39	41.7 Å²	41.7	27%	0.273	22%	0.224	S	C	.	.			trans	-93	142.8	170.9	-179.9	0	0	0	0	109.7	R365 E366	S363-R365 PolarHBondContact O-N 2.96Å; S363-R365 PolarHBondContact OG-N 3.19Å; S363-E366 PolarHBondContact O-N 3.47Å
364	L	84.4	Confident	84.1	Confident	29 Å²	29	45 Å²	45	15%	0.152	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-58.4	-20.2	172.5	-170.7	66.5	0	0	0	111.9	L374 W377 R378 F381	L364-L374 HydrophobicContact CG-CD2 4.26Å; L364-W377 HydrophobicContact CD1-CB 3.84Å; L364-R378 HydrophobicContact CD1-CG 4.2Å; L364-R378 HydrophobicContact CD2-CG 3.58Å; L364-F381 HydrophobicContact CD1-CD2 3.75Å; L364-F381 HydrophobicContact CD1-CE2 3.7Å
365	R	78.7	Confident	83.9	Confident	157 Å²	157	50.2 Å²	50.2	59%	0.592	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-75.1	-20.4	175.4	-60.1	-173.1	-174.1	172.5	5.3	114.2	S363 V367 L448	S363-R365 PolarHBondContact O-N 2.96Å; S363-R365 PolarHBondContact OG-N 3.19Å; R365-V367 PolarHBondContact O-N 3.19Å; R365-L448 PolarHBondContact NH2-O 3.07Å
366	E	79.7	Confident	83.8	Confident	20 Å²	20	50.6 Å²	50.6	9%	0.093	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-79.4	-7.4	177.5	-64.5	-170.1	167.7	0	0	112.1	K359 S363 N431 I438	K359-E366 IonicContact NZ-OE1 3.6Å; K359-E366 PolarHBondContact NZ-OE1 3.41Å; K359-E366 IonicContact NZ-OE2 2.7Å; K359-E366 PolarHBondContact NZ-OE2 2.99Å; S363-E366 PolarHBondContact O-N 3.47Å; E366-N431 PolarHBondContact O-ND2 3.19Å; E366-I438 HydrophobicContact CB-CG2 3.84Å; E366-I438 HydrophobicContact CG-CG2 4.4Å
367	V	81.4	Confident	83.8	Confident	9 Å²	9	50.6 Å²	50.6	6%	0.055	27%	0.271	C	S	.	.	S	Bend	trans	-96.6	141	-175.9	-177.5	0	0	0	0	110.2	F351 R365 S369 W377 F381 N431	F351-V367 HydrophobicContact CE1-CG1 4.46Å; F351-V367 HydrophobicContact CE1-CG2 4.33Å; R365-V367 PolarHBondContact O-N 3.19Å; V367-S369 PolarHBondContact O-N 3.29Å; V367-W377 HydrophobicContact CB-CD2 4.45Å; V367-W377 HydrophobicContact CG1-CD2 3.16Å; V367-W377 HydrophobicContact CG1-CE3 3.36Å; V367-W377 HydrophobicContact CG1-CG 3.75Å; V367-W377 HydrophobicContact CG1-CH2 3.42Å; V367-W377 VanDerWaalsContact CG1-CH2 3.42Å; V367-W377 HydrophobicContact CG1-CZ2 3.24Å; V367-W377 HydrophobicContact CG1-CZ3 3.46Å; V367-W377 VanDerWaalsContact CG1-CZ3 3.46Å; V367-F381 HydrophobicContact CG2-CE2 3.78Å; V367-F381 HydrophobicContact CG2-CZ 3.77Å; V367-N431 VanDerWaalsContact C-ND2 3.31Å
368	D	79.5	Confident	83.8	Confident	13 Å²	13	54.5 Å²	54.5	7%	0.07	28%	0.284	C	S	.	.			trans	-73.7	101.8	-176	-163.2	-20.6	0	0	0	110.5	S370 Y371 W377 F429 S430 N431	D368-S370 PolarHBondContact O-N 3.01Å; D368-S370 VanDerWaalsContact OD1-CB 3.24Å; D368-S370 WeakPolarHBondContact OD1-CB 3.45Å; D368-S370 PolarHBondContact OD1-N 3.46Å; D368-S370 PolarHBondContact OD1-OG 3.44Å; D368-S370 PolarHBondContact OD2-OG 3.45Å; D368-Y371 PolarHBondContact O-N 2.85Å; D368-W377 PolarHBondContact O-NE1 3.06Å; D368-F429 HydrophobicContact CB-CD1 4.13Å; D368-S430 PolarHBondContact OD2-N 3.11Å; D368-S430 PolarHBondContact OD2-OG 3.4Å; D368-N431 PolarHBondContact N-ND2 3.2Å
369	S	77.4	Confident	83.9	Confident	78 Å²	78	51.7 Å²	51.7	55%	0.545	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-14.6	176.5	58.2	0	0	0	0	113.1	V367	V367-S369 PolarHBondContact O-N 3.29Å
370	S	77.3	Confident	84	Confident	98 Å²	98	49.5 Å²	49.5	69%	0.685	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-29.4	175.1	76.7	0	0	0	0	112.3	D368	D368-S370 PolarHBondContact O-N 3.01Å; D368-S370 VanDerWaalsContact OD1-CB 3.24Å; D368-S370 WeakPolarHBondContact OD1-CB 3.45Å; D368-S370 PolarHBondContact OD1-N 3.46Å; D368-S370 PolarHBondContact OD1-OG 3.44Å; D368-S370 PolarHBondContact OD2-OG 3.45Å
371	Y	82.4	Confident	84.2	Confident	43 Å²	43	46 Å²	46	17%	0.169	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-37.4	-179	-170.2	-97.4	0	0	0	112.5	Q344 N347 D368 W377 C428 F429	Q344-Y371 HydrophobicContact CB-CE1 3.82Å; Q344-Y371 HydrophobicContact CG-CE1 3.89Å; N347-Y371 PolarHBondContact ND2-OH 2.79Å; D368-Y371 PolarHBondContact O-N 2.85Å; Y371-W377 HydrophobicContact CD1-CZ2 4.18Å; Y371-C428 WeakPolarHBondContact CD2-O 3.43Å; Y371-C428 HydrophobicContact CE2-CB 4.28Å; Y371-F429 HydrophobicContact CD1-CD1 4.36Å; Y371-F429 AromaticContact CD1-CE1 3.44Å; Y371-F429 HydrophobicContact CD1-CE1 3.44Å; Y371-F429 VanDerWaalsContact CD1-CE1 3.44Å; Y371-F429 HydrophobicContact CD1-CZ 4.05Å; Y371-F429 HydrophobicContact CD2-CD1 4.3Å; Y371-F429 AromaticContact CD2-CE1 4Å; Y371-F429 HydrophobicContact CD2-CE1 4Å; Y371-F429 AromaticContact CE1-CE1 3.79Å; Y371-F429 HydrophobicContact CE1-CE1 3.79Å; Y371-F429 AromaticContact CE1-CZ 3.9Å; Y371-F429 HydrophobicContact CE1-CZ 3.9Å; Y371-F429 HydrophobicContact CE2-CE1 4.32Å; Y371-F429 HydrophobicContact CG-CD1 4.03Å; Y371-F429 AromaticContact CG-CE1 3.54Å; Y371-F429 HydrophobicContact CG-CE1 3.54Å; Y371-F429 HydrophobicContact CG-CZ 4.42Å
372	M	83.7	Confident	84.2	Confident	5 Å²	5	48.3 Å²	48.3	3%	0.025	26%	0.261	C	S	.	.	S	Bend	trans	-158.1	148.1	-175.2	-178.3	-173.2	-70.4	0	0	111	T340 Q344 L345 A348 V376 W377 L380	T340-M372 HydrophobicContact CG2-CE 3.36Å; T340-M372 HydrophobicContact CG2-CG 4.08Å; T340-M372 HydrophobicContact CG2-SD 4.34Å; Q344-M372 HydrophobicContact CB-CE 4Å; Q344-M372 WeakPolarHBondContact O-CE 3.38Å; L345-M372 HydrophobicContact CD2-CE 3.67Å; L345-M372 HydrophobicContact CD2-SD 4.07Å; L345-M372 HydrophobicContact CG-CE 4.2Å; A348-M372 HydrophobicContact CB-CE 3.65Å; A348-M372 HydrophobicContact CB-SD 4.14Å; M372-V376 HydrophobicContact CE-CG1 4.39Å; M372-V376 HydrophobicContact CG-CB 3.71Å; M372-V376 HydrophobicContact CG-CG1 3.94Å; M372-V376 HydrophobicContact CG-CG2 4.24Å; M372-V376 HydrophobicContact SD-CB 3.6Å; M372-V376 HydrophobicContact SD-CG1 3.23Å; M372-V376 WeakPolarHBondContact SD-CG1 3.42Å; M372-W377 HydrophobicContact CB-CZ2 4.46Å; M372-W377 PolarHBondContact O-NE1 3.02Å; M372-W377 VanDerWaalsContact O-NE1 3.13Å; M372-W377 HydrophobicContact SD-CD2 4.49Å; M372-L380 HydrophobicContact SD-CD1 4.25Å
373	P	83.9	Confident	84.1	Confident	68 Å²	68	49.5 Å²	49.5	44%	0.442	27%	0.271	S	S	.	.			trans	-57.5	141.7	178.4	-23.9	33.3	0	0	0	112.6	D375 V376 W377	P373-D375 PolarHBondContact O-N 3.19Å; P373-D375 VanDerWaalsContact O-N 3.09Å; P373-V376 HydrophobicContact CB-CG2 4.27Å; P373-V376 HydrophobicContact CG-CG2 4.43Å; P373-V376 PolarHBondContact O-N 3.17Å; P373-W377 PolarHBondContact O-N 3.24Å
374	L	85	Confident	84.1	Confident	72 Å²	72	47.9 Å²	47.9	38%	0.377	26%	0.259	S	S	.	.	H	α-helix	trans	-57.7	-27.9	-177.7	-71.5	175	0	0	0	113.7	L364 W377 R378	L364-L374 HydrophobicContact CG-CD2 4.26Å; L374-W377 PolarHBondContact O-N 3.14Å; L374-R378 WeakPolarHBondContact O-CB 3.19Å; L374-R378 VanDerWaalsContact O-CG 3.27Å; L374-R378 WeakPolarHBondContact O-CG 3.33Å; L374-R378 PolarHBondContact O-N 3.27Å
375	D	84.8	Confident	84.3	Confident	110 Å²	110	46.8 Å²	46.8	59%	0.588	25%	0.253	S	S	*	.	H	α-helix	trans	-71.4	-33.3	178.6	-62.9	-35.7	0	0	0	112.4	P373 R378 S379	P373-D375 PolarHBondContact O-N 3.19Å; P373-D375 VanDerWaalsContact O-N 3.09Å; D375-R378 PolarHBondContact O-N 3.25Å; D375-R378 IonicContact OD1-CZ 2.87Å; D375-R378 IonicContact OD1-NH1 3.76Å; D375-R378 PolarHBondContact OD1-NH1 3.34Å; D375-S379 PolarHBondContact O-N 3.18Å
376	V	87.5	Confident	84.6	Confident	7 Å²	7	43 Å²	43	4%	0.042	25%	0.248	C	C	.	.	H	α-helix	trans	-71.5	-43.9	174.3	-171.4	0	0	0	0	109.7	W338 L345 M372 P373 R378 S379 L380	W338-V376 HydrophobicContact CB-CG2 4.21Å; W338-V376 HydrophobicContact CD2-CG1 3.85Å; W338-V376 HydrophobicContact CD2-CG2 4.2Å; W338-V376 HydrophobicContact CE3-CG1 3.81Å; W338-V376 HydrophobicContact CG-CG1 4.32Å; W338-V376 HydrophobicContact CG-CG2 3.88Å; W338-V376 HydrophobicContact CH2-CG1 3.81Å; W338-V376 HydrophobicContact CZ2-CG1 4.11Å; W338-V376 HydrophobicContact CZ3-CG1 3.74Å; L345-V376 HydrophobicContact CD2-CG1 3.58Å; M372-V376 HydrophobicContact CE-CG1 4.39Å; M372-V376 HydrophobicContact CG-CB 3.71Å; M372-V376 HydrophobicContact CG-CG1 3.94Å; M372-V376 HydrophobicContact CG-CG2 4.24Å; M372-V376 HydrophobicContact SD-CB 3.6Å; M372-V376 HydrophobicContact SD-CG1 3.23Å; M372-V376 WeakPolarHBondContact SD-CG1 3.42Å; P373-V376 HydrophobicContact CB-CG2 4.27Å; P373-V376 HydrophobicContact CG-CG2 4.43Å; P373-V376 PolarHBondContact O-N 3.17Å; V376-R378 VanDerWaalsContact C-N 3.32Å; V376-R378 PolarHBondContact O-N 3.14Å; V376-S379 WeakPolarHBondContact O-CB 2.98Å; V376-S379 PolarHBondContact O-N 2.88Å; V376-S379 VanDerWaalsContact O-N 3.09Å; V376-L380 WeakPolarHBondContact O-CG 3.47Å; V376-L380 PolarHBondContact O-N 3.31Å
377	W	89.3	Confident	84.9	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-55.7	-45.2	172	-75.3	119	0	0	0	112.4	A348 F351 I352 L364 V367 D368 Y371 M372 P373 L374 S379 L380 F381 F429	A348-W377 HydrophobicContact CB-CE3 4.08Å; A348-W377 HydrophobicContact CB-CH2 3.47Å; A348-W377 VanDerWaalsContact CB-CH2 3.47Å; A348-W377 HydrophobicContact CB-CZ2 4.09Å; A348-W377 HydrophobicContact CB-CZ3 3.48Å; A348-W377 VanDerWaalsContact CB-CZ3 3.48Å; A348-W377 WeakPolarHBondContact O-CZ3 3.12Å; F351-W377 AromaticContact CD1-CH2 3.89Å; F351-W377 HydrophobicContact CD1-CH2 3.89Å; F351-W377 HydrophobicContact CD1-CZ3 4.17Å; I352-W377 HydrophobicContact CD1-CE3 3.92Å; I352-W377 HydrophobicContact CD1-CZ3 4.01Å; I352-W377 HydrophobicContact CG1-CE3 4.26Å; I352-W377 HydrophobicContact CG1-CZ3 3.96Å; L364-W377 HydrophobicContact CD1-CB 3.84Å; V367-W377 HydrophobicContact CB-CD2 4.45Å; V367-W377 HydrophobicContact CG1-CD2 3.16Å; V367-W377 HydrophobicContact CG1-CE3 3.36Å; V367-W377 HydrophobicContact CG1-CG 3.75Å; V367-W377 HydrophobicContact CG1-CH2 3.42Å; V367-W377 VanDerWaalsContact CG1-CH2 3.42Å; V367-W377 HydrophobicContact CG1-CZ2 3.24Å; V367-W377 HydrophobicContact CG1-CZ3 3.46Å; V367-W377 VanDerWaalsContact CG1-CZ3 3.46Å; D368-W377 PolarHBondContact O-NE1 3.06Å; Y371-W377 HydrophobicContact CD1-CZ2 4.18Å; M372-W377 HydrophobicContact CB-CZ2 4.46Å; M372-W377 PolarHBondContact O-NE1 3.02Å; M372-W377 VanDerWaalsContact O-NE1 3.13Å; M372-W377 HydrophobicContact SD-CD2 4.49Å; P373-W377 PolarHBondContact O-N 3.24Å; L374-W377 PolarHBondContact O-N 3.14Å; W377-S379 VanDerWaalsContact C-N 3.33Å; W377-S379 PolarHBondContact O-N 3.09Å; W377-L380 HydrophobicContact CE3-CD1 4.33Å; W377-L380 PolarHBondContact O-N 2.82Å; W377-F381 WeakPolarHBondContact O-CD2 3.44Å; W377-F381 PolarHBondContact O-N 3.01Å; W377-F429 HydrophobicContact CH2-CD1 4.44Å; W377-F429 AromaticContact CH2-CE1 3.64Å; W377-F429 HydrophobicContact CH2-CE1 3.64Å; W377-F429 HydrophobicContact CH2-CZ 4.11Å; W377-F429 HydrophobicContact CZ2-CD1 4.42Å; W377-F429 AromaticContact CZ2-CE1 3.75Å; W377-F429 HydrophobicContact CZ2-CE1 3.75Å
378	R	87.9	Confident	85.1	Confident	116 Å²	116	49.9 Å²	49.9	44%	0.438	28%	0.284	S	S	.	.	H	α-helix	trans	-58.8	-44.6	174.5	-77.4	170.3	-177.6	157.4	-4.5	111.6	L364 L374 D375 V376 L380 F381 V382	L364-R378 HydrophobicContact CD1-CG 4.2Å; L364-R378 HydrophobicContact CD2-CG 3.58Å; L374-R378 WeakPolarHBondContact O-CB 3.19Å; L374-R378 VanDerWaalsContact O-CG 3.27Å; L374-R378 WeakPolarHBondContact O-CG 3.33Å; L374-R378 PolarHBondContact O-N 3.27Å; D375-R378 PolarHBondContact O-N 3.25Å; D375-R378 IonicContact OD1-CZ 2.87Å; D375-R378 IonicContact OD1-NH1 3.76Å; D375-R378 PolarHBondContact OD1-NH1 3.34Å; V376-R378 VanDerWaalsContact C-N 3.32Å; V376-R378 PolarHBondContact O-N 3.14Å; R378-L380 VanDerWaalsContact C-N 3.31Å; R378-L380 PolarHBondContact O-N 2.92Å; R378-F381 PolarHBondContact O-N 3.09Å; R378-V382 VanDerWaalsContact O-CG2 3.27Å; R378-V382 WeakPolarHBondContact O-CG2 3.27Å; R378-V382 PolarHBondContact O-N 3.05Å
379	S	86.5	Confident	85.1	Confident	45 Å²	45	59.7 Å²	59.7	32%	0.315	32%	0.32	S	S	.	.	H	α-helix	trans	-61.2	-40.2	177.6	-169.5	0	0	0	0	112.2	W338 D375 V376 W377 V382 S383	W338-S379 WeakPolarHBondContact CZ2-OG 3.47Å; D375-S379 PolarHBondContact O-N 3.18Å; V376-S379 WeakPolarHBondContact O-CB 2.98Å; V376-S379 PolarHBondContact O-N 2.88Å; V376-S379 VanDerWaalsContact O-N 3.09Å; W377-S379 VanDerWaalsContact C-N 3.33Å; W377-S379 PolarHBondContact O-N 3.09Å; S379-V382 PolarHBondContact O-N 3.41Å; S379-S383 PolarHBondContact O-N 3.45Å
380	L	88.2	Confident	85	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-64.8	-44.7	174.7	-65	178	0	0	0	111.6	F328 L345 A348 I352 M372 V376 W377 R378 S383	F328-L380 HydrophobicContact CE1-CD2 4.35Å; F328-L380 HydrophobicContact CZ-CD2 3.66Å; L345-L380 HydrophobicContact CD2-CD1 4.5Å; A348-L380 HydrophobicContact CB-CD1 3.62Å; I352-L380 HydrophobicContact CD1-CB 3.61Å; I352-L380 HydrophobicContact CD1-CD1 4.38Å; M372-L380 HydrophobicContact SD-CD1 4.25Å; V376-L380 WeakPolarHBondContact O-CG 3.47Å; V376-L380 PolarHBondContact O-N 3.31Å; W377-L380 HydrophobicContact CE3-CD1 4.33Å; W377-L380 PolarHBondContact O-N 2.82Å; R378-L380 VanDerWaalsContact C-N 3.31Å; R378-L380 PolarHBondContact O-N 2.92Å; L380-S383 PolarHBondContact O-N 3.2Å; L380-S383 PolarHBondContact O-OG 2.92Å
381	F	89.2	Confident	85.1	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-59.1	-48.4	174.4	-84.4	-67.8	0	0	0	111.8	I352 Y356 L362 L364 V367 W377 R378 S383 I384 S385 W393	I352-F381 HydrophobicContact CD1-CD1 4.46Å; I352-F381 HydrophobicContact CD1-CD2 4.33Å; I352-F381 HydrophobicContact CD1-CE1 4.44Å; I352-F381 HydrophobicContact CD1-CE2 4.3Å; I352-F381 HydrophobicContact CD1-CG 4.4Å; I352-F381 HydrophobicContact CD1-CZ 4.36Å; I352-F381 HydrophobicContact CG1-CE1 4.11Å; I352-F381 HydrophobicContact CG1-CE2 4.34Å; I352-F381 HydrophobicContact CG1-CZ 3.98Å; I352-F381 HydrophobicContact CG2-CD1 4.07Å; I352-F381 HydrophobicContact CG2-CE1 3.8Å; I352-F381 HydrophobicContact CG2-CZ 4.47Å; Y356-F381 HydrophobicContact CE2-CE1 4.44Å; L362-F381 HydrophobicContact CB-CE1 3.93Å; L362-F381 HydrophobicContact CB-CZ 4.22Å; L362-F381 HydrophobicContact CD1-CE1 4.09Å; L362-F381 HydrophobicContact CD1-CZ 4.48Å; L364-F381 HydrophobicContact CD1-CD2 3.75Å; L364-F381 HydrophobicContact CD1-CE2 3.7Å; V367-F381 HydrophobicContact CG2-CE2 3.78Å; V367-F381 HydrophobicContact CG2-CZ 3.77Å; W377-F381 WeakPolarHBondContact O-CD2 3.44Å; W377-F381 PolarHBondContact O-N 3.01Å; R378-F381 PolarHBondContact O-N 3.09Å; F381-S383 PolarHBondContact O-N 3.23Å; F381-S383 VanDerWaalsContact O-N 3.13Å; F381-I384 PolarHBondContact O-N 3.4Å; F381-S385 VanDerWaalsContact C-OG 3.27Å; F381-S385 WeakPolarHBondContact CD1-OG 3.22Å; F381-S385 WeakPolarHBondContact O-CA 3.26Å; F381-S385 WeakPolarHBondContact O-CB 3.46Å; F381-S385 PolarHBondContact O-N 2.9Å; F381-S385 VanDerWaalsContact O-O 3.11Å; F381-S385 PolarHBondContact O-OG 2.87Å; F381-W393 HydrophobicContact CB-CD2 3.66Å; F381-W393 HydrophobicContact CB-CE3 3.7Å; F381-W393 HydrophobicContact CB-CG 4.14Å; F381-W393 HydrophobicContact CB-CH2 4.24Å; F381-W393 HydrophobicContact CB-CZ2 4.22Å; F381-W393 HydrophobicContact CB-CZ3 3.98Å; F381-W393 HydrophobicContact CD1-CB 3.72Å; F381-W393 HydrophobicContact CD1-CD2 4.19Å; F381-W393 AromaticContact CD1-CG 3.75Å; F381-W393 HydrophobicContact CD1-CG 3.75Å; F381-W393 HydrophobicContact CE1-CB 4.12Å; F381-W393 HydrophobicContact CE1-CG 4.32Å; F381-W393 HydrophobicContact CG-CB 4.41Å; F381-W393 HydrophobicContact CG-CD2 4Å; F381-W393 HydrophobicContact CG-CE3 4.46Å; F381-W393 AromaticContact CG-CG 3.96Å; F381-W393 HydrophobicContact CG-CG 3.96Å
382	V	87.9	Confident	85.4	Confident	98 Å²	98	62.5 Å²	62.5	59%	0.594	32%	0.321	S	S	*	.	H	α-helix	trans	-56.7	-32.5	179.5	171.6	0	0	0	0	112.2	R378 S379 I384 W393	R378-V382 VanDerWaalsContact O-CG2 3.27Å; R378-V382 WeakPolarHBondContact O-CG2 3.27Å; R378-V382 PolarHBondContact O-N 3.05Å; S379-V382 PolarHBondContact O-N 3.41Å; V382-I384 PolarHBondContact O-N 3.48Å; V382-W393 HydrophobicContact CB-CZ3 4.47Å; V382-W393 HydrophobicContact CG2-CH2 3.51Å; V382-W393 HydrophobicContact CG2-CZ3 3.7Å
383	S	84.5	Confident	85.6	Confident	33 Å²	33	63.7 Å²	63.7	23%	0.231	33%	0.325	C	S	.	.	H	α-helix	trans	-72.8	-22.2	179.5	71.7	0	0	0	0	115.1	S379 L380 F381	S379-S383 PolarHBondContact O-N 3.45Å; L380-S383 PolarHBondContact O-N 3.2Å; L380-S383 PolarHBondContact O-OG 2.92Å; F381-S383 PolarHBondContact O-N 3.23Å; F381-S383 VanDerWaalsContact O-N 3.13Å
384	I	86.8	Confident	85.8	Confident	4 Å²	4	63.6 Å²	63.6	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-120.6	-23.7	-171.5	-57.7	171.7	0	0	0	111.4	I286 R349 L353 F381 V382 L395 M396	I286-I384 HydrophobicContact CD1-CG2 3.69Å; I286-I384 WeakPolarHBondContact CD1-O 3.29Å; R349-I384 HydrophobicContact CG-CD1 3.76Å; L353-I384 HydrophobicContact CD2-CD1 4.22Å; L353-I384 HydrophobicContact CD2-CG2 3.89Å; F381-I384 PolarHBondContact O-N 3.4Å; V382-I384 PolarHBondContact O-N 3.48Å; I384-L395 HydrophobicContact CG2-CD2 3.88Å; I384-M396 PolarHBondContact O-N 2.83Å
385	S	88.1	Confident	85.9	Confident	6 Å²	6	60.6 Å²	60.6	4%	0.042	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	151.9	-164	66.3	0	0	0	0	112.2	Y356 F381 K394	Y356-S385 WeakPolarHBondContact OH-CB 3.29Å; Y356-S385 PolarHBondContact OH-OG 2.78Å; F381-S385 VanDerWaalsContact C-OG 3.27Å; F381-S385 WeakPolarHBondContact CD1-OG 3.22Å; F381-S385 WeakPolarHBondContact O-CA 3.26Å; F381-S385 WeakPolarHBondContact O-CB 3.46Å; F381-S385 PolarHBondContact O-N 2.9Å; F381-S385 VanDerWaalsContact O-O 3.11Å; F381-S385 PolarHBondContact O-OG 2.87Å; S385-K394 CarbonylContact C-O 3.59Å; S385-K394 VanDerWaalsContact CA-O 3.24Å; S385-K394 WeakPolarHBondContact CA-O 3.06Å; S385-K394 WeakPolarHBondContact CB-O 3.4Å
386	T	86.5	Confident	86	Confident	78 Å²	78	61.3 Å²	61.3	48%	0.479	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	132.3	176.8	-26.7	0	0	0	0	108.7	V388 K394	T386-V388 PolarHBondContact O-N 2.96Å; T386-K394 PolarHBondContact N-O 2.87Å; T386-K394 PolarHBondContact O-N 3.02Å
387	M	86.2	Confident	85.8	Confident	123 Å²	123	62.5 Å²	62.5	61%	0.606	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	117.9	177.1	-172.2	-178.7	67	0	0	110.1	W393	M387-W393 HydrophobicContact CB-CD2 4.12Å; M387-W393 HydrophobicContact CB-CE3 3.87Å; M387-W393 HydrophobicContact CB-CH2 4.04Å; M387-W393 HydrophobicContact CB-CZ2 4.27Å; M387-W393 HydrophobicContact CB-CZ3 3.85Å; M387-W393 HydrophobicContact CG-CD2 4.45Å; M387-W393 HydrophobicContact CG-CZ2 4.39Å; M387-W393 HydrophobicContact SD-CZ2 4.34Å
388	V	85.2	Confident	85.5	Confident	50 Å²	50	68.7 Å²	68.7	30%	0.303	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	117.5	170.8	-177.1	0	0	0	0	107.9	T386 N390 K391 G392 K394	T386-V388 PolarHBondContact O-N 2.96Å; V388-N390 PolarHBondContact O-N 2.96Å; V388-K391 HydrophobicContact CB-CB 4.26Å; V388-K391 HydrophobicContact CG1-CB 4.03Å; V388-K391 HydrophobicContact CG1-CD 4.01Å; V388-K391 HydrophobicContact CG1-CG 4.19Å; V388-K391 PolarHBondContact O-N 3.44Å; V388-K391 VanDerWaalsContact O-N 3.11Å; V388-G392 PolarHBondContact N-O 3.49Å; V388-G392 PolarHBondContact O-N 3.24Å; V388-G392 VanDerWaalsContact O-O 3.08Å; V388-K394 HydrophobicContact CG2-CB 3.73Å
389	R	79.4	Confident	85.3	Confident	220 Å²	220	64.9 Å²	64.9	83%	0.83	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	130.8	179.7	-64.8	-175.3	-173.3	171.4	1.4	110.3	K391	R389-K391 PolarHBondContact O-N 2.96Å
390	N	74.8	Confident	85.2	Confident	118 Å²	118	63.4 Å²	63.4	63%	0.631	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	0.2	177.8	-57.1	-19	0	0	0	117.5	V388 S449	V388-N390 PolarHBondContact O-N 2.96Å; N390-S449 WeakPolarHBondContact CB-OG 3.41Å; N390-S449 PolarHBondContact OD1-OG 2.79Å
391	K	79.7	Confident	84.9	Confident	146 Å²	146	68.5 Å²	68.5	64%	0.635	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	-33.6	177.6	-61.7	-173.2	-179.3	179.2	0	112.7	I361 V388 R389	I361-K391 HydrophobicContact CD1-CB 3.99Å; I361-K391 HydrophobicContact CD1-CD 4.18Å; I361-K391 HydrophobicContact CG2-CB 4.28Å; I361-K391 WeakPolarHBondContact CG2-O 3.27Å; V388-K391 HydrophobicContact CB-CB 4.26Å; V388-K391 HydrophobicContact CG1-CB 4.03Å; V388-K391 HydrophobicContact CG1-CD 4.01Å; V388-K391 HydrophobicContact CG1-CG 4.19Å; V388-K391 PolarHBondContact O-N 3.44Å; V388-K391 VanDerWaalsContact O-N 3.11Å; R389-K391 PolarHBondContact O-N 2.96Å
392	G	87.3	Confident	84.7	Confident	14 Å²	14	71.2 Å²	71.2	14%	0.144	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	123.8	-147.8	-175.2	0	0	0	0	0	110.9	V388	V388-G392 PolarHBondContact N-O 3.49Å; V388-G392 PolarHBondContact O-N 3.24Å; V388-G392 VanDerWaalsContact O-O 3.08Å
393	W	88.8	Confident	84.7	Confident	29 Å²	29	66.7 Å²	66.7	11%	0.11	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	124.3	-178	-62.4	86.5	0	0	0	109.6	Y356 I361 L362 F381 V382 M387	Y356-W393 VanDerWaalsContact CE1-O 3.24Å; Y356-W393 WeakPolarHBondContact CE1-O 3.31Å; Y356-W393 VanDerWaalsContact OH-C 3.3Å; Y356-W393 WeakPolarHBondContact OH-CB 3.35Å; Y356-W393 PolarHBondContact OH-O 3.09Å; I361-W393 WeakPolarHBondContact CA-O 3.39Å; L362-W393 PolarHBondContact N-O 3.36Å; L362-W393 PolarHBondContact O-N 3.47Å; F381-W393 HydrophobicContact CB-CD2 3.66Å; F381-W393 HydrophobicContact CB-CE3 3.7Å; F381-W393 HydrophobicContact CB-CG 4.14Å; F381-W393 HydrophobicContact CB-CH2 4.24Å; F381-W393 HydrophobicContact CB-CZ2 4.22Å; F381-W393 HydrophobicContact CB-CZ3 3.98Å; F381-W393 HydrophobicContact CD1-CB 3.72Å; F381-W393 HydrophobicContact CD1-CD2 4.19Å; F381-W393 AromaticContact CD1-CG 3.75Å; F381-W393 HydrophobicContact CD1-CG 3.75Å; F381-W393 HydrophobicContact CE1-CB 4.12Å; F381-W393 HydrophobicContact CE1-CG 4.32Å; F381-W393 HydrophobicContact CG-CB 4.41Å; F381-W393 HydrophobicContact CG-CD2 4Å; F381-W393 HydrophobicContact CG-CE3 4.46Å; F381-W393 AromaticContact CG-CG 3.96Å; F381-W393 HydrophobicContact CG-CG 3.96Å; V382-W393 HydrophobicContact CB-CZ3 4.47Å; V382-W393 HydrophobicContact CG2-CH2 3.51Å; V382-W393 HydrophobicContact CG2-CZ3 3.7Å; M387-W393 HydrophobicContact CB-CD2 4.12Å; M387-W393 HydrophobicContact CB-CE3 3.87Å; M387-W393 HydrophobicContact CB-CH2 4.04Å; M387-W393 HydrophobicContact CB-CZ2 4.27Å; M387-W393 HydrophobicContact CB-CZ3 3.85Å; M387-W393 HydrophobicContact CG-CD2 4.45Å; M387-W393 HydrophobicContact CG-CZ2 4.39Å; M387-W393 HydrophobicContact SD-CZ2 4.34Å
394	K	89.2	Confident	84.6	Confident	67 Å²	67	67.3 Å²	67.3	29%	0.291	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	145.1	173.6	-177.7	-175.5	170.4	-173.8	0	108.2	S385 T386 V388 E398	S385-K394 CarbonylContact C-O 3.59Å; S385-K394 VanDerWaalsContact CA-O 3.24Å; S385-K394 WeakPolarHBondContact CA-O 3.06Å; S385-K394 WeakPolarHBondContact CB-O 3.4Å; T386-K394 PolarHBondContact N-O 2.87Å; T386-K394 PolarHBondContact O-N 3.02Å; V388-K394 HydrophobicContact CG2-CB 3.73Å; K394-E398 IonicContact NZ-OE1 3.26Å; K394-E398 PolarHBondContact NZ-OE1 3.39Å
395	L	87	Confident	84.6	Confident	9 Å²	9	74.6 Å²	74.6	5%	0.047	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50	144.1	171.6	-70.6	171.7	0	0	0	111.1	I286 V316 L319 Y356 I384 T397	I286-L395 HydrophobicContact CD1-CD2 3.83Å; V316-L395 HydrophobicContact CG1-CD1 4.27Å; L319-L395 HydrophobicContact CD1-CD1 4.41Å; Y356-L395 HydrophobicContact CD1-CD1 4.35Å; Y356-L395 HydrophobicContact CD1-CD2 4.08Å; Y356-L395 HydrophobicContact CD1-CG 3.71Å; Y356-L395 HydrophobicContact CD2-CD2 3.35Å; Y356-L395 HydrophobicContact CD2-CG 3.96Å; Y356-L395 HydrophobicContact CE1-CD2 4.4Å; Y356-L395 HydrophobicContact CE1-CG 4.11Å; Y356-L395 HydrophobicContact CE2-CD2 3.7Å; Y356-L395 HydrophobicContact CE2-CG 4.31Å; Y356-L395 HydrophobicContact CG-CD1 4.13Å; Y356-L395 HydrophobicContact CG-CD2 3.57Å; Y356-L395 HydrophobicContact CG-CG 3.65Å; I384-L395 HydrophobicContact CG2-CD2 3.88Å; L395-T397 PolarHBondContact O-N 3.41Å
396	M	85.2	Confident	84.5	Confident	124 Å²	124	81.1 Å²	81.1	61%	0.611	40%	0.4	S	S	*	.	S	Bend	trans	-59.4	-33	-175.8	-166.4	177.8	-166.7	0	0	113	I384	I384-M396 PolarHBondContact O-N 2.83Å
397	T	84.4	Confident	84.6	Confident	32 Å²	32	78.6 Å²	78.6	20%	0.196	38%	0.382	C	S	.	.	S	Bend	trans	-110.1	146.2	177.9	-49	0	0	0	0	109.6	I286 R288 L319 L395	I286-T397 PolarHBondContact O-OG1 3.42Å; R288-T397 HydrophobicContact CG-CG2 4.39Å; L319-T397 HydrophobicContact CD1-CG2 4.39Å; L319-T397 HydrophobicContact CD2-CG2 3.97Å; L395-T397 PolarHBondContact O-N 3.41Å
398	E	83	Confident	84.7	Confident	130 Å²	130	76 Å²	76	61%	0.607	38%	0.375	S	S	*	.			trans	-68.1	144.6	175	-56	-148	124.7	0	0	111	K394	K394-E398 IonicContact NZ-OE1 3.26Å; K394-E398 PolarHBondContact NZ-OE1 3.39Å
399	P	83.2	Confident	84.9	Confident	36 Å²	36	78.4 Å²	78.4	23%	0.234	39%	0.389	C	S	.	.			trans	-58.6	142	-180	27.4	-36.3	0	0	0	110.9	R317	R317-P399 HydrophobicContact CB-CB 3.94Å; R317-P399 WeakPolarHBondContact O-CA 3.41Å
400	D	84	Confident	85.3	Confident	15 Å²	15	68.2 Å²	68.2	8%	0.08	35%	0.351	C	S	.	.			trans	-105	89.1	-178.8	-175.6	4.8	0	0	0	110.3	R288 R317 G318 L319 T402 F403	R288-D400 HydrophobicContact CG-CB 4.17Å; R317-D400 PolarHBondContact O-N 2.94Å; R317-D400 VanDerWaalsContact O-N 3.15Å; G318-D400 WeakPolarHBondContact CA-O 3.25Å; L319-D400 HydrophobicContact CD2-CB 4.09Å; D400-T402 PolarHBondContact O-N 3.1Å; D400-T402 WeakPolarHBondContact OD1-CB 3.49Å; D400-T402 PolarHBondContact OD1-N 3.47Å; D400-T402 VanDerWaalsContact OD1-N 3.08Å; D400-T402 PolarHBondContact OD1-OG1 2.63Å; D400-F403 PolarHBondContact O-N 3.5Å
401	D	82.6	Confident	86	Confident	106 Å²	106	63.6 Å²	63.6	57%	0.567	33%	0.329	S	S	*	.	H	α-helix	trans	-68.3	-17.1	178.7	-62	-37.8	0	0	0	112.2	F403 Q405	D401-F403 VanDerWaalsContact C-N 3.35Å; D401-Q405 PolarHBondContact O-N 2.93Å
402	T	85.4	Confident	86.4	Confident	58 Å²	58	59.6 Å²	59.6	36%	0.356	32%	0.32	S	S	.	.	H	α-helix	trans	-70.7	-32.9	179.8	76.9	0	0	0	0	111.8	D400 A404 Q405 R406	D400-T402 PolarHBondContact O-N 3.1Å; D400-T402 WeakPolarHBondContact OD1-CB 3.49Å; D400-T402 PolarHBondContact OD1-N 3.47Å; D400-T402 VanDerWaalsContact OD1-N 3.08Å; D400-T402 PolarHBondContact OD1-OG1 2.63Å; T402-A404 PolarHBondContact O-N 2.88Å; T402-Q405 PolarHBondContact O-N 3.29Å; T402-R406 WeakPolarHBondContact O-CG 3.25Å; T402-R406 PolarHBondContact O-N 3.04Å
403	F	86.8	Confident	86.5	Confident	3 Å²	3	64.6 Å²	64.6	1%	0.013	33%	0.334	C	S	.	.	H	α-helix	trans	-63.8	-43.1	178.5	-176.6	-95.4	0	0	0	111.8	F289 L306 L315 W320 D400 D401 Q405 R406 F407 I410	F289-F403 HydrophobicContact CB-CD2 3.34Å; F289-F403 HydrophobicContact CB-CE2 3.56Å; F289-F403 HydrophobicContact CB-CG 4.42Å; F289-F403 HydrophobicContact CD1-CD2 4.17Å; F289-F403 HydrophobicContact CD1-CE2 4.06Å; F289-F403 HydrophobicContact CD2-CD2 4.47Å; F289-F403 AromaticContact CD2-CE2 3.82Å; F289-F403 HydrophobicContact CD2-CE2 3.82Å; F289-F403 AromaticContact CG-CD2 3.76Å; F289-F403 HydrophobicContact CG-CD2 3.76Å; F289-F403 AromaticContact CG-CE2 3.53Å; F289-F403 HydrophobicContact CG-CE2 3.53Å; L306-F403 HydrophobicContact CD2-CE2 3.82Å; L306-F403 HydrophobicContact CD2-CZ 3.7Å; L315-F403 HydrophobicContact CD1-CD1 3.68Å; L315-F403 HydrophobicContact CD1-CE1 3.56Å; L315-F403 HydrophobicContact CD1-CZ 4.32Å; L315-F403 HydrophobicContact CD2-CD1 3.87Å; L315-F403 HydrophobicContact CD2-CE1 3.61Å; L315-F403 HydrophobicContact CG-CD1 4.41Å; L315-F403 HydrophobicContact CG-CE1 4.24Å; W320-F403 AromaticContact CE2-CZ 3.96Å; W320-F403 HydrophobicContact CZ2-CE1 4.31Å; W320-F403 AromaticContact CZ2-CZ 3.8Å; W320-F403 HydrophobicContact CZ2-CZ 3.8Å; W320-F403 AromaticContact NE1-CE2 3.66Å; W320-F403 AromaticContact NE1-CZ 3.54Å; D400-F403 PolarHBondContact O-N 3.5Å; D401-F403 VanDerWaalsContact C-N 3.35Å; F403-Q405 VanDerWaalsContact C-N 3.26Å; F403-Q405 PolarHBondContact O-N 2.78Å; F403-R406 PolarHBondContact O-N 2.91Å; F403-F407 AromaticContact CD2-CD2 3.87Å; F403-F407 HydrophobicContact CD2-CD2 3.87Å; F403-F407 HydrophobicContact CD2-CE2 4.46Å; F403-F407 HydrophobicContact CE1-CB 4.48Å; F403-F407 HydrophobicContact CE2-CB 4.49Å; F403-F407 AromaticContact CE2-CD2 3.52Å; F403-F407 HydrophobicContact CE2-CD2 3.52Å; F403-F407 HydrophobicContact CE2-CE2 4.15Å; F403-F407 HydrophobicContact CE2-CG 4.35Å; F403-F407 HydrophobicContact CZ-CB 4.2Å; F403-F407 HydrophobicContact CZ-CD2 4.06Å; F403-F407 HydrophobicContact CZ-CG 4.47Å; F403-F407 PolarHBondContact O-N 3.06Å; F403-I410 HydrophobicContact CE1-CG2 4.31Å; F403-I410 HydrophobicContact CZ-CG2 4.27Å
404	A	82.7	Confident	86.5	Confident	45 Å²	45	63.4 Å²	63.4	37%	0.372	33%	0.33	S	S	.	.	H	α-helix	trans	-63.6	-33.6	179	0	0	0	0	0	112.1	T402 P408	T402-A404 PolarHBondContact O-N 2.88Å; A404-P408 WeakPolarHBondContact O-CA 3.5Å
405	Q	86.4	Confident	86.5	Confident	158 Å²	158	63.4 Å²	63.4	74%	0.738	33%	0.331	S	S	*	.	H	α-helix	trans	-72.9	-39.3	175.4	-65.9	176.7	12.2	0	0	112.4	D401 T402 F403	D401-Q405 PolarHBondContact O-N 2.93Å; T402-Q405 PolarHBondContact O-N 3.29Å; F403-Q405 VanDerWaalsContact C-N 3.26Å; F403-Q405 PolarHBondContact O-N 2.78Å
406	R	87.2	Confident	86.7	Confident	143 Å²	143	71.8 Å²	71.8	54%	0.54	36%	0.362	S	S	.	.	H	α-helix	trans	-74.5	-38.9	-179.2	-71.1	-173.3	-174.6	165.3	12.8	113.3	E290 T402 F403 P408	E290-R406 IonicContact OE1-CZ 3.75Å; E290-R406 VanDerWaalsContact OE1-CZ 3.24Å; E290-R406 IonicContact OE1-NH1 3.39Å; E290-R406 PolarHBondContact OE1-NH1 2.87Å; E290-R406 IonicContact OE1-NH2 3.15Å; E290-R406 PolarHBondContact OE1-NH2 3.33Å; T402-R406 WeakPolarHBondContact O-CG 3.25Å; T402-R406 PolarHBondContact O-N 3.04Å; F403-R406 PolarHBondContact O-N 2.91Å; R406-P408 VanDerWaalsContact C-CD 3.5Å; R406-P408 WeakPolarHBondContact O-CD 3.22Å
407	F	87.8	Confident	86.9	Confident	24 Å²	24	68.9 Å²	68.9	11%	0.105	35%	0.349	C	S	.	.			trans	-128.6	66.4	-175.1	-57.3	-73.9	0	0	0	112.1	F289 D302 L306 F403 T409 I410 A411	F289-F407 AromaticContact CD1-CE2 3.93Å; F289-F407 HydrophobicContact CD1-CE2 3.93Å; F289-F407 AromaticContact CE1-CE2 3.64Å; F289-F407 HydrophobicContact CE1-CE2 3.64Å; F289-F407 HydrophobicContact CE1-CZ 4.03Å; F289-F407 HydrophobicContact CZ-CE2 4.29Å; F289-F407 HydrophobicContact CZ-CZ 4.48Å; D302-F407 HydrophobicContact CB-CE1 4.42Å; D302-F407 HydrophobicContact CB-CZ 4.1Å; L306-F407 HydrophobicContact CD1-CD1 3.65Å; L306-F407 HydrophobicContact CD1-CD2 4.16Å; L306-F407 HydrophobicContact CD1-CE1 3.61Å; L306-F407 HydrophobicContact CD1-CE2 4.13Å; L306-F407 HydrophobicContact CD1-CG 3.93Å; L306-F407 HydrophobicContact CD1-CZ 3.86Å; F403-F407 AromaticContact CD2-CD2 3.87Å; F403-F407 HydrophobicContact CD2-CD2 3.87Å; F403-F407 HydrophobicContact CD2-CE2 4.46Å; F403-F407 HydrophobicContact CE1-CB 4.48Å; F403-F407 HydrophobicContact CE2-CB 4.49Å; F403-F407 AromaticContact CE2-CD2 3.52Å; F403-F407 HydrophobicContact CE2-CD2 3.52Å; F403-F407 HydrophobicContact CE2-CE2 4.15Å; F403-F407 HydrophobicContact CE2-CG 4.35Å; F403-F407 HydrophobicContact CZ-CB 4.2Å; F403-F407 HydrophobicContact CZ-CD2 4.06Å; F403-F407 HydrophobicContact CZ-CG 4.47Å; F403-F407 PolarHBondContact O-N 3.06Å; F407-T409 VanDerWaalsContact C-N 3.27Å; F407-T409 PolarHBondContact O-N 3.28Å; F407-I410 HydrophobicContact CB-CB 4.35Å; F407-I410 HydrophobicContact CB-CD1 4.19Å; F407-I410 PolarHBondContact O-N 3.48Å; F407-A411 PolarHBondContact O-N 3.44Å; F407-A411 VanDerWaalsContact O-N 3.12Å
408	P	88.4	Confident	87.1	Confident	70 Å²	70	67.4 Å²	67.4	46%	0.455	34%	0.339	S	S	.	.	H	α-helix	trans	-65.1	-30.2	-174.7	26.3	-35.3	0	0	0	113	A404 R406 S412	A404-P408 WeakPolarHBondContact O-CA 3.5Å; R406-P408 VanDerWaalsContact C-CD 3.5Å; R406-P408 WeakPolarHBondContact O-CD 3.22Å; P408-S412 WeakPolarHBondContact O-CB 3.38Å; P408-S412 PolarHBondContact O-N 2.96Å; P408-S412 PolarHBondContact O-OG 2.73Å
409	T	88.6	Confident	87.4	Confident	100 Å²	100	64.5 Å²	64.5	61%	0.613	33%	0.328	S	S	*	.	H	α-helix	trans	-64.4	-43.1	179.1	52.5	0	0	0	0	111.8	F407 R413	F407-T409 VanDerWaalsContact C-N 3.27Å; F407-T409 PolarHBondContact O-N 3.28Å; T409-R413 WeakPolarHBondContact O-CB 2.94Å; T409-R413 PolarHBondContact O-N 3.18Å
410	I	89.3	Confident	87.6	Confident	5 Å²	5	66.6 Å²	66.6	3%	0.026	34%	0.344	C	S	.	.	H	α-helix	trans	-71.8	-44.2	178.3	-71.3	159.7	0	0	0	110.4	L306 E310 W320 F403 F407 S412 R413 Q414	L306-I410 HydrophobicContact CB-CD1 3.69Å; L306-I410 HydrophobicContact CD1-CD1 3.45Å; L306-I410 VanDerWaalsContact CD1-CD1 3.45Å; L306-I410 HydrophobicContact CD2-CD1 4.07Å; L306-I410 HydrophobicContact CG-CD1 3.9Å; E310-I410 WeakPolarHBondContact OE1-CG2 3.37Å; W320-I410 HydrophobicContact CH2-CG2 4.38Å; W320-I410 HydrophobicContact CZ2-CG2 4.25Å; F403-I410 HydrophobicContact CE1-CG2 4.31Å; F403-I410 HydrophobicContact CZ-CG2 4.27Å; F407-I410 HydrophobicContact CB-CB 4.35Å; F407-I410 HydrophobicContact CB-CD1 4.19Å; F407-I410 PolarHBondContact O-N 3.48Å; I410-S412 VanDerWaalsContact C-N 3.3Å; I410-S412 PolarHBondContact O-N 3.32Å; I410-R413 PolarHBondContact O-N 2.99Å; I410-Q414 HydrophobicContact CG2-CG 4.34Å; I410-Q414 WeakPolarHBondContact O-CB 3.43Å; I410-Q414 VanDerWaalsContact O-CG 3.31Å; I410-Q414 WeakPolarHBondContact O-CG 3.45Å; I410-Q414 PolarHBondContact O-N 2.89Å
411	A	88	Confident	87.7	Confident	21 Å²	21	68.9 Å²	68.9	17%	0.174	35%	0.351	C	S	.	.	H	α-helix	trans	-56.9	-44.3	174.2	0	0	0	0	0	111.8	L315 F407 R413 Q414 Q415	L315-A411 HydrophobicContact CD2-CB 4.29Å; F407-A411 PolarHBondContact O-N 3.44Å; F407-A411 VanDerWaalsContact O-N 3.12Å; A411-R413 PolarHBondContact O-N 3.18Å; A411-Q414 PolarHBondContact O-N 3.25Å; A411-Q415 WeakPolarHBondContact O-CB 3.43Å; A411-Q415 PolarHBondContact O-N 3.5Å
412	S	89	Confident	87.8	Confident	63 Å²	63	64.9 Å²	64.9	44%	0.441	33%	0.33	S	S	.	.	H	α-helix	trans	-64	-40.6	176.4	-57.1	0	0	0	0	112.5	P408 I410 Q415 R416	P408-S412 WeakPolarHBondContact O-CB 3.38Å; P408-S412 PolarHBondContact O-N 2.96Å; P408-S412 PolarHBondContact O-OG 2.73Å; I410-S412 VanDerWaalsContact C-N 3.3Å; I410-S412 PolarHBondContact O-N 3.32Å; S412-Q415 PolarHBondContact O-N 3.11Å; S412-R416 WeakPolarHBondContact O-CG 3.38Å; S412-R416 PolarHBondContact O-N 3.1Å; S412-R416 VanDerWaalsContact O-N 3.09Å
413	R	89.7	Confident	87.6	Confident	118 Å²	118	66.1 Å²	66.1	45%	0.445	34%	0.34	S	S	.	.	H	α-helix	trans	-65.3	-44.4	176.8	178.7	166.3	58.4	-164.7	-6.7	111.5	E310 T409 I410 A411 Q415 R416 I417	E310-R413 VanDerWaalsContact CD-CZ 3.48Å; E310-R413 IonicContact OE1-CZ 2.88Å; E310-R413 IonicContact OE1-NE 2.69Å; E310-R413 PolarHBondContact OE1-NE 3.01Å; E310-R413 IonicContact OE1-NH2 2.95Å; E310-R413 PolarHBondContact OE1-NH2 3.37Å; E310-R413 IonicContact OE2-CZ 3.24Å; E310-R413 IonicContact OE2-NE 2.71Å; E310-R413 PolarHBondContact OE2-NE 3.2Å; E310-R413 VanDerWaalsContact OE2-NE 3.15Å; E310-R413 IonicContact OE2-NH1 3.17Å; E310-R413 IonicContact OE2-NH2 2.75Å; E310-R413 PolarHBondContact OE2-NH2 3.14Å; T409-R413 WeakPolarHBondContact O-CB 2.94Å; T409-R413 PolarHBondContact O-N 3.18Å; I410-R413 PolarHBondContact O-N 2.99Å; A411-R413 PolarHBondContact O-N 3.18Å; R413-Q415 VanDerWaalsContact C-N 3.33Å; R413-Q415 PolarHBondContact O-N 3.2Å; R413-R416 PolarHBondContact O-N 3.24Å; R413-I417 HydrophobicContact CG-CD1 4.43Å; R413-I417 WeakPolarHBondContact O-CG1 3.32Å; R413-I417 PolarHBondContact O-N 2.93Å
414	Q	89.6	Confident	87.6	Confident	5 Å²	5	70 Å²	70	2%	0.023	36%	0.358	C	S	.	.	H	α-helix	trans	-64.2	-37.6	176.4	-69.9	-72.6	-32.7	0	0	111.7	L315 I410 A411 R416 I417 W418	L315-Q414 HydrophobicContact CB-CB 3.94Å; L315-Q414 HydrophobicContact CB-CG 3.72Å; L315-Q414 HydrophobicContact CD2-CB 4.31Å; L315-Q414 HydrophobicContact CD2-CG 4.36Å; I410-Q414 HydrophobicContact CG2-CG 4.34Å; I410-Q414 WeakPolarHBondContact O-CB 3.43Å; I410-Q414 VanDerWaalsContact O-CG 3.31Å; I410-Q414 WeakPolarHBondContact O-CG 3.45Å; I410-Q414 PolarHBondContact O-N 2.89Å; A411-Q414 PolarHBondContact O-N 3.25Å; Q414-R416 PolarHBondContact O-N 3.26Å; Q414-I417 WeakPolarHBondContact O-CB 3.35Å; Q414-I417 PolarHBondContact O-N 2.63Å; Q414-W418 PolarHBondContact O-N 3.27Å
415	Q	88.4	Confident	87.7	Confident	67 Å²	67	68 Å²	68	31%	0.313	34%	0.341	S	S	.	.	H	α-helix	trans	-58.4	-47.7	172	-173.4	64.5	50.9	0	0	111.7	M357 A411 S412 R413 I417 W418 D419	M357-Q415 VanDerWaalsContact CE-CD 3.48Å; A411-Q415 WeakPolarHBondContact O-CB 3.43Å; A411-Q415 PolarHBondContact O-N 3.5Å; S412-Q415 PolarHBondContact O-N 3.11Å; R413-Q415 VanDerWaalsContact C-N 3.33Å; R413-Q415 PolarHBondContact O-N 3.2Å; Q415-I417 VanDerWaalsContact C-N 3.3Å; Q415-I417 PolarHBondContact O-N 3.31Å; Q415-W418 PolarHBondContact O-N 3.01Å; Q415-W418 VanDerWaalsContact O-N 3.1Å; Q415-D419 PolarHBondContact NE2-OD1 3.38Å; Q415-D419 PolarHBondContact O-N 3.44Å
416	R	90.5	Very high	87.4	Confident	185 Å²	185	62.3 Å²	62.3	70%	0.698	32%	0.32	S	S	*	.	H	α-helix	trans	-61.1	-37.3	175.9	-69.1	-179.3	-164	155	3.5	112.8	S412 R413 Q414 W418 D419 S420	S412-R416 WeakPolarHBondContact O-CG 3.38Å; S412-R416 PolarHBondContact O-N 3.1Å; S412-R416 VanDerWaalsContact O-N 3.09Å; R413-R416 PolarHBondContact O-N 3.24Å; Q414-R416 PolarHBondContact O-N 3.26Å; R416-W418 VanDerWaalsContact C-N 3.33Å; R416-D419 PolarHBondContact O-N 3.02Å; R416-S420 WeakPolarHBondContact O-CB 3.5Å; R416-S420 PolarHBondContact O-N 3.03Å; R416-S420 PolarHBondContact O-OG 3.39Å
417	I	89.4	Confident	87.1	Confident	63 Å²	63	64.2 Å²	64.2	32%	0.323	33%	0.333	S	S	.	.	H	α-helix	trans	-61	-45.1	174.7	-67.3	167.5	0	0	0	109.8	R413 Q414 Q415 S420 R421	R413-I417 HydrophobicContact CG-CD1 4.43Å; R413-I417 WeakPolarHBondContact O-CG1 3.32Å; R413-I417 PolarHBondContact O-N 2.93Å; Q414-I417 WeakPolarHBondContact O-CB 3.35Å; Q414-I417 PolarHBondContact O-N 2.63Å; Q415-I417 VanDerWaalsContact C-N 3.3Å; Q415-I417 PolarHBondContact O-N 3.31Å; I417-S420 PolarHBondContact O-N 3.09Å; I417-S420 PolarHBondContact O-OG 2.92Å; I417-R421 WeakPolarHBondContact O-CG 3.32Å; I417-R421 PolarHBondContact O-N 3.35Å
418	W	89.9	Confident	86.7	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-66.9	-42.3	176.8	-74.6	116.7	0	0	0	113.3	V314 L315 V316 L353 Y354 M357 Q414 Q415 R416 S420 R421 T422 F425	V314-W418 HydrophobicContact CB-CZ2 4.02Å; V314-W418 HydrophobicContact CG1-CD2 4.5Å; V314-W418 VanDerWaalsContact CG1-CE2 3.42Å; V314-W418 HydrophobicContact CG1-CH2 4.17Å; V314-W418 HydrophobicContact CG1-CZ2 3.23Å; L315-W418 PolarHBondContact O-NE1 3.23Å; V316-W418 HydrophobicContact CG2-CZ2 3.85Å; L353-W418 HydrophobicContact CB-CH2 3.74Å; L353-W418 HydrophobicContact CB-CZ2 4.18Å; L353-W418 HydrophobicContact CD1-CH2 4.48Å; Y354-W418 HydrophobicContact CD2-CE3 4.27Å; M357-W418 HydrophobicContact CE-CB 3.94Å; M357-W418 HydrophobicContact CE-CG 3.78Å; M357-W418 HydrophobicContact SD-CB 3.51Å; M357-W418 VanDerWaalsContact SD-CB 3.51Å; M357-W418 HydrophobicContact SD-CD2 4.44Å; M357-W418 HydrophobicContact SD-CG 3.58Å; M357-W418 VanDerWaalsContact SD-CG 3.58Å; Q414-W418 PolarHBondContact O-N 3.27Å; Q415-W418 PolarHBondContact O-N 3.01Å; Q415-W418 VanDerWaalsContact O-N 3.1Å; R416-W418 VanDerWaalsContact C-N 3.33Å; W418-S420 VanDerWaalsContact C-N 3.26Å; W418-S420 PolarHBondContact O-N 3.39Å; W418-R421 WeakPolarHBondContact O-CB 3.41Å; W418-R421 PolarHBondContact O-N 2.99Å; W418-T422 PolarHBondContact O-N 3.07Å; W418-T422 VanDerWaalsContact O-N 3.16Å; W418-T422 PolarHBondContact O-OG1 3.14Å; W418-F425 HydrophobicContact CE3-CE2 4.4Å; W418-F425 HydrophobicContact CZ3-CE2 4.33Å; W418-F425 HydrophobicContact CZ3-CZ 4.26Å
419	D	87.7	Confident	86.3	Confident	70 Å²	70	61.3 Å²	61.3	37%	0.374	32%	0.317	S	S	.	.	H	α-helix	trans	-63.1	-35.1	177.6	-62	-25.6	0	0	0	111.2	Q415 R416 R421 T422	Q415-D419 PolarHBondContact NE2-OD1 3.38Å; Q415-D419 PolarHBondContact O-N 3.44Å; R416-D419 PolarHBondContact O-N 3.02Å; D419-R421 PolarHBondContact O-N 2.91Å; D419-T422 WeakPolarHBondContact O-CB 3.14Å; D419-T422 PolarHBondContact O-N 2.96Å; D419-T422 PolarHBondContact O-OG1 3.1Å
420	S	88.2	Confident	85.4	Confident	80 Å²	80	60.5 Å²	60.5	56%	0.559	32%	0.315	S	S	*	.	H	α-helix	trans	-67.8	-22.9	174	76.4	0	0	0	0	113.7	R416 I417 W418 P423	R416-S420 WeakPolarHBondContact O-CB 3.5Å; R416-S420 PolarHBondContact O-N 3.03Å; R416-S420 PolarHBondContact O-OG 3.39Å; I417-S420 PolarHBondContact O-N 3.09Å; I417-S420 PolarHBondContact O-OG 2.92Å; W418-S420 VanDerWaalsContact C-N 3.26Å; W418-S420 PolarHBondContact O-N 3.39Å; S420-P423 WeakPolarHBondContact O-CD 3.37Å; S420-P423 WeakPolarHBondContact O-CG 3.2Å
421	R	86.4	Confident	84.2	Confident	62 Å²	62	61.7 Å²	61.7	23%	0.234	32%	0.321	C	S	.	.	H	α-helix	trans	-88.1	-18.3	176.9	-69.6	174.8	172.3	-145.3	-9.1	112.8	D350 I417 W418 D419 H424 F425	D350-R421 IonicContact OD2-CZ 2.73Å; D350-R421 IonicContact OD2-NH1 3.24Å; D350-R421 PolarHBondContact OD2-NH1 3.45Å; I417-R421 WeakPolarHBondContact O-CG 3.32Å; I417-R421 PolarHBondContact O-N 3.35Å; W418-R421 WeakPolarHBondContact O-CB 3.41Å; W418-R421 PolarHBondContact O-N 2.99Å; D419-R421 PolarHBondContact O-N 2.91Å; R421-H424 WeakPolarHBondContact O-CA 3.41Å; R421-H424 VanDerWaalsContact O-CB 3.29Å; R421-H424 WeakPolarHBondContact O-CB 3.3Å; R421-H424 PolarHBondContact O-N 2.92Å; R421-F425 HydrophobicContact CB-CD2 4.3Å; R421-F425 HydrophobicContact CB-CE2 3.66Å; R421-F425 HydrophobicContact CB-CZ 4.16Å; R421-F425 VanDerWaalsContact O-CD2 3.29Å; R421-F425 WeakPolarHBondContact O-CD2 3.26Å; R421-F425 PolarHBondContact O-N 3.16Å; R421-F425 VanDerWaalsContact O-N 3.11Å
422	T	83.7	Confident	82.9	Confident	22 Å²	22	61.2 Å²	61.2	14%	0.135	32%	0.316	C	S	.	.	H	α-helix	trans	-48.4	-49.6	176	-60.2	0	0	0	0	114.2	Y354 W418 D419 H424 F425 A426	Y354-T422 WeakPolarHBondContact CE2-OG1 3.27Å; Y354-T422 PolarHBondContact OH-OG1 3.47Å; W418-T422 PolarHBondContact O-N 3.07Å; W418-T422 VanDerWaalsContact O-N 3.16Å; W418-T422 PolarHBondContact O-OG1 3.14Å; D419-T422 WeakPolarHBondContact O-CB 3.14Å; D419-T422 PolarHBondContact O-N 2.96Å; D419-T422 PolarHBondContact O-OG1 3.1Å; T422-H424 VanDerWaalsContact C-N 3.25Å; T422-H424 PolarHBondContact O-N 3.39Å; T422-F425 PolarHBondContact O-N 3.3Å; T422-F425 VanDerWaalsContact O-N 3.15Å; T422-A426 PolarHBondContact O-N 3.45Å
423	P	82.8	Confident	81.5	Confident	85 Å²	85	60 Å²	60	55%	0.552	31%	0.306	S	S	*	.	H	α-helix	trans	-64.6	-29.3	178.7	25	-35.4	0	0	0	113	S420 A426 K427	S420-P423 WeakPolarHBondContact O-CD 3.37Å; S420-P423 WeakPolarHBondContact O-CG 3.2Å; P423-A426 PolarHBondContact O-N 3.28Å; P423-K427 PolarHBondContact O-N 3.43Å; P423-K427 VanDerWaalsContact O-N 3.09Å
424	H	85.8	Confident	79.9	Confident	84 Å²	84	64 Å²	64	39%	0.389	33%	0.33	S	S	.	.	H	α-helix	trans	-66.7	-42.7	174.3	-178.2	73.9	0	0	0	111.2	R421 T422 K427 C428	R421-H424 WeakPolarHBondContact O-CA 3.41Å; R421-H424 VanDerWaalsContact O-CB 3.29Å; R421-H424 WeakPolarHBondContact O-CB 3.3Å; R421-H424 PolarHBondContact O-N 2.92Å; T422-H424 VanDerWaalsContact C-N 3.25Å; T422-H424 PolarHBondContact O-N 3.39Å; H424-K427 PolarHBondContact O-N 3.08Å; H424-C428 PolarHBondContact O-N 3.15Å
425	F	84.4	Confident	78.3	Confident	3 Å²	3	70.3 Å²	70.3	1%	0.013	36%	0.359	C	S	.	.	H	α-helix	trans	-67.5	-38.1	175.9	-60	-50.6	0	0	0	112.6	D350 F351 Y354 W418 R421 T422 K427 C428 F429	D350-F425 HydrophobicContact CB-CE1 3.92Å; D350-F425 HydrophobicContact CB-CZ 3.87Å; F351-F425 HydrophobicContact CB-CD1 4.23Å; F351-F425 HydrophobicContact CB-CE1 4.32Å; F351-F425 HydrophobicContact CD2-CB 4.26Å; F351-F425 HydrophobicContact CD2-CD1 4.3Å; F351-F425 HydrophobicContact CD2-CG 4.3Å; Y354-F425 HydrophobicContact CD1-CD2 4Å; Y354-F425 HydrophobicContact CD1-CE2 4.41Å; Y354-F425 HydrophobicContact CD2-CD2 4.12Å; Y354-F425 AromaticContact CD2-CE2 4Å; Y354-F425 HydrophobicContact CD2-CE2 4Å; Y354-F425 AromaticContact CG-CD2 3.78Å; Y354-F425 HydrophobicContact CG-CD2 3.78Å; Y354-F425 AromaticContact CG-CE2 3.75Å; Y354-F425 HydrophobicContact CG-CE2 3.75Å; W418-F425 HydrophobicContact CE3-CE2 4.4Å; W418-F425 HydrophobicContact CZ3-CE2 4.33Å; W418-F425 HydrophobicContact CZ3-CZ 4.26Å; R421-F425 HydrophobicContact CB-CD2 4.3Å; R421-F425 HydrophobicContact CB-CE2 3.66Å; R421-F425 HydrophobicContact CB-CZ 4.16Å; R421-F425 VanDerWaalsContact O-CD2 3.29Å; R421-F425 WeakPolarHBondContact O-CD2 3.26Å; R421-F425 PolarHBondContact O-N 3.16Å; R421-F425 VanDerWaalsContact O-N 3.11Å; T422-F425 PolarHBondContact O-N 3.3Å; T422-F425 VanDerWaalsContact O-N 3.15Å; F425-K427 PolarHBondContact O-N 3.49Å; F425-C428 PolarHBondContact O-N 3.08Å; F425-F429 HydrophobicContact CB-CD2 4.27Å; F425-F429 HydrophobicContact CD1-CD2 4.26Å; F425-F429 AromaticContact CD1-CE2 3.99Å; F425-F429 HydrophobicContact CD1-CE2 3.99Å; F425-F429 WeakPolarHBondContact O-CD2 3.31Å; F425-F429 PolarHBondContact O-N 3.12Å
426	A	80.7	Confident	76.8	Confident	38 Å²	38	67.3 Å²	67.3	31%	0.314	35%	0.346	S	S	.	.	H	α-helix	trans	-60.9	-33.8	173.4	0	0	0	0	0	112.5	T422 P423 V432	T422-A426 PolarHBondContact O-N 3.45Å; P423-A426 PolarHBondContact O-N 3.28Å; A426-V432 HydrophobicContact CB-CB 4.45Å; A426-V432 HydrophobicContact CB-CG1 4.18Å
427	K	81.7	Confident	75.2	Confident	184 Å²	184	66.5 Å²	66.5	80%	0.8	34%	0.343	S	S	*	.	H	α-helix	trans	-73.2	-36.2	174.4	-173	176.1	-179.9	177.3	0	113.1	P423 H424 F425	P423-K427 PolarHBondContact O-N 3.43Å; P423-K427 VanDerWaalsContact O-N 3.09Å; H424-K427 PolarHBondContact O-N 3.08Å; F425-K427 PolarHBondContact O-N 3.49Å
428	C	79.1	Confident	73.8	Confident	32 Å²	32	64.1 Å²	64.1	22%	0.216	33%	0.331	C	S	.	.	H	α-helix	trans	-87.3	-27	-175.7	-71.1	0	0	0	0	114.3	Y371 H424 F425	Y371-C428 WeakPolarHBondContact CD2-O 3.43Å; Y371-C428 HydrophobicContact CE2-CB 4.28Å; H424-C428 PolarHBondContact O-N 3.15Å; F425-C428 PolarHBondContact O-N 3.08Å
429	F	79.6	Confident	72.1	Confident	1 Å²	1	68.3 Å²	68.3	0%	0.004	35%	0.353	C	S	.	.			trans	-130.1	123.8	-171.9	-56.8	-76.1	0	0	0	110.6	N347 F351 D368 Y371 W377 F425 N431 V432	N347-F429 HydrophobicContact CB-CZ 4.47Å; F351-F429 HydrophobicContact CB-CD2 4.12Å; F351-F429 HydrophobicContact CB-CE2 3.54Å; F351-F429 HydrophobicContact CB-CZ 3.8Å; F351-F429 AromaticContact CD2-CD2 3.6Å; F351-F429 HydrophobicContact CD2-CD2 3.6Å; F351-F429 AromaticContact CD2-CE2 3.94Å; F351-F429 HydrophobicContact CD2-CE2 3.94Å; F351-F429 HydrophobicContact CD2-CG 4.1Å; F351-F429 HydrophobicContact CE2-CB 4.34Å; F351-F429 HydrophobicContact CE2-CD2 4.16Å; F351-F429 HydrophobicContact CE2-CG 4.29Å; F351-F429 AromaticContact CG-CD2 3.82Å; F351-F429 HydrophobicContact CG-CD2 3.82Å; F351-F429 HydrophobicContact CG-CE1 4.48Å; F351-F429 AromaticContact CG-CE2 3.76Å; F351-F429 HydrophobicContact CG-CE2 3.76Å; F351-F429 HydrophobicContact CG-CG 4.24Å; F351-F429 HydrophobicContact CG-CZ 4.09Å; D368-F429 HydrophobicContact CB-CD1 4.13Å; Y371-F429 HydrophobicContact CD1-CD1 4.36Å; Y371-F429 AromaticContact CD1-CE1 3.44Å; Y371-F429 HydrophobicContact CD1-CE1 3.44Å; Y371-F429 VanDerWaalsContact CD1-CE1 3.44Å; Y371-F429 HydrophobicContact CD1-CZ 4.05Å; Y371-F429 HydrophobicContact CD2-CD1 4.3Å; Y371-F429 AromaticContact CD2-CE1 4Å; Y371-F429 HydrophobicContact CD2-CE1 4Å; Y371-F429 AromaticContact CE1-CE1 3.79Å; Y371-F429 HydrophobicContact CE1-CE1 3.79Å; Y371-F429 AromaticContact CE1-CZ 3.9Å; Y371-F429 HydrophobicContact CE1-CZ 3.9Å; Y371-F429 HydrophobicContact CE2-CE1 4.32Å; Y371-F429 HydrophobicContact CG-CD1 4.03Å; Y371-F429 AromaticContact CG-CE1 3.54Å; Y371-F429 HydrophobicContact CG-CE1 3.54Å; Y371-F429 HydrophobicContact CG-CZ 4.42Å; W377-F429 HydrophobicContact CH2-CD1 4.44Å; W377-F429 AromaticContact CH2-CE1 3.64Å; W377-F429 HydrophobicContact CH2-CE1 3.64Å; W377-F429 HydrophobicContact CH2-CZ 4.11Å; W377-F429 HydrophobicContact CZ2-CD1 4.42Å; W377-F429 AromaticContact CZ2-CE1 3.75Å; W377-F429 HydrophobicContact CZ2-CE1 3.75Å; F425-F429 HydrophobicContact CB-CD2 4.27Å; F425-F429 HydrophobicContact CD1-CD2 4.26Å; F425-F429 AromaticContact CD1-CE2 3.99Å; F425-F429 HydrophobicContact CD1-CE2 3.99Å; F425-F429 WeakPolarHBondContact O-CD2 3.31Å; F425-F429 PolarHBondContact O-N 3.12Å; F429-N431 PolarHBondContact O-N 2.83Å; F429-V432 HydrophobicContact CB-CG2 4.31Å; F429-V432 PolarHBondContact O-N 3.49Å
430	S	68.7	Low	70.5	Confident	83 Å²	83	72.4 Å²	72.4	58%	0.58	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-18.8	-178.9	60.6	0	0	0	0	113.8	D368 V432	D368-S430 PolarHBondContact OD2-N 3.11Å; D368-S430 PolarHBondContact OD2-OG 3.4Å; S430-V432 VanDerWaalsContact C-N 3.27Å; S430-V432 PolarHBondContact O-N 3.08Å
431	N	65.3	Low	68.3	Low	30 Å²	30	72 Å²	72	16%	0.16	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	0.5	-176.5	-65.2	-12	0	0	0	114.4	E366 V367 D368 F429 I438 L439	E366-N431 PolarHBondContact O-ND2 3.19Å; V367-N431 VanDerWaalsContact C-ND2 3.31Å; D368-N431 PolarHBondContact N-ND2 3.2Å; F429-N431 PolarHBondContact O-N 2.83Å; N431-I438 WeakPolarHBondContact O-CA 3.34Å; N431-L439 PolarHBondContact O-N 2.72Å
432	V	61	Low	65.8	Low	11 Å²	11	71.2 Å²	71.2	7%	0.067	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-105.8	117	-179.5	-176.3	0	0	0	0	108.8	F351 A426 F429 S430	F351-V432 HydrophobicContact CD2-CG2 4.4Å; F351-V432 HydrophobicContact CE2-CG2 3.44Å; F351-V432 VanDerWaalsContact CE2-CG2 3.44Å; F351-V432 HydrophobicContact CZ-CG2 4.13Å; A426-V432 HydrophobicContact CB-CB 4.45Å; A426-V432 HydrophobicContact CB-CG1 4.18Å; F429-V432 HydrophobicContact CB-CG2 4.31Å; F429-V432 PolarHBondContact O-N 3.49Å; S430-V432 VanDerWaalsContact C-N 3.27Å; S430-V432 PolarHBondContact O-N 3.08Å
433	T	58.4	Low	63.4	Low	37 Å²	37	78.3 Å²	78.3	23%	0.227	42%	0.417	C	S	.	.			trans	-63.9	159.1	171.1	50.1	0	0	0	0	111.4	E435 G436 R437 L439	T433-E435 PolarHBondContact O-N 2.86Å; T433-E435 VanDerWaalsContact O-N 3.1Å; T433-G436 WeakPolarHBondContact O-CA 3.21Å; T433-G436 PolarHBondContact O-N 2.89Å; T433-R437 PolarHBondContact N-O 2.98Å; T433-R437 WeakPolarHBondContact OG1-CA 3.24Å; T433-R437 WeakPolarHBondContact OG1-CB 3.45Å; T433-R437 PolarHBondContact OG1-N 3.3Å; T433-R437 PolarHBondContact OG1-O 3.04Å; T433-L439 HydrophobicContact CG2-CD1 4.04Å; T433-L439 HydrophobicContact CG2-CD2 3.4Å; T433-L439 HydrophobicContact CG2-CG 3.67Å
434	E	55.7	Low	61.1	Low	203 Å²	203	82.3 Å²	82.3	95%	0.949	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-25.9	171.2	-65.6	-172.6	164	0	0	112.4	G436	E434-G436 PolarHBondContact O-N 3.13Å
435	E	56.3	Low	58.6	Low	136 Å²	136	83.1 Å²	83.1	64%	0.636	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	2	172.7	-57.5	-175.4	163.9	0	0	114.2	T433 R437	T433-E435 PolarHBondContact O-N 2.86Å; T433-E435 VanDerWaalsContact O-N 3.1Å; E435-R437 HydrophobicContact CB-CG 4.45Å; E435-R437 PolarHBondContact O-N 2.83Å; E435-R437 IonicContact OE2-CZ 2.68Å; E435-R437 VanDerWaalsContact OE2-CZ 3.24Å; E435-R437 IonicContact OE2-NE 3.93Å; E435-R437 IonicContact OE2-NH1 3.14Å; E435-R437 PolarHBondContact OE2-NH1 2.66Å
436	G	57.5	Low	55.8	Low	4 Å²	4	87.4 Å²	87.4	4%	0.041	47%	0.469	C	S	.	.	S	Bend	trans	73.1	9.6	-179.1	0	0	0	0	0	114.9	Y354 T433 E434	Y354-G436 PolarHBondContact OH-O 3.45Å; T433-G436 WeakPolarHBondContact O-CA 3.21Å; T433-G436 PolarHBondContact O-N 2.89Å; E434-G436 PolarHBondContact O-N 3.13Å
437	R	56.8	Low	53.5	Low	169 Å²	169	95 Å²	95	64%	0.638	49%	0.491	S	S	*	.			trans	-81.1	130	174	-60.2	177.1	174.7	153.8	-7.5	109.9	T433 E435 L439	T433-R437 PolarHBondContact N-O 2.98Å; T433-R437 WeakPolarHBondContact OG1-CA 3.24Å; T433-R437 WeakPolarHBondContact OG1-CB 3.45Å; T433-R437 PolarHBondContact OG1-N 3.3Å; T433-R437 PolarHBondContact OG1-O 3.04Å; E435-R437 HydrophobicContact CB-CG 4.45Å; E435-R437 PolarHBondContact O-N 2.83Å; E435-R437 IonicContact OE2-CZ 2.68Å; E435-R437 VanDerWaalsContact OE2-CZ 3.24Å; E435-R437 IonicContact OE2-NE 3.93Å; E435-R437 IonicContact OE2-NH1 3.14Å; E435-R437 PolarHBondContact OE2-NH1 2.66Å; R437-L439 PolarHBondContact O-N 3.17Å
438	I	60.9	Low	51.1	Low	12 Å²	12	91.5 Å²	91.5	6%	0.062	48%	0.481	C	S	.	.	B	Isolated β-bridge	trans	-75.7	110.6	172.8	-60.5	173.8	0	0	0	108.2	F351 G355 K359 L362 E366 N431 K440	F351-I438 HydrophobicContact CZ-CD1 4.38Å; G355-I438 VanDerWaalsContact CA-CD1 3.49Å; K359-I438 PolarHBondContact NZ-O 3.49Å; L362-I438 HydrophobicContact CD2-CD1 4.42Å; E366-I438 HydrophobicContact CB-CG2 3.84Å; E366-I438 HydrophobicContact CG-CG2 4.4Å; N431-I438 WeakPolarHBondContact O-CA 3.34Å; I438-K440 PolarHBondContact O-N 3.3Å
439	L	53.6	Low	48.7	Very low	89 Å²	89	93.1 Å²	93.1	47%	0.466	49%	0.493	S	S	.	.			trans	-59	129.6	178.2	-68.6	173.8	0	0	0	109.8	N431 T433 R437 A441	N431-L439 PolarHBondContact O-N 2.72Å; T433-L439 HydrophobicContact CG2-CD1 4.04Å; T433-L439 HydrophobicContact CG2-CD2 3.4Å; T433-L439 HydrophobicContact CG2-CG 3.67Å; R437-L439 PolarHBondContact O-N 3.17Å; L439-A441 PolarHBondContact O-N 3.36Å
440	K	53	Low	46.3	Very low	156 Å²	156	97.6 Å²	97.6	68%	0.678	52%	0.524	S	S	*	.			trans	-71.8	115.3	165.4	-73.8	-177.7	178.7	174.2	0	107	I438 G442	I438-K440 PolarHBondContact O-N 3.3Å; K440-G442 PolarHBondContact O-N 2.85Å
441	A	42.6	Very low	44.5	Very low	71 Å²	71	98.1 Å²	98.1	59%	0.587	53%	0.533	S	S	*	.	S	Bend	trans	-66.7	88.3	163.4	0	0	0	0	0	108.4	L439	L439-A441 PolarHBondContact O-N 3.36Å
442	G	34.9	Very low	42.9	Very low	46 Å²	46	103.7 Å²	103.7	47%	0.474	56%	0.563	S	S	.	*			trans	132.5	84.4	170	0	0	0	0	0	115.4	K440	K440-G442 PolarHBondContact O-N 2.85Å
443	D	33.1	Very low	41.7	Very low	170 Å²	170	110.3 Å²	110.3	91%	0.909	60%	0.598	S	S	*	*	S	Bend	trans	-87.2	13.4	149.3	-106.4	-2.8	0	0	0	111.9
444	Q	34.7	Very low	40.7	Very low	170 Å²	170	114.2 Å²	114.2	79%	0.794	62%	0.622	S	S	*	*	S	Bend	trans	-131.3	132	164.8	-59.6	-170.8	21	0	0	106.8
445	V	31.8	Very low	40	Very low	100 Å²	100	111.9 Å²	111.9	61%	0.606	62%	0.616	S	S	*	*			trans	85.5	58.4	-178.1	-153	0	0	0	0	115.5	L448	V445-L448 HydrophobicContact CG1-CD1 4.46Å; V445-L448 HydrophobicContact CG1-CG 4.48Å
446	S	27.1	Very low	39	Very low	93 Å²	93	114.3 Å²	114.3	65%	0.65	63%	0.628	S	S	*	*			trans	-53	149.6	131.1	52	0	0	0	0	108.7
447	Y	31.2	Very low	38	Very low	197 Å²	197	122 Å²	122	77%	0.773	66%	0.662	S	S	*	*			trans	90.5	35.9	-176.8	-52	-75.8	0	0	0	118.9
448	L	31.1	Very low	37.1	Very low	111 Å²	111	120.5 Å²	120.5	58%	0.581	67%	0.667	S	S	*	*			trans	-142.9	62.3	156.1	-71.1	177.8	0	0	0	111.1	R365 V445	R365-L448 PolarHBondContact NH2-O 3.07Å; V445-L448 HydrophobicContact CG1-CD1 4.46Å; V445-L448 HydrophobicContact CG1-CG 4.48Å
449	S	29.1	Very low	36	Very low	66 Å²	66	124.8 Å²	124.8	46%	0.462	71%	0.705	S	S	.	*	S	Bend	trans	-145.3	64	162.4	178.4	0	0	0	0	108.5	N390	N390-S449 WeakPolarHBondContact CB-OG 3.41Å; N390-S449 PolarHBondContact OD1-OG 2.79Å
450	S	29.3	Very low	35.2	Very low	96 Å²	96	131.8 Å²	131.8	67%	0.671	73%	0.725	S	S	*	*			trans	-164.8	92.6	169.8	60.7	0	0	0	0	109.3
451	A	31.4	Very low	34.4	Very low	93 Å²	93	135.4 Å²	135.4	77%	0.769	73%	0.734	S	S	*	*	S	Bend	trans	-141.2	76.1	160.9	0	0	0	0	0	105.6
452	D	32.3	Very low	34.2	Very low	148 Å²	148	139.5 Å²	139.5	79%	0.791	75%	0.746	S	S	*	*			trans	166	90.8	161.3	-89.5	-10.3	0	0	0	104.5
453	N	35.5	Very low	33.9	Very low	150 Å²	150	147.2 Å²	147.2	80%	0.802	76%	0.761	S	S	*	*			trans	-162.1	98	159.2	-84.2	-22.2	0	0	0	105.6
454	T	36.9	Very low	34	Very low	119 Å²	119	145.4 Å²	145.4	73%	0.73	76%	0.76	S	S	*	*			trans	-63.5	154.6	140.7	44.6	0	0	0	0	108.1
455	D	40.8	Very low	33.8	Very low	154 Å²	154	145 Å²	145	82%	0.824	76%	0.758	S	S	*	*			trans	97.2	119.1	168.5	-46.8	-26	0	0	0	115.6
456	E	36.2	Very low	33.9	Very low	187 Å²	187	150.3 Å²	150.3	87%	0.874	77%	0.773	S	S	*	*			trans	-70.4	171.4	-171.8	-74	171.5	121.3	0	0	113.3
457	E	35.8	Very low	34.1	Very low	165 Å²	165	152.9 Å²	152.9	77%	0.771	78%	0.777	S	S	*	*			trans	101.6	126.8	141.7	-123.5	-175.1	147.9	0	0	117.7
458	N	37.2	Very low	34.4	Very low	137 Å²	137	151.3 Å²	151.3	73%	0.733	78%	0.782	S	S	*	*			trans	81.5	92.3	159	-57.9	-38.4	0	0	0	118.3
459	A	38.9	Very low	34.4	Very low	103 Å²	103	153.8 Å²	153.8	85%	0.851	79%	0.79	S	S	*	*				172.3	117.5	98.7	0	0	0	0	0	111
460	R	35.8	Very low	34.8	Very low	235 Å²	235	156.3 Å²	156.3	89%	0.887	81%	0.808	S	S	*	*			trans	-80.1	159.7	165.9	-69.3	174.1	169.7	166.2	-3.3	109.6
461	R	37.1	Very low	34.9	Very low	232 Å²	232	159.1 Å²	159.1	88%	0.875	82%	0.815	S	S	*	*			trans	88.3	125.1	171.8	-53.4	172.9	-178.4	134.6	-2.4	112
462	D	37.1	Very low	35.2	Very low	158 Å²	158	159.7 Å²	159.7	85%	0.845	81%	0.811	S	S	*	*			cis	-148.4	155.5	37.7	-94.5	-45.2	0	0	0	115.1
463	R	30.5	Very low	35	Very low	207 Å²	207	158.5 Å²	158.5	78%	0.781	81%	0.81	S	S	*	*			trans	-84.7	142.9	177	172.9	-165.6	-91.1	-165	-8.9	110.4
464	C	33.9	Very low	34.9	Very low	132 Å²	132	159 Å²	159	89%	0.892	81%	0.811	S	S	*	*			trans	-164.5	122.1	134.5	-103.6	0	0	0	0	112.5
465	E	29.8	Very low	34.5	Very low	161 Å²	161	157.6 Å²	157.6	75%	0.752	81%	0.812	S	S	*	*			trans	-65	147.3	168	-65	156.5	142.7	0	0	110.7
466	K	35.2	Very low	34.2	Very low	212 Å²	212	158.8 Å²	158.8	92%	0.922	81%	0.812	S	S	*	*			trans	-150.7	124.2	139.3	-109.8	176.8	-173	-175.3	0	110.2
467	M	31.8	Very low	33.9	Very low	148 Å²	148	155.5 Å²	155.5	73%	0.729	81%	0.81	S	S	*	*			trans	-97.2	129.6	-178.8	-178.3	174.7	170.5	0	0	105.9
468	D	36.4	Very low	33.5	Very low	164 Å²	164	152.1 Å²	152.1	88%	0.877	81%	0.81	S	S	*	*			trans	-144.5	118.9	157.8	-94	-35.1	0	0	0	108.7
469	Q	32.1	Very low	33.3	Very low	163 Å²	163	150 Å²	150	76%	0.762	81%	0.811	S	S	*	*			trans	-91.5	129.7	172	-67	175.3	5.4	0	0	108.1
470	S	37.9	Very low	33	Very low	118 Å²	118	151 Å²	151	83%	0.825	81%	0.81	S	S	*	*			trans	-164.6	110.1	146.3	34.5	0	0	0	0	109.8
471	N	31.3	Very low	33.1	Very low	155 Å²	155	148.2 Å²	148.2	83%	0.829	81%	0.81	S	S	*	*			trans	-99.3	157.2	152.9	-118.8	-7.3	0	0	0	105.3
472	P	36.2	Very low	32.7	Very low	106 Å²	106	140.6 Å²	140.6	69%	0.688	80%	0.804	S	S	*	*				-155.6	167.7	64.8	41.1	-19.9	0	0	0	117.6
473	T	29.7	Very low	32.3	Very low	123 Å²	123	137 Å²	137	76%	0.755	81%	0.805	S	S	*	*			trans	49.1	116.8	147.2	36.7	0	0	0	0	120.2
474	L	33.4	Very low	32.3	Very low	160 Å²	160	132.3 Å²	132.3	84%	0.838	80%	0.804	S	S	*	*			trans	-147.5	111.6	134.3	-101.5	165.1	0	0	0	109.5
475	A	27.8	Very low	32.1	Very low	90 Å²	90	131.2 Å²	131.2	74%	0.744	80%	0.795	S	S	*	*			trans	-80.4	135.1	171.5	0	0	0	0	0	109.5
476	H	33.7	Very low	32.1	Very low	179 Å²	179	132.5 Å²	132.5	83%	0.829	80%	0.8	S	S	*	*			trans	-125.1	120.6	157.8	-85.1	-65.3	0	0	0	110.6
477	S	29.8	Very low	31.8	Very low	117 Å²	117	125.8 Å²	125.8	82%	0.818	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-62.9	134.6	-175	-177.5	0	0	0	0	113
478	A	28.2	Very low	32.4	Very low	95 Å²	95	125.4 Å²	125.4	79%	0.785	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-89.4	121.8	162.3	0	0	0	0	0	108.9
479	A	32.5	Very low	33.6	Very low	91 Å²	91	120.9 Å²	120.9	75%	0.752	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-91.4	129.2	168.6	0	0	0	0	0	109.7
480	P	33.5	Very low	35.4	Very low	126 Å²	126	114.5 Å²	114.5	82%	0.818	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-92.7	125.8	168.8	33.1	-25.3	0	0	0	109.7
481	I	37.3	Very low	37.3	Very low	175 Å²	175	112 Å²	112	90%	0.897	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-87.1	127.4	166.6	-63.2	175.4	0	0	0	107.5
482	G	29.3	Very low	39.6	Very low	73 Å²	73	107 Å²	107	75%	0.753	71%	0.707	S	S	*	*			trans	-90.6	-172.4	-169.9	0	0	0	0	0	117.1
483	G	29	Very low	41.8	Very low	83 Å²	83	103.1 Å²	103.1	86%	0.856	68%	0.681	S	S	*	*			trans	99.4	128.7	175.8	0	0	0	0	0	111.7
484	S	29.2	Very low	44.3	Very low	108 Å²	108	97.2 Å²	97.2	76%	0.755	65%	0.646	S	S	*	*			cis	-163	152.9	8.3	175.7	0	0	0	0	106.8	H486	S484-H486 PolarHBondContact O-N 2.82Å
485	P	29.4	Very low	46.7	Very low	108 Å²	108	90.6 Å²	90.6	70%	0.701	61%	0.613	S	S	*	*			trans	-98.7	78.8	-164.5	37.4	-30.3	0	0	0	112.4
486	H	29.7	Very low	49.3	Very low	188 Å²	188	89.1 Å²	89.1	87%	0.87	60%	0.6	S	S	*	*			trans	-152.4	117.6	165	-77	-61.7	0	0	0	111.2	S484	S484-H486 PolarHBondContact O-N 2.82Å
487	G	29.5	Very low	51.8	Low	71 Å²	71	81.9 Å²	81.9	73%	0.732	57%	0.57	S	S	*	*	S	Bend	trans	126	124.5	175.6	0	0	0	0	0	111.5	S489	G487-S489 PolarHBondContact O-N 3.17Å
488	I	45.6	Very low	54.3	Low	141 Å²	141	76.5 Å²	76.5	72%	0.723	53%	0.531	S	S	*	.			trans	-55.5	101.1	177.1	-61.8	165	0	0	0	107.7	S490 V493	I488-S490 PolarHBondContact O-N 2.91Å; I488-V493 HydrophobicContact CG2-CG2 4.31Å
489	S	61.1	Low	56.9	Low	68 Å²	68	79.1 Å²	79.1	48%	0.476	53%	0.525	S	S	.	.			trans	-65.4	124.1	-174.5	-175.4	0	0	0	0	108.7	G487 N491 G492	G487-S489 PolarHBondContact O-N 3.17Å; S489-N491 PolarHBondContact O-N 3.44Å; S489-G492 PolarHBondContact O-N 3.22Å
490	S	68.8	Low	59.3	Low	30 Å²	30	78.7 Å²	78.7	21%	0.21	52%	0.521	C	S	.	.	H	α-helix	trans	-47.2	-29.8	174.9	44.6	0	0	0	0	113	I488 G492 V493 I494	I488-S490 PolarHBondContact O-N 2.91Å; S490-G492 VanDerWaalsContact C-N 3.33Å; S490-G492 PolarHBondContact O-N 2.85Å; S490-V493 PolarHBondContact O-N 3.42Å; S490-I494 WeakPolarHBondContact O-CG1 3.47Å; S490-I494 PolarHBondContact O-N 3.44Å; S490-I494 VanDerWaalsContact O-N 3.13Å
491	N	77.6	Confident	61.5	Low	66 Å²	66	77.2 Å²	77.2	35%	0.353	50%	0.503	S	S	.	.	H	α-helix	trans	-60.9	-34.9	173.5	-69.5	-23.8	0	0	0	113.8	S489 S495	S489-N491 PolarHBondContact O-N 3.44Å; N491-S495 WeakPolarHBondContact O-CB 3.33Å; N491-S495 PolarHBondContact O-N 3.23Å
492	G	80.9	Confident	63.6	Low	48 Å²	48	70 Å²	70	50%	0.495	47%	0.468	S	S	.	.	H	α-helix	trans	-68.4	-42.7	179.3	0	0	0	0	0	112.4	S489 S490 S495 A496	S489-G492 PolarHBondContact O-N 3.22Å; S490-G492 VanDerWaalsContact C-N 3.33Å; S490-G492 PolarHBondContact O-N 2.85Å; G492-S495 PolarHBondContact O-N 3.41Å; G492-A496 WeakPolarHBondContact O-CB 3.45Å; G492-A496 PolarHBondContact O-N 2.95Å
493	V	82.7	Confident	66.1	Low	25 Å²	25	66.9 Å²	66.9	15%	0.152	43%	0.434	C	S	.	.	H	α-helix	trans	-66	-48.3	177.3	-177.2	0	0	0	0	110.2	I488 S490 S495 A496 C497 S516	I488-V493 HydrophobicContact CG2-CG2 4.31Å; S490-V493 PolarHBondContact O-N 3.42Å; V493-S495 VanDerWaalsContact C-N 3.32Å; V493-S495 PolarHBondContact O-N 2.87Å; V493-A496 WeakPolarHBondContact O-CB 3.25Å; V493-A496 PolarHBondContact O-N 3Å; V493-A496 VanDerWaalsContact O-N 3.13Å; V493-C497 PolarHBondContact O-N 3.32Å; V493-C497 PolarHBondContact O-SG 2.86Å; V493-S516 WeakPolarHBondContact CG2-OG 3.33Å
494	I	81.9	Confident	68.8	Low	0 Å²	0	63.4 Å²	63.4	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-63.7	-38.7	179.3	-63.8	169.3	0	0	0	110.9	S490 C497 F498 L509 V513 M526 C534 L538	S490-I494 WeakPolarHBondContact O-CG1 3.47Å; S490-I494 PolarHBondContact O-N 3.44Å; S490-I494 VanDerWaalsContact O-N 3.13Å; I494-C497 PolarHBondContact O-N 2.8Å; I494-F498 HydrophobicContact CG2-CD2 3.71Å; I494-F498 HydrophobicContact CG2-CE2 3.46Å; I494-F498 VanDerWaalsContact CG2-CE2 3.46Å; I494-F498 VanDerWaalsContact O-CD2 3.29Å; I494-F498 WeakPolarHBondContact O-CD2 3.39Å; I494-F498 PolarHBondContact O-N 2.94Å; I494-L509 HydrophobicContact CG2-CD2 4.2Å; I494-V513 HydrophobicContact CD1-CG2 4.3Å; I494-V513 HydrophobicContact CG1-CG2 3.93Å; I494-M526 HydrophobicContact CD1-CE 4.14Å; I494-C534 HydrophobicContact CD1-CB 3.49Å; I494-C534 VanDerWaalsContact CD1-CB 3.49Å; I494-L538 HydrophobicContact CB-CD1 3.84Å; I494-L538 HydrophobicContact CG2-CD1 3.5Å; I494-L538 VanDerWaalsContact CG2-CD1 3.5Å
495	S	82.7	Confident	71.4	Confident	21 Å²	21	58.9 Å²	58.9	15%	0.147	36%	0.364	C	S	.	.	H	α-helix	trans	-63.9	-39.1	173.8	-178.9	0	0	0	0	112.4	N491 G492 V493 F498 K499 F560	N491-S495 WeakPolarHBondContact O-CB 3.33Å; N491-S495 PolarHBondContact O-N 3.23Å; G492-S495 PolarHBondContact O-N 3.41Å; V493-S495 VanDerWaalsContact C-N 3.32Å; V493-S495 PolarHBondContact O-N 2.87Å; S495-F498 PolarHBondContact O-N 2.74Å; S495-K499 WeakPolarHBondContact O-CG 3.32Å; S495-K499 PolarHBondContact O-N 2.78Å; S495-F560 WeakPolarHBondContact OG-CE1 3.26Å; S495-F560 WeakPolarHBondContact OG-CZ 3.28Å
496	A	83.9	Confident	74.1	Confident	58 Å²	58	54.4 Å²	54.4	48%	0.479	33%	0.334	S	S	.	.	H	α-helix	trans	-65	-41	175.5	0	0	0	0	0	111.8	G492 V493 K499 A500	G492-A496 WeakPolarHBondContact O-CB 3.45Å; G492-A496 PolarHBondContact O-N 2.95Å; V493-A496 WeakPolarHBondContact O-CB 3.25Å; V493-A496 PolarHBondContact O-N 3Å; V493-A496 VanDerWaalsContact O-N 3.13Å; A496-K499 PolarHBondContact O-N 3.44Å; A496-A500 PolarHBondContact O-N 3.45Å; A496-A500 VanDerWaalsContact O-N 3.16Å
497	C	84.8	Confident	76.6	Confident	28 Å²	28	46.7 Å²	46.7	19%	0.189	30%	0.301	C	S	.	.	H	α-helix	trans	-60.3	-46.9	175	-64.7	0	0	0	0	112	V493 I494 K499 A500 Q501 L504 L509 A512	V493-C497 PolarHBondContact O-N 3.32Å; V493-C497 PolarHBondContact O-SG 2.86Å; I494-C497 PolarHBondContact O-N 2.8Å; C497-K499 VanDerWaalsContact C-N 3.3Å; C497-K499 PolarHBondContact O-N 3.32Å; C497-A500 PolarHBondContact O-N 3.28Å; C497-A500 VanDerWaalsContact O-N 3.12Å; C497-Q501 PolarHBondContact O-N 3.49Å; C497-L504 HydrophobicContact CB-CD1 3.67Å; C497-L509 HydrophobicContact CB-CD2 4.21Å; C497-A512 WeakPolarHBondContact SG-CB 3.44Å
498	F	83.7	Confident	79.2	Confident	4 Å²	4	46 Å²	46	2%	0.018	28%	0.28	C	S	.	.	H	α-helix	trans	-68.9	-24.7	178.6	-77.1	-53.7	0	0	0	114.2	I494 S495 Q501 L504 L509 A535 A540 F555 A557 F560	I494-F498 HydrophobicContact CG2-CD2 3.71Å; I494-F498 HydrophobicContact CG2-CE2 3.46Å; I494-F498 VanDerWaalsContact CG2-CE2 3.46Å; I494-F498 VanDerWaalsContact O-CD2 3.29Å; I494-F498 WeakPolarHBondContact O-CD2 3.39Å; I494-F498 PolarHBondContact O-N 2.94Å; S495-F498 PolarHBondContact O-N 2.74Å; F498-Q501 WeakPolarHBondContact CA-O 3.13Å; F498-L504 HydrophobicContact CD1-CD1 3.93Å; F498-L504 HydrophobicContact CE1-CB 4.38Å; F498-L504 HydrophobicContact CE1-CD1 4.08Å; F498-L509 HydrophobicContact CZ-CD1 4.1Å; F498-L509 HydrophobicContact CZ-CD2 4.39Å; F498-A535 HydrophobicContact CE2-CB 3.98Å; F498-A535 HydrophobicContact CZ-CB 4.07Å; F498-A540 HydrophobicContact CE1-CB 4.11Å; F498-A540 HydrophobicContact CE2-CB 3.88Å; F498-A540 HydrophobicContact CZ-CB 3.55Å; F498-F555 HydrophobicContact CE1-CB 4.11Å; F498-F555 HydrophobicContact CZ-CB 3.93Å; F498-A557 HydrophobicContact CB-CB 3.73Å; F498-A557 HydrophobicContact CD1-CB 3.38Å; F498-A557 HydrophobicContact CD2-CB 4.49Å; F498-A557 HydrophobicContact CE1-CB 4.08Å; F498-A557 HydrophobicContact CG-CB 3.63Å; F498-F560 HydrophobicContact CB-CD2 3.8Å; F498-F560 HydrophobicContact CB-CE2 3.91Å
499	K	81.3	Confident	81.1	Confident	150 Å²	150	39.4 Å²	39.4	65%	0.652	25%	0.245	S	C	*	.	H	α-helix	trans	-70.6	-32.9	170.3	-75.2	175.7	-176.9	-179	0	112.2	S495 A496 C497 F560	S495-K499 WeakPolarHBondContact O-CG 3.32Å; S495-K499 PolarHBondContact O-N 2.78Å; A496-K499 PolarHBondContact O-N 3.44Å; C497-K499 VanDerWaalsContact C-N 3.3Å; C497-K499 PolarHBondContact O-N 3.32Å; K499-F560 HydrophobicContact CG-CD1 3.84Å; K499-F560 HydrophobicContact CG-CE1 4.35Å; K499-F560 HydrophobicContact CG-CG 4.38Å
500	A	82.7	Confident	82.2	Confident	81 Å²	81	40.9 Å²	40.9	67%	0.669	24%	0.241	S	C	*	.	H	α-helix	trans	-80.7	-42.7	179.5	0	0	0	0	0	112.5	A496 C497	A496-A500 PolarHBondContact O-N 3.45Å; A496-A500 VanDerWaalsContact O-N 3.16Å; C497-A500 PolarHBondContact O-N 3.28Å; C497-A500 VanDerWaalsContact O-N 3.12Å
501	Q	80.6	Confident	82.9	Confident	95 Å²	95	45.7 Å²	45.7	44%	0.444	26%	0.26	S	S	.	.			trans	-138	122.4	178.7	-70.3	-173.2	-34.4	0	0	110.7	C497 F498 L503 L504	C497-Q501 PolarHBondContact O-N 3.49Å; F498-Q501 WeakPolarHBondContact CA-O 3.13Å; Q501-L503 VanDerWaalsContact C-N 3.26Å; Q501-L503 PolarHBondContact O-N 3.39Å; Q501-L504 HydrophobicContact CB-CD2 4.07Å; Q501-L504 HydrophobicContact CB-CG 4.38Å
502	P	80.9	Confident	83.2	Confident	24 Å²	24	43.9 Å²	43.9	16%	0.156	25%	0.254	C	S	.	.	S	Bend	trans	-76	-13.3	-176.7	28.9	-33.3	0	0	0	113.5	A556 A557 E609 Y610	P502-A556 CarbonylContact O-C 3.54Å; P502-A556 VanDerWaalsContact O-CA 3.31Å; P502-A556 WeakPolarHBondContact O-CA 3.17Å; P502-A557 PolarHBondContact O-N 3.18Å; P502-E609 HydrophobicContact CG-CB 4.02Å; P502-Y610 HydrophobicContact CB-CD1 4.48Å; P502-Y610 HydrophobicContact CB-CE1 3.73Å; P502-Y610 HydrophobicContact CG-CE1 4.41Å
503	L	83.2	Confident	83.3	Confident	8 Å²	8	41.8 Å²	41.8	4%	0.042	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	122.8	174.6	-78.6	172.2	0	0	0	110.3	Q501 L543 F555 A556 Y610 K621 V623	Q501-L503 VanDerWaalsContact C-N 3.26Å; Q501-L503 PolarHBondContact O-N 3.39Å; L503-L543 HydrophobicContact CD2-CD1 3.74Å; L503-F555 WeakPolarHBondContact CA-O 3.22Å; L503-A556 HydrophobicContact CD2-CB 3.76Å; L503-Y610 HydrophobicContact CD1-CD1 4.37Å; L503-Y610 WeakPolarHBondContact CD1-O 3.35Å; L503-Y610 HydrophobicContact CD2-CD1 4.16Å; L503-Y610 HydrophobicContact CG-CD1 3.92Å; L503-K621 HydrophobicContact CD1-CB 4.15Å; L503-V623 HydrophobicContact CB-CG2 3.88Å
504	L	83.6	Confident	83.2	Confident	9 Å²	9	43 Å²	43	5%	0.047	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	143.1	179	-69.3	169	0	0	0	111.1	C497 F498 Q501 M508 L509 F555	C497-L504 HydrophobicContact CB-CD1 3.67Å; F498-L504 HydrophobicContact CD1-CD1 3.93Å; F498-L504 HydrophobicContact CE1-CB 4.38Å; F498-L504 HydrophobicContact CE1-CD1 4.08Å; Q501-L504 HydrophobicContact CB-CD2 4.07Å; Q501-L504 HydrophobicContact CB-CG 4.38Å; L504-M508 HydrophobicContact CD2-CB 4.25Å; L504-M508 HydrophobicContact CD2-CE 3.72Å; L504-M508 HydrophobicContact CD2-SD 4.06Å; L504-L509 HydrophobicContact CB-CD2 4.36Å; L504-L509 HydrophobicContact CB-CG 4.12Å; L504-L509 HydrophobicContact CD1-CD2 3.66Å; L504-L509 HydrophobicContact CD1-CG 4.34Å; L504-F555 PolarHBondContact N-O 3.28Å; L504-F555 PolarHBondContact O-N 3.24Å
505	T	85.8	Confident	83	Confident	14 Å²	14	46.3 Å²	46.3	9%	0.086	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	159.2	168.3	66.6	0	0	0	0	110.5	S507 M508 L509 M554	T505-S507 PolarHBondContact O-N 3.5Å; T505-M508 PolarHBondContact O-N 3.03Å; T505-M508 WeakPolarHBondContact OG1-CG 3.43Å; T505-M508 PolarHBondContact OG1-N 3.46Å; T505-L509 PolarHBondContact O-N 3.23Å; T505-L509 VanDerWaalsContact O-N 3.14Å; T505-M554 HydrophobicContact CG2-CG 4.11Å
506	I	84.4	Confident	82.4	Confident	13 Å²	13	47.6 Å²	47.6	7%	0.067	27%	0.269	C	S	.	.	H	α-helix	trans	-58.2	-33.8	174.2	-164.6	164.7	0	0	0	112.5	L509 R510 N528 E532 K553 F555	I506-L509 PolarHBondContact O-N 3Å; I506-R510 WeakPolarHBondContact O-CB 3.25Å; I506-R510 PolarHBondContact O-N 3.05Å; I506-N528 HydrophobicContact CD1-CB 3.78Å; I506-E532 HydrophobicContact CD1-CG 3.74Å; I506-E532 VanDerWaalsContact CD1-OE1 3.23Å; I506-E532 WeakPolarHBondContact CD1-OE1 3.24Å; I506-K553 PolarHBondContact N-O 2.89Å; I506-F555 HydrophobicContact CB-CE2 4.35Å
507	S	82.6	Confident	81.5	Confident	26 Å²	26	48.6 Å²	48.6	18%	0.182	27%	0.265	C	S	.	.	H	α-helix	trans	-66.1	-42.3	178.6	-68.6	0	0	0	0	112	T505 R510 E511 E552	T505-S507 PolarHBondContact O-N 3.5Å; S507-R510 PolarHBondContact O-N 3.24Å; S507-E511 WeakPolarHBondContact O-CB 3.36Å; S507-E511 PolarHBondContact O-N 3.2Å; S507-E552 PolarHBondContact OG-OE1 3.39Å; S507-E552 PolarHBondContact OG-OE2 3.5Å
508	M	85	Confident	80.2	Confident	58 Å²	58	55.8 Å²	55.8	29%	0.286	29%	0.293	S	S	.	.	H	α-helix	trans	-66.2	-41.3	175.8	-67.8	174.8	80.1	0	0	112.4	L504 T505 R510 E511 A512 V623	L504-M508 HydrophobicContact CD2-CB 4.25Å; L504-M508 HydrophobicContact CD2-CE 3.72Å; L504-M508 HydrophobicContact CD2-SD 4.06Å; T505-M508 PolarHBondContact O-N 3.03Å; T505-M508 WeakPolarHBondContact OG1-CG 3.43Å; T505-M508 PolarHBondContact OG1-N 3.46Å; M508-R510 VanDerWaalsContact C-N 3.34Å; M508-E511 PolarHBondContact O-N 3.13Å; M508-A512 WeakPolarHBondContact O-CB 3.44Å; M508-A512 PolarHBondContact O-N 3.29Å; M508-V623 HydrophobicContact CE-CG1 3.97Å; M508-V623 HydrophobicContact SD-CG1 3.38Å; M508-V623 WeakPolarHBondContact SD-CG1 3.48Å
509	L	84.4	Confident	78.9	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-62.7	-42.9	176.2	-74.4	173.1	0	0	0	111.4	I494 C497 F498 L504 T505 I506 A512 V513 I531 F555	I494-L509 HydrophobicContact CG2-CD2 4.2Å; C497-L509 HydrophobicContact CB-CD2 4.21Å; F498-L509 HydrophobicContact CZ-CD1 4.1Å; F498-L509 HydrophobicContact CZ-CD2 4.39Å; L504-L509 HydrophobicContact CB-CD2 4.36Å; L504-L509 HydrophobicContact CB-CG 4.12Å; L504-L509 HydrophobicContact CD1-CD2 3.66Å; L504-L509 HydrophobicContact CD1-CG 4.34Å; T505-L509 PolarHBondContact O-N 3.23Å; T505-L509 VanDerWaalsContact O-N 3.14Å; I506-L509 PolarHBondContact O-N 3Å; L509-A512 PolarHBondContact O-N 3.03Å; L509-V513 VanDerWaalsContact O-CG2 3.31Å; L509-V513 WeakPolarHBondContact O-CG2 3.39Å; L509-V513 PolarHBondContact O-N 3.36Å; L509-I531 HydrophobicContact CB-CG2 3.75Å; L509-I531 HydrophobicContact CD1-CG2 4.13Å; L509-F555 HydrophobicContact CD1-CD2 4.15Å
510	R	84.7	Confident	77.2	Confident	99 Å²	99	56.5 Å²	56.5	37%	0.374	33%	0.325	S	S	.	.	H	α-helix	trans	-61.9	-43.4	175.5	-176.6	179.3	61.8	-169.3	-3.2	111.7	I506 S507 M508 V513 N514 I531	I506-R510 WeakPolarHBondContact O-CB 3.25Å; I506-R510 PolarHBondContact O-N 3.05Å; S507-R510 PolarHBondContact O-N 3.24Å; M508-R510 VanDerWaalsContact C-N 3.34Å; R510-V513 PolarHBondContact O-N 3.35Å; R510-N514 VanDerWaalsContact O-CB 3.25Å; R510-N514 WeakPolarHBondContact O-CB 3.34Å; R510-N514 PolarHBondContact O-N 3.07Å; R510-N514 PolarHBondContact O-ND2 2.9Å; R510-I531 HydrophobicContact CB-CD1 3.77Å; R510-I531 HydrophobicContact CG-CD1 4.07Å
511	E	83.8	Confident	75	Confident	132 Å²	132	60.8 Å²	60.8	62%	0.617	34%	0.337	S	S	*	.	H	α-helix	trans	-63.6	-40.8	177.6	-172.2	173.6	-171.8	0	0	112.2	S507 M508 S515	S507-E511 WeakPolarHBondContact O-CB 3.36Å; S507-E511 PolarHBondContact O-N 3.2Å; M508-E511 PolarHBondContact O-N 3.13Å; E511-S515 VanDerWaalsContact O-CB 3.25Å; E511-S515 WeakPolarHBondContact O-CB 3.28Å; E511-S515 PolarHBondContact O-N 3.04Å; E511-S515 PolarHBondContact O-OG 2.63Å
512	A	83.6	Confident	73.5	Confident	28 Å²	28	62.5 Å²	62.5	23%	0.231	35%	0.353	C	S	.	.	H	α-helix	trans	-66.2	-43.9	177	0	0	0	0	0	112.6	C497 M508 L509 S515 S516	C497-A512 WeakPolarHBondContact SG-CB 3.44Å; M508-A512 WeakPolarHBondContact O-CB 3.44Å; M508-A512 PolarHBondContact O-N 3.29Å; L509-A512 PolarHBondContact O-N 3.03Å; A512-S515 PolarHBondContact O-N 3.14Å; A512-S516 PolarHBondContact O-N 2.98Å
513	V	83.3	Confident	71.8	Confident	3 Å²	3	71 Å²	71	2%	0.018	39%	0.391	C	S	.	.	H	α-helix	trans	-63.7	-47.3	176.1	173.2	0	0	0	0	110.5	I494 L509 R510 S515 S516 M517 M526	I494-V513 HydrophobicContact CD1-CG2 4.3Å; I494-V513 HydrophobicContact CG1-CG2 3.93Å; L509-V513 VanDerWaalsContact O-CG2 3.31Å; L509-V513 WeakPolarHBondContact O-CG2 3.39Å; L509-V513 PolarHBondContact O-N 3.36Å; R510-V513 PolarHBondContact O-N 3.35Å; V513-S515 VanDerWaalsContact C-N 3.31Å; V513-S515 PolarHBondContact O-N 3.37Å; V513-S516 PolarHBondContact O-N 3.36Å; V513-M517 HydrophobicContact CG1-CE 4.09Å; V513-M517 HydrophobicContact CG1-SD 4.33Å; V513-M517 WeakPolarHBondContact O-CG 3.32Å; V513-M517 PolarHBondContact O-N 3.08Å; V513-M526 HydrophobicContact CG1-CE 3.98Å; V513-M526 HydrophobicContact CG2-CE 4.17Å
514	N	79.9	Confident	70.4	Confident	50 Å²	50	73.6 Å²	73.6	27%	0.267	41%	0.414	S	S	.	.	H	α-helix	trans	-64.1	-36.9	179.6	-72.5	-8.1	0	0	0	112	R510 M517 K518	R510-N514 VanDerWaalsContact O-CB 3.25Å; R510-N514 WeakPolarHBondContact O-CB 3.34Å; R510-N514 PolarHBondContact O-N 3.07Å; R510-N514 PolarHBondContact O-ND2 2.9Å; N514-M517 PolarHBondContact O-N 3.48Å; N514-K518 WeakPolarHBondContact O-CG 3.49Å; N514-K518 PolarHBondContact O-N 3.17Å
515	S	78.4	Confident	69.4	Low	70 Å²	70	81.5 Å²	81.5	49%	0.49	45%	0.45	S	S	.	.	H	α-helix	trans	-67.2	-36.6	176.5	-61.4	0	0	0	0	112.1	E511 A512 V513	E511-S515 VanDerWaalsContact O-CB 3.25Å; E511-S515 WeakPolarHBondContact O-CB 3.28Å; E511-S515 PolarHBondContact O-N 3.04Å; E511-S515 PolarHBondContact O-OG 2.63Å; A512-S515 PolarHBondContact O-N 3.14Å; V513-S515 VanDerWaalsContact C-N 3.31Å; V513-S515 PolarHBondContact O-N 3.37Å
516	S	70.9	Confident	68.6	Low	48 Å²	48	82.2 Å²	82.2	34%	0.336	45%	0.453	S	S	.	.	H	α-helix	trans	-73.2	-27	175.3	-170.4	0	0	0	0	113.3	V493 A512 V513	V493-S516 WeakPolarHBondContact CG2-OG 3.33Å; A512-S516 PolarHBondContact O-N 2.98Å; V513-S516 PolarHBondContact O-N 3.36Å
517	M	64.5	Low	68.4	Low	80 Å²	80	85.2 Å²	85.2	39%	0.394	47%	0.472	S	S	.	.	H	α-helix	trans	-81.4	-23.3	179.5	-74.9	-166.9	173.5	0	0	113.9	V513 N514 S519 G520	V513-M517 HydrophobicContact CG1-CE 4.09Å; V513-M517 HydrophobicContact CG1-SD 4.33Å; V513-M517 WeakPolarHBondContact O-CG 3.32Å; V513-M517 PolarHBondContact O-N 3.08Å; N514-M517 PolarHBondContact O-N 3.48Å; M517-S519 PolarHBondContact O-N 3.15Å; M517-G520 PolarHBondContact O-N 2.81Å
518	K	58.1	Low	68.4	Low	179 Å²	179	87.1 Å²	87.1	78%	0.778	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-9	179.3	-78.4	172.9	-176.3	179.7	0	115.1	N514	N514-K518 WeakPolarHBondContact O-CG 3.49Å; N514-K518 PolarHBondContact O-N 3.17Å
519	S	54.4	Low	68.3	Low	120 Å²	120	91.3 Å²	91.3	84%	0.839	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-3.3	176	-170.1	0	0	0	0	114.5	M517	M517-S519 PolarHBondContact O-N 3.15Å
520	G	46.9	Very low	68.2	Low	49 Å²	49	94.4 Å²	94.4	51%	0.505	51%	0.51	S	S	.	.	S	Bend	trans	-134.3	127.1	-179.3	0	0	0	0	0	111.8	M517 V522	M517-G520 PolarHBondContact O-N 2.81Å; G520-V522 PolarHBondContact O-N 3.41Å
521	N	35.6	Very low	68.2	Low	171 Å²	171	89.7 Å²	89.7	91%	0.914	49%	0.493	S	S	*	.	S	Bend	trans	-47.8	132.8	172.8	-98.2	-22.1	0	0	0	111.4
522	V	48.7	Very low	68.2	Low	130 Å²	130	84.8 Å²	84.8	79%	0.788	47%	0.47	S	S	*	.			trans	127	110	165.1	176.9	0	0	0	0	111.3	G520 A524	G520-V522 PolarHBondContact O-N 3.41Å; V522-A524 VanDerWaalsContact C-N 3.3Å; V522-A524 PolarHBondContact O-N 2.99Å
523	Q	46.6	Very low	68.2	Low	203 Å²	203	87.8 Å²	87.8	95%	0.949	48%	0.479	S	S	*	.			trans	-69.2	73.3	177.3	-70.7	179.6	-38.8	0	0	112.1
524	A	53.5	Low	68.2	Low	62 Å²	62	88.6 Å²	88.6	51%	0.512	49%	0.485	S	S	.	.			trans	-106.9	89.1	167	0	0	0	0	0	109	V522 M526	V522-A524 VanDerWaalsContact C-N 3.3Å; V522-A524 PolarHBondContact O-N 2.99Å; A524-M526 PolarHBondContact O-N 3.32Å; A524-M526 VanDerWaalsContact O-N 3.15Å
525	E	62.5	Low	68.4	Low	175 Å²	175	86.2 Å²	86.2	82%	0.818	47%	0.472	S	S	*	.			trans	-64.5	112.7	169.4	-68.1	-174.6	169.4	0	0	108.7	T527	E525-T527 PolarHBondContact O-N 2.89Å
526	M	69.7	Low	68.6	Low	30 Å²	30	86.6 Å²	86.6	15%	0.148	47%	0.471	C	S	.	.			trans	-68.8	127.8	177.3	-164.9	157.2	87.3	0	0	109	I494 V513 A524 D530 I531	I494-M526 HydrophobicContact CD1-CE 4.14Å; V513-M526 HydrophobicContact CG1-CE 3.98Å; V513-M526 HydrophobicContact CG2-CE 4.17Å; A524-M526 PolarHBondContact O-N 3.32Å; A524-M526 VanDerWaalsContact O-N 3.15Å; M526-D530 HydrophobicContact CG-CB 3.5Å; M526-D530 HydrophobicContact SD-CB 4.27Å; M526-I531 HydrophobicContact CE-CB 4.34Å; M526-I531 HydrophobicContact CE-CG1 3.42Å; M526-I531 VanDerWaalsContact CE-CG1 3.42Å; M526-I531 HydrophobicContact CG-CG1 4.28Å
527	T	79.6	Confident	69.1	Low	75 Å²	75	88 Å²	88	46%	0.46	49%	0.485	S	S	.	.			trans	-69	155.8	-176	72.6	0	0	0	0	110.4	E525 Y529 D530 I531	E525-T527 PolarHBondContact O-N 2.89Å; T527-Y529 PolarHBondContact O-N 3.09Å; T527-Y529 VanDerWaalsContact O-N 3.16Å; T527-D530 WeakPolarHBondContact CB-OD2 3.33Å; T527-D530 PolarHBondContact N-OD2 3.47Å; T527-D530 VanDerWaalsContact N-OD2 3.13Å; T527-D530 PolarHBondContact O-N 3.28Å; T527-D530 PolarHBondContact OG1-N 3.45Å; T527-D530 PolarHBondContact OG1-OD2 2.92Å; T527-I531 PolarHBondContact O-N 2.77Å
528	N	82	Confident	69.9	Low	67 Å²	67	85.9 Å²	85.9	36%	0.358	48%	0.475	S	S	.	.	H	α-helix	trans	-54.1	-35.6	173.9	-78	-4.2	0	0	0	111.5	I506 I531 E532	I506-N528 HydrophobicContact CD1-CB 3.78Å; N528-I531 PolarHBondContact O-N 3.35Å; N528-E532 VanDerWaalsContact O-CG 3.23Å; N528-E532 WeakPolarHBondContact O-CG 3.48Å; N528-E532 PolarHBondContact O-N 3.31Å
529	Y	83.1	Confident	70.9	Confident	146 Å²	146	78 Å²	78	57%	0.573	45%	0.445	S	S	*	.	H	α-helix	trans	-63	-42.6	177.1	-179.1	-99.7	0	0	0	112.4	T527 I531 E532 Q533	T527-Y529 PolarHBondContact O-N 3.09Å; T527-Y529 VanDerWaalsContact O-N 3.16Å; Y529-I531 PolarHBondContact O-N 3Å; Y529-E532 WeakPolarHBondContact O-CB 3.5Å; Y529-E532 PolarHBondContact O-N 2.82Å; Y529-Q533 HydrophobicContact CD1-CG 4.21Å; Y529-Q533 HydrophobicContact CE1-CG 3.82Å; Y529-Q533 HydrophobicContact CE2-CG 4.39Å; Y529-Q533 WeakPolarHBondContact O-CG 3.42Å; Y529-Q533 PolarHBondContact O-N 3.3Å
530	D	82.2	Confident	72.2	Confident	65 Å²	65	72.6 Å²	72.6	35%	0.348	41%	0.408	S	S	.	.	H	α-helix	trans	-66	-39.4	179.5	-57.4	-41.6	0	0	0	111.5	M526 T527 E532 Q533 C534	M526-D530 HydrophobicContact CG-CB 3.5Å; M526-D530 HydrophobicContact SD-CB 4.27Å; T527-D530 WeakPolarHBondContact CB-OD2 3.33Å; T527-D530 PolarHBondContact N-OD2 3.47Å; T527-D530 VanDerWaalsContact N-OD2 3.13Å; T527-D530 PolarHBondContact O-N 3.28Å; T527-D530 PolarHBondContact OG1-N 3.45Å; T527-D530 PolarHBondContact OG1-OD2 2.92Å; D530-E532 VanDerWaalsContact C-N 3.35Å; D530-Q533 PolarHBondContact O-N 2.93Å; D530-C534 WeakPolarHBondContact O-CB 3.47Å; D530-C534 PolarHBondContact O-N 2.77Å; D530-C534 PolarHBondContact O-SG 3.05Å
531	I	84	Confident	73.9	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-62.8	-42.6	174	-63.6	166.7	0	0	0	110.6	L509 R510 M526 T527 N528 Y529 C534 A535	L509-I531 HydrophobicContact CB-CG2 3.75Å; L509-I531 HydrophobicContact CD1-CG2 4.13Å; R510-I531 HydrophobicContact CB-CD1 3.77Å; R510-I531 HydrophobicContact CG-CD1 4.07Å; M526-I531 HydrophobicContact CE-CB 4.34Å; M526-I531 HydrophobicContact CE-CG1 3.42Å; M526-I531 VanDerWaalsContact CE-CG1 3.42Å; M526-I531 HydrophobicContact CG-CG1 4.28Å; T527-I531 PolarHBondContact O-N 2.77Å; N528-I531 PolarHBondContact O-N 3.35Å; Y529-I531 PolarHBondContact O-N 3Å; I531-C534 PolarHBondContact O-N 3.14Å; I531-A535 WeakPolarHBondContact O-CB 3.36Å; I531-A535 PolarHBondContact O-N 2.91Å
532	E	83.8	Confident	76.2	Confident	29 Å²	29	67.1 Å²	67.1	14%	0.136	37%	0.366	C	S	.	.	H	α-helix	trans	-61.7	-46.6	176.9	-69.7	-179.5	-162	0	0	111.6	I506 N528 Y529 D530 C534 A535 V536 K553 F555	I506-E532 HydrophobicContact CD1-CG 3.74Å; I506-E532 VanDerWaalsContact CD1-OE1 3.23Å; I506-E532 WeakPolarHBondContact CD1-OE1 3.24Å; N528-E532 VanDerWaalsContact O-CG 3.23Å; N528-E532 WeakPolarHBondContact O-CG 3.48Å; N528-E532 PolarHBondContact O-N 3.31Å; Y529-E532 WeakPolarHBondContact O-CB 3.5Å; Y529-E532 PolarHBondContact O-N 2.82Å; D530-E532 VanDerWaalsContact C-N 3.35Å; E532-C534 PolarHBondContact O-N 3.46Å; E532-A535 PolarHBondContact O-N 3.41Å; E532-V536 VanDerWaalsContact O-CG2 3.32Å; E532-V536 WeakPolarHBondContact O-CG2 3.31Å; E532-V536 PolarHBondContact O-N 2.91Å; E532-K553 WeakPolarHBondContact OE1-CD 3.49Å; E532-K553 WeakPolarHBondContact OE1-CE 3.12Å; E532-K553 IonicContact OE1-NZ 3.49Å; E532-K553 PolarHBondContact OE1-NZ 2.85Å; E532-K553 IonicContact OE2-NZ 2.69Å; E532-K553 PolarHBondContact OE2-NZ 2.98Å; E532-F555 HydrophobicContact CB-CZ 4.28Å; E532-F555 HydrophobicContact CG-CE2 4.25Å; E532-F555 HydrophobicContact CG-CZ 3.71Å
533	Q	84.1	Confident	77.5	Confident	91 Å²	91	61.2 Å²	61.2	43%	0.425	33%	0.33	S	S	.	.	H	α-helix	trans	-63.6	-41.1	178	-67	-54.9	-37.1	0	0	112	Y529 D530 V536 A537	Y529-Q533 HydrophobicContact CD1-CG 4.21Å; Y529-Q533 HydrophobicContact CE1-CG 3.82Å; Y529-Q533 HydrophobicContact CE2-CG 4.39Å; Y529-Q533 WeakPolarHBondContact O-CG 3.42Å; Y529-Q533 PolarHBondContact O-N 3.3Å; D530-Q533 PolarHBondContact O-N 2.93Å; Q533-V536 PolarHBondContact O-N 2.9Å; Q533-A537 VanDerWaalsContact O-CB 3.29Å; Q533-A537 WeakPolarHBondContact O-CB 3.16Å; Q533-A537 PolarHBondContact O-N 2.86Å
534	C	83.5	Confident	78.4	Confident	21 Å²	21	58.7 Å²	58.7	14%	0.142	32%	0.319	C	S	.	.	H	α-helix	trans	-63.1	-42.7	175.7	-66.4	0	0	0	0	111.7	I494 D530 I531 E532 A537 L538	I494-C534 HydrophobicContact CD1-CB 3.49Å; I494-C534 VanDerWaalsContact CD1-CB 3.49Å; D530-C534 WeakPolarHBondContact O-CB 3.47Å; D530-C534 PolarHBondContact O-N 2.77Å; D530-C534 PolarHBondContact O-SG 3.05Å; I531-C534 PolarHBondContact O-N 3.14Å; E532-C534 PolarHBondContact O-N 3.46Å; C534-A537 PolarHBondContact O-N 2.9Å; C534-L538 WeakPolarHBondContact O-CG 3.43Å; C534-L538 PolarHBondContact O-N 2.99Å
535	A	83.4	Confident	78.5	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-64.5	-44	178	0	0	0	0	0	112.2	F498 I531 E532 L538 G539 A540 F555	F498-A535 HydrophobicContact CE2-CB 3.98Å; F498-A535 HydrophobicContact CZ-CB 4.07Å; I531-A535 WeakPolarHBondContact O-CB 3.36Å; I531-A535 PolarHBondContact O-N 2.91Å; E532-A535 PolarHBondContact O-N 3.41Å; A535-L538 PolarHBondContact O-N 2.73Å; A535-G539 PolarHBondContact O-N 3.3Å; A535-A540 HydrophobicContact CB-CB 4.19Å; A535-A540 WeakPolarHBondContact O-CB 3.17Å; A535-A540 PolarHBondContact O-N 3.47Å; A535-F555 HydrophobicContact CB-CD1 4.17Å; A535-F555 HydrophobicContact CB-CG 4.44Å
536	V	83.8	Confident	78	Confident	77 Å²	77	58.5 Å²	58.5	47%	0.467	31%	0.311	S	S	.	.	H	α-helix	trans	-64.4	-41.4	176.8	173.1	0	0	0	0	111.1	E532 Q533 L538 G539	E532-V536 VanDerWaalsContact O-CG2 3.32Å; E532-V536 WeakPolarHBondContact O-CG2 3.31Å; E532-V536 PolarHBondContact O-N 2.91Å; Q533-V536 PolarHBondContact O-N 2.9Å; V536-L538 VanDerWaalsContact C-N 3.29Å; V536-L538 PolarHBondContact O-N 3.12Å; V536-G539 WeakPolarHBondContact O-CA 3.23Å; V536-G539 PolarHBondContact O-N 2.84Å
537	A	82.2	Confident	77.1	Confident	77 Å²	77	65.5 Å²	65.5	64%	0.636	34%	0.344	S	S	*	.	H	α-helix	trans	-61.2	-37	176.2	0	0	0	0	0	112.5	Q533 C534 G539	Q533-A537 VanDerWaalsContact O-CB 3.29Å; Q533-A537 WeakPolarHBondContact O-CB 3.16Å; Q533-A537 PolarHBondContact O-N 2.86Å; C534-A537 PolarHBondContact O-N 2.9Å; A537-G539 PolarHBondContact O-N 2.97Å
538	L	80.5	Confident	75.5	Confident	36 Å²	36	69.2 Å²	69.2	19%	0.188	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-4	174.3	-69.4	169.3	0	0	0	113.6	I494 C534 A535 V536	I494-L538 HydrophobicContact CB-CD1 3.84Å; I494-L538 HydrophobicContact CG2-CD1 3.5Å; I494-L538 VanDerWaalsContact CG2-CD1 3.5Å; C534-L538 WeakPolarHBondContact O-CG 3.43Å; C534-L538 PolarHBondContact O-N 2.99Å; A535-L538 PolarHBondContact O-N 2.73Å; V536-L538 VanDerWaalsContact C-N 3.29Å; V536-L538 PolarHBondContact O-N 3.12Å
539	G	78.4	Confident	73.7	Confident	13 Å²	13	76.2 Å²	76.2	13%	0.134	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	20	179.4	0	0	0	0	0	114.6	A535 V536 A537 T558	A535-G539 PolarHBondContact O-N 3.3Å; V536-G539 WeakPolarHBondContact O-CA 3.23Å; V536-G539 PolarHBondContact O-N 2.84Å; A537-G539 PolarHBondContact O-N 2.97Å; G539-T558 PolarHBondContact O-OG1 3.46Å
540	A	82.8	Confident	72.3	Confident	7 Å²	7	73.1 Å²	73.1	6%	0.058	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	140.8	168.5	0	0	0	0	0	110.6	F498 A535 F555 A556	F498-A540 HydrophobicContact CE1-CB 4.11Å; F498-A540 HydrophobicContact CE2-CB 3.88Å; F498-A540 HydrophobicContact CZ-CB 3.55Å; A535-A540 HydrophobicContact CB-CB 4.19Å; A535-A540 WeakPolarHBondContact O-CB 3.17Å; A535-A540 PolarHBondContact O-N 3.47Å; A540-F555 HydrophobicContact CB-CB 4.28Å; A540-F555 HydrophobicContact CB-CD1 4.5Å; A540-A556 CarbonylContact C-O 3.53Å; A540-A556 WeakPolarHBondContact CA-O 3.36Å
541	V	82.7	Confident	71.3	Confident	42 Å²	42	72 Å²	72	26%	0.255	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.2	179.6	180	0	0	0	0	108.7	L543 A556 T558 V571	V541-L543 PolarHBondContact O-N 3.5Å; V541-A556 PolarHBondContact N-O 2.83Å; V541-A556 PolarHBondContact O-N 3.5Å; V541-T558 HydrophobicContact CG2-CG2 4.2Å; V541-V571 HydrophobicContact CB-CG1 3.75Å; V541-V571 HydrophobicContact CG1-CG1 3.69Å; V541-V571 HydrophobicContact CG2-CG1 4.32Å
542	Q	83	Confident	70.6	Confident	63 Å²	63	77.1 Å²	77.1	29%	0.294	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	124.7	178.1	-170.9	-174.4	-3.8	0	0	111	M554 F555	Q542-M554 WeakPolarHBondContact CA-O 3.49Å; Q542-F555 HydrophobicContact CB-CD1 4.29Å; Q542-F555 HydrophobicContact CB-CE1 3.91Å; Q542-F555 HydrophobicContact CG-CE1 4.06Å; Q542-F555 HydrophobicContact CG-CZ 4.24Å
543	L	75.6	Confident	70.3	Confident	7 Å²	7	79.7 Å²	79.7	4%	0.037	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	111.6	172.3	-69.7	174.5	0	0	0	109.2	L503 V541 S545 M554 A556 V571 L574 R575 V620	L503-L543 HydrophobicContact CD2-CD1 3.74Å; V541-L543 PolarHBondContact O-N 3.5Å; L543-S545 PolarHBondContact O-N 2.82Å; L543-M554 HydrophobicContact CB-CB 4.31Å; L543-M554 PolarHBondContact N-O 2.96Å; L543-A556 HydrophobicContact CD1-CB 3.91Å; L543-A556 HydrophobicContact CG-CB 4.23Å; L543-V571 HydrophobicContact CD2-CG1 3.99Å; L543-L574 HydrophobicContact CD2-CB 4.2Å; L543-R575 HydrophobicContact CD2-CB 4.46Å; L543-V620 HydrophobicContact CD1-CG1 4.37Å
544	Q	65.6	Low	70.2	Confident	150 Å²	150	76.7 Å²	76.7	70%	0.701	42%	0.421	S	S	*	.			trans	-81.7	109.6	172	-67.8	-173.9	0.6	0	0	109.5	K546	Q544-K546 PolarHBondContact O-N 3.44Å
545	S	55.2	Low	70.2	Confident	62 Å²	62	75.7 Å²	75.7	43%	0.434	41%	0.414	S	S	.	.			trans	-68.1	104	168.9	-175	0	0	0	0	108.8	L543 E547	L543-S545 PolarHBondContact O-N 2.82Å; S545-E547 PolarHBondContact O-N 3.38Å
546	K	53.8	Low	70.2	Confident	170 Å²	170	75.7 Å²	75.7	74%	0.739	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-4.1	178.8	-71.9	-178.7	176.8	169.5	0	113.7	Q544	Q544-K546 PolarHBondContact O-N 3.44Å
547	E	50.3	Low	70.2	Confident	178 Å²	178	72.1 Å²	72.1	83%	0.832	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-3.4	-167.7	-72	-169.2	158.4	0	0	115.8	S545	S545-E547 PolarHBondContact O-N 3.38Å
548	K	46.5	Very low	70	Confident	152 Å²	152	68.6 Å²	68.6	66%	0.661	36%	0.363	S	S	*	.			trans	-146.2	111.6	175.7	-64.9	-178	-175.5	167.5	0	112.1	G550 G551	K548-G550 PolarHBondContact O-N 2.89Å; K548-G551 PolarHBondContact O-N 2.99Å; K548-G551 VanDerWaalsContact O-N 3.1Å
549	E	43	Very low	69.6	Low	214 Å²	214	73.4 Å²	73.4	100%	1	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	103.2	156.5	-74.7	-177.4	159.4	0	0	107.3
550	G	54.4	Low	69.2	Low	81 Å²	81	74.7 Å²	74.7	84%	0.835	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	112	8.6	-175.6	0	0	0	0	0	116.6	K548	K548-G550 PolarHBondContact O-N 2.89Å
551	G	60.8	Low	68.7	Low	41 Å²	41	77 Å²	77	42%	0.423	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-74.6	142.4	172.7	0	0	0	0	0	113.5	K548	K548-G551 PolarHBondContact O-N 2.99Å; K548-G551 VanDerWaalsContact O-N 3.1Å
552	E	69.7	Low	68.1	Low	109 Å²	109	78.5 Å²	78.5	51%	0.509	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-59.8	143.3	173.2	-66.4	-170.3	161.2	0	0	111.6	S507 M554	S507-E552 PolarHBondContact OG-OE1 3.39Å; S507-E552 PolarHBondContact OG-OE2 3.5Å; E552-M554 PolarHBondContact O-N 3.49Å
553	K	78.1	Confident	68	Low	82 Å²	82	79.6 Å²	79.6	36%	0.357	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-69.5	129.6	176.5	-65.6	175	177.8	176.8	0	109.9	I506 E532 F555	I506-K553 PolarHBondContact N-O 2.89Å; E532-K553 WeakPolarHBondContact OE1-CD 3.49Å; E532-K553 WeakPolarHBondContact OE1-CE 3.12Å; E532-K553 IonicContact OE1-NZ 3.49Å; E532-K553 PolarHBondContact OE1-NZ 2.85Å; E532-K553 IonicContact OE2-NZ 2.69Å; E532-K553 PolarHBondContact OE2-NZ 2.98Å; K553-F555 HydrophobicContact CB-CE2 4.05Å; K553-F555 HydrophobicContact CB-CZ 4.39Å
554	M	81.4	Confident	68.2	Low	29 Å²	29	81.5 Å²	81.5	14%	0.143	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	141.2	174.4	-69.8	-174	-69.4	0	0	110.9	T505 Q542 L543 E552 V620	T505-M554 HydrophobicContact CG2-CG 4.11Å; Q542-M554 WeakPolarHBondContact CA-O 3.49Å; L543-M554 HydrophobicContact CB-CB 4.31Å; L543-M554 PolarHBondContact N-O 2.96Å; E552-M554 PolarHBondContact O-N 3.49Å; M554-V620 HydrophobicContact CE-CG1 4.09Å; M554-V620 HydrophobicContact SD-CG1 4.49Å
555	F	83.4	Confident	69	Low	0 Å²	0	80 Å²	80	0%	0	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	129.2	177.8	-68	-84.3	0	0	0	110.2	F498 L503 L504 I506 L509 E532 A535 A540 Q542 K553	F498-F555 HydrophobicContact CE1-CB 4.11Å; F498-F555 HydrophobicContact CZ-CB 3.93Å; L503-F555 WeakPolarHBondContact CA-O 3.22Å; L504-F555 PolarHBondContact N-O 3.28Å; L504-F555 PolarHBondContact O-N 3.24Å; I506-F555 HydrophobicContact CB-CE2 4.35Å; L509-F555 HydrophobicContact CD1-CD2 4.15Å; E532-F555 HydrophobicContact CB-CZ 4.28Å; E532-F555 HydrophobicContact CG-CE2 4.25Å; E532-F555 HydrophobicContact CG-CZ 3.71Å; A535-F555 HydrophobicContact CB-CD1 4.17Å; A535-F555 HydrophobicContact CB-CG 4.44Å; A540-F555 HydrophobicContact CB-CB 4.28Å; A540-F555 HydrophobicContact CB-CD1 4.5Å; Q542-F555 HydrophobicContact CB-CD1 4.29Å; Q542-F555 HydrophobicContact CB-CE1 3.91Å; Q542-F555 HydrophobicContact CG-CE1 4.06Å; Q542-F555 HydrophobicContact CG-CZ 4.24Å; K553-F555 HydrophobicContact CB-CE2 4.05Å; K553-F555 HydrophobicContact CB-CZ 4.39Å
556	A	84	Confident	70.5	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	116.8	175.4	0	0	0	0	0	110.2	P502 L503 A540 V541 L543 V571 Y610	P502-A556 CarbonylContact O-C 3.54Å; P502-A556 VanDerWaalsContact O-CA 3.31Å; P502-A556 WeakPolarHBondContact O-CA 3.17Å; L503-A556 HydrophobicContact CD2-CB 3.76Å; A540-A556 CarbonylContact C-O 3.53Å; A540-A556 WeakPolarHBondContact CA-O 3.36Å; V541-A556 PolarHBondContact N-O 2.83Å; V541-A556 PolarHBondContact O-N 3.5Å; L543-A556 HydrophobicContact CD1-CB 3.91Å; L543-A556 HydrophobicContact CG-CB 4.23Å; A556-V571 HydrophobicContact CB-CG1 4.24Å; A556-V571 HydrophobicContact CB-CG2 3.66Å; A556-Y610 HydrophobicContact CB-CD1 4.26Å; A556-Y610 HydrophobicContact CB-CE1 4.14Å
557	A	83.3	Confident	72.1	Confident	1 Å²	1	69.7 Å²	69.7	1%	0.008	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	130.6	175.3	0	0	0	0	0	110.4	F498 P502 F560 Y610	F498-A557 HydrophobicContact CB-CB 3.73Å; F498-A557 HydrophobicContact CD1-CB 3.38Å; F498-A557 HydrophobicContact CD2-CB 4.49Å; F498-A557 HydrophobicContact CE1-CB 4.08Å; F498-A557 HydrophobicContact CG-CB 3.63Å; P502-A557 PolarHBondContact O-N 3.18Å; A557-F560 HydrophobicContact CB-CD2 3.85Å; A557-Y610 PolarHBondContact O-OH 3.08Å
558	T	77.6	Confident	73.8	Confident	4 Å²	4	64.4 Å²	64.4	3%	0.025	35%	0.353	C	S	.	.			trans	-115.6	-18	-178.2	60.3	0	0	0	0	114	G539 V541 P564 L568 V571	G539-T558 PolarHBondContact O-OG1 3.46Å; V541-T558 HydrophobicContact CG2-CG2 4.2Å; T558-P564 WeakPolarHBondContact O-CA 3.41Å; T558-P564 WeakPolarHBondContact O-CB 3.43Å; T558-L568 HydrophobicContact CG2-CD2 3.85Å; T558-L568 HydrophobicContact CG2-CG 4.22Å; T558-L568 WeakPolarHBondContact OG1-CD2 3.47Å; T558-V571 HydrophobicContact CG2-CB 4.21Å; T558-V571 HydrophobicContact CG2-CG2 3.77Å
559	K	72.5	Confident	75.7	Confident	136 Å²	136	57.5 Å²	57.5	59%	0.591	32%	0.323	S	S	*	.	S	Bend	trans	-87.8	-11.4	-178.5	-65.7	-172.2	-179.1	173.6	0	114.4
560	F	69.5	Low	77.8	Confident	41 Å²	41	47.3 Å²	47.3	18%	0.18	28%	0.275	C	S	.	.	S	Bend	trans	-100.7	130.3	-178.4	-59.1	-77.2	0	0	0	109.9	S495 F498 K499 A557 R567	S495-F560 WeakPolarHBondContact OG-CE1 3.26Å; S495-F560 WeakPolarHBondContact OG-CZ 3.28Å; F498-F560 HydrophobicContact CB-CD2 3.8Å; F498-F560 HydrophobicContact CB-CE2 3.91Å; K499-F560 HydrophobicContact CG-CD1 3.84Å; K499-F560 HydrophobicContact CG-CE1 4.35Å; K499-F560 HydrophobicContact CG-CG 4.38Å; A557-F560 HydrophobicContact CB-CD2 3.85Å; F560-R567 WeakPolarHBondContact O-CD 3.46Å; F560-R567 PolarHBondContact O-NE 2.76Å; F560-R567 PolarHBondContact O-NH1 3.44Å
561	G	72.2	Confident	79.3	Confident	56 Å²	56	43.6 Å²	43.6	58%	0.577	24%	0.237	S	C	*	.	S	Bend	trans	104.3	-178.9	-179.9	0	0	0	0	0	114.3
562	S	70.9	Confident	80.5	Confident	72 Å²	72	44.8 Å²	44.8	50%	0.503	23%	0.231	S	C	.	.	S	Bend	trans	-70.3	149	173.6	51.3	0	0	0	0	110.9	R567	S562-R567 PolarHBondContact O-NE 2.86Å
563	W	79.4	Confident	81.2	Confident	87 Å²	87	40.3 Å²	40.3	33%	0.33	21%	0.211	S	C	.	.			trans	54.6	61.2	175.7	-56.6	102.8	0	0	0	115.8	H565 V566 R567 N596 P598 L606	W563-H565 PolarHBondContact O-N 2.81Å; W563-H565 VanDerWaalsContact O-N 3.15Å; W563-V566 HydrophobicContact CB-CB 4.02Å; W563-V566 HydrophobicContact CB-CG2 3.95Å; W563-V566 PolarHBondContact O-N 3.47Å; W563-R567 PolarHBondContact O-N 2.85Å; W563-R567 VanDerWaalsContact O-N 3.12Å; W563-N596 HydrophobicContact CH2-CB 4.27Å; W563-N596 HydrophobicContact CZ3-CB 4.17Å; W563-N596 WeakPolarHBondContact CZ3-O 3.3Å; W563-P598 HydrophobicContact CD2-CB 4.48Å; W563-P598 HydrophobicContact CD2-CG 4.07Å; W563-P598 HydrophobicContact CG-CG 4.18Å; W563-P598 HydrophobicContact CZ2-CB 4.22Å; W563-P598 HydrophobicContact CZ2-CG 4.48Å; W563-L606 HydrophobicContact CB-CD1 4.1Å; W563-L606 HydrophobicContact CG-CD1 4.44Å
564	P	81.1	Confident	81.4	Confident	46 Å²	46	36.7 Å²	36.7	30%	0.299	20%	0.195	S	C	.	.	H	α-helix	trans	-58	-32.5	-178.8	22.9	-33.5	0	0	0	113.4	T558 V566 R567 L568	T558-P564 WeakPolarHBondContact O-CA 3.41Å; T558-P564 WeakPolarHBondContact O-CB 3.43Å; P564-V566 VanDerWaalsContact C-N 3.34Å; P564-V566 PolarHBondContact O-N 2.98Å; P564-R567 PolarHBondContact O-N 2.8Å; P564-L568 WeakPolarHBondContact O-CG 3.5Å; P564-L568 PolarHBondContact O-N 3.36Å
565	H	83.1	Confident	81.4	Confident	118 Å²	118	41.2 Å²	41.2	55%	0.546	21%	0.21	S	C	.	.	H	α-helix	trans	-66.2	-34.4	176.7	-53.6	-57	0	0	0	113.1	W563 L569 F593	W563-H565 PolarHBondContact O-N 2.81Å; W563-H565 VanDerWaalsContact O-N 3.15Å; H565-L569 PolarHBondContact O-N 2.87Å; H565-F593 HydrophobicContact CB-CE1 3.65Å; H565-F593 HydrophobicContact CB-CZ 3.57Å
566	V	86.1	Confident	81.2	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.03	24%	0.235	C	C	.	.	H	α-helix	trans	-74.5	-40.9	176.1	179.8	0	0	0	0	110.2	W563 P564 L568 L569 I570 F585 L603 L606	W563-V566 HydrophobicContact CB-CB 4.02Å; W563-V566 HydrophobicContact CB-CG2 3.95Å; W563-V566 PolarHBondContact O-N 3.47Å; P564-V566 VanDerWaalsContact C-N 3.34Å; P564-V566 PolarHBondContact O-N 2.98Å; V566-L568 VanDerWaalsContact C-N 3.34Å; V566-L568 PolarHBondContact O-N 3.31Å; V566-L569 WeakPolarHBondContact O-CB 3.48Å; V566-L569 PolarHBondContact O-N 2.91Å; V566-L569 VanDerWaalsContact O-N 3.11Å; V566-I570 HydrophobicContact CG1-CD1 4.45Å; V566-I570 WeakPolarHBondContact O-CG1 3.35Å; V566-I570 PolarHBondContact O-N 3.25Å; V566-F585 HydrophobicContact CG1-CZ 3.77Å; V566-L603 HydrophobicContact CG1-CD2 3.9Å; V566-L606 HydrophobicContact CG1-CD1 4.2Å
567	R	87	Confident	80.9	Confident	11 Å²	11	51.2 Å²	51.2	4%	0.042	26%	0.259	C	S	.	.	H	α-helix	trans	-59	-43.2	174.3	-67	176	176	-102.6	-4.7	111.9	F560 S562 W563 P564 L569 I570 V571 L606 E609 Y610	F560-R567 WeakPolarHBondContact O-CD 3.46Å; F560-R567 PolarHBondContact O-NE 2.76Å; F560-R567 PolarHBondContact O-NH1 3.44Å; S562-R567 PolarHBondContact O-NE 2.86Å; W563-R567 PolarHBondContact O-N 2.85Å; W563-R567 VanDerWaalsContact O-N 3.12Å; P564-R567 PolarHBondContact O-N 2.8Å; R567-L569 VanDerWaalsContact C-N 3.33Å; R567-L569 PolarHBondContact O-N 2.91Å; R567-I570 PolarHBondContact O-N 2.93Å; R567-V571 WeakPolarHBondContact O-CG2 3.23Å; R567-V571 PolarHBondContact O-N 2.9Å; R567-V571 VanDerWaalsContact O-N 3.1Å; R567-L606 HydrophobicContact CG-CD2 4.48Å; R567-E609 IonicContact CZ-OE1 2.79Å; R567-E609 IonicContact CZ-OE2 2.87Å; R567-E609 IonicContact NH1-OE2 2.71Å; R567-E609 PolarHBondContact NH1-OE2 2.93Å; R567-E609 VanDerWaalsContact NH2-CD 3.27Å; R567-E609 IonicContact NH2-OE1 2.75Å; R567-E609 PolarHBondContact NH2-OE1 3.44Å; R567-E609 IonicContact NH2-OE2 3.77Å; R567-E609 PolarHBondContact NH2-OE2 2.95Å; R567-Y610 HydrophobicContact CB-CE2 4.37Å; R567-Y610 WeakPolarHBondContact CD-OH 3.1Å; R567-Y610 HydrophobicContact CG-CE2 4.05Å; R567-Y610 PolarHBondContact NH1-OH 2.86Å
568	L	85.7	Confident	80.7	Confident	67 Å²	67	53 Å²	53	35%	0.351	28%	0.277	S	S	.	.	H	α-helix	trans	-57	-45.2	172.5	-80.2	166.4	0	0	0	111.8	T558 P564 V566 I570 V571 E572	T558-L568 HydrophobicContact CG2-CD2 3.85Å; T558-L568 HydrophobicContact CG2-CG 4.22Å; T558-L568 WeakPolarHBondContact OG1-CD2 3.47Å; P564-L568 WeakPolarHBondContact O-CG 3.5Å; P564-L568 PolarHBondContact O-N 3.36Å; V566-L568 VanDerWaalsContact C-N 3.34Å; V566-L568 PolarHBondContact O-N 3.31Å; L568-I570 PolarHBondContact O-N 3.16Å; L568-V571 PolarHBondContact O-N 2.8Å; L568-E572 WeakPolarHBondContact O-CG 3.35Å; L568-E572 PolarHBondContact O-N 2.85Å
569	L	86.2	Confident	81.1	Confident	7 Å²	7	58 Å²	58	4%	0.037	30%	0.299	C	S	.	.	H	α-helix	trans	-63.4	-39.6	178.8	-176.2	60.6	0	0	0	112.5	H565 V566 R567 E572 M573 F585 A588 C589 K592 F593	H565-L569 PolarHBondContact O-N 2.87Å; V566-L569 WeakPolarHBondContact O-CB 3.48Å; V566-L569 PolarHBondContact O-N 2.91Å; V566-L569 VanDerWaalsContact O-N 3.11Å; R567-L569 VanDerWaalsContact C-N 3.33Å; R567-L569 PolarHBondContact O-N 2.91Å; L569-E572 PolarHBondContact O-N 2.84Å; L569-M573 HydrophobicContact CD1-CG 4.4Å; L569-M573 HydrophobicContact CG-SD 4.42Å; L569-M573 WeakPolarHBondContact O-CB 3.37Å; L569-M573 VanDerWaalsContact O-CG 3.31Å; L569-M573 WeakPolarHBondContact O-CG 3.39Å; L569-M573 PolarHBondContact O-N 3.17Å; L569-F585 HydrophobicContact CD2-CE2 4.44Å; L569-F585 HydrophobicContact CG-CE2 4.48Å; L569-A588 HydrophobicContact CD2-CB 4.15Å; L569-C589 HydrophobicContact CD2-CB 4.48Å; L569-K592 HydrophobicContact CD1-CD 3.85Å; L569-F593 HydrophobicContact CD2-CE2 4.15Å
570	I	87.1	Confident	81.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59.1	-50	174.9	-65.8	166.6	0	0	0	109.9	V566 R567 L568 M573 L574 F580 F585 L606 V607 Y610	V566-I570 HydrophobicContact CG1-CD1 4.45Å; V566-I570 WeakPolarHBondContact O-CG1 3.35Å; V566-I570 PolarHBondContact O-N 3.25Å; R567-I570 PolarHBondContact O-N 2.93Å; L568-I570 PolarHBondContact O-N 3.16Å; I570-M573 PolarHBondContact O-N 3.11Å; I570-L574 HydrophobicContact CG2-CD1 4.04Å; I570-L574 HydrophobicContact CG2-CG 4.48Å; I570-L574 WeakPolarHBondContact O-CG 3.38Å; I570-L574 PolarHBondContact O-N 2.85Å; I570-F580 HydrophobicContact CG2-CZ 4.3Å; I570-F585 HydrophobicContact CD1-CE2 4.29Å; I570-F585 HydrophobicContact CD1-CZ 3.96Å; I570-F585 HydrophobicContact CG1-CD2 4.32Å; I570-F585 HydrophobicContact CG1-CE2 3.38Å; I570-F585 HydrophobicContact CG1-CZ 3.55Å; I570-L606 HydrophobicContact CD1-CB 4.28Å; I570-V607 HydrophobicContact CD1-CG2 3.87Å; I570-V607 HydrophobicContact CG1-CG2 4.19Å; I570-Y610 HydrophobicContact CD1-CD2 4.37Å; I570-Y610 HydrophobicContact CG2-CD2 4.22Å; I570-Y610 HydrophobicContact CG2-CG 4.24Å
571	V	86.2	Confident	82.8	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.018	28%	0.277	C	S	.	.	H	α-helix	trans	-65	-40.4	-178.6	173.4	0	0	0	0	111.9	V541 L543 A556 T558 R567 L568 L574 R575 Y610	V541-V571 HydrophobicContact CB-CG1 3.75Å; V541-V571 HydrophobicContact CG1-CG1 3.69Å; V541-V571 HydrophobicContact CG2-CG1 4.32Å; L543-V571 HydrophobicContact CD2-CG1 3.99Å; A556-V571 HydrophobicContact CB-CG1 4.24Å; A556-V571 HydrophobicContact CB-CG2 3.66Å; T558-V571 HydrophobicContact CG2-CB 4.21Å; T558-V571 HydrophobicContact CG2-CG2 3.77Å; R567-V571 WeakPolarHBondContact O-CG2 3.23Å; R567-V571 PolarHBondContact O-N 2.9Å; R567-V571 VanDerWaalsContact O-N 3.1Å; L568-V571 PolarHBondContact O-N 2.8Å; V571-L574 PolarHBondContact O-N 2.68Å; V571-R575 WeakPolarHBondContact O-CB 3.49Å; V571-R575 PolarHBondContact O-N 2.76Å; V571-Y610 HydrophobicContact CG2-CD1 4.31Å; V571-Y610 HydrophobicContact CG2-CE1 4.21Å
572	E	85.3	Confident	83.7	Confident	67 Å²	67	50.8 Å²	50.8	31%	0.313	26%	0.255	S	S	.	.	H	α-helix	trans	-59.5	-46.2	172.4	-76.1	179.6	167.2	0	0	111.5	L568 L569 L574 R575 D576 K592	L568-E572 WeakPolarHBondContact O-CG 3.35Å; L568-E572 PolarHBondContact O-N 2.85Å; L569-E572 PolarHBondContact O-N 2.84Å; E572-L574 VanDerWaalsContact C-N 3.34Å; E572-L574 PolarHBondContact O-N 2.87Å; E572-R575 PolarHBondContact O-N 2.76Å; E572-D576 WeakPolarHBondContact O-CB 3.21Å; E572-D576 VanDerWaalsContact O-CG 3.28Å; E572-D576 PolarHBondContact O-N 2.83Å; E572-K592 IonicContact OE2-NZ 2.83Å; E572-K592 PolarHBondContact OE2-NZ 3.23Å
573	M	84.6	Confident	84.5	Confident	15 Å²	15	52.2 Å²	52.2	7%	0.074	26%	0.261	C	S	.	.	H	α-helix	trans	-64.8	-36.9	178.6	-74.2	-172.5	63.4	0	0	112.6	L569 I570 K577 F580 V584 F585 A588	L569-M573 HydrophobicContact CD1-CG 4.4Å; L569-M573 HydrophobicContact CG-SD 4.42Å; L569-M573 WeakPolarHBondContact O-CB 3.37Å; L569-M573 VanDerWaalsContact O-CG 3.31Å; L569-M573 WeakPolarHBondContact O-CG 3.39Å; L569-M573 PolarHBondContact O-N 3.17Å; I570-M573 PolarHBondContact O-N 3.11Å; M573-K577 WeakPolarHBondContact O-CB 3.39Å; M573-K577 PolarHBondContact O-N 3.43Å; M573-F580 HydrophobicContact CB-CD1 4.01Å; M573-F580 HydrophobicContact CB-CE1 4.28Å; M573-F580 HydrophobicContact CE-CB 3.63Å; M573-F580 HydrophobicContact CE-CD1 4.26Å; M573-F580 HydrophobicContact CE-CD2 4.17Å; M573-F580 HydrophobicContact CE-CG 3.77Å; M573-V584 HydrophobicContact CE-CG1 3.91Å; M573-F585 HydrophobicContact CE-CB 4.32Å; M573-F585 HydrophobicContact SD-CB 4.44Å; M573-F585 HydrophobicContact SD-CD2 3.81Å; M573-A588 HydrophobicContact SD-CB 3.91Å
574	L	83.7	Confident	85	Confident	6 Å²	6	50.8 Å²	50.8	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-67.9	-42.9	174	-70.6	173.4	0	0	0	112	L543 I570 V571 E572 D576 G578 F580 V620	L543-L574 HydrophobicContact CD2-CB 4.2Å; I570-L574 HydrophobicContact CG2-CD1 4.04Å; I570-L574 HydrophobicContact CG2-CG 4.48Å; I570-L574 WeakPolarHBondContact O-CG 3.38Å; I570-L574 PolarHBondContact O-N 2.85Å; V571-L574 PolarHBondContact O-N 2.68Å; E572-L574 VanDerWaalsContact C-N 3.34Å; E572-L574 PolarHBondContact O-N 2.87Å; L574-D576 VanDerWaalsContact C-N 3.35Å; L574-D576 PolarHBondContact O-N 3.39Å; L574-G578 WeakPolarHBondContact O-CA 3.48Å; L574-G578 PolarHBondContact O-N 3.1Å; L574-F580 HydrophobicContact CD2-CD1 4.06Å; L574-F580 HydrophobicContact CD2-CE1 3.58Å; L574-F580 HydrophobicContact CG-CE1 3.89Å; L574-V620 HydrophobicContact CB-CG2 4.19Å; L574-V620 HydrophobicContact CD1-CG2 4.17Å; L574-V620 HydrophobicContact CD2-CG2 3.76Å; L574-V620 HydrophobicContact CG-CG2 4.24Å
575	R	80.7	Confident	85.3	Confident	123 Å²	123	48.6 Å²	48.6	46%	0.464	25%	0.248	S	C	.	.	H	α-helix	trans	-61.9	-42.9	177.8	-172.3	-170.7	69.2	-165.1	-2.2	111.8	L543 V571 E572	L543-R575 HydrophobicContact CD2-CB 4.46Å; V571-R575 WeakPolarHBondContact O-CB 3.49Å; V571-R575 PolarHBondContact O-N 2.76Å; E572-R575 PolarHBondContact O-N 2.76Å
576	D	79.6	Confident	85.6	Confident	97 Å²	97	46.3 Å²	46.3	52%	0.519	24%	0.236	S	C	.	.	H	α-helix	trans	-81.7	-47.7	-172.8	-67.2	-2.2	0	0	0	111.8	E572 L574	E572-D576 WeakPolarHBondContact O-CB 3.21Å; E572-D576 VanDerWaalsContact O-CG 3.28Å; E572-D576 PolarHBondContact O-N 2.83Å; L574-D576 VanDerWaalsContact C-N 3.35Å; L574-D576 PolarHBondContact O-N 3.39Å
577	K	76.8	Confident	85.6	Confident	113 Å²	113	52.9 Å²	52.9	49%	0.491	26%	0.264	S	S	.	.	H	α-helix	trans	-103.4	-18.8	-172.1	-61.7	-177.8	-179.8	176.6	0	114.6	M573 K579	M573-K577 WeakPolarHBondContact O-CB 3.39Å; M573-K577 PolarHBondContact O-N 3.43Å; K577-K579 WeakPolarHBondContact CB-O 3.22Å; K577-K579 PolarHBondContact O-N 3.12Å
578	G	80	Confident	85.6	Confident	38 Å²	38	53.7 Å²	53.7	39%	0.392	27%	0.273	S	S	.	.	S	Bend	trans	70.7	-25.4	-172.5	0	0	0	0	0	115	L574	L574-G578 WeakPolarHBondContact O-CA 3.48Å; L574-G578 PolarHBondContact O-N 3.1Å
579	K	85.8	Confident	85.6	Confident	111 Å²	111	50.6 Å²	50.6	48%	0.483	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	152.3	179	66.6	-171.7	178.9	-175.9	0	111.7	K577 T617 Y618 Y619	K577-K579 WeakPolarHBondContact CB-O 3.22Å; K577-K579 PolarHBondContact O-N 3.12Å; K579-T617 HydrophobicContact CB-CG2 3.87Å; K579-T617 HydrophobicContact CD-CG2 4.25Å; K579-T617 HydrophobicContact CG-CG2 4.15Å; K579-Y618 WeakPolarHBondContact CA-O 3.4Å; K579-Y618 WeakPolarHBondContact CB-O 3.3Å; K579-Y619 HydrophobicContact CB-CD1 3.94Å; K579-Y619 HydrophobicContact CB-CE1 3.94Å; K579-Y619 HydrophobicContact CD-CD1 4.43Å; K579-Y619 HydrophobicContact CD-CE1 3.66Å; K579-Y619 HydrophobicContact CG-CE1 4.46Å
580	F	88.7	Confident	85.5	Confident	7 Å²	7	53.5 Å²	53.5	3%	0.031	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	160.1	175.7	59.3	-94.3	0	0	0	112.3	I570 M573 L574 F585 V607 Y618	I570-F580 HydrophobicContact CG2-CZ 4.3Å; M573-F580 HydrophobicContact CB-CD1 4.01Å; M573-F580 HydrophobicContact CB-CE1 4.28Å; M573-F580 HydrophobicContact CE-CB 3.63Å; M573-F580 HydrophobicContact CE-CD1 4.26Å; M573-F580 HydrophobicContact CE-CD2 4.17Å; M573-F580 HydrophobicContact CE-CG 3.77Å; L574-F580 HydrophobicContact CD2-CD1 4.06Å; L574-F580 HydrophobicContact CD2-CE1 3.58Å; L574-F580 HydrophobicContact CG-CE1 3.89Å; F580-F585 HydrophobicContact CD2-CB 3.73Å; F580-F585 HydrophobicContact CD2-CG 4.45Å; F580-F585 HydrophobicContact CE2-CB 3.78Å; F580-F585 HydrophobicContact CE2-CD2 4.27Å; F580-F585 HydrophobicContact CE2-CG 4.03Å; F580-V607 HydrophobicContact CE2-CG1 4.07Å; F580-V607 HydrophobicContact CE2-CG2 4.5Å; F580-V607 HydrophobicContact CZ-CG1 4.05Å; F580-Y618 HydrophobicContact CD2-CD2 4.22Å; F580-Y618 AromaticContact CE2-CD2 3.96Å; F580-Y618 HydrophobicContact CE2-CD2 3.96Å; F580-Y618 HydrophobicContact CE2-CG 4.22Å; F580-Y618 PolarHBondContact N-O 3.33Å; F580-Y618 VanDerWaalsContact N-O 3.11Å; F580-Y618 WeakPolarHBondContact O-CB 3.37Å; F580-Y618 PolarHBondContact O-N 3.4Å
581	T	89.8	Confident	85.4	Confident	46 Å²	46	57.5 Å²	57.5	28%	0.282	31%	0.308	S	S	.	.			trans	-94.7	156	171.4	60	0	0	0	0	110.4	T583 V584 F585	T581-T583 PolarHBondContact O-N 2.77Å; T581-T583 PolarHBondContact OG1-OG1 2.91Å; T581-V584 PolarHBondContact O-N 3.37Å; T581-V584 VanDerWaalsContact OG1-CG2 3.25Å; T581-V584 WeakPolarHBondContact OG1-CG2 3.33Å; T581-V584 PolarHBondContact OG1-N 3.26Å; T581-F585 PolarHBondContact O-N 3.32Å; T581-F585 VanDerWaalsContact O-N 3.08Å
582	F	89.4	Confident	85.1	Confident	28 Å²	28	63 Å²	63	12%	0.123	33%	0.332	C	S	.	.	H	α-helix	trans	-55.7	-38.3	177.8	-167	-113	0	0	0	112.3	V584 F585 K586 L603 R604 Y618	F582-V584 PolarHBondContact O-N 2.93Å; F582-F585 HydrophobicContact CD2-CD1 4.37Å; F582-F585 HydrophobicContact CE2-CD1 4.29Å; F582-F585 PolarHBondContact O-N 3.07Å; F582-K586 HydrophobicContact CE1-CD 4.36Å; F582-K586 WeakPolarHBondContact O-CB 3.3Å; F582-K586 PolarHBondContact O-N 3.18Å; F582-L603 HydrophobicContact CE2-CB 4.22Å; F582-L603 HydrophobicContact CZ-CB 4.18Å; F582-R604 HydrophobicContact CD2-CG 3.98Å; F582-R604 HydrophobicContact CE1-CG 4.38Å; F582-R604 HydrophobicContact CE2-CB 4.43Å; F582-R604 HydrophobicContact CE2-CG 3.38Å; F582-R604 HydrophobicContact CZ-CG 3.62Å; F582-Y618 HydrophobicContact CB-CE2 3.85Å; F582-Y618 HydrophobicContact CD2-CE2 4.09Å; F582-Y618 HydrophobicContact CG-CE2 4.44Å
583	T	88.3	Confident	84.9	Confident	102 Å²	102	62.8 Å²	62.8	63%	0.626	33%	0.33	S	S	*	.	H	α-helix	trans	-63.4	-41.3	-179.5	51.2	0	0	0	0	112.4	T581 K587	T581-T583 PolarHBondContact O-N 2.77Å; T581-T583 PolarHBondContact OG1-OG1 2.91Å; T583-K587 WeakPolarHBondContact O-CB 3.34Å; T583-K587 PolarHBondContact O-N 3.29Å
584	V	89.3	Confident	84	Confident	57 Å²	57	67.1 Å²	67.1	35%	0.345	37%	0.368	S	S	.	.	H	α-helix	trans	-69.8	-38.7	177	175	0	0	0	0	110.7	M573 T581 F582 A588	M573-V584 HydrophobicContact CE-CG1 3.91Å; T581-V584 PolarHBondContact O-N 3.37Å; T581-V584 VanDerWaalsContact OG1-CG2 3.25Å; T581-V584 WeakPolarHBondContact OG1-CG2 3.33Å; T581-V584 PolarHBondContact OG1-N 3.26Å; F582-V584 PolarHBondContact O-N 2.93Å; V584-A588 PolarHBondContact O-N 3.39Å
585	F	88.9	Confident	83.2	Confident	0 Å²	0	70 Å²	70	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-64.5	-50.1	175.4	173.7	-112.6	0	0	0	111.9	V566 L569 I570 M573 F580 T581 F582 K587 A588 C589 L603 V607	V566-F585 HydrophobicContact CG1-CZ 3.77Å; L569-F585 HydrophobicContact CD2-CE2 4.44Å; L569-F585 HydrophobicContact CG-CE2 4.48Å; I570-F585 HydrophobicContact CD1-CE2 4.29Å; I570-F585 HydrophobicContact CD1-CZ 3.96Å; I570-F585 HydrophobicContact CG1-CD2 4.32Å; I570-F585 HydrophobicContact CG1-CE2 3.38Å; I570-F585 HydrophobicContact CG1-CZ 3.55Å; M573-F585 HydrophobicContact CE-CB 4.32Å; M573-F585 HydrophobicContact SD-CB 4.44Å; M573-F585 HydrophobicContact SD-CD2 3.81Å; F580-F585 HydrophobicContact CD2-CB 3.73Å; F580-F585 HydrophobicContact CD2-CG 4.45Å; F580-F585 HydrophobicContact CE2-CB 3.78Å; F580-F585 HydrophobicContact CE2-CD2 4.27Å; F580-F585 HydrophobicContact CE2-CG 4.03Å; T581-F585 PolarHBondContact O-N 3.32Å; T581-F585 VanDerWaalsContact O-N 3.08Å; F582-F585 HydrophobicContact CD2-CD1 4.37Å; F582-F585 HydrophobicContact CE2-CD1 4.29Å; F582-F585 PolarHBondContact O-N 3.07Å; F585-K587 VanDerWaalsContact C-N 3.29Å; F585-K587 PolarHBondContact O-N 3.18Å; F585-A588 WeakPolarHBondContact O-CA 3.33Å; F585-A588 WeakPolarHBondContact O-CB 3.37Å; F585-A588 PolarHBondContact O-N 2.77Å; F585-C589 VanDerWaalsContact CZ-SG 3.51Å; F585-C589 PolarHBondContact O-N 2.88Å; F585-C589 PolarHBondContact O-SG 2.87Å; F585-L603 HydrophobicContact CE1-CB 4.41Å; F585-L603 HydrophobicContact CE1-CD2 3.88Å; F585-L603 HydrophobicContact CZ-CD2 4.22Å; F585-V607 HydrophobicContact CD1-CG2 3.76Å; F585-V607 HydrophobicContact CE1-CG2 3.39Å; F585-V607 HydrophobicContact CE2-CG2 4.45Å; F585-V607 HydrophobicContact CG-CG2 4.4Å; F585-V607 HydrophobicContact CZ-CG2 3.78Å
586	K	88.2	Confident	82.6	Confident	70 Å²	70	70.1 Å²	70.1	30%	0.304	41%	0.409	S	S	.	.	H	α-helix	trans	-56.4	-43.8	176.6	-175.7	170.7	179.6	167.1	0	111.6	F582 A588 C589 T590 D600	F582-K586 HydrophobicContact CE1-CD 4.36Å; F582-K586 WeakPolarHBondContact O-CB 3.3Å; F582-K586 PolarHBondContact O-N 3.18Å; K586-A588 VanDerWaalsContact C-N 3.3Å; K586-A588 PolarHBondContact O-N 2.9Å; K586-C589 WeakPolarHBondContact O-CB 3.08Å; K586-C589 PolarHBondContact O-N 2.88Å; K586-T590 WeakPolarHBondContact O-CG2 3.37Å; K586-T590 PolarHBondContact O-N 3.18Å; K586-T590 PolarHBondContact O-OG1 2.83Å; K586-D600 VanDerWaalsContact CE-OD1 3.27Å; K586-D600 WeakPolarHBondContact CE-OD1 3.43Å; K586-D600 IonicContact NZ-OD1 2.93Å; K586-D600 PolarHBondContact NZ-OD1 3.28Å; K586-D600 IonicContact NZ-OD2 2.93Å; K586-D600 PolarHBondContact NZ-OD2 2.92Å
587	K	87.3	Confident	82.1	Confident	143 Å²	143	69.3 Å²	69.3	62%	0.622	40%	0.403	S	S	*	.	H	α-helix	trans	-63.3	-34	175.6	-170.5	176	-179.3	179	0	112.9	T583 F585 T590 A591	T583-K587 WeakPolarHBondContact O-CB 3.34Å; T583-K587 PolarHBondContact O-N 3.29Å; F585-K587 VanDerWaalsContact C-N 3.29Å; F585-K587 PolarHBondContact O-N 3.18Å; K587-T590 WeakPolarHBondContact CA-OG1 3.45Å; K587-T590 PolarHBondContact O-OG1 3.19Å; K587-T590 VanDerWaalsContact O-OG1 3.09Å; K587-A591 VanDerWaalsContact O-CB 3.29Å; K587-A591 WeakPolarHBondContact O-CB 3.29Å; K587-A591 PolarHBondContact O-N 3.14Å; K587-A591 VanDerWaalsContact O-N 3.15Å
588	A	86.8	Confident	82	Confident	27 Å²	27	64.2 Å²	64.2	22%	0.223	38%	0.381	C	S	.	.	H	α-helix	trans	-72.1	-38.8	175	0	0	0	0	0	111.8	L569 M573 V584 F585 K586 A591 K592	L569-A588 HydrophobicContact CD2-CB 4.15Å; M573-A588 HydrophobicContact SD-CB 3.91Å; V584-A588 PolarHBondContact O-N 3.39Å; F585-A588 WeakPolarHBondContact O-CA 3.33Å; F585-A588 WeakPolarHBondContact O-CB 3.37Å; F585-A588 PolarHBondContact O-N 2.77Å; K586-A588 VanDerWaalsContact C-N 3.3Å; K586-A588 PolarHBondContact O-N 2.9Å; A588-A591 PolarHBondContact O-N 2.93Å; A588-K592 PolarHBondContact O-N 2.92Å
589	C	85.3	Confident	82.2	Confident	2 Å²	2	69.4 Å²	69.4	1%	0.014	40%	0.395	C	S	.	.	H	α-helix	trans	-61.9	-48.9	173.9	-67.4	0	0	0	0	111.4	L569 F585 K586 A591 K592 F593 M597	L569-C589 HydrophobicContact CD2-CB 4.48Å; F585-C589 VanDerWaalsContact CZ-SG 3.51Å; F585-C589 PolarHBondContact O-N 2.88Å; F585-C589 PolarHBondContact O-SG 2.87Å; K586-C589 WeakPolarHBondContact O-CB 3.08Å; K586-C589 PolarHBondContact O-N 2.88Å; C589-A591 VanDerWaalsContact C-N 3.25Å; C589-A591 PolarHBondContact O-N 3.41Å; C589-K592 PolarHBondContact O-N 3.3Å; C589-F593 PolarHBondContact O-N 2.96Å; C589-M597 HydrophobicContact CB-SD 4.46Å
590	T	84.4	Confident	82	Confident	68 Å²	68	67 Å²	67	42%	0.417	39%	0.388	S	S	.	.	H	α-helix	trans	-65.5	-29.5	179.3	56.9	0	0	0	0	112.6	K586 K587 M597	K586-T590 WeakPolarHBondContact O-CG2 3.37Å; K586-T590 PolarHBondContact O-N 3.18Å; K586-T590 PolarHBondContact O-OG1 2.83Å; K587-T590 WeakPolarHBondContact CA-OG1 3.45Å; K587-T590 PolarHBondContact O-OG1 3.19Å; K587-T590 VanDerWaalsContact O-OG1 3.09Å; T590-M597 HydrophobicContact CG2-CE 4.38Å; T590-M597 HydrophobicContact CG2-SD 3.69Å
591	A	84	Confident	81.8	Confident	84 Å²	84	69.9 Å²	69.9	69%	0.694	41%	0.413	S	S	*	.	H	α-helix	trans	-74.5	-36.8	176.2	0	0	0	0	0	113.3	K587 A588 C589	K587-A591 VanDerWaalsContact O-CB 3.29Å; K587-A591 WeakPolarHBondContact O-CB 3.29Å; K587-A591 PolarHBondContact O-N 3.14Å; K587-A591 VanDerWaalsContact O-N 3.15Å; A588-A591 PolarHBondContact O-N 2.93Å; C589-A591 VanDerWaalsContact C-N 3.25Å; C589-A591 PolarHBondContact O-N 3.41Å
592	K	80.7	Confident	81.5	Confident	119 Å²	119	71.8 Å²	71.8	52%	0.517	42%	0.419	S	S	.	.	H	α-helix	trans	-88.5	-31.2	-179.4	-74.6	-160.9	-178.3	-174.5	0	113.7	L569 E572 A588 C589	L569-K592 HydrophobicContact CD1-CD 3.85Å; E572-K592 IonicContact OE2-NZ 2.83Å; E572-K592 PolarHBondContact OE2-NZ 3.23Å; A588-K592 PolarHBondContact O-N 2.92Å; C589-K592 PolarHBondContact O-N 3.3Å
593	F	80.7	Confident	81.4	Confident	62 Å²	62	70.4 Å²	70.4	27%	0.272	41%	0.413	S	S	.	.			trans	-125	84.4	-172.9	-52.7	-68.9	0	0	0	109.7	H565 L569 C589 G595	H565-F593 HydrophobicContact CB-CE1 3.65Å; H565-F593 HydrophobicContact CB-CZ 3.57Å; L569-F593 HydrophobicContact CD2-CE2 4.15Å; C589-F593 PolarHBondContact O-N 2.96Å; F593-G595 PolarHBondContact O-N 3.41Å; F593-G595 VanDerWaalsContact O-N 3.16Å
594	A	65.3	Low	81.2	Confident	106 Å²	106	71.4 Å²	71.4	88%	0.876	41%	0.405	S	S	*	.	S	Bend	trans	-76.1	7.8	-172.6	0	0	0	0	0	115.5
595	G	66.4	Low	81.1	Confident	66 Å²	66	74.9 Å²	74.9	68%	0.68	42%	0.417	S	S	*	.	S	Bend	trans	-160.6	0.2	-171.5	0	0	0	0	0	119	F593	F593-G595 PolarHBondContact O-N 3.41Å; F593-G595 VanDerWaalsContact O-N 3.16Å
596	N	68.4	Low	80.9	Confident	127 Å²	127	75.1 Å²	75.1	68%	0.679	42%	0.419	S	S	*	.			trans	-147.4	85.1	175	-91	-28.6	0	0	0	108.7	W563	W563-N596 HydrophobicContact CH2-CB 4.27Å; W563-N596 HydrophobicContact CZ3-CB 4.17Å; W563-N596 WeakPolarHBondContact CZ3-O 3.3Å
597	M	69.7	Low	80.9	Confident	80 Å²	80	71.8 Å²	71.8	39%	0.394	40%	0.404	S	S	.	.			trans	-113.1	128.9	-177.6	-167	174.7	73.3	0	0	109.7	C589 T590 L603	C589-M597 HydrophobicContact CB-SD 4.46Å; T590-M597 HydrophobicContact CG2-CE 4.38Å; T590-M597 HydrophobicContact CG2-SD 3.69Å; M597-L603 HydrophobicContact CG-CD1 4.14Å; M597-L603 HydrophobicContact SD-CD1 4.28Å
598	P	75.6	Confident	80.8	Confident	5 Å²	5	70.4 Å²	70.4	3%	0.032	40%	0.4	C	S	.	.			trans	-63.5	156.5	171.2	18.6	-23.4	0	0	0	111.4	W563 E602 L603	W563-P598 HydrophobicContact CD2-CB 4.48Å; W563-P598 HydrophobicContact CD2-CG 4.07Å; W563-P598 HydrophobicContact CG-CG 4.18Å; W563-P598 HydrophobicContact CZ2-CB 4.22Å; W563-P598 HydrophobicContact CZ2-CG 4.48Å; P598-E602 HydrophobicContact CB-CB 3.87Å; P598-E602 WeakPolarHBondContact CB-OE2 3.49Å; P598-L603 HydrophobicContact CB-CG 4.47Å; P598-L603 HydrophobicContact CG-CD2 3.74Å; P598-L603 HydrophobicContact CG-CG 3.94Å
599	E	82.5	Confident	80.7	Confident	147 Å²	147	72.1 Å²	72.1	69%	0.687	40%	0.403	S	S	*	.			trans	-59.1	155.3	177.8	-70.4	-166.5	166.9	0	0	111.4	A601 E602 L603	E599-A601 PolarHBondContact O-N 3.03Å; E599-E602 PolarHBondContact O-N 2.77Å; E599-L603 PolarHBondContact O-N 3.31Å
600	D	82.9	Confident	80.6	Confident	60 Å²	60	72 Å²	72	32%	0.321	40%	0.403	S	S	.	.	H	α-helix	trans	-56	-26.3	-179.9	-87.5	8.9	0	0	0	112.7	K586 R604	K586-D600 VanDerWaalsContact CE-OD1 3.27Å; K586-D600 WeakPolarHBondContact CE-OD1 3.43Å; K586-D600 IonicContact NZ-OD1 2.93Å; K586-D600 PolarHBondContact NZ-OD1 3.28Å; K586-D600 IonicContact NZ-OD2 2.93Å; K586-D600 PolarHBondContact NZ-OD2 2.92Å; D600-R604 VanDerWaalsContact O-CG 3.29Å; D600-R604 WeakPolarHBondContact O-CG 3.36Å; D600-R604 PolarHBondContact O-N 2.94Å
601	A	84	Confident	80.7	Confident	68 Å²	68	69 Å²	69	56%	0.562	39%	0.385	S	S	*	.	H	α-helix	trans	-69.2	-52.4	174.5	0	0	0	0	0	111.9	E599 L603 R604 E605	E599-A601 PolarHBondContact O-N 3.03Å; A601-L603 VanDerWaalsContact C-N 3.31Å; A601-L603 PolarHBondContact O-N 3.34Å; A601-R604 PolarHBondContact O-N 2.91Å; A601-R604 VanDerWaalsContact O-N 3.11Å; A601-E605 PolarHBondContact O-N 2.84Å
602	E	83.9	Confident	80.7	Confident	86 Å²	86	66.8 Å²	66.8	40%	0.402	36%	0.363	S	S	.	.	H	α-helix	trans	-61.5	-38.7	177	-66.9	-175.4	176.1	0	0	111.7	P598 E599 R604 E605 L606	P598-E602 HydrophobicContact CB-CB 3.87Å; P598-E602 WeakPolarHBondContact CB-OE2 3.49Å; E599-E602 PolarHBondContact O-N 2.77Å; E602-R604 VanDerWaalsContact C-N 3.31Å; E602-R604 PolarHBondContact O-N 2.85Å; E602-E605 PolarHBondContact O-N 3.45Å; E602-L606 WeakPolarHBondContact O-CB 3.49Å; E602-L606 WeakPolarHBondContact O-CG 3.46Å; E602-L606 PolarHBondContact O-N 3.28Å
603	L	85.7	Confident	81.1	Confident	0 Å²	0	66 Å²	66	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-61.6	-38	174.5	-78.4	172.5	0	0	0	112.5	V566 F582 F585 M597 P598 E599 A601 V607	V566-L603 HydrophobicContact CG1-CD2 3.9Å; F582-L603 HydrophobicContact CE2-CB 4.22Å; F582-L603 HydrophobicContact CZ-CB 4.18Å; F585-L603 HydrophobicContact CE1-CB 4.41Å; F585-L603 HydrophobicContact CE1-CD2 3.88Å; F585-L603 HydrophobicContact CZ-CD2 4.22Å; M597-L603 HydrophobicContact CG-CD1 4.14Å; M597-L603 HydrophobicContact SD-CD1 4.28Å; P598-L603 HydrophobicContact CB-CG 4.47Å; P598-L603 HydrophobicContact CG-CD2 3.74Å; P598-L603 HydrophobicContact CG-CG 3.94Å; E599-L603 PolarHBondContact O-N 3.31Å; A601-L603 VanDerWaalsContact C-N 3.31Å; A601-L603 PolarHBondContact O-N 3.34Å; L603-V607 VanDerWaalsContact O-CG2 3.23Å; L603-V607 WeakPolarHBondContact O-CG2 3.45Å; L603-V607 PolarHBondContact O-N 3.49Å
604	R	86.1	Confident	81.2	Confident	123 Å²	123	70.3 Å²	70.3	46%	0.464	38%	0.379	S	S	.	.	H	α-helix	trans	-71.2	-39.6	177.1	-75.1	176.9	-173.1	-156.9	7	111.5	F582 D600 A601 E602 V607 Q608	F582-R604 HydrophobicContact CD2-CG 3.98Å; F582-R604 HydrophobicContact CE1-CG 4.38Å; F582-R604 HydrophobicContact CE2-CB 4.43Å; F582-R604 HydrophobicContact CE2-CG 3.38Å; F582-R604 HydrophobicContact CZ-CG 3.62Å; D600-R604 VanDerWaalsContact O-CG 3.29Å; D600-R604 WeakPolarHBondContact O-CG 3.36Å; D600-R604 PolarHBondContact O-N 2.94Å; A601-R604 PolarHBondContact O-N 2.91Å; A601-R604 VanDerWaalsContact O-N 3.11Å; E602-R604 VanDerWaalsContact C-N 3.31Å; E602-R604 PolarHBondContact O-N 2.85Å; R604-V607 PolarHBondContact O-N 2.75Å; R604-Q608 VanDerWaalsContact O-CG 3.28Å; R604-Q608 WeakPolarHBondContact O-CG 3.39Å; R604-Q608 PolarHBondContact O-N 3.26Å
605	E	86.4	Confident	81.9	Confident	129 Å²	129	77.4 Å²	77.4	60%	0.603	38%	0.383	S	S	*	.	H	α-helix	trans	-61.1	-49.5	176.3	-169.9	175	-172	0	0	111	A601 E602 V607 Q608 E609	A601-E605 PolarHBondContact O-N 2.84Å; E602-E605 PolarHBondContact O-N 3.45Å; E605-V607 VanDerWaalsContact C-N 3.27Å; E605-V607 PolarHBondContact O-N 2.83Å; E605-Q608 PolarHBondContact O-N 3.03Å; E605-E609 PolarHBondContact O-N 2.8Å
606	L	85	Confident	82.6	Confident	6 Å²	6	76.7 Å²	76.7	3%	0.031	38%	0.375	C	S	.	.	H	α-helix	trans	-57.6	-38	175.3	-72.1	172.2	0	0	0	112.6	W563 V566 R567 I570 E602 Y610	W563-L606 HydrophobicContact CB-CD1 4.1Å; W563-L606 HydrophobicContact CG-CD1 4.44Å; V566-L606 HydrophobicContact CG1-CD1 4.2Å; R567-L606 HydrophobicContact CG-CD2 4.48Å; I570-L606 HydrophobicContact CD1-CB 4.28Å; E602-L606 WeakPolarHBondContact O-CB 3.49Å; E602-L606 WeakPolarHBondContact O-CG 3.46Å; E602-L606 PolarHBondContact O-N 3.28Å; L606-Y610 WeakPolarHBondContact O-CD2 3.28Å
607	V	87	Confident	83.5	Confident	0 Å²	0	72 Å²	72	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-71.2	-37.2	177.1	171.5	0	0	0	0	111.7	I570 F580 F585 L603 R604 E605 E609 Y610 C611 Y618	I570-V607 HydrophobicContact CD1-CG2 3.87Å; I570-V607 HydrophobicContact CG1-CG2 4.19Å; F580-V607 HydrophobicContact CE2-CG1 4.07Å; F580-V607 HydrophobicContact CE2-CG2 4.5Å; F580-V607 HydrophobicContact CZ-CG1 4.05Å; F585-V607 HydrophobicContact CD1-CG2 3.76Å; F585-V607 HydrophobicContact CE1-CG2 3.39Å; F585-V607 HydrophobicContact CE2-CG2 4.45Å; F585-V607 HydrophobicContact CG-CG2 4.4Å; F585-V607 HydrophobicContact CZ-CG2 3.78Å; L603-V607 VanDerWaalsContact O-CG2 3.23Å; L603-V607 WeakPolarHBondContact O-CG2 3.45Å; L603-V607 PolarHBondContact O-N 3.49Å; R604-V607 PolarHBondContact O-N 2.75Å; E605-V607 VanDerWaalsContact C-N 3.27Å; E605-V607 PolarHBondContact O-N 2.83Å; V607-E609 VanDerWaalsContact C-N 3.25Å; V607-E609 PolarHBondContact O-N 3.21Å; V607-Y610 PolarHBondContact O-N 3.44Å; V607-C611 HydrophobicContact CG1-CB 3.98Å; V607-C611 WeakPolarHBondContact O-CA 3.21Å; V607-C611 VanDerWaalsContact O-CB 3.27Å; V607-C611 WeakPolarHBondContact O-CB 3.33Å; V607-C611 PolarHBondContact O-N 3.01Å; V607-Y618 HydrophobicContact CG1-CD1 3.48Å; V607-Y618 VanDerWaalsContact CG1-CD1 3.48Å; V607-Y618 HydrophobicContact CG1-CD2 3.99Å; V607-Y618 HydrophobicContact CG1-CE1 3.6Å; V607-Y618 HydrophobicContact CG1-CE2 4.08Å; V607-Y618 HydrophobicContact CG1-CG 3.69Å
608	Q	85.6	Confident	84.3	Confident	114 Å²	114	68.7 Å²	68.7	53%	0.533	34%	0.335	S	S	.	.	H	α-helix	trans	-68	-23.5	179.4	-74.9	175.5	17.2	0	0	113.4	R604 E605 Y610	R604-Q608 VanDerWaalsContact O-CG 3.28Å; R604-Q608 WeakPolarHBondContact O-CG 3.39Å; R604-Q608 PolarHBondContact O-N 3.26Å; E605-Q608 PolarHBondContact O-N 3.03Å; Q608-Y610 VanDerWaalsContact C-N 3.3Å; Q608-Y610 PolarHBondContact O-N 3.12Å
609	E	84.1	Confident	84.7	Confident	63 Å²	63	72.3 Å²	72.3	29%	0.294	35%	0.348	S	S	.	.	H	α-helix	trans	-61.2	-38	171.3	-71	-175.1	-152.6	0	0	112.4	P502 R567 E605 V607	P502-E609 HydrophobicContact CG-CB 4.02Å; R567-E609 IonicContact CZ-OE1 2.79Å; R567-E609 IonicContact CZ-OE2 2.87Å; R567-E609 IonicContact NH1-OE2 2.71Å; R567-E609 PolarHBondContact NH1-OE2 2.93Å; R567-E609 VanDerWaalsContact NH2-CD 3.27Å; R567-E609 IonicContact NH2-OE1 2.75Å; R567-E609 PolarHBondContact NH2-OE1 3.44Å; R567-E609 IonicContact NH2-OE2 3.77Å; R567-E609 PolarHBondContact NH2-OE2 2.95Å; E605-E609 PolarHBondContact O-N 2.8Å; V607-E609 VanDerWaalsContact C-N 3.25Å; V607-E609 PolarHBondContact O-N 3.21Å
610	Y	84	Confident	84.8	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-102.4	-24.5	-177.7	-60.1	-90.8	0	0	0	114	P502 L503 A556 A557 R567 I570 V571 L606 V607 Q608 K621	P502-Y610 HydrophobicContact CB-CD1 4.48Å; P502-Y610 HydrophobicContact CB-CE1 3.73Å; P502-Y610 HydrophobicContact CG-CE1 4.41Å; L503-Y610 HydrophobicContact CD1-CD1 4.37Å; L503-Y610 WeakPolarHBondContact CD1-O 3.35Å; L503-Y610 HydrophobicContact CD2-CD1 4.16Å; L503-Y610 HydrophobicContact CG-CD1 3.92Å; A556-Y610 HydrophobicContact CB-CD1 4.26Å; A556-Y610 HydrophobicContact CB-CE1 4.14Å; A557-Y610 PolarHBondContact O-OH 3.08Å; R567-Y610 HydrophobicContact CB-CE2 4.37Å; R567-Y610 WeakPolarHBondContact CD-OH 3.1Å; R567-Y610 HydrophobicContact CG-CE2 4.05Å; R567-Y610 PolarHBondContact NH1-OH 2.86Å; I570-Y610 HydrophobicContact CD1-CD2 4.37Å; I570-Y610 HydrophobicContact CG2-CD2 4.22Å; I570-Y610 HydrophobicContact CG2-CG 4.24Å; V571-Y610 HydrophobicContact CG2-CD1 4.31Å; V571-Y610 HydrophobicContact CG2-CE1 4.21Å; L606-Y610 WeakPolarHBondContact O-CD2 3.28Å; V607-Y610 PolarHBondContact O-N 3.44Å; Q608-Y610 VanDerWaalsContact C-N 3.3Å; Q608-Y610 PolarHBondContact O-N 3.12Å; Y610-K621 WeakPolarHBondContact O-CB 3.39Å; Y610-K621 PolarHBondContact O-N 3.45Å
611	C	86.1	Confident	84.7	Confident	5 Å²	5	69 Å²	69	3%	0.034	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	148.8	-166.9	-55.2	0	0	0	0	113.6	V607 Y618 Y619	V607-C611 HydrophobicContact CG1-CB 3.98Å; V607-C611 WeakPolarHBondContact O-CA 3.21Å; V607-C611 VanDerWaalsContact O-CB 3.27Å; V607-C611 WeakPolarHBondContact O-CB 3.33Å; V607-C611 PolarHBondContact O-N 3.01Å; C611-Y618 HydrophobicContact CB-CD1 3.87Å; C611-Y618 HydrophobicContact CB-CG 4.24Å; C611-Y619 CarbonylContact C-O 3.59Å; C611-Y619 WeakPolarHBondContact CA-O 3.18Å; C611-Y619 VanDerWaalsContact CB-O 3.26Å; C611-Y619 WeakPolarHBondContact CB-O 2.81Å
612	C	85.5	Confident	84	Confident	36 Å²	36	73.2 Å²	73.2	24%	0.243	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	138.5	165.9	69.3	0	0	0	0	111.2	Y618 Y619	C612-Y618 WeakPolarHBondContact O-CA 3.05Å; C612-Y619 PolarHBondContact N-O 2.68Å; C612-Y619 PolarHBondContact O-N 3.33Å
613	L	87.3	Confident	83	Confident	104 Å²	104	73.9 Å²	73.9	55%	0.545	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	119.2	177.8	-177.1	67.2	0	0	0	110.1	Y618	L613-Y618 HydrophobicContact CB-CD1 4.26Å; L613-Y618 HydrophobicContact CB-CE1 4.07Å; L613-Y618 HydrophobicContact CD1-CD1 4.17Å; L613-Y618 HydrophobicContact CD1-CD2 4.48Å; L613-Y618 HydrophobicContact CD1-CE1 3.96Å; L613-Y618 HydrophobicContact CD1-CE2 4.29Å; L613-Y618 HydrophobicContact CD1-CG 4.42Å
614	R	82.9	Confident	82.9	Confident	152 Å²	152	77.6 Å²	77.6	57%	0.574	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.9	120.1	171	-65.8	-175.6	178.1	-177	3.6	110.1	G616 T617 Y619	R614-G616 VanDerWaalsContact C-N 3.3Å; R614-G616 PolarHBondContact O-N 2.86Å; R614-T617 PolarHBondContact N-O 3.28Å; R614-T617 PolarHBondContact O-N 2.76Å; R614-Y619 HydrophobicContact CB-CD2 3.91Å; R614-Y619 HydrophobicContact CB-CE2 3.72Å; R614-Y619 HydrophobicContact CG-CD2 4.38Å
615	R	80.1	Confident	82.7	Confident	255 Å²	255	75.2 Å²	75.2	96%	0.962	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	44.8	178	-57.9	-179.1	177.5	-179.2	-2.4	113.2	T617	R615-T617 VanDerWaalsContact C-N 3.28Å; R615-T617 PolarHBondContact O-N 3.11Å
616	G	82.1	Confident	82.5	Confident	50 Å²	50	72.2 Å²	72.2	52%	0.515	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.1	4.5	178.9	0	0	0	0	0	115.8	R614	R614-G616 VanDerWaalsContact C-N 3.3Å; R614-G616 PolarHBondContact O-N 2.86Å
617	T	86.5	Confident	82.4	Confident	30 Å²	30	76.1 Å²	76.1	18%	0.184	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	137.1	177.1	-48.5	0	0	0	0	110.1	K579 R614 R615 Y619	K579-T617 HydrophobicContact CB-CG2 3.87Å; K579-T617 HydrophobicContact CD-CG2 4.25Å; K579-T617 HydrophobicContact CG-CG2 4.15Å; R614-T617 PolarHBondContact N-O 3.28Å; R614-T617 PolarHBondContact O-N 2.76Å; R615-T617 VanDerWaalsContact C-N 3.28Å; R615-T617 PolarHBondContact O-N 3.11Å; T617-Y619 HydrophobicContact CG2-CE2 4.04Å; T617-Y619 VanDerWaalsContact O-CD2 3.31Å; T617-Y619 WeakPolarHBondContact O-CD2 3.44Å; T617-Y619 WeakPolarHBondContact O-CE2 3.28Å
618	Y	87.7	Confident	82.1	Confident	10 Å²	10	80.8 Å²	80.8	4%	0.039	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	131.5	173.6	-68.6	-76.6	0	0	0	110.6	K579 F580 F582 V607 C611 C612 L613	K579-Y618 WeakPolarHBondContact CA-O 3.4Å; K579-Y618 WeakPolarHBondContact CB-O 3.3Å; F580-Y618 HydrophobicContact CD2-CD2 4.22Å; F580-Y618 AromaticContact CE2-CD2 3.96Å; F580-Y618 HydrophobicContact CE2-CD2 3.96Å; F580-Y618 HydrophobicContact CE2-CG 4.22Å; F580-Y618 PolarHBondContact N-O 3.33Å; F580-Y618 VanDerWaalsContact N-O 3.11Å; F580-Y618 WeakPolarHBondContact O-CB 3.37Å; F580-Y618 PolarHBondContact O-N 3.4Å; F582-Y618 HydrophobicContact CB-CE2 3.85Å; F582-Y618 HydrophobicContact CD2-CE2 4.09Å; F582-Y618 HydrophobicContact CG-CE2 4.44Å; V607-Y618 HydrophobicContact CG1-CD1 3.48Å; V607-Y618 VanDerWaalsContact CG1-CD1 3.48Å; V607-Y618 HydrophobicContact CG1-CD2 3.99Å; V607-Y618 HydrophobicContact CG1-CE1 3.6Å; V607-Y618 HydrophobicContact CG1-CE2 4.08Å; V607-Y618 HydrophobicContact CG1-CG 3.69Å; C611-Y618 HydrophobicContact CB-CD1 3.87Å; C611-Y618 HydrophobicContact CB-CG 4.24Å; C612-Y618 WeakPolarHBondContact O-CA 3.05Å; L613-Y618 HydrophobicContact CB-CD1 4.26Å; L613-Y618 HydrophobicContact CB-CE1 4.07Å; L613-Y618 HydrophobicContact CD1-CD1 4.17Å; L613-Y618 HydrophobicContact CD1-CD2 4.48Å; L613-Y618 HydrophobicContact CD1-CE1 3.96Å; L613-Y618 HydrophobicContact CD1-CE2 4.29Å; L613-Y618 HydrophobicContact CD1-CG 4.42Å
619	Y	83.9	Confident	81.8	Confident	80 Å²	80	78.6 Å²	78.6	31%	0.314	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	155.8	175.5	-61.5	-95.3	0	0	0	109.1	K579 C611 C612 R614 T617 K621	K579-Y619 HydrophobicContact CB-CD1 3.94Å; K579-Y619 HydrophobicContact CB-CE1 3.94Å; K579-Y619 HydrophobicContact CD-CD1 4.43Å; K579-Y619 HydrophobicContact CD-CE1 3.66Å; K579-Y619 HydrophobicContact CG-CE1 4.46Å; C611-Y619 CarbonylContact C-O 3.59Å; C611-Y619 WeakPolarHBondContact CA-O 3.18Å; C611-Y619 VanDerWaalsContact CB-O 3.26Å; C611-Y619 WeakPolarHBondContact CB-O 2.81Å; C612-Y619 PolarHBondContact N-O 2.68Å; C612-Y619 PolarHBondContact O-N 3.33Å; R614-Y619 HydrophobicContact CB-CD2 3.91Å; R614-Y619 HydrophobicContact CB-CE2 3.72Å; R614-Y619 HydrophobicContact CG-CD2 4.38Å; T617-Y619 HydrophobicContact CG2-CE2 4.04Å; T617-Y619 VanDerWaalsContact O-CD2 3.31Å; T617-Y619 WeakPolarHBondContact O-CD2 3.44Å; T617-Y619 WeakPolarHBondContact O-CE2 3.28Å; Y619-K621 PolarHBondContact O-N 3.47Å
620	V	83.3	Confident	81.7	Confident	35 Å²	35	79.7 Å²	79.7	21%	0.212	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.1	131.4	169.7	-175.8	0	0	0	0	109	L543 M554 L574 E622	L543-V620 HydrophobicContact CD1-CG1 4.37Å; M554-V620 HydrophobicContact CE-CG1 4.09Å; M554-V620 HydrophobicContact SD-CG1 4.49Å; L574-V620 HydrophobicContact CB-CG2 4.19Å; L574-V620 HydrophobicContact CD1-CG2 4.17Å; L574-V620 HydrophobicContact CD2-CG2 3.76Å; L574-V620 HydrophobicContact CG-CG2 4.24Å; V620-E622 PolarHBondContact O-N 2.95Å
621	K	81.9	Confident	81.5	Confident	103 Å²	103	85.8 Å²	85.8	45%	0.448	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-68.6	123.1	174.9	-169.6	175.3	-179.4	179.3	0	108.6	L503 Y610 Y619 V623	L503-K621 HydrophobicContact CD1-CB 4.15Å; Y610-K621 WeakPolarHBondContact O-CB 3.39Å; Y610-K621 PolarHBondContact O-N 3.45Å; Y619-K621 PolarHBondContact O-N 3.47Å; K621-V623 PolarHBondContact O-N 3.44Å
622	E	69.8	Low	81.1	Confident	157 Å²	157	92.6 Å²	92.6	73%	0.734	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-69.4	122.9	170.3	-66.5	179	152.8	0	0	107.5	V620	V620-E622 PolarHBondContact O-N 2.95Å
623	V	62.5	Low	80.7	Confident	99 Å²	99	97.7 Å²	97.7	60%	0.6	47%	0.466	S	S	*	.			trans	-97.8	0	178.5	-174.4	0	0	0	0	109.8	L503 M508 K621	L503-V623 HydrophobicContact CB-CG2 3.88Å; M508-V623 HydrophobicContact CE-CG1 3.97Å; M508-V623 HydrophobicContact SD-CG1 3.38Å; M508-V623 WeakPolarHBondContact SD-CG1 3.48Å; K621-V623 PolarHBondContact O-N 3.44Å

Retrieved 623 of 623 residues in 442 ms (Link to these results)

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