A0A075B7A1_HUMAN Loading...

sphingosine kinase

AlphaFold DB , UniProt , Accession A0A075B7A1, Species HUMAN (Homo sapiens, Human), Gene SPHK2, Length 349 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	42.3	Very low	40.9	Very low	242 Å²	242	118.5 Å²	118.5	100%	1.192	76%	0.762	S	S	*	*				0	104.8	0	-154.1	161.2	98.7	0	0	106.3
2	A	32.8	Very low	43.4	Very low	90 Å²	90	117.3 Å²	117.3	74%	0.744	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-61.8	140.3	177.4	0	0	0	0	0	108.6
3	P	38.8	Very low	46.1	Very low	113 Å²	113	115.2 Å²	115.2	73%	0.734	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-59.3	144.7	175.4	26.4	-32.4	0	0	0	108.8
4	P	38.8	Very low	48.7	Very low	111 Å²	111	111.7 Å²	111.7	72%	0.721	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-56.8	143	173.4	25.5	-32.4	0	0	0	108.7
5	P	35.8	Very low	51.1	Low	114 Å²	114	105.1 Å²	105.1	74%	0.74	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-55.2	140.6	174.2	24.5	-32.5	0	0	0	108.7
6	P	37.2	Very low	53.4	Low	113 Å²	113	105.7 Å²	105.7	73%	0.734	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-56.5	143.2	177.1	24	-31.9	0	0	0	109	L8	P6-L8 PolarHBondContact O-N 3.4Å
7	P	39.8	Very low	55.3	Low	121 Å²	121	100.1 Å²	100.1	79%	0.786	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-54.3	128.5	172	23	-30.8	0	0	0	107.8	A9	P7-A9 PolarHBondContact O-N 3.41Å
8	L	42.3	Very low	57.2	Low	170 Å²	170	100.4 Å²	100.4	89%	0.89	62%	0.62	S	S	*	*			trans	-39	115.6	172.1	-74.4	157.8	0	0	0	107.9	P6 A10	P6-L8 PolarHBondContact O-N 3.4Å; L8-A10 PolarHBondContact O-N 3.32Å
9	A	38.9	Very low	58.8	Low	96 Å²	96	95.3 Å²	95.3	79%	0.793	59%	0.588	S	S	*	*			trans	-44	114.6	-172.4	0	0	0	0	0	109.7	P7 S11	P7-A9 PolarHBondContact O-N 3.41Å; A9-S11 PolarHBondContact O-N 3.06Å
10	A	44.3	Very low	60.1	Low	97 Å²	97	90.8 Å²	90.8	80%	0.802	56%	0.561	S	S	*	*			trans	-62	103.8	173.4	0	0	0	0	0	106.3	L8 T12	L8-A10 PolarHBondContact O-N 3.32Å; A10-T12 PolarHBondContact O-N 2.96Å
11	S	58.5	Low	61.2	Low	36 Å²	36	86.9 Å²	86.9	25%	0.252	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-55.5	128	177	42.1	0	0	0	0	108.3	A9 T34	A9-S11 PolarHBondContact O-N 3.06Å; S11-T34 VanDerWaalsContact OG-CB 3.22Å; S11-T34 WeakPolarHBondContact OG-CB 3.22Å; S11-T34 WeakPolarHBondContact OG-CG2 3.39Å; S11-T34 PolarHBondContact OG-OG1 3.27Å
12	T	71.3	Confident	62.8	Low	104 Å²	104	82.5 Å²	82.5	64%	0.638	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-56.2	130.2	-179.9	44.3	0	0	0	0	109.8	A10 L14	A10-T12 PolarHBondContact O-N 2.96Å; T12-L14 PolarHBondContact O-N 3.29Å
13	P	78.1	Confident	64.7	Low	90 Å²	90	82.8 Å²	82.8	58%	0.584	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-65.5	124.2	178.6	27.8	-33.4	0	0	0	109.7	T32	P13-T32 HydrophobicContact CB-CG2 3.53Å
14	L	82.9	Confident	66.1	Low	67 Å²	67	79.9 Å²	79.9	35%	0.351	49%	0.489	S	S	.	.	S	Bend	trans	-90.2	-32.7	179.4	-63.5	173.3	0	0	0	111.5	T12 L33 L124 L130	T12-L14 PolarHBondContact O-N 3.29Å; L14-L33 PolarHBondContact N-O 3.35Å; L14-L124 HydrophobicContact CD1-CD1 4.17Å; L14-L124 HydrophobicContact CD1-CD2 3.92Å; L14-L130 HydrophobicContact CD1-CD1 4.14Å
15	L	85.1	Confident	67.4	Low	13 Å²	13	86.8 Å²	86.8	7%	0.068	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	138.9	178.2	-163.6	64.1	0	0	0	109.3	T32 L33 W117 A120 I136	L15-T32 CarbonylContact O-C 3.47Å; L15-T32 WeakPolarHBondContact O-CA 3.39Å; L15-L33 HydrophobicContact CB-CB 3.98Å; L15-L33 HydrophobicContact CB-CD2 4.38Å; L15-L33 PolarHBondContact N-O 3.44Å; L15-L33 PolarHBondContact O-N 3.5Å; L15-W117 HydrophobicContact CB-CH2 4.31Å; L15-W117 HydrophobicContact CB-CZ2 4.32Å; L15-W117 HydrophobicContact CD2-CD2 3.5Å; L15-W117 VanDerWaalsContact CD2-CD2 3.5Å; L15-W117 VanDerWaalsContact CD2-CE2 3.42Å; L15-W117 HydrophobicContact CD2-CE3 3.99Å; L15-W117 HydrophobicContact CD2-CG 3.75Å; L15-W117 HydrophobicContact CD2-CH2 4.29Å; L15-W117 HydrophobicContact CD2-CZ2 3.85Å; L15-W117 HydrophobicContact CD2-CZ3 4.36Å; L15-W117 HydrophobicContact CG-CD2 4.27Å; L15-W117 HydrophobicContact CG-CH2 4.12Å; L15-W117 HydrophobicContact CG-CZ2 3.66Å; L15-A120 HydrophobicContact CD2-CB 4.02Å; L15-I136 HydrophobicContact CD1-CD1 4.35Å
16	H	87.8	Confident	69.1	Low	114 Å²	114	83.2 Å²	83.2	53%	0.528	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	139.4	177.2	-177.4	83.5	0	0	0	110	L31 T32	H16-L31 WeakPolarHBondContact CA-O 3.41Å; H16-L31 PolarHBondContact ND1-O 3.25Å; H16-T32 PolarHBondContact ND1-OG1 2.97Å
17	G	86.3	Confident	71.2	Confident	11 Å²	11	80 Å²	80	11%	0.113	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170	156.3	-176.7	0	0	0	0	0	113	L31	G17-L31 PolarHBondContact N-O 3.49Å; G17-L31 PolarHBondContact O-N 3.12Å
18	E	88.8	Confident	73.4	Confident	106 Å²	106	78.6 Å²	78.6	50%	0.495	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	131.5	-179.4	-64.1	-167.4	178.3	0	0	111.8	F29 L43	E18-F29 WeakPolarHBondContact CA-O 3.45Å; E18-L43 HydrophobicContact CG-CD1 4.12Å
19	F	88.3	Confident	75.5	Confident	2 Å²	2	72.6 Å²	72.6	1%	0.009	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	143.5	-177.3	-65.2	-95.6	0	0	0	111.4	R28 F29 L31 F99 R100 A101 E113 W117	F19-R28 CarbonylContact O-C 3.55Å; F19-R28 WeakPolarHBondContact O-CA 3.31Å; F19-F29 PolarHBondContact N-O 3.24Å; F19-F29 PolarHBondContact O-N 3.19Å; F19-L31 HydrophobicContact CD2-CB 4.12Å; F19-L31 HydrophobicContact CD2-CD1 3.41Å; F19-L31 VanDerWaalsContact CD2-CD1 3.41Å; F19-L31 HydrophobicContact CD2-CG 3.61Å; F19-L31 HydrophobicContact CE2-CB 4.25Å; F19-L31 HydrophobicContact CE2-CD1 3.74Å; F19-L31 HydrophobicContact CE2-CG 4.15Å; F19-L31 HydrophobicContact CG-CD1 3.99Å; F19-L31 HydrophobicContact CG-CG 4.42Å; F19-F99 HydrophobicContact CB-CB 3.8Å; F19-F99 HydrophobicContact CB-CD1 4.38Å; F19-F99 HydrophobicContact CB-CG 4.48Å; F19-F99 HydrophobicContact CD1-CB 3.98Å; F19-F99 HydrophobicContact CG-CB 3.99Å; F19-R100 CarbonylContact C-O 3.54Å; F19-R100 WeakPolarHBondContact CA-O 3.44Å; F19-A101 HydrophobicContact CD1-CB 4.15Å; F19-A101 HydrophobicContact CE1-CB 3.97Å; F19-E113 HydrophobicContact CZ-CG 4.37Å; F19-W117 HydrophobicContact CE2-CD2 4.01Å; F19-W117 AromaticContact CE2-CE2 3.54Å; F19-W117 HydrophobicContact CE2-CG 4.48Å; F19-W117 HydrophobicContact CE2-CH2 4.39Å; F19-W117 AromaticContact CE2-CZ2 3.76Å; F19-W117 HydrophobicContact CE2-CZ2 3.76Å; F19-W117 AromaticContact CE2-NE1 3.75Å; F19-W117 AromaticContact CZ-CD1 3.6Å; F19-W117 AromaticContact CZ-CD2 3.88Å; F19-W117 HydrophobicContact CZ-CD2 3.88Å; F19-W117 AromaticContact CZ-CE2 3.62Å; F19-W117 AromaticContact CZ-CG 3.87Å; F19-W117 HydrophobicContact CZ-CG 3.87Å; F19-W117 HydrophobicContact CZ-CZ2 4.3Å; F19-W117 AromaticContact CZ-NE1 3.41Å
20	G	85.1	Confident	77.8	Confident	5 Å²	5	68.2 Å²	68.2	5%	0.052	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	163.4	165.8	0	0	0	0	0	112.1	R100	G20-R100 PolarHBondContact N-O 3.46Å; G20-R100 PolarHBondContact O-N 2.8Å
21	S	83.1	Confident	80	Confident	10 Å²	10	63.6 Å²	63.6	7%	0.07	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	156.6	167.4	64.4	0	0	0	0	111.6	P23 G26 P27	S21-P23 CarbonylContact O-C 3.32Å; S21-P23 VanDerWaalsContact O-O 3.06Å; S21-P23 PolarHBondContact OG-O 3.07Å; S21-P23 VanDerWaalsContact OG-O 3.13Å; S21-G26 WeakPolarHBondContact OG-CA 3.4Å; S21-G26 PolarHBondContact OG-N 2.63Å; S21-P27 VanDerWaalsContact CB-O 3.26Å; S21-P27 WeakPolarHBondContact CB-O 3.42Å; S21-P27 PolarHBondContact N-O 2.9Å; S21-P27 VanDerWaalsContact N-O 3.09Å; S21-P27 PolarHBondContact OG-O 3.29Å
22	Y	74.9	Confident	81.4	Confident	150 Å²	150	63.3 Å²	63.3	59%	0.588	33%	0.332	S	S	*	.	S	Bend	trans	-102.5	129.5	156.5	-175.1	-99.2	0	0	0	110.2	Y78 T98	Y22-Y78 AromaticContact CD2-CD1 3.91Å; Y22-Y78 HydrophobicContact CD2-CD1 3.91Å; Y22-Y78 AromaticContact CD2-CE1 3.48Å; Y22-Y78 HydrophobicContact CD2-CE1 3.48Å; Y22-Y78 VanDerWaalsContact CD2-CE1 3.48Å; Y22-Y78 HydrophobicContact CE2-CE1 4.14Å; Y22-Y78 HydrophobicContact CG-CE1 4.41Å; Y22-T98 HydrophobicContact CG-CG2 4.24Å; Y22-T98 PolarHBondContact N-O 3.4Å
23	P	73.3	Confident	82.1	Confident	96 Å²	96	58.4 Å²	58.4	62%	0.623	30%	0.302	S	S	*	.	S	Bend	cis	-71.4	160	-1	27.7	-33.3	0	0	0	114.2	S21 R25 G26	S21-P23 CarbonylContact O-C 3.32Å; S21-P23 VanDerWaalsContact O-O 3.06Å; S21-P23 PolarHBondContact OG-O 3.07Å; S21-P23 VanDerWaalsContact OG-O 3.13Å; P23-R25 PolarHBondContact O-N 3.43Å; P23-G26 PolarHBondContact O-N 3.1Å
24	A	67.1	Low	82.5	Confident	52 Å²	52	54.3 Å²	54.3	43%	0.43	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-13.5	-165.7	0	0	0	0	0	117.3
25	R	66.3	Low	82.5	Confident	255 Å²	255	54.3 Å²	54.3	96%	0.962	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	9.4	-179.4	-67.8	-173	179	-173.6	-0.1	114.4	P23	P23-R25 PolarHBondContact O-N 3.43Å
26	G	72.5	Confident	82.2	Confident	40 Å²	40	60.7 Å²	60.7	41%	0.412	31%	0.31	S	S	.	.	S	Bend	trans	-98.4	-168	-176.5	0	0	0	0	0	114.5	S21 P23	S21-G26 WeakPolarHBondContact OG-CA 3.4Å; S21-G26 PolarHBondContact OG-N 2.63Å; P23-G26 PolarHBondContact O-N 3.1Å
27	P	81.6	Confident	82.1	Confident	44 Å²	44	55.6 Å²	55.6	29%	0.286	29%	0.288	S	S	.	.			trans	-71.1	154.2	-174.7	30.4	-35.3	0	0	0	112.5	S21 F29 R42	S21-P27 VanDerWaalsContact CB-O 3.26Å; S21-P27 WeakPolarHBondContact CB-O 3.42Å; S21-P27 PolarHBondContact N-O 2.9Å; S21-P27 VanDerWaalsContact N-O 3.09Å; S21-P27 PolarHBondContact OG-O 3.29Å; P27-F29 HydrophobicContact CG-CE1 4.4Å; P27-F29 HydrophobicContact CG-CE2 4.14Å; P27-F29 HydrophobicContact CG-CZ 3.76Å; P27-R42 HydrophobicContact CB-CG 4.07Å
28	R	85.1	Confident	82.1	Confident	93 Å²	93	55.2 Å²	55.2	35%	0.351	28%	0.283	S	S	.	.			trans	-85.9	147.4	168.1	-61.2	-174.5	78.4	82.2	2.2	111.1	F19 L43 D102	F19-R28 CarbonylContact O-C 3.55Å; F19-R28 WeakPolarHBondContact O-CA 3.31Å; R28-L43 HydrophobicContact CB-CD1 3.86Å; R28-L43 PolarHBondContact O-N 3.41Å; R28-D102 IonicContact CZ-OD1 3.8Å; R28-D102 VanDerWaalsContact CZ-OD1 3.29Å; R28-D102 IonicContact NH1-OD1 3.94Å; R28-D102 PolarHBondContact NH1-OD1 2.95Å; R28-D102 IonicContact NH1-OD2 3.87Å; R28-D102 PolarHBondContact NH1-OD2 3.37Å; R28-D102 VanDerWaalsContact NH1-OD2 3.1Å; R28-D102 IonicContact NH2-OD1 2.91Å; R28-D102 PolarHBondContact NH2-OD1 2.89Å
29	F	87.3	Confident	82	Confident	44 Å²	44	53.7 Å²	53.7	19%	0.193	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	134.6	180	-58.8	-79.4	0	0	0	110.2	E18 F19 P27 L31 I40 Q41 R42 F99	E18-F29 WeakPolarHBondContact CA-O 3.45Å; F19-F29 PolarHBondContact N-O 3.24Å; F19-F29 PolarHBondContact O-N 3.19Å; P27-F29 HydrophobicContact CG-CE1 4.4Å; P27-F29 HydrophobicContact CG-CE2 4.14Å; P27-F29 HydrophobicContact CG-CZ 3.76Å; F29-L31 HydrophobicContact CB-CD2 4.35Å; F29-I40 HydrophobicContact CB-CG2 4.28Å; F29-I40 HydrophobicContact CD1-CG2 3.82Å; F29-I40 HydrophobicContact CE1-CG2 4.45Å; F29-I40 HydrophobicContact CG-CG2 4.21Å; F29-Q41 CarbonylContact C-O 3.54Å; F29-Q41 WeakPolarHBondContact CA-O 3.3Å; F29-R42 HydrophobicContact CD1-CB 4.11Å; F29-R42 HydrophobicContact CE1-CB 4.15Å; F29-R42 HydrophobicContact CE1-CG 4.38Å; F29-F99 HydrophobicContact CB-CE1 4.5Å; F29-F99 HydrophobicContact CD2-CD1 4.27Å; F29-F99 HydrophobicContact CD2-CE1 4.27Å; F29-F99 HydrophobicContact CG-CE1 4.43Å
30	A	87.3	Confident	82	Confident	4 Å²	4	54.4 Å²	54.4	3%	0.033	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	122.5	161.2	0	0	0	0	0	108.3	Q41 L43	A30-Q41 HydrophobicContact CB-CB 4.46Å; A30-Q41 PolarHBondContact N-O 3.02Å; A30-Q41 PolarHBondContact O-N 3.13Å; A30-L43 HydrophobicContact CB-CD2 3.82Å; A30-L43 HydrophobicContact CB-CG 4.24Å
31	L	89.1	Confident	81.9	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	134.6	175.3	-59.9	-169.8	0	0	0	108.9	H16 G17 F19 F29 L38 H39 I40 F99 W117	H16-L31 WeakPolarHBondContact CA-O 3.41Å; H16-L31 PolarHBondContact ND1-O 3.25Å; G17-L31 PolarHBondContact N-O 3.49Å; G17-L31 PolarHBondContact O-N 3.12Å; F19-L31 HydrophobicContact CD2-CB 4.12Å; F19-L31 HydrophobicContact CD2-CD1 3.41Å; F19-L31 VanDerWaalsContact CD2-CD1 3.41Å; F19-L31 HydrophobicContact CD2-CG 3.61Å; F19-L31 HydrophobicContact CE2-CB 4.25Å; F19-L31 HydrophobicContact CE2-CD1 3.74Å; F19-L31 HydrophobicContact CE2-CG 4.15Å; F19-L31 HydrophobicContact CG-CD1 3.99Å; F19-L31 HydrophobicContact CG-CG 4.42Å; F29-L31 HydrophobicContact CB-CD2 4.35Å; L31-L38 HydrophobicContact CB-CD1 4.45Å; L31-H39 CarbonylContact C-O 3.57Å; L31-H39 WeakPolarHBondContact CA-O 3.46Å; L31-I40 HydrophobicContact CD2-CB 4.03Å; L31-I40 HydrophobicContact CD2-CG1 3.61Å; L31-I40 HydrophobicContact CD2-CG2 3.89Å; L31-F99 HydrophobicContact CD1-CB 4.35Å; L31-F99 HydrophobicContact CD1-CD1 3.98Å; L31-F99 HydrophobicContact CD1-CD2 3.94Å; L31-F99 HydrophobicContact CD1-CE1 4.26Å; L31-F99 HydrophobicContact CD1-CE2 4.22Å; L31-F99 HydrophobicContact CD1-CG 3.81Å; L31-F99 HydrophobicContact CD1-CZ 4.37Å; L31-F99 HydrophobicContact CD2-CD1 4.1Å; L31-F99 HydrophobicContact CD2-CE1 3.7Å; L31-F99 HydrophobicContact CD2-CZ 3.94Å; L31-F99 HydrophobicContact CG-CD1 4.44Å; L31-F99 HydrophobicContact CG-CE1 4.5Å; L31-W117 HydrophobicContact CB-CE3 4.5Å; L31-W117 HydrophobicContact CB-CH2 3.41Å; L31-W117 VanDerWaalsContact CB-CH2 3.41Å; L31-W117 HydrophobicContact CB-CZ2 4.2Å; L31-W117 HydrophobicContact CB-CZ3 3.58Å; L31-W117 HydrophobicContact CD1-CE3 4.38Å; L31-W117 HydrophobicContact CD1-CZ3 4.21Å; L31-W117 WeakPolarHBondContact O-CH2 3.4Å
32	T	88.3	Confident	82	Confident	29 Å²	29	65.3 Å²	65.3	18%	0.178	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	113.8	171.9	-52.7	0	0	0	0	108.9	P13 L15 H16 H39	P13-T32 HydrophobicContact CB-CG2 3.53Å; L15-T32 CarbonylContact O-C 3.47Å; L15-T32 WeakPolarHBondContact O-CA 3.39Å; H16-T32 PolarHBondContact ND1-OG1 2.97Å; T32-H39 PolarHBondContact N-O 3.34Å; T32-H39 PolarHBondContact O-N 3.13Å
33	L	86.7	Confident	82.1	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	130.2	177.8	-173.4	62.8	0	0	0	109.3	L14 L15 L38 L58 W117 A120 L121 L124	L14-L33 PolarHBondContact N-O 3.35Å; L15-L33 HydrophobicContact CB-CB 3.98Å; L15-L33 HydrophobicContact CB-CD2 4.38Å; L15-L33 PolarHBondContact N-O 3.44Å; L15-L33 PolarHBondContact O-N 3.5Å; L33-L38 HydrophobicContact CB-CD1 4.34Å; L33-L38 HydrophobicContact CD1-CB 4.35Å; L33-L38 HydrophobicContact CD1-CD1 4.11Å; L33-L58 HydrophobicContact CD1-CD2 4.29Å; L33-W117 HydrophobicContact CB-CZ3 4.08Å; L33-A120 HydrophobicContact CD2-CB 3.79Å; L33-L121 HydrophobicContact CD1-CD1 4.01Å; L33-L124 HydrophobicContact CD1-CD1 3.82Å; L33-L124 HydrophobicContact CD2-CD1 3.67Å; L33-L124 HydrophobicContact CG-CD1 3.64Å
34	T	86.8	Confident	81.9	Confident	4 Å²	4	67.1 Å²	67.1	3%	0.025	32%	0.322	C	S	.	.			trans	-122.6	170.9	172.7	72	0	0	0	0	109.4	S11 Q36 A37	S11-T34 VanDerWaalsContact OG-CB 3.22Å; S11-T34 WeakPolarHBondContact OG-CB 3.22Å; S11-T34 WeakPolarHBondContact OG-CG2 3.39Å; S11-T34 PolarHBondContact OG-OG1 3.27Å; T34-Q36 PolarHBondContact O-N 2.89Å; T34-Q36 VanDerWaalsContact O-N 3.09Å; T34-Q36 PolarHBondContact OG1-N 3.26Å; T34-A37 PolarHBondContact N-O 3.28Å; T34-A37 PolarHBondContact OG1-N 3.25Å; T34-A37 PolarHBondContact OG1-O 3.26Å
35	S	81.7	Confident	81.5	Confident	68 Å²	68	69.1 Å²	69.1	48%	0.476	33%	0.331	S	S	.	.	S	Bend	trans	-62.3	-15.1	177.6	57.3	0	0	0	0	114.4	L58	S35-L58 WeakPolarHBondContact O-CD1 3.33Å
36	Q	78.8	Confident	81.1	Confident	146 Å²	146	63.2 Å²	63.2	68%	0.682	31%	0.312	S	S	*	.	S	Bend	trans	-121.9	-25.6	-175.4	-63.2	-163.3	-19.9	0	0	114.4	T34 L58	T34-Q36 PolarHBondContact O-N 2.89Å; T34-Q36 VanDerWaalsContact O-N 3.09Å; T34-Q36 PolarHBondContact OG1-N 3.26Å; Q36-L58 PolarHBondContact O-N 3.12Å
37	A	85.6	Confident	80.2	Confident	8 Å²	8	67.8 Å²	67.8	7%	0.066	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	153.9	-175.8	0	0	0	0	0	112.8	T34 L55 V56	T34-A37 PolarHBondContact N-O 3.28Å; T34-A37 PolarHBondContact OG1-N 3.25Å; T34-A37 PolarHBondContact OG1-O 3.26Å; A37-L55 HydrophobicContact CB-CD1 3.57Å; A37-L55 HydrophobicContact CB-CG 4.2Å; A37-V56 CarbonylContact C-O 3.59Å; A37-V56 WeakPolarHBondContact CA-O 3.49Å
38	L	87.1	Confident	78.7	Confident	2 Å²	2	73.9 Å²	73.9	1%	0.01	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	118.3	165.1	178	69	0	0	0	109.3	L31 L33 I40 V56 I81 W117	L31-L38 HydrophobicContact CB-CD1 4.45Å; L33-L38 HydrophobicContact CB-CD1 4.34Å; L33-L38 HydrophobicContact CD1-CB 4.35Å; L33-L38 HydrophobicContact CD1-CD1 4.11Å; L38-I40 HydrophobicContact CD2-CD1 4.19Å; L38-I40 HydrophobicContact CD2-CG1 4.2Å; L38-I40 HydrophobicContact CG-CG1 4.13Å; L38-V56 HydrophobicContact CB-CB 4.44Å; L38-V56 PolarHBondContact N-O 2.84Å; L38-V56 PolarHBondContact O-N 3.17Å; L38-I81 HydrophobicContact CD2-CD1 3.19Å; L38-W117 HydrophobicContact CD1-CZ3 3.94Å
39	H	86.6	Confident	77	Confident	75 Å²	75	72.4 Å²	72.4	35%	0.347	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	125.3	174.5	-64.4	-118.3	0	0	0	109.3	L31 T32 G54 L55	L31-H39 CarbonylContact C-O 3.57Å; L31-H39 WeakPolarHBondContact CA-O 3.46Å; T32-H39 PolarHBondContact N-O 3.34Å; T32-H39 PolarHBondContact O-N 3.13Å; H39-G54 CarbonylContact C-O 3.49Å; H39-G54 WeakPolarHBondContact CA-O 3.12Å; H39-L55 WeakPolarHBondContact CE1-CD1 3.21Å; H39-L55 VanDerWaalsContact NE2-CD1 3.31Å; H39-L55 WeakPolarHBondContact NE2-CD1 3.35Å
40	I	87.8	Confident	74.9	Confident	17 Å²	17	80.3 Å²	80.3	9%	0.087	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	103.3	-179.5	-59.1	158.7	0	0	0	106.8	F29 L31 L38 G54 V56 F99	F29-I40 HydrophobicContact CB-CG2 4.28Å; F29-I40 HydrophobicContact CD1-CG2 3.82Å; F29-I40 HydrophobicContact CE1-CG2 4.45Å; F29-I40 HydrophobicContact CG-CG2 4.21Å; L31-I40 HydrophobicContact CD2-CB 4.03Å; L31-I40 HydrophobicContact CD2-CG1 3.61Å; L31-I40 HydrophobicContact CD2-CG2 3.89Å; L38-I40 HydrophobicContact CD2-CD1 4.19Å; L38-I40 HydrophobicContact CD2-CG1 4.2Å; L38-I40 HydrophobicContact CG-CG1 4.13Å; I40-G54 PolarHBondContact N-O 2.93Å; I40-G54 WeakPolarHBondContact O-CA 3.4Å; I40-V56 HydrophobicContact CD1-CG2 3.71Å; I40-F99 HydrophobicContact CD1-CZ 3.79Å; I40-F99 HydrophobicContact CG1-CZ 4.04Å; I40-F99 HydrophobicContact CG2-CE1 4.06Å; I40-F99 HydrophobicContact CG2-CZ 4.29Å
41	Q	84.1	Confident	73.2	Confident	132 Å²	132	86.5 Å²	86.5	62%	0.617	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	131.5	178.8	-176.2	172.7	-0.2	0	0	110	F29 A30	F29-Q41 CarbonylContact C-O 3.54Å; F29-Q41 WeakPolarHBondContact CA-O 3.3Å; A30-Q41 HydrophobicContact CB-CB 4.46Å; A30-Q41 PolarHBondContact N-O 3.02Å; A30-Q41 PolarHBondContact O-N 3.13Å
42	R	83.3	Confident	71.3	Confident	112 Å²	112	97.3 Å²	97.3	42%	0.423	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	124.5	174.4	-178.1	174.3	156.2	171.2	-2.1	109.5	P27 F29 R44	P27-R42 HydrophobicContact CB-CG 4.07Å; F29-R42 HydrophobicContact CD1-CB 4.11Å; F29-R42 HydrophobicContact CE1-CB 4.15Å; F29-R42 HydrophobicContact CE1-CG 4.38Å; R42-R44 PolarHBondContact NE-O 2.91Å; R42-R44 PolarHBondContact NH2-O 3.42Å; R42-R44 PolarHBondContact O-N 3.22Å
43	L	76.9	Confident	69.8	Low	71 Å²	71	98.2 Å²	98.2	37%	0.372	49%	0.491	S	S	.	.	S	Bend	trans	-68.3	-30.9	-174.8	-74	174	0	0	0	113.6	E18 R28 A30 P45	E18-L43 HydrophobicContact CG-CD1 4.12Å; R28-L43 HydrophobicContact CB-CD1 3.86Å; R28-L43 PolarHBondContact O-N 3.41Å; A30-L43 HydrophobicContact CB-CD2 3.82Å; A30-L43 HydrophobicContact CB-CG 4.24Å; L43-P45 WeakPolarHBondContact O-CD 3.38Å
44	R	69.8	Low	69	Low	212 Å²	212	99.3 Å²	99.3	80%	0.8	50%	0.502	S	S	*	.	S	Bend	trans	-117.8	85.5	172.6	-65.1	-170.7	-173.4	-179.3	2.6	110.4	R42	R42-R44 PolarHBondContact NE-O 2.91Å; R42-R44 PolarHBondContact NH2-O 3.42Å; R42-R44 PolarHBondContact O-N 3.22Å
45	P	60	Low	68.8	Low	95 Å²	95	103.8 Å²	103.8	62%	0.617	53%	0.526	S	S	*	.			trans	-66.9	142.6	179.2	26.6	-31.7	0	0	0	110.6	L43	L43-P45 WeakPolarHBondContact O-CD 3.38Å
46	K	57.1	Low	68.9	Low	130 Å²	130	100.6 Å²	100.6	57%	0.565	50%	0.503	S	S	*	.			trans	-72.7	131.6	168.7	-163.6	178.2	-178.2	-173.7	0	106.8	E48 A49	K46-E48 PolarHBondContact O-N 3.19Å; K46-A49 HydrophobicContact CB-CB 4.38Å; K46-A49 PolarHBondContact O-N 2.88Å
47	P	53.1	Low	69.1	Low	136 Å²	136	95.9 Å²	95.9	88%	0.883	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-22.3	-169.7	16	-28.9	0	0	0	115.1
48	E	50.4	Low	68.7	Low	172 Å²	172	96.4 Å²	96.4	80%	0.804	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-4.6	-178.3	-63.6	176.3	152.6	0	0	114.7	K46	K46-E48 PolarHBondContact O-N 3.19Å
49	A	48.8	Very low	68.1	Low	62 Å²	62	100 Å²	100	51%	0.512	52%	0.517	S	S	.	.			trans	-95.5	108.7	-174.8	0	0	0	0	0	110.8	K46	K46-A49 HydrophobicContact CB-CB 4.38Å; K46-A49 PolarHBondContact O-N 2.88Å
50	R	44.6	Very low	67.6	Low	211 Å²	211	98.8 Å²	98.8	80%	0.796	51%	0.512	S	S	*	.			trans	-48.1	139.2	159.2	-80.6	-176.5	179.3	179.9	1	108.6	R52	R50-R52 PolarHBondContact O-N 2.61Å
51	P	51.2	Low	67.3	Low	133 Å²	133	98.4 Å²	98.4	86%	0.864	51%	0.51	S	S	*	.			trans	-64.4	86.6	175.3	25.4	-31.9	0	0	0	109.5
52	R	49.1	Very low	67	Low	227 Å²	227	92.8 Å²	92.8	86%	0.857	49%	0.485	S	S	*	.			trans	-88.8	115.5	175.4	-74.5	-175.3	174.8	178.8	1	108.1	R50	R50-R52 PolarHBondContact O-N 2.61Å
53	G	57.5	Low	66.9	Low	48 Å²	48	87.6 Å²	87.6	50%	0.495	47%	0.467	S	S	.	.	S	Bend	trans	86.6	24.1	162.8	0	0	0	0	0	117.1	R97	G53-R97 PolarHBondContact O-NH1 3.5Å; G53-R97 PolarHBondContact O-NH2 2.71Å
54	G	69.4	Low	67.4	Low	24 Å²	24	85.1 Å²	85.1	25%	0.247	46%	0.455	C	S	.	.			trans	-76.1	-25	174.4	0	0	0	0	0	114	H39 I40	H39-G54 CarbonylContact C-O 3.49Å; H39-G54 WeakPolarHBondContact CA-O 3.12Å; I40-G54 PolarHBondContact N-O 2.93Å; I40-G54 WeakPolarHBondContact O-CA 3.4Å
55	L	82	Confident	68.2	Low	99 Å²	99	76.8 Å²	76.8	52%	0.518	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	122.4	176.6	-169.4	73.4	0	0	0	110.1	A37 H39	A37-L55 HydrophobicContact CB-CD1 3.57Å; A37-L55 HydrophobicContact CB-CG 4.2Å; H39-L55 WeakPolarHBondContact CE1-CD1 3.21Å; H39-L55 VanDerWaalsContact NE2-CD1 3.31Å; H39-L55 WeakPolarHBondContact NE2-CD1 3.35Å
56	V	83.8	Confident	69.5	Low	1 Å²	1	74.4 Å²	74.4	1%	0.006	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	104.1	170.8	178.7	0	0	0	0	107.7	A37 L38 I40 V61 T83 R97	A37-V56 CarbonylContact C-O 3.59Å; A37-V56 WeakPolarHBondContact CA-O 3.49Å; L38-V56 HydrophobicContact CB-CB 4.44Å; L38-V56 PolarHBondContact N-O 2.84Å; L38-V56 PolarHBondContact O-N 3.17Å; I40-V56 HydrophobicContact CD1-CG2 3.71Å; V56-V61 HydrophobicContact CG1-CG2 3.77Å; V56-T83 HydrophobicContact CG1-CG2 3.73Å; V56-R97 VanDerWaalsContact CG2-CZ 3.49Å
57	P	82.2	Confident	71	Confident	46 Å²	46	71.9 Å²	71.9	30%	0.299	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	140.8	174.1	-20.4	31.8	0	0	0	110.6	A59 E60	P57-A59 PolarHBondContact O-N 3.37Å; P57-E60 HydrophobicContact CB-CG 4.32Å; P57-E60 HydrophobicContact CG-CG 4.33Å; P57-E60 WeakPolarHBondContact O-CB 3.32Å; P57-E60 PolarHBondContact O-N 2.78Å
58	L	79	Confident	72.7	Confident	19 Å²	19	72.3 Å²	72.3	10%	0.099	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-61.2	-26.8	176.9	-68.2	-178.9	0	0	0	112.2	L33 S35 Q36 E60 V61 L121 L124	L33-L58 HydrophobicContact CD1-CD2 4.29Å; S35-L58 WeakPolarHBondContact O-CD1 3.33Å; Q36-L58 PolarHBondContact O-N 3.12Å; L58-E60 PolarHBondContact O-N 2.65Å; L58-E60 VanDerWaalsContact O-N 3.14Å; L58-V61 HydrophobicContact CD2-CG2 4.34Å; L58-V61 WeakPolarHBondContact O-CB 3.4Å; L58-V61 PolarHBondContact O-N 2.74Å; L58-L121 HydrophobicContact CD2-CD1 3.41Å; L58-L121 VanDerWaalsContact CD2-CD1 3.41Å; L58-L124 HydrophobicContact CD1-CB 3.93Å; L58-L124 HydrophobicContact CD1-CD1 4.03Å
59	A	72.9	Confident	74.3	Confident	79 Å²	79	65.5 Å²	65.5	65%	0.653	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-64.2	-12.1	172.3	0	0	0	0	0	114.6	P57 R92	P57-A59 PolarHBondContact O-N 3.37Å; A59-R92 PolarHBondContact O-NH1 3.45Å
60	E	77.1	Confident	75.8	Confident	49 Å²	49	74.4 Å²	74.4	23%	0.229	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-99.3	-10.4	172.5	-60.2	-169.5	163.2	0	0	112.6	P57 L58 T83 Y84	P57-E60 HydrophobicContact CB-CG 4.32Å; P57-E60 HydrophobicContact CG-CG 4.33Å; P57-E60 WeakPolarHBondContact O-CB 3.32Å; P57-E60 PolarHBondContact O-N 2.78Å; L58-E60 PolarHBondContact O-N 2.65Å; L58-E60 VanDerWaalsContact O-N 3.14Å; E60-T83 CarbonylContact O-C 3.55Å; E60-T83 VanDerWaalsContact O-CA 3.26Å; E60-T83 WeakPolarHBondContact O-CA 3.41Å; E60-Y84 PolarHBondContact O-N 2.95Å
61	V	80.7	Confident	77.4	Confident	9 Å²	9	67.3 Å²	67.3	6%	0.055	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	123.6	-178.2	-179.2	0	0	0	0	109.2	V56 L58 I81 T83 L121 L125	V56-V61 HydrophobicContact CG1-CG2 3.77Å; L58-V61 HydrophobicContact CD2-CG2 4.34Å; L58-V61 WeakPolarHBondContact O-CB 3.4Å; L58-V61 PolarHBondContact O-N 2.74Å; V61-I81 HydrophobicContact CG1-CG2 3.76Å; V61-I81 HydrophobicContact CG2-CG2 4.37Å; V61-T83 HydrophobicContact CG2-CG2 4.23Å; V61-L121 HydrophobicContact CG1-CD1 4.39Å; V61-L121 HydrophobicContact CG1-CD2 4.1Å; V61-L121 HydrophobicContact CG1-CG 4.43Å; V61-L125 HydrophobicContact CB-CD2 4.12Å; V61-L125 HydrophobicContact CG1-CD1 3.94Å; V61-L125 HydrophobicContact CG1-CD2 4.25Å
62	S	77.5	Confident	78.6	Confident	14 Å²	14	66.3 Å²	66.3	10%	0.098	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	-37.4	173.8	-153.3	0	0	0	0	111.9	Y82 A175 F303	S62-Y82 PolarHBondContact N-O 3.25Å; S62-A175 WeakPolarHBondContact O-CA 3.47Å; S62-F303 VanDerWaalsContact CB-CZ 3.46Å; S62-F303 VanDerWaalsContact OG-CE1 3.22Å; S62-F303 WeakPolarHBondContact OG-CE1 3.11Å; S62-F303 WeakPolarHBondContact OG-CZ 3.46Å
63	G	82.1	Confident	80.1	Confident	3 Å²	3	61 Å²	61	3%	0.031	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.8	-174.5	-169.2	0	0	0	0	0	111.1	Y82 E174	G63-Y82 PolarHBondContact O-N 3.45Å; G63-E174 WeakPolarHBondContact CA-O 3.3Å
64	C	86.6	Confident	81.3	Confident	18 Å²	18	59.9 Å²	59.9	12%	0.122	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	160	-175.6	57.9	0	0	0	0	111.9	F79 C80 I81 A118 L121	C64-F79 HydrophobicContact CB-CE2 3.63Å; C64-F79 HydrophobicContact CB-CZ 4.06Å; C64-C80 CarbonylContact C-O 3.6Å; C64-C80 WeakPolarHBondContact CA-O 3.47Å; C64-C80 WeakPolarHBondContact CB-O 3.4Å; C64-I81 HydrophobicContact CB-CG1 4.47Å; C64-A118 PolarHBondContact SG-O 2.92Å; C64-L121 HydrophobicContact CB-CD2 3.78Å
65	C	86.5	Confident	82.1	Confident	38 Å²	38	61.1 Å²	61.1	26%	0.257	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	160	172.3	68	0	0	0	0	112.1	C80 Y82	C65-C80 PolarHBondContact N-O 3.28Å; C65-C80 WeakPolarHBondContact O-CB 3.2Å; C65-C80 PolarHBondContact O-N 3.07Å; C65-Y82 HydrophobicContact CB-CE2 4.44Å; C65-Y82 PolarHBondContact SG-OH 3.06Å
66	T	88.8	Confident	82.3	Confident	45 Å²	45	56.4 Å²	56.4	28%	0.276	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	139	170.4	59	0	0	0	0	110.2	Y78 A114 A118	T66-Y78 CarbonylContact C-O 3.59Å; T66-Y78 VanDerWaalsContact CA-O 3.28Å; T66-Y78 WeakPolarHBondContact CA-O 3.14Å; T66-A114 HydrophobicContact CG2-CB 3.96Å; T66-A114 WeakPolarHBondContact CG2-O 3.16Å; T66-A118 HydrophobicContact CG2-CB 4.06Å
67	L	88.1	Confident	82.7	Confident	77 Å²	77	56.4 Å²	56.4	40%	0.403	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	153.1	179.4	-55.8	170.6	0	0	0	110.1	Y78 C80	L67-Y78 PolarHBondContact N-O 3Å; L67-Y78 PolarHBondContact O-N 3.26Å; L67-C80 HydrophobicContact CD1-CB 3.9Å; L67-C80 HydrophobicContact CG-CB 4.36Å
68	R	88.4	Confident	83	Confident	144 Å²	144	54.8 Å²	54.8	54%	0.543	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	145.5	172.8	-171.3	177.4	-175	-179.4	0.4	109.8	Y107	R68-Y107 HydrophobicContact CB-CE2 4.31Å; R68-Y107 WeakPolarHBondContact CD-OH 3.3Å; R68-Y107 HydrophobicContact CG-CE2 3.66Å; R68-Y107 WeakPolarHBondContact CG-OH 3.49Å
69	S	83.9	Confident	83.6	Confident	30 Å²	30	54 Å²	54	21%	0.21	30%	0.301	C	S	.	.			trans	-57.9	150.4	170.3	-155.5	0	0	0	0	111.3	S71 D74	S69-S71 PolarHBondContact O-N 3.1Å; S69-D74 VanDerWaalsContact CB-OD2 3.24Å; S69-D74 WeakPolarHBondContact CB-OD2 3.4Å; S69-D74 PolarHBondContact OG-OD2 3.43Å; S69-D74 VanDerWaalsContact OG-OD2 3.09Å
70	R	80.4	Confident	84.4	Confident	248 Å²	248	50.3 Å²	50.3	94%	0.936	27%	0.271	S	S	*	.	S	Bend	trans	-70.9	-21.7	169.5	-66.9	-175.2	-179.4	-175.2	-0.7	112	P72	R70-P72 WeakPolarHBondContact O-CD 3.45Å
71	S	79.4	Confident	85	Confident	63 Å²	63	48 Å²	48	44%	0.441	26%	0.26	S	S	.	.	S	Bend	trans	-85.5	117.2	177.8	-60	0	0	0	0	109.6	S69 S73 D74	S69-S71 PolarHBondContact O-N 3.1Å; S71-S73 PolarHBondContact O-N 2.87Å; S71-D74 PolarHBondContact O-N 3.44Å; S71-D74 VanDerWaalsContact O-N 3.16Å
72	P	75.5	Confident	85.3	Confident	112 Å²	112	49 Å²	49	73%	0.727	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-15.2	-178.7	26.4	-33.4	0	0	0	113.5	R70	R70-P72 WeakPolarHBondContact O-CD 3.45Å
73	S	80.1	Confident	85.5	Confident	114 Å²	114	48.5 Å²	48.5	80%	0.797	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-9.4	175.2	53.2	0	0	0	0	114.4	S71 S75	S71-S73 PolarHBondContact O-N 2.87Å; S73-S75 PolarHBondContact O-N 3.45Å
74	D	82.8	Confident	85.3	Confident	25 Å²	25	48.4 Å²	48.4	13%	0.134	26%	0.258	C	S	.	.			trans	-81.5	112.5	176.9	-166.8	9	0	0	0	108.9	S69 S71 A76 Y78 R100	S69-D74 VanDerWaalsContact CB-OD2 3.24Å; S69-D74 WeakPolarHBondContact CB-OD2 3.4Å; S69-D74 PolarHBondContact OG-OD2 3.43Å; S69-D74 VanDerWaalsContact OG-OD2 3.09Å; S71-D74 PolarHBondContact O-N 3.44Å; S71-D74 VanDerWaalsContact O-N 3.16Å; D74-A76 PolarHBondContact O-N 3.16Å; D74-A76 VanDerWaalsContact OD1-CB 3.23Å; D74-A76 WeakPolarHBondContact OD1-CB 3.34Å; D74-A76 PolarHBondContact OD1-N 3.18Å; D74-Y78 PolarHBondContact OD2-OH 3.29Å; D74-R100 IonicContact OD1-CZ 3.67Å; D74-R100 IonicContact OD1-NH2 2.68Å; D74-R100 PolarHBondContact OD1-NH2 3.13Å
75	S	86	Confident	84.9	Confident	50 Å²	50	49.6 Å²	49.6	35%	0.35	27%	0.265	S	S	.	.			trans	-74.3	-5	173.1	57.7	0	0	0	0	112.5	S73 A105 Y107 N110	S73-S75 PolarHBondContact O-N 3.45Å; S75-A105 WeakPolarHBondContact CB-O 2.97Å; S75-Y107 VanDerWaalsContact O-CA 3.23Å; S75-Y107 WeakPolarHBondContact O-CA 3.48Å; S75-N110 PolarHBondContact O-ND2 2.99Å
76	A	87.6	Confident	84.1	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.275	C	S	.	.			trans	-78.7	142.9	179.5	0	0	0	0	0	112.8	D74 Y78 R100 A101 D102	D74-A76 PolarHBondContact O-N 3.16Å; D74-A76 VanDerWaalsContact OD1-CB 3.23Å; D74-A76 WeakPolarHBondContact OD1-CB 3.34Å; D74-A76 PolarHBondContact OD1-N 3.18Å; A76-Y78 HydrophobicContact CB-CE2 4.49Å; A76-R100 HydrophobicContact CB-CG 3.71Å; A76-A101 VanDerWaalsContact CA-O 3.28Å; A76-A101 WeakPolarHBondContact CA-O 3.33Å; A76-A101 WeakPolarHBondContact CB-O 3.11Å; A76-D102 HydrophobicContact CB-CB 4.32Å
77	A	90.3	Very high	83	Confident	1 Å²	1	53 Å²	53	1%	0.008	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	158.4	163.9	0	0	0	0	0	109.7	A101 Y107 N110 R111 A114	A77-A101 HydrophobicContact CB-CB 4.38Å; A77-A101 PolarHBondContact N-O 3.21Å; A77-A101 PolarHBondContact O-N 3.14Å; A77-Y107 HydrophobicContact CB-CE2 4.14Å; A77-N110 HydrophobicContact CB-CB 4.06Å; A77-N110 WeakPolarHBondContact CB-O 3.5Å; A77-R111 HydrophobicContact CB-CB 4.21Å; A77-A114 HydrophobicContact CB-CB 4.07Å
78	Y	90.4	Very high	81.6	Confident	13 Å²	13	62 Å²	62	5%	0.051	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	131.9	-179.2	-62.5	-87.5	0	0	0	110	Y22 T66 L67 D74 A76 T98 F99 R100	Y22-Y78 AromaticContact CD2-CD1 3.91Å; Y22-Y78 HydrophobicContact CD2-CD1 3.91Å; Y22-Y78 AromaticContact CD2-CE1 3.48Å; Y22-Y78 HydrophobicContact CD2-CE1 3.48Å; Y22-Y78 VanDerWaalsContact CD2-CE1 3.48Å; Y22-Y78 HydrophobicContact CE2-CE1 4.14Å; Y22-Y78 HydrophobicContact CG-CE1 4.41Å; T66-Y78 CarbonylContact C-O 3.59Å; T66-Y78 VanDerWaalsContact CA-O 3.28Å; T66-Y78 WeakPolarHBondContact CA-O 3.14Å; L67-Y78 PolarHBondContact N-O 3Å; L67-Y78 PolarHBondContact O-N 3.26Å; D74-Y78 PolarHBondContact OD2-OH 3.29Å; A76-Y78 HydrophobicContact CB-CE2 4.49Å; Y78-T98 HydrophobicContact CD1-CG2 4.18Å; Y78-F99 CarbonylContact C-O 3.51Å; Y78-F99 VanDerWaalsContact CA-O 3.3Å; Y78-F99 WeakPolarHBondContact CA-O 3.24Å; Y78-R100 HydrophobicContact CD1-CB 4.03Å; Y78-R100 HydrophobicContact CD1-CG 4.14Å; Y78-R100 HydrophobicContact CE1-CB 3.85Å; Y78-R100 HydrophobicContact CE1-CG 3.61Å
79	F	91	Very high	80.2	Confident	1 Å²	1	66.8 Å²	66.8	0%	0.004	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	119.8	173.7	174	-126.4	0	0	0	109.1	C64 I81 T98 F99 A114 W117 A118 L121	C64-F79 HydrophobicContact CB-CE2 3.63Å; C64-F79 HydrophobicContact CB-CZ 4.06Å; F79-I81 HydrophobicContact CD1-CD1 4.25Å; F79-I81 HydrophobicContact CD1-CG1 4.19Å; F79-I81 HydrophobicContact CE1-CD1 3.43Å; F79-I81 VanDerWaalsContact CE1-CD1 3.43Å; F79-I81 HydrophobicContact CE1-CG1 3.59Å; F79-I81 HydrophobicContact CE2-CG1 4.31Å; F79-I81 HydrophobicContact CZ-CD1 3.81Å; F79-I81 HydrophobicContact CZ-CG1 3.65Å; F79-T98 WeakPolarHBondContact O-CA 2.88Å; F79-F99 HydrophobicContact CB-CB 4.47Å; F79-F99 HydrophobicContact CD1-CD2 4.07Å; F79-F99 PolarHBondContact N-O 3.26Å; F79-F99 PolarHBondContact O-N 3.22Å; F79-A114 HydrophobicContact CB-CB 4.21Å; F79-W117 HydrophobicContact CD1-CB 4.11Å; F79-W117 HydrophobicContact CD2-CB 4.37Å; F79-W117 HydrophobicContact CE1-CB 3.91Å; F79-W117 HydrophobicContact CE1-CE3 4.21Å; F79-W117 HydrophobicContact CE2-CB 4.23Å; F79-W117 HydrophobicContact CG-CB 4.32Å; F79-W117 HydrophobicContact CZ-CB 3.99Å; F79-A118 HydrophobicContact CD2-CB 4.19Å; F79-A118 HydrophobicContact CE2-CB 3.83Å; F79-L121 HydrophobicContact CZ-CD2 3.9Å
80	C	90.4	Very high	79	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.014	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131.2	-173.8	-171.9	0	0	0	0	110.4	C64 C65 L67 T96 R97	C64-C80 CarbonylContact C-O 3.6Å; C64-C80 WeakPolarHBondContact CA-O 3.47Å; C64-C80 WeakPolarHBondContact CB-O 3.4Å; C65-C80 PolarHBondContact N-O 3.28Å; C65-C80 WeakPolarHBondContact O-CB 3.2Å; C65-C80 PolarHBondContact O-N 3.07Å; L67-C80 HydrophobicContact CD1-CB 3.9Å; L67-C80 HydrophobicContact CG-CB 4.36Å; C80-T96 WeakPolarHBondContact SG-CG2 3.46Å; C80-R97 WeakPolarHBondContact CA-O 3.4Å
81	I	89.5	Confident	78	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.01	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	130.3	178.9	-48.6	-178.8	0	0	0	109.3	L38 V61 C64 F79 T83 R97 F99 L121	L38-I81 HydrophobicContact CD2-CD1 3.19Å; V61-I81 HydrophobicContact CG1-CG2 3.76Å; V61-I81 HydrophobicContact CG2-CG2 4.37Å; C64-I81 HydrophobicContact CB-CG1 4.47Å; F79-I81 HydrophobicContact CD1-CD1 4.25Å; F79-I81 HydrophobicContact CD1-CG1 4.19Å; F79-I81 HydrophobicContact CE1-CD1 3.43Å; F79-I81 VanDerWaalsContact CE1-CD1 3.43Å; F79-I81 HydrophobicContact CE1-CG1 3.59Å; F79-I81 HydrophobicContact CE2-CG1 4.31Å; F79-I81 HydrophobicContact CZ-CD1 3.81Å; F79-I81 HydrophobicContact CZ-CG1 3.65Å; I81-T83 HydrophobicContact CG2-CG2 3.98Å; I81-R97 PolarHBondContact N-O 3.37Å; I81-R97 PolarHBondContact O-N 3.13Å; I81-F99 HydrophobicContact CD1-CD2 4.16Å; I81-F99 HydrophobicContact CD1-CE2 3.67Å; I81-F99 HydrophobicContact CG1-CD2 4.35Å; I81-F99 HydrophobicContact CG1-CE2 4.1Å; I81-L121 HydrophobicContact CD1-CD2 4.13Å; I81-L121 HydrophobicContact CG1-CD2 4.23Å; I81-L121 HydrophobicContact CG2-CD2 4.03Å
82	Y	85.1	Confident	77.5	Confident	30 Å²	30	54.3 Å²	54.3	12%	0.118	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	119	176.1	-56.8	-71.6	0	0	0	109.4	S62 G63 C65 T96 E174	S62-Y82 PolarHBondContact N-O 3.25Å; G63-Y82 PolarHBondContact O-N 3.45Å; C65-Y82 HydrophobicContact CB-CE2 4.44Å; C65-Y82 PolarHBondContact SG-OH 3.06Å; Y82-T96 HydrophobicContact CD1-CG2 4.2Å; Y82-T96 HydrophobicContact CE1-CG2 4.01Å; Y82-E174 HydrophobicContact CD1-CG 3.77Å; Y82-E174 HydrophobicContact CD2-CB 3.71Å; Y82-E174 HydrophobicContact CD2-CG 3.67Å; Y82-E174 HydrophobicContact CE1-CG 3.98Å; Y82-E174 HydrophobicContact CE2-CB 4.23Å; Y82-E174 HydrophobicContact CE2-CG 3.87Å; Y82-E174 HydrophobicContact CG-CB 3.88Å; Y82-E174 HydrophobicContact CG-CG 3.62Å
83	T	83.2	Confident	77.3	Confident	2 Å²	2	58 Å²	58	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	149.8	-177.6	61.2	0	0	0	0	110.8	V56 E60 V61 I81 P85 A95	V56-T83 HydrophobicContact CG1-CG2 3.73Å; E60-T83 CarbonylContact O-C 3.55Å; E60-T83 VanDerWaalsContact O-CA 3.26Å; E60-T83 WeakPolarHBondContact O-CA 3.41Å; V61-T83 HydrophobicContact CG2-CG2 4.23Å; I81-T83 HydrophobicContact CG2-CG2 3.98Å; T83-P85 VanDerWaalsContact C-CD 3.44Å; T83-A95 PolarHBondContact N-O 3.39Å; T83-A95 PolarHBondContact O-N 3.18Å; T83-A95 VanDerWaalsContact O-O 3.08Å; T83-A95 WeakPolarHBondContact OG1-CB 3.27Å; T83-A95 PolarHBondContact OG1-O 2.93Å
84	Y	77.8	Confident	77.4	Confident	1 Å²	1	58.3 Å²	58.3	0%	0.004	26%	0.264	C	S	.	.			trans	-133.8	67.3	-178	-74.2	-99	0	0	0	110	E60 R92 R93 R94 M171 E174 F303 R307	E60-Y84 PolarHBondContact O-N 2.95Å; Y84-R92 WeakPolarHBondContact O-CD 3.48Å; Y84-R92 PolarHBondContact O-NH1 2.85Å; Y84-R93 WeakPolarHBondContact CA-O 3.37Å; Y84-R94 HydrophobicContact CD1-CB 4.22Å; Y84-R94 HydrophobicContact CE1-CB 3.5Å; Y84-R94 HydrophobicContact CE1-CG 4.02Å; Y84-R94 HydrophobicContact CE2-CG 4.27Å; Y84-M171 HydrophobicContact CE1-SD 4.33Å; Y84-M171 WeakPolarHBondContact OH-CG 3.31Å; Y84-E174 WeakPolarHBondContact CE2-OE2 3.49Å; Y84-E174 PolarHBondContact OH-OE2 3.4Å; Y84-F303 HydrophobicContact CD1-CE1 4.15Å; Y84-F303 HydrophobicContact CD1-CZ 4.19Å; Y84-F303 AromaticContact CD2-CE1 3.43Å; Y84-F303 HydrophobicContact CD2-CE1 3.43Å; Y84-F303 VanDerWaalsContact CD2-CE1 3.43Å; Y84-F303 HydrophobicContact CD2-CE2 4.05Å; Y84-F303 AromaticContact CD2-CZ 3Å; Y84-F303 HydrophobicContact CD2-CZ 3Å; Y84-F303 HydrophobicContact CE1-CE1 4.47Å; Y84-F303 AromaticContact CE2-CE1 3.73Å; Y84-F303 HydrophobicContact CE2-CE1 3.73Å; Y84-F303 AromaticContact CE2-CZ 3.74Å; Y84-F303 HydrophobicContact CE2-CZ 3.74Å; Y84-F303 AromaticContact CG-CE1 3.58Å; Y84-F303 HydrophobicContact CG-CE1 3.58Å; Y84-F303 AromaticContact CG-CE2 3.97Å; Y84-F303 HydrophobicContact CG-CE2 3.97Å; Y84-F303 AromaticContact CG-CZ 3.21Å; Y84-F303 HydrophobicContact CG-CZ 3.21Å; Y84-R307 VanDerWaalsContact CE1-CZ 3.45Å; Y84-R307 PolarHBondContact OH-NH1 2.94Å; Y84-R307 VanDerWaalsContact OH-NH1 3.15Å
85	P	77.6	Confident	77.3	Confident	43 Å²	43	58.7 Å²	58.7	28%	0.279	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-60.9	142.7	178.2	25.7	-36.4	0	0	0	111.1	T83 G87 R92 R93 A95	T83-P85 VanDerWaalsContact C-CD 3.44Å; P85-G87 PolarHBondContact O-N 3.43Å; P85-R92 WeakPolarHBondContact O-CA 3.06Å; P85-R93 VanDerWaalsContact CD-O 3.32Å; P85-R93 WeakPolarHBondContact CD-O 3.41Å; P85-R93 PolarHBondContact O-N 2.97Å; P85-A95 HydrophobicContact CG-CB 4.31Å
86	R	69.3	Low	77.3	Confident	123 Å²	123	59.2 Å²	59.2	46%	0.464	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-71.9	120.8	171.9	-82	-176.5	158.8	130.9	-5.6	110	R92 D306	R86-R92 HydrophobicContact CG-CG 3.73Å; R86-D306 IonicContact CZ-OD1 3.71Å; R86-D306 IonicContact CZ-OD2 3.88Å; R86-D306 VanDerWaalsContact CZ-OD2 3.25Å; R86-D306 IonicContact NE-OD2 3.53Å; R86-D306 IonicContact NH1-OD2 3.17Å; R86-D306 IonicContact NH2-OD1 3.65Å; R86-D306 PolarHBondContact NH2-OD1 3.42Å; R86-D306 IonicContact NH2-OD2 3.29Å; R86-D306 PolarHBondContact NH2-OD2 3.01Å
87	G	66.5	Low	77.3	Confident	33 Å²	33	63 Å²	63	34%	0.34	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-78	168.6	173.6	0	0	0	0	0	112.6	P85 R89 G90 A91	P85-G87 PolarHBondContact O-N 3.43Å; G87-R89 PolarHBondContact O-N 2.99Å; G87-G90 PolarHBondContact O-N 3.48Å; G87-A91 WeakPolarHBondContact CA-O 3.27Å; G87-A91 PolarHBondContact N-O 3.09Å
88	R	59.3	Low	77.2	Confident	264 Å²	264	64.6 Å²	64.6	100%	0.996	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-19.5	-177.5	-67.6	-173.5	-177.7	-175.2	0.2	115.5
89	R	58	Low	77.2	Confident	245 Å²	245	64.2 Å²	64.2	93%	0.925	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	23.4	179.7	-62.9	-175	-179.6	175.8	-0.3	112.5	G87 A91	G87-R89 PolarHBondContact O-N 2.99Å; R89-A91 PolarHBondContact O-N 3Å
90	G	59.7	Low	77.2	Confident	47 Å²	47	66.3 Å²	66.3	49%	0.485	30%	0.302	S	S	.	.	S	Bend	trans	75.9	-14.5	-174.7	0	0	0	0	0	114.6	G87 R92	G87-G90 PolarHBondContact O-N 3.48Å; G90-R92 PolarHBondContact O-N 3.4Å
91	A	58.5	Low	77.1	Confident	13 Å²	13	66.4 Å²	66.4	11%	0.107	30%	0.303	C	S	.	.			trans	-72.9	122.9	-176.1	0	0	0	0	0	114.4	G87 R89 G310	G87-A91 WeakPolarHBondContact CA-O 3.27Å; G87-A91 PolarHBondContact N-O 3.09Å; R89-A91 PolarHBondContact O-N 3Å; A91-G310 VanDerWaalsContact CA-CA 3.5Å; A91-G310 VanDerWaalsContact CB-C 3.5Å; A91-G310 WeakPolarHBondContact CB-O 3.3Å
92	R	69.3	Low	77	Confident	19 Å²	19	68.5 Å²	68.5	7%	0.072	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-76.6	135	169.5	-68.7	-172.5	-175	-123.4	14.6	111.6	A59 Y84 P85 R86 G90 D306	A59-R92 PolarHBondContact O-NH1 3.45Å; Y84-R92 WeakPolarHBondContact O-CD 3.48Å; Y84-R92 PolarHBondContact O-NH1 2.85Å; P85-R92 WeakPolarHBondContact O-CA 3.06Å; R86-R92 HydrophobicContact CG-CG 3.73Å; G90-R92 PolarHBondContact O-N 3.4Å; R92-D306 HydrophobicContact CG-CB 4.14Å; R92-D306 IonicContact CZ-OD2 2.78Å; R92-D306 VanDerWaalsContact CZ-OD2 3.28Å; R92-D306 IonicContact NE-OD2 2.87Å; R92-D306 PolarHBondContact NE-OD2 2.77Å; R92-D306 IonicContact NH2-OD2 3.1Å; R92-D306 PolarHBondContact NH2-OD2 2.78Å
93	R	71.6	Confident	77	Confident	191 Å²	191	70.6 Å²	70.6	72%	0.721	35%	0.345	S	S	*	.			trans	-123.4	134.6	177.7	-68	-174	175.3	-156.8	-2.7	110.4	Y84 P85 A95	Y84-R93 WeakPolarHBondContact CA-O 3.37Å; P85-R93 VanDerWaalsContact CD-O 3.32Å; P85-R93 WeakPolarHBondContact CD-O 3.41Å; P85-R93 PolarHBondContact O-N 2.97Å; R93-A95 PolarHBondContact O-N 3.25Å
94	R	80.6	Confident	77.2	Confident	119 Å²	119	71.6 Å²	71.6	45%	0.449	35%	0.353	S	S	.	.			trans	-59.5	125.4	173.6	-175.5	-179.7	-178.4	-105.6	6.8	109.7	Y84 E174	Y84-R94 HydrophobicContact CD1-CB 4.22Å; Y84-R94 HydrophobicContact CE1-CB 3.5Å; Y84-R94 HydrophobicContact CE1-CG 4.02Å; Y84-R94 HydrophobicContact CE2-CG 4.27Å; R94-E174 IonicContact CZ-OE1 2.84Å; R94-E174 IonicContact NE-OE1 3.13Å; R94-E174 PolarHBondContact NE-OE1 3.12Å; R94-E174 IonicContact NE-OE2 3.89Å; R94-E174 IonicContact NH2-OE1 3.37Å; R94-E174 PolarHBondContact NH2-OE1 3.38Å
95	A	82.6	Confident	77.6	Confident	33 Å²	33	75.9 Å²	75.9	27%	0.273	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	127.2	171.7	0	0	0	0	0	108.6	T83 P85 R93	T83-A95 PolarHBondContact N-O 3.39Å; T83-A95 PolarHBondContact O-N 3.18Å; T83-A95 VanDerWaalsContact O-O 3.08Å; T83-A95 WeakPolarHBondContact OG1-CB 3.27Å; T83-A95 PolarHBondContact OG1-O 2.93Å; P85-A95 HydrophobicContact CG-CB 4.31Å; R93-A95 PolarHBondContact O-N 3.25Å
96	T	85.8	Confident	78.2	Confident	61 Å²	61	76.5 Å²	76.5	37%	0.374	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	129.2	179.3	-56.3	0	0	0	0	108.7	C80 Y82	C80-T96 WeakPolarHBondContact SG-CG2 3.46Å; Y82-T96 HydrophobicContact CD1-CG2 4.2Å; Y82-T96 HydrophobicContact CE1-CG2 4.01Å
97	R	86.1	Confident	79.2	Confident	80 Å²	80	72.7 Å²	72.7	30%	0.302	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	122.4	173	-60.7	-171.6	-171.9	-158.7	3.8	108.4	G53 V56 C80 I81 F99	G53-R97 PolarHBondContact O-NH1 3.5Å; G53-R97 PolarHBondContact O-NH2 2.71Å; V56-R97 VanDerWaalsContact CG2-CZ 3.49Å; C80-R97 WeakPolarHBondContact CA-O 3.4Å; I81-R97 PolarHBondContact N-O 3.37Å; I81-R97 PolarHBondContact O-N 3.13Å; R97-F99 HydrophobicContact CB-CE2 3.88Å; R97-F99 HydrophobicContact CB-CZ 3.94Å
98	T	89.1	Confident	80.3	Confident	34 Å²	34	78.5 Å²	78.5	21%	0.209	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	128	-179.1	-53	0	0	0	0	109.9	Y22 Y78 F79	Y22-T98 HydrophobicContact CG-CG2 4.24Å; Y22-T98 PolarHBondContact N-O 3.4Å; Y78-T98 HydrophobicContact CD1-CG2 4.18Å; F79-T98 WeakPolarHBondContact O-CA 2.88Å
99	F	89.7	Confident	81.7	Confident	6 Å²	6	71.1 Å²	71.1	3%	0.026	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	137.4	-177.5	-59.2	-73.3	0	0	0	108.8	F19 F29 L31 I40 Y78 F79 I81 R97	F19-F99 HydrophobicContact CB-CB 3.8Å; F19-F99 HydrophobicContact CB-CD1 4.38Å; F19-F99 HydrophobicContact CB-CG 4.48Å; F19-F99 HydrophobicContact CD1-CB 3.98Å; F19-F99 HydrophobicContact CG-CB 3.99Å; F29-F99 HydrophobicContact CB-CE1 4.5Å; F29-F99 HydrophobicContact CD2-CD1 4.27Å; F29-F99 HydrophobicContact CD2-CE1 4.27Å; F29-F99 HydrophobicContact CG-CE1 4.43Å; L31-F99 HydrophobicContact CD1-CB 4.35Å; L31-F99 HydrophobicContact CD1-CD1 3.98Å; L31-F99 HydrophobicContact CD1-CD2 3.94Å; L31-F99 HydrophobicContact CD1-CE1 4.26Å; L31-F99 HydrophobicContact CD1-CE2 4.22Å; L31-F99 HydrophobicContact CD1-CG 3.81Å; L31-F99 HydrophobicContact CD1-CZ 4.37Å; L31-F99 HydrophobicContact CD2-CD1 4.1Å; L31-F99 HydrophobicContact CD2-CE1 3.7Å; L31-F99 HydrophobicContact CD2-CZ 3.94Å; L31-F99 HydrophobicContact CG-CD1 4.44Å; L31-F99 HydrophobicContact CG-CE1 4.5Å; I40-F99 HydrophobicContact CD1-CZ 3.79Å; I40-F99 HydrophobicContact CG1-CZ 4.04Å; I40-F99 HydrophobicContact CG2-CE1 4.06Å; I40-F99 HydrophobicContact CG2-CZ 4.29Å; Y78-F99 CarbonylContact C-O 3.51Å; Y78-F99 VanDerWaalsContact CA-O 3.3Å; Y78-F99 WeakPolarHBondContact CA-O 3.24Å; F79-F99 HydrophobicContact CB-CB 4.47Å; F79-F99 HydrophobicContact CD1-CD2 4.07Å; F79-F99 PolarHBondContact N-O 3.26Å; F79-F99 PolarHBondContact O-N 3.22Å; I81-F99 HydrophobicContact CD1-CD2 4.16Å; I81-F99 HydrophobicContact CD1-CE2 3.67Å; I81-F99 HydrophobicContact CG1-CD2 4.35Å; I81-F99 HydrophobicContact CG1-CE2 4.1Å; R97-F99 HydrophobicContact CB-CE2 3.88Å; R97-F99 HydrophobicContact CB-CZ 3.94Å
100	R	90.7	Very high	83.3	Confident	45 Å²	45	59.7 Å²	59.7	17%	0.17	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	117.4	-179.8	-174.8	-177.5	-169.5	-146.4	0.9	109	F19 G20 D74 A76 Y78 D102	F19-R100 CarbonylContact C-O 3.54Å; F19-R100 WeakPolarHBondContact CA-O 3.44Å; G20-R100 PolarHBondContact N-O 3.46Å; G20-R100 PolarHBondContact O-N 2.8Å; D74-R100 IonicContact OD1-CZ 3.67Å; D74-R100 IonicContact OD1-NH2 2.68Å; D74-R100 PolarHBondContact OD1-NH2 3.13Å; A76-R100 HydrophobicContact CB-CG 3.71Å; Y78-R100 HydrophobicContact CD1-CB 4.03Å; Y78-R100 HydrophobicContact CD1-CG 4.14Å; Y78-R100 HydrophobicContact CE1-CB 3.85Å; Y78-R100 HydrophobicContact CE1-CG 3.61Å; R100-D102 HydrophobicContact CG-CB 4.32Å; R100-D102 IonicContact NH1-OD2 2.86Å
101	A	88.9	Confident	84.7	Confident	4 Å²	4	63.8 Å²	63.8	3%	0.033	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	107.3	168.7	0	0	0	0	0	108.3	F19 A76 A77 N110 A114	F19-A101 HydrophobicContact CD1-CB 4.15Å; F19-A101 HydrophobicContact CE1-CB 3.97Å; A76-A101 VanDerWaalsContact CA-O 3.28Å; A76-A101 WeakPolarHBondContact CA-O 3.33Å; A76-A101 WeakPolarHBondContact CB-O 3.11Å; A77-A101 HydrophobicContact CB-CB 4.38Å; A77-A101 PolarHBondContact N-O 3.21Å; A77-A101 PolarHBondContact O-N 3.14Å; A101-N110 HydrophobicContact CB-CB 4.31Å; A101-N110 WeakPolarHBondContact O-CB 3.42Å; A101-A114 HydrophobicContact CB-CB 4.44Å
102	D	87.9	Confident	86.2	Confident	45 Å²	45	66 Å²	66	24%	0.241	35%	0.35	C	S	.	.			trans	-134.1	22.8	-179.1	64.8	-3.4	0	0	0	112.2	R28 A76 R100 A104	R28-D102 IonicContact CZ-OD1 3.8Å; R28-D102 VanDerWaalsContact CZ-OD1 3.29Å; R28-D102 IonicContact NH1-OD1 3.94Å; R28-D102 PolarHBondContact NH1-OD1 2.95Å; R28-D102 IonicContact NH1-OD2 3.87Å; R28-D102 PolarHBondContact NH1-OD2 3.37Å; R28-D102 VanDerWaalsContact NH1-OD2 3.1Å; R28-D102 IonicContact NH2-OD1 2.91Å; R28-D102 PolarHBondContact NH2-OD1 2.89Å; A76-D102 HydrophobicContact CB-CB 4.32Å; R100-D102 HydrophobicContact CG-CB 4.32Å; R100-D102 IonicContact NH1-OD2 2.86Å; D102-A104 VanDerWaalsContact C-N 3.35Å
103	G	83.9	Confident	87.2	Confident	74 Å²	74	68 Å²	68	76%	0.763	36%	0.36	S	S	*	.	S	Bend	trans	-74.8	-24	-178.1	0	0	0	0	0	113.7	N110	G103-N110 PolarHBondContact N-OD1 3.2Å; G103-N110 VanDerWaalsContact N-OD1 3.14Å
104	A	88.3	Confident	88.1	Confident	23 Å²	23	58.9 Å²	58.9	19%	0.19	33%	0.326	C	S	.	.	S	Bend	trans	-108.5	158.8	-178	0	0	0	0	0	113	D102 E109 N110	D102-A104 VanDerWaalsContact C-N 3.35Å; A104-E109 HydrophobicContact CB-CB 3.41Å; A104-E109 VanDerWaalsContact CB-CB 3.41Å; A104-E109 HydrophobicContact CB-CG 4.38Å; A104-E109 WeakPolarHBondContact CB-OE2 3.09Å; A104-N110 WeakPolarHBondContact CB-OD1 3.4Å; A104-N110 PolarHBondContact N-OD1 2.91Å; A104-N110 PolarHBondContact O-ND2 3.43Å
105	A	86.4	Confident	88.6	Confident	91 Å²	91	56.1 Å²	56.1	75%	0.752	32%	0.318	S	S	*	.	S	Bend	trans	-71.8	-31.9	177.3	0	0	0	0	0	112.5	S75	S75-A105 WeakPolarHBondContact CB-O 2.97Å
106	T	90.5	Very high	89	Confident	57 Å²	57	59.1 Å²	59.1	35%	0.35	32%	0.322	S	S	.	.	S	Bend	trans	-102.1	151	-175.6	69.7	0	0	0	0	112.1	E108 E109 N110	T106-E108 VanDerWaalsContact C-N 3.29Å; T106-E108 PolarHBondContact O-N 3.2Å; T106-E109 WeakPolarHBondContact OG1-CB 3.26Å; T106-E109 VanDerWaalsContact OG1-CG 3.3Å; T106-E109 WeakPolarHBondContact OG1-CG 3.42Å; T106-E109 PolarHBondContact OG1-N 3.35Å; T106-E109 PolarHBondContact OG1-OE1 3.29Å; T106-N110 PolarHBondContact O-N 2.99Å; T106-N110 PolarHBondContact O-ND2 2.97Å; T106-N110 VanDerWaalsContact O-ND2 3.14Å
107	Y	89.4	Confident	89.2	Confident	43 Å²	43	56.3 Å²	56.3	17%	0.169	30%	0.304	C	S	.	.	H	α-helix	trans	-64.7	-34.1	174	170.7	-103.4	0	0	0	112.7	R68 S75 A77 N110 R111	R68-Y107 HydrophobicContact CB-CE2 4.31Å; R68-Y107 WeakPolarHBondContact CD-OH 3.3Å; R68-Y107 HydrophobicContact CG-CE2 3.66Å; R68-Y107 WeakPolarHBondContact CG-OH 3.49Å; S75-Y107 VanDerWaalsContact O-CA 3.23Å; S75-Y107 WeakPolarHBondContact O-CA 3.48Å; A77-Y107 HydrophobicContact CB-CE2 4.14Å; Y107-N110 PolarHBondContact O-N 3.12Å; Y107-R111 HydrophobicContact CE1-CB 4.3Å; Y107-R111 HydrophobicContact CE2-CB 4.46Å; Y107-R111 WeakPolarHBondContact O-CB 3.25Å; Y107-R111 PolarHBondContact O-N 3.04Å
108	E	89.4	Confident	89.4	Confident	154 Å²	154	52.9 Å²	52.9	72%	0.72	29%	0.293	S	S	*	.	H	α-helix	trans	-67.6	-42.7	-175.9	-64.2	-175.5	167.1	0	0	111.7	T106 R111 A112	T106-E108 VanDerWaalsContact C-N 3.29Å; T106-E108 PolarHBondContact O-N 3.2Å; E108-R111 PolarHBondContact O-N 3.37Å; E108-A112 WeakPolarHBondContact O-CB 3.45Å; E108-A112 PolarHBondContact O-N 2.53Å
109	E	89.4	Confident	89.4	Confident	110 Å²	110	51.3 Å²	51.3	51%	0.514	28%	0.284	S	S	.	.	H	α-helix	trans	-65.9	-44.7	174.6	-72.4	162.6	-126.8	0	0	111.7	A104 T106 R111 A112 E113	A104-E109 HydrophobicContact CB-CB 3.41Å; A104-E109 VanDerWaalsContact CB-CB 3.41Å; A104-E109 HydrophobicContact CB-CG 4.38Å; A104-E109 WeakPolarHBondContact CB-OE2 3.09Å; T106-E109 WeakPolarHBondContact OG1-CB 3.26Å; T106-E109 VanDerWaalsContact OG1-CG 3.3Å; T106-E109 WeakPolarHBondContact OG1-CG 3.42Å; T106-E109 PolarHBondContact OG1-N 3.35Å; T106-E109 PolarHBondContact OG1-OE1 3.29Å; E109-R111 VanDerWaalsContact C-N 3.27Å; E109-R111 PolarHBondContact O-N 2.96Å; E109-A112 WeakPolarHBondContact O-CB 3.37Å; E109-A112 PolarHBondContact O-N 3.43Å; E109-E113 PolarHBondContact O-N 3.09Å
110	N	90.6	Very high	89.3	Confident	5 Å²	5	51 Å²	51	3%	0.027	28%	0.282	C	S	.	.	H	α-helix	trans	-62	-37.4	175.7	-74.9	-39.8	0	0	0	111.7	S75 A77 A101 G103 A104 T106 Y107 A114	S75-N110 PolarHBondContact O-ND2 2.99Å; A77-N110 HydrophobicContact CB-CB 4.06Å; A77-N110 WeakPolarHBondContact CB-O 3.5Å; A101-N110 HydrophobicContact CB-CB 4.31Å; A101-N110 WeakPolarHBondContact O-CB 3.42Å; G103-N110 PolarHBondContact N-OD1 3.2Å; G103-N110 VanDerWaalsContact N-OD1 3.14Å; A104-N110 WeakPolarHBondContact CB-OD1 3.4Å; A104-N110 PolarHBondContact N-OD1 2.91Å; A104-N110 PolarHBondContact O-ND2 3.43Å; T106-N110 PolarHBondContact O-N 2.99Å; T106-N110 PolarHBondContact O-ND2 2.97Å; T106-N110 VanDerWaalsContact O-ND2 3.14Å; Y107-N110 PolarHBondContact O-N 3.12Å; N110-A114 PolarHBondContact O-N 3.32Å
111	R	90.8	Very high	89.1	Confident	133 Å²	133	49 Å²	49	50%	0.502	28%	0.275	S	S	.	.	H	α-helix	trans	-67.3	-42.3	174.7	-178.4	-173.4	179.6	177.5	-1.1	111.2	A77 Y107 E108 E109 E113 A114 Q115	A77-R111 HydrophobicContact CB-CB 4.21Å; Y107-R111 HydrophobicContact CE1-CB 4.3Å; Y107-R111 HydrophobicContact CE2-CB 4.46Å; Y107-R111 WeakPolarHBondContact O-CB 3.25Å; Y107-R111 PolarHBondContact O-N 3.04Å; E108-R111 PolarHBondContact O-N 3.37Å; E109-R111 VanDerWaalsContact C-N 3.27Å; E109-R111 PolarHBondContact O-N 2.96Å; R111-E113 VanDerWaalsContact C-N 3.3Å; R111-E113 PolarHBondContact O-N 3.18Å; R111-A114 PolarHBondContact O-N 3.08Å; R111-Q115 VanDerWaalsContact O-CB 3.28Å; R111-Q115 WeakPolarHBondContact O-CB 3.48Å; R111-Q115 PolarHBondContact O-N 3.38Å
112	A	89.6	Confident	88.9	Confident	60 Å²	60	49.9 Å²	49.9	50%	0.496	28%	0.28	S	S	.	.	H	α-helix	trans	-60	-42.8	177.3	0	0	0	0	0	110.9	E108 E109 Q115 R116	E108-A112 WeakPolarHBondContact O-CB 3.45Å; E108-A112 PolarHBondContact O-N 2.53Å; E109-A112 WeakPolarHBondContact O-CB 3.37Å; E109-A112 PolarHBondContact O-N 3.43Å; A112-Q115 PolarHBondContact O-N 2.91Å; A112-R116 WeakPolarHBondContact O-CB 3.26Å; A112-R116 PolarHBondContact O-N 3.46Å
113	E	90	Very high	88.7	Confident	60 Å²	60	47.8 Å²	47.8	28%	0.28	27%	0.269	S	S	.	.	H	α-helix	trans	-64.3	-48.8	174.7	-174.1	60.9	-162.6	0	0	111.4	F19 E109 R111 Q115 R116 W117	F19-E113 HydrophobicContact CZ-CG 4.37Å; E109-E113 PolarHBondContact O-N 3.09Å; R111-E113 VanDerWaalsContact C-N 3.3Å; R111-E113 PolarHBondContact O-N 3.18Å; E113-Q115 PolarHBondContact O-N 2.86Å; E113-R116 VanDerWaalsContact O-CB 3.32Å; E113-R116 WeakPolarHBondContact O-CB 3.4Å; E113-R116 PolarHBondContact O-N 3.12Å; E113-R116 VanDerWaalsContact O-N 3.14Å; E113-W117 PolarHBondContact O-N 2.92Å; E113-W117 VanDerWaalsContact O-N 3.08Å; E113-W117 VanDerWaalsContact OE1-CD1 3.23Å; E113-W117 PolarHBondContact OE1-NE1 3.06Å
114	A	90.4	Very high	88.6	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58.4	-37.2	176.2	0	0	0	0	0	112.4	T66 A77 F79 A101 N110 R111 A118	T66-A114 HydrophobicContact CG2-CB 3.96Å; T66-A114 WeakPolarHBondContact CG2-O 3.16Å; A77-A114 HydrophobicContact CB-CB 4.07Å; F79-A114 HydrophobicContact CB-CB 4.21Å; A101-A114 HydrophobicContact CB-CB 4.44Å; N110-A114 PolarHBondContact O-N 3.32Å; R111-A114 PolarHBondContact O-N 3.08Å; A114-A118 WeakPolarHBondContact O-CB 3.47Å; A114-A118 PolarHBondContact O-N 3.14Å
115	Q	90.7	Very high	88.2	Confident	61 Å²	61	47.5 Å²	47.5	29%	0.285	25%	0.246	S	C	.	.	H	α-helix	trans	-69.1	-42.7	176.6	-167.9	69.5	16.3	0	0	111.4	R111 A112 E113 W117 A118 T119	R111-Q115 VanDerWaalsContact O-CB 3.28Å; R111-Q115 WeakPolarHBondContact O-CB 3.48Å; R111-Q115 PolarHBondContact O-N 3.38Å; A112-Q115 PolarHBondContact O-N 2.91Å; E113-Q115 PolarHBondContact O-N 2.86Å; Q115-W117 VanDerWaalsContact C-N 3.27Å; Q115-W117 PolarHBondContact O-N 3.29Å; Q115-A118 PolarHBondContact O-N 2.96Å; Q115-A118 VanDerWaalsContact O-N 3.16Å; Q115-T119 WeakPolarHBondContact O-CB 3.39Å; Q115-T119 PolarHBondContact O-N 3Å; Q115-T119 PolarHBondContact O-OG1 3.01Å
116	R	90.4	Very high	87.6	Confident	95 Å²	95	44.2 Å²	44.2	36%	0.358	21%	0.214	S	C	.	.	H	α-helix	trans	-53.6	-46.7	175	-169.3	-170.4	179.6	163.4	3	110.9	A112 E113 T119 A120 I136	A112-R116 WeakPolarHBondContact O-CB 3.26Å; A112-R116 PolarHBondContact O-N 3.46Å; E113-R116 VanDerWaalsContact O-CB 3.32Å; E113-R116 WeakPolarHBondContact O-CB 3.4Å; E113-R116 PolarHBondContact O-N 3.12Å; E113-R116 VanDerWaalsContact O-N 3.14Å; R116-T119 PolarHBondContact O-N 3.4Å; R116-A120 WeakPolarHBondContact O-CB 3.22Å; R116-A120 PolarHBondContact O-N 3.11Å; R116-I136 HydrophobicContact CG-CB 3.82Å; R116-I136 HydrophobicContact CG-CG2 4.3Å
117	W	91.2	Very high	86.9	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-66.6	-42.4	177.1	-81.2	74.9	0	0	0	113.1	L15 F19 L31 L33 L38 F79 E113 Q115 A120 L121	L15-W117 HydrophobicContact CB-CH2 4.31Å; L15-W117 HydrophobicContact CB-CZ2 4.32Å; L15-W117 HydrophobicContact CD2-CD2 3.5Å; L15-W117 VanDerWaalsContact CD2-CD2 3.5Å; L15-W117 VanDerWaalsContact CD2-CE2 3.42Å; L15-W117 HydrophobicContact CD2-CE3 3.99Å; L15-W117 HydrophobicContact CD2-CG 3.75Å; L15-W117 HydrophobicContact CD2-CH2 4.29Å; L15-W117 HydrophobicContact CD2-CZ2 3.85Å; L15-W117 HydrophobicContact CD2-CZ3 4.36Å; L15-W117 HydrophobicContact CG-CD2 4.27Å; L15-W117 HydrophobicContact CG-CH2 4.12Å; L15-W117 HydrophobicContact CG-CZ2 3.66Å; F19-W117 HydrophobicContact CE2-CD2 4.01Å; F19-W117 AromaticContact CE2-CE2 3.54Å; F19-W117 HydrophobicContact CE2-CG 4.48Å; F19-W117 HydrophobicContact CE2-CH2 4.39Å; F19-W117 AromaticContact CE2-CZ2 3.76Å; F19-W117 HydrophobicContact CE2-CZ2 3.76Å; F19-W117 AromaticContact CE2-NE1 3.75Å; F19-W117 AromaticContact CZ-CD1 3.6Å; F19-W117 AromaticContact CZ-CD2 3.88Å; F19-W117 HydrophobicContact CZ-CD2 3.88Å; F19-W117 AromaticContact CZ-CE2 3.62Å; F19-W117 AromaticContact CZ-CG 3.87Å; F19-W117 HydrophobicContact CZ-CG 3.87Å; F19-W117 HydrophobicContact CZ-CZ2 4.3Å; F19-W117 AromaticContact CZ-NE1 3.41Å; L31-W117 HydrophobicContact CB-CE3 4.5Å; L31-W117 HydrophobicContact CB-CH2 3.41Å; L31-W117 VanDerWaalsContact CB-CH2 3.41Å; L31-W117 HydrophobicContact CB-CZ2 4.2Å; L31-W117 HydrophobicContact CB-CZ3 3.58Å; L31-W117 HydrophobicContact CD1-CE3 4.38Å; L31-W117 HydrophobicContact CD1-CZ3 4.21Å; L31-W117 WeakPolarHBondContact O-CH2 3.4Å; L33-W117 HydrophobicContact CB-CZ3 4.08Å; L38-W117 HydrophobicContact CD1-CZ3 3.94Å; F79-W117 HydrophobicContact CD1-CB 4.11Å; F79-W117 HydrophobicContact CD2-CB 4.37Å; F79-W117 HydrophobicContact CE1-CB 3.91Å; F79-W117 HydrophobicContact CE1-CE3 4.21Å; F79-W117 HydrophobicContact CE2-CB 4.23Å; F79-W117 HydrophobicContact CG-CB 4.32Å; F79-W117 HydrophobicContact CZ-CB 3.99Å; E113-W117 PolarHBondContact O-N 2.92Å; E113-W117 VanDerWaalsContact O-N 3.08Å; E113-W117 VanDerWaalsContact OE1-CD1 3.23Å; E113-W117 PolarHBondContact OE1-NE1 3.06Å; Q115-W117 VanDerWaalsContact C-N 3.27Å; Q115-W117 PolarHBondContact O-N 3.29Å; W117-A120 PolarHBondContact O-N 2.8Å; W117-L121 WeakPolarHBondContact O-CB 3.44Å; W117-L121 PolarHBondContact O-N 3.46Å
118	A	89.9	Confident	86.4	Confident	8 Å²	8	43.4 Å²	43.4	7%	0.066	22%	0.222	C	C	.	.	H	α-helix	trans	-62.9	-43.1	176.5	0	0	0	0	0	112	C64 T66 F79 A114 Q115 T122	C64-A118 PolarHBondContact SG-O 2.92Å; T66-A118 HydrophobicContact CG2-CB 4.06Å; F79-A118 HydrophobicContact CD2-CB 4.19Å; F79-A118 HydrophobicContact CE2-CB 3.83Å; A114-A118 WeakPolarHBondContact O-CB 3.47Å; A114-A118 PolarHBondContact O-N 3.14Å; Q115-A118 PolarHBondContact O-N 2.96Å; Q115-A118 VanDerWaalsContact O-N 3.16Å; A118-T122 VanDerWaalsContact O-CB 3.29Å; A118-T122 WeakPolarHBondContact O-CB 3.41Å; A118-T122 PolarHBondContact O-N 2.94Å; A118-T122 PolarHBondContact O-OG1 3.45Å
119	T	88.6	Confident	85.7	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.006	23%	0.225	C	C	.	.	H	α-helix	trans	-62.4	-50	175.3	-60.1	0	0	0	0	110.8	Q115 R116 L121 T122 C123 I136 T137 L141	Q115-T119 WeakPolarHBondContact O-CB 3.39Å; Q115-T119 PolarHBondContact O-N 3Å; Q115-T119 PolarHBondContact O-OG1 3.01Å; R116-T119 PolarHBondContact O-N 3.4Å; T119-L121 VanDerWaalsContact C-N 3.35Å; T119-L121 PolarHBondContact O-N 2.96Å; T119-T122 PolarHBondContact O-N 3.11Å; T119-C123 WeakPolarHBondContact O-CB 3.41Å; T119-C123 PolarHBondContact O-N 2.81Å; T119-C123 PolarHBondContact O-SG 3.41Å; T119-C123 VanDerWaalsContact O-SG 3.32Å; T119-I136 HydrophobicContact CG2-CG2 3.63Å; T119-T137 VanDerWaalsContact CG2-O 3.3Å; T119-T137 WeakPolarHBondContact CG2-O 3.42Å; T119-L141 HydrophobicContact CG2-CD1 4.09Å; T119-L141 HydrophobicContact CG2-CG 4.01Å
120	A	88.7	Confident	85.2	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-56.8	-48.5	-179.7	0	0	0	0	0	112	L15 L33 R116 W117 C123 L124 L130 I136	L15-A120 HydrophobicContact CD2-CB 4.02Å; L33-A120 HydrophobicContact CD2-CB 3.79Å; R116-A120 WeakPolarHBondContact O-CB 3.22Å; R116-A120 PolarHBondContact O-N 3.11Å; W117-A120 PolarHBondContact O-N 2.8Å; A120-C123 PolarHBondContact O-N 2.99Å; A120-L124 WeakPolarHBondContact O-CG 3.33Å; A120-L124 PolarHBondContact O-N 3.11Å; A120-L124 VanDerWaalsContact O-N 3.11Å; A120-L130 HydrophobicContact CB-CD1 4.34Å; A120-L130 HydrophobicContact CB-CD2 4.48Å; A120-I136 HydrophobicContact CB-CD1 3.94Å; A120-I136 HydrophobicContact CB-CG2 4.2Å
121	L	86.9	Confident	84.4	Confident	2 Å²	2	40 Å²	40	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-65.2	-42.2	179.2	-175.3	59.9	0	0	0	111.6	L33 L58 V61 C64 F79 I81 W117 T119 L124 L125	L33-L121 HydrophobicContact CD1-CD1 4.01Å; L58-L121 HydrophobicContact CD2-CD1 3.41Å; L58-L121 VanDerWaalsContact CD2-CD1 3.41Å; V61-L121 HydrophobicContact CG1-CD1 4.39Å; V61-L121 HydrophobicContact CG1-CD2 4.1Å; V61-L121 HydrophobicContact CG1-CG 4.43Å; C64-L121 HydrophobicContact CB-CD2 3.78Å; F79-L121 HydrophobicContact CZ-CD2 3.9Å; I81-L121 HydrophobicContact CD1-CD2 4.13Å; I81-L121 HydrophobicContact CG1-CD2 4.23Å; I81-L121 HydrophobicContact CG2-CD2 4.03Å; W117-L121 WeakPolarHBondContact O-CB 3.44Å; W117-L121 PolarHBondContact O-N 3.46Å; T119-L121 VanDerWaalsContact C-N 3.35Å; T119-L121 PolarHBondContact O-N 2.96Å; L121-L124 PolarHBondContact O-N 3.31Å; L121-L125 HydrophobicContact CG-CD1 4.24Å; L121-L125 VanDerWaalsContact O-CG 3.26Å; L121-L125 WeakPolarHBondContact O-CG 3.42Å; L121-L125 PolarHBondContact O-N 2.84Å
122	T	84.2	Confident	83	Confident	24 Å²	24	37.1 Å²	37.1	15%	0.147	23%	0.233	C	C	.	.	H	α-helix	trans	-65.1	-39.4	177.9	-55.5	0	0	0	0	111.6	A118 T119 L125 R126 L141	A118-T122 VanDerWaalsContact O-CB 3.29Å; A118-T122 WeakPolarHBondContact O-CB 3.41Å; A118-T122 PolarHBondContact O-N 2.94Å; A118-T122 PolarHBondContact O-OG1 3.45Å; T119-T122 PolarHBondContact O-N 3.11Å; T122-L125 PolarHBondContact O-N 3.36Å; T122-R126 HydrophobicContact CG2-CG 4.4Å; T122-R126 WeakPolarHBondContact O-CB 3.09Å; T122-R126 VanDerWaalsContact O-CG 3.29Å; T122-R126 WeakPolarHBondContact O-CG 3.39Å; T122-R126 PolarHBondContact O-N 2.76Å; T122-L141 HydrophobicContact CG2-CD1 4.09Å; T122-L141 HydrophobicContact CG2-CD2 3.6Å
123	C	84	Confident	81.6	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.007	26%	0.255	C	S	.	.	H	α-helix	trans	-59.4	-47.3	173.7	-73.5	0	0	0	0	111.3	T119 A120 L125 R126 G127 L128 L130 L141	T119-C123 WeakPolarHBondContact O-CB 3.41Å; T119-C123 PolarHBondContact O-N 2.81Å; T119-C123 PolarHBondContact O-SG 3.41Å; T119-C123 VanDerWaalsContact O-SG 3.32Å; A120-C123 PolarHBondContact O-N 2.99Å; C123-L125 PolarHBondContact O-N 2.76Å; C123-R126 CarbonylContact O-C 3.55Å; C123-R126 PolarHBondContact O-N 3.08Å; C123-R126 VanDerWaalsContact O-N 3.13Å; C123-G127 PolarHBondContact O-N 2.81Å; C123-L128 HydrophobicContact CB-CB 4.04Å; C123-L128 PolarHBondContact O-N 2.83Å; C123-L130 HydrophobicContact CB-CD2 3.55Å; C123-L130 HydrophobicContact CB-CG 4.25Å; C123-L141 WeakPolarHBondContact SG-CD2 3.38Å
124	L	82	Confident	80.4	Confident	33 Å²	33	41.4 Å²	41.4	17%	0.173	26%	0.257	C	S	.	.	H	α-helix	trans	-62.5	-41.8	177.5	-68.6	175.1	0	0	0	112.4	L14 L33 L58 A120 L121 R126 G127 L130	L14-L124 HydrophobicContact CD1-CD1 4.17Å; L14-L124 HydrophobicContact CD1-CD2 3.92Å; L33-L124 HydrophobicContact CD1-CD1 3.82Å; L33-L124 HydrophobicContact CD2-CD1 3.67Å; L33-L124 HydrophobicContact CG-CD1 3.64Å; L58-L124 HydrophobicContact CD1-CB 3.93Å; L58-L124 HydrophobicContact CD1-CD1 4.03Å; A120-L124 WeakPolarHBondContact O-CG 3.33Å; A120-L124 PolarHBondContact O-N 3.11Å; A120-L124 VanDerWaalsContact O-N 3.11Å; L121-L124 PolarHBondContact O-N 3.31Å; L124-R126 PolarHBondContact O-N 3.4Å; L124-G127 PolarHBondContact O-N 3.11Å; L124-G127 VanDerWaalsContact O-N 3.14Å; L124-L130 HydrophobicContact CD1-CD1 4.16Å; L124-L130 HydrophobicContact CD2-CD1 3.86Å; L124-L130 HydrophobicContact CD2-CG 4.39Å; L124-L130 HydrophobicContact CG-CD1 3.8Å
125	L	78.6	Confident	79.6	Confident	58 Å²	58	49.2 Å²	49.2	30%	0.304	29%	0.294	S	S	.	.	H	α-helix	trans	-63.8	-31.1	175.7	-68.8	172.2	0	0	0	112.4	V61 L121 T122 C123	V61-L125 HydrophobicContact CB-CD2 4.12Å; V61-L125 HydrophobicContact CG1-CD1 3.94Å; V61-L125 HydrophobicContact CG1-CD2 4.25Å; L121-L125 HydrophobicContact CG-CD1 4.24Å; L121-L125 VanDerWaalsContact O-CG 3.26Å; L121-L125 WeakPolarHBondContact O-CG 3.42Å; L121-L125 PolarHBondContact O-N 2.84Å; T122-L125 PolarHBondContact O-N 3.36Å; C123-L125 PolarHBondContact O-N 2.76Å
126	R	75.1	Confident	79.2	Confident	22 Å²	22	47 Å²	47	8%	0.083	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	0.3	176.4	-67.7	-179.3	178.8	-176.6	0.3	113.6	T122 C123 L124 L128 P142 L296	T122-R126 HydrophobicContact CG2-CG 4.4Å; T122-R126 WeakPolarHBondContact O-CB 3.09Å; T122-R126 VanDerWaalsContact O-CG 3.29Å; T122-R126 WeakPolarHBondContact O-CG 3.39Å; T122-R126 PolarHBondContact O-N 2.76Å; C123-R126 CarbonylContact O-C 3.55Å; C123-R126 PolarHBondContact O-N 3.08Å; C123-R126 VanDerWaalsContact O-N 3.13Å; L124-R126 PolarHBondContact O-N 3.4Å; R126-L128 HydrophobicContact CB-CD1 4.07Å; R126-L128 HydrophobicContact CB-CG 4.02Å; R126-L128 PolarHBondContact O-N 3.42Å; R126-P142 PolarHBondContact NH1-O 2.99Å; R126-L296 HydrophobicContact CG-CD1 4.34Å; R126-L296 HydrophobicContact CG-CD2 4.26Å
127	G	75.1	Confident	78.8	Confident	50 Å²	50	44.6 Å²	44.6	52%	0.515	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	21.9	-177	0	0	0	0	0	114.5	C123 L124	C123-G127 PolarHBondContact O-N 2.81Å; L124-G127 PolarHBondContact O-N 3.11Å; L124-G127 VanDerWaalsContact O-N 3.14Å
128	L	78.6	Confident	78.1	Confident	32 Å²	32	47.7 Å²	47.7	17%	0.168	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-81.6	138.5	178.1	-63.4	171.9	0	0	0	110.4	C123 R126 L130 L141 P142 L292	C123-L128 HydrophobicContact CB-CB 4.04Å; C123-L128 PolarHBondContact O-N 2.83Å; R126-L128 HydrophobicContact CB-CD1 4.07Å; R126-L128 HydrophobicContact CB-CG 4.02Å; R126-L128 PolarHBondContact O-N 3.42Å; L128-L130 PolarHBondContact O-N 2.78Å; L128-L141 HydrophobicContact CD1-CD2 4.38Å; L128-P142 VanDerWaalsContact CD1-CD 3.4Å; L128-P142 HydrophobicContact CD1-CG 4.08Å; L128-L292 HydrophobicContact CD2-CD1 3.93Å; L128-L292 HydrophobicContact CD2-CD2 4.01Å
129	P	75.1	Confident	77.7	Confident	119 Å²	119	54 Å²	54	77%	0.773	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-65.5	130.9	177	28	-33.4	0	0	0	109.9
130	L	79.3	Confident	77.2	Confident	34 Å²	34	57.3 Å²	57.3	18%	0.178	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-85.8	137.9	170.5	-72.9	177.3	0	0	0	109.8	L14 A120 C123 L124 L128 G132	L14-L130 HydrophobicContact CD1-CD1 4.14Å; A120-L130 HydrophobicContact CB-CD1 4.34Å; A120-L130 HydrophobicContact CB-CD2 4.48Å; C123-L130 HydrophobicContact CB-CD2 3.55Å; C123-L130 HydrophobicContact CB-CG 4.25Å; L124-L130 HydrophobicContact CD1-CD1 4.16Å; L124-L130 HydrophobicContact CD2-CD1 3.86Å; L124-L130 HydrophobicContact CD2-CG 4.39Å; L124-L130 HydrophobicContact CG-CD1 3.8Å; L128-L130 PolarHBondContact O-N 2.78Å; L130-G132 PolarHBondContact O-N 2.94Å
131	P	72.9	Confident	76.7	Confident	46 Å²	46	59.4 Å²	59.4	30%	0.299	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-66.1	123.3	170.4	27.8	-31.5	0	0	0	108.5	I136 L140	P131-I136 HydrophobicContact CG-CG1 4.49Å; P131-L140 HydrophobicContact CG-CD1 3.98Å
132	G	61.5	Low	76	Confident	72 Å²	72	62.1 Å²	62.1	74%	0.742	38%	0.379	S	S	*	.	S	Bend	trans	-61.4	-46.3	-175.8	0	0	0	0	0	113.1	L130	L130-G132 PolarHBondContact O-N 2.94Å
133	D	60.9	Low	75.8	Confident	177 Å²	177	68.6 Å²	68.6	95%	0.947	40%	0.4	S	S	*	.	S	Bend	trans	-115.2	1.4	-178.9	-60.3	-36.7	0	0	0	113.1
134	G	64.4	Low	75.4	Confident	32 Å²	32	71.3 Å²	71.3	33%	0.33	42%	0.418	S	S	.	.	S	Bend	trans	-88.6	160.6	-175.3	0	0	0	0	0	113.8	I136	G134-I136 PolarHBondContact O-N 3.38Å
135	E	74.2	Confident	75.2	Confident	165 Å²	165	70.8 Å²	70.8	77%	0.771	42%	0.416	S	S	*	.			trans	-64.6	126.5	173.6	-65.4	-171	166.6	0	0	110.6	T137	E135-T137 HydrophobicContact CB-CG2 4.14Å; E135-T137 PolarHBondContact O-N 3.07Å; E135-T137 VanDerWaalsContact O-N 3.17Å
136	I	81.1	Confident	75.4	Confident	15 Å²	15	72.6 Å²	72.6	8%	0.077	42%	0.419	C	S	.	.			trans	-84.9	91.2	175.7	-58.3	172.4	0	0	0	107.5	L15 R116 T119 A120 P131 G134 L140	L15-I136 HydrophobicContact CD1-CD1 4.35Å; R116-I136 HydrophobicContact CG-CB 3.82Å; R116-I136 HydrophobicContact CG-CG2 4.3Å; T119-I136 HydrophobicContact CG2-CG2 3.63Å; A120-I136 HydrophobicContact CB-CD1 3.94Å; A120-I136 HydrophobicContact CB-CG2 4.2Å; P131-I136 HydrophobicContact CG-CG1 4.49Å; G134-I136 PolarHBondContact O-N 3.38Å; I136-L140 HydrophobicContact CG2-CD1 4.31Å
137	T	81.8	Confident	75.9	Confident	44 Å²	44	72.6 Å²	72.6	27%	0.27	42%	0.421	S	S	.	.			trans	-97.1	152.5	178	61.7	0	0	0	0	111.2	T119 E135 D139 L140	T119-T137 VanDerWaalsContact CG2-O 3.3Å; T119-T137 WeakPolarHBondContact CG2-O 3.42Å; E135-T137 HydrophobicContact CB-CG2 4.14Å; E135-T137 PolarHBondContact O-N 3.07Å; E135-T137 VanDerWaalsContact O-N 3.17Å; T137-D139 PolarHBondContact O-N 3.07Å; T137-D139 VanDerWaalsContact O-N 3.1Å; T137-L140 WeakPolarHBondContact O-CB 3.44Å; T137-L140 WeakPolarHBondContact O-CG 3.26Å; T137-L140 PolarHBondContact O-N 3.43Å
138	P	77.7	Confident	76.5	Confident	66 Å²	66	70.2 Å²	70.2	43%	0.429	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-59.3	-19.6	177.2	25	-34.8	0	0	0	113.7	L140 L141	P138-L140 PolarHBondContact O-N 3.23Å; P138-L141 PolarHBondContact O-N 3.17Å; P138-L141 VanDerWaalsContact O-N 3.08Å
139	D	80.6	Confident	77	Confident	141 Å²	141	68.7 Å²	68.7	75%	0.754	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-66	-17.8	178.4	-52.5	-46.5	0	0	0	113.3	T137 L141	T137-D139 PolarHBondContact O-N 3.07Å; T137-D139 VanDerWaalsContact O-N 3.1Å; D139-L141 PolarHBondContact O-N 2.68Å
140	L	77.8	Confident	77.7	Confident	71 Å²	71	63 Å²	63	37%	0.372	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-66.9	-21.4	172.8	-65	174.1	0	0	0	112.6	P131 I136 T137 P138	P131-L140 HydrophobicContact CG-CD1 3.98Å; I136-L140 HydrophobicContact CG2-CD1 4.31Å; T137-L140 WeakPolarHBondContact O-CB 3.44Å; T137-L140 WeakPolarHBondContact O-CG 3.26Å; T137-L140 PolarHBondContact O-N 3.43Å; P138-L140 PolarHBondContact O-N 3.23Å
141	L	78.1	Confident	78.2	Confident	44 Å²	44	61.4 Å²	61.4	23%	0.23	34%	0.343	C	S	.	.	S	Bend	trans	-86.3	126	-178.4	-70.6	173.3	0	0	0	110.7	T119 T122 C123 L128 P138 D139	T119-L141 HydrophobicContact CG2-CD1 4.09Å; T119-L141 HydrophobicContact CG2-CG 4.01Å; T122-L141 HydrophobicContact CG2-CD1 4.09Å; T122-L141 HydrophobicContact CG2-CD2 3.6Å; C123-L141 WeakPolarHBondContact SG-CD2 3.38Å; L128-L141 HydrophobicContact CD1-CD2 4.38Å; P138-L141 PolarHBondContact O-N 3.17Å; P138-L141 VanDerWaalsContact O-N 3.08Å; D139-L141 PolarHBondContact O-N 2.68Å
142	P	74.1	Confident	78.8	Confident	59 Å²	59	61.3 Å²	61.3	38%	0.383	34%	0.34	S	S	.	.			trans	-64.8	161.7	169	29.1	-34.1	0	0	0	109.9	R126 L128	R126-P142 PolarHBondContact NH1-O 2.99Å; L128-P142 VanDerWaalsContact CD1-CD 3.4Å; L128-P142 HydrophobicContact CD1-CG 4.08Å
143	R	79.5	Confident	79.8	Confident	159 Å²	159	58.7 Å²	58.7	60%	0.6	31%	0.31	S	S	*	.			trans	-45.2	139.8	174.2	70.9	179.8	-170.7	176.6	4.8	110.4	D203	R143-D203 IonicContact NH2-OD1 3.99Å; R143-D203 PolarHBondContact NH2-OD1 3.17Å; R143-D203 VanDerWaalsContact NH2-OD1 3.13Å
144	P	74.9	Confident	80.6	Confident	58 Å²	58	57.8 Å²	57.8	38%	0.377	30%	0.298	S	S	.	.			trans	-60	135.8	177.8	25.4	-32.9	0	0	0	109.4	R146	P144-R146 PolarHBondContact O-N 2.66Å
145	P	77.9	Confident	80.8	Confident	22 Å²	22	56.6 Å²	56.6	14%	0.143	29%	0.286	C	S	.	.			trans	-58.1	137	177.1	-17.7	27.2	0	0	0	110.3	L177 S178 D203	P145-L177 HydrophobicContact CB-CD2 4Å; P145-L177 HydrophobicContact CG-CD2 3.56Å; P145-S178 PolarHBondContact O-N 3.23Å; P145-S178 VanDerWaalsContact O-O 3.1Å; P145-D203 VanDerWaalsContact CA-OD2 3.25Å; P145-D203 WeakPolarHBondContact CA-OD2 3.35Å; P145-D203 HydrophobicContact CB-CB 4.27Å
146	R	83.1	Confident	80.2	Confident	96 Å²	96	49.6 Å²	49.6	36%	0.362	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	112.9	175.7	-65.1	-178.2	70.6	-172.4	-0.5	109.5	P144 S178 E201 W202 D203	P144-R146 PolarHBondContact O-N 2.66Å; R146-S178 CarbonylContact C-O 3.47Å; R146-S178 WeakPolarHBondContact CA-O 3.49Å; R146-E201 WeakPolarHBondContact CD-O 3.47Å; R146-E201 IonicContact NH1-OE1 3.07Å; R146-W202 HydrophobicContact CB-CE3 4.01Å; R146-W202 HydrophobicContact CB-CZ3 4.27Å; R146-D203 PolarHBondContact N-OD2 2.98Å; R146-D203 PolarHBondContact O-N 3.37Å
147	L	85.1	Confident	79.7	Confident	22 Å²	22	59.3 Å²	59.3	12%	0.115	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	138.3	178.5	-62.5	-178.4	0	0	0	111.7	L149 L177 S178 F179 N180 W202 G204 V206	L147-L149 HydrophobicContact CB-CD1 4.31Å; L147-L177 HydrophobicContact CD1-CB 4.46Å; L147-L177 HydrophobicContact CD1-CD1 3.8Å; L147-S178 PolarHBondContact N-O 3.1Å; L147-F179 HydrophobicContact CB-CB 4.43Å; L147-F179 CarbonylContact O-C 3.54Å; L147-F179 WeakPolarHBondContact O-CA 3.26Å; L147-N180 PolarHBondContact O-N 2.88Å; L147-W202 WeakPolarHBondContact O-CZ3 3.5Å; L147-G204 WeakPolarHBondContact CA-O 3.34Å; L147-V206 HydrophobicContact CD1-CG2 4.43Å
148	L	88.3	Confident	79.3	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	117.3	169.4	-179	67.3	0	0	0	109.7	L150 N180 I182 L197 W202 G204 I205 V206	L148-L150 HydrophobicContact CD1-CD2 4.47Å; L148-L150 HydrophobicContact CD2-CD2 4.19Å; L148-L150 HydrophobicContact CD2-CG 4.43Å; L148-L150 HydrophobicContact CG-CD2 4.14Å; L148-L150 HydrophobicContact CG-CG 4.36Å; L148-N180 HydrophobicContact CD1-CB 4.38Å; L148-I182 HydrophobicContact CD1-CD1 3.72Å; L148-I182 HydrophobicContact CD1-CG1 4.08Å; L148-L197 HydrophobicContact CD2-CD1 3.39Å; L148-W202 HydrophobicContact CB-CD2 4.02Å; L148-W202 HydrophobicContact CB-CE3 3.96Å; L148-W202 HydrophobicContact CB-CG 4.41Å; L148-W202 HydrophobicContact CB-CZ3 4.46Å; L148-W202 HydrophobicContact CD1-CH2 4.47Å; L148-W202 HydrophobicContact CD1-CZ2 4.35Å; L148-G204 PolarHBondContact N-O 2.8Å; L148-I205 HydrophobicContact CB-CG1 4.35Å; L148-I205 HydrophobicContact CD2-CG1 4.38Å; L148-I205 HydrophobicContact CD2-CG2 4.47Å; L148-I205 CarbonylContact O-C 3.54Å; L148-I205 WeakPolarHBondContact O-CA 3.43Å; L148-V206 PolarHBondContact O-N 2.99Å
149	L	88.9	Confident	79.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	118.9	175	-77.9	90.1	0	0	0	110.5	L147 V168 L169 I172 F179 N180 L181 I182 V206 V208	L147-L149 HydrophobicContact CB-CD1 4.31Å; L149-V168 HydrophobicContact CD2-CG1 4.02Å; L149-L169 HydrophobicContact CD2-CD2 4.09Å; L149-I172 HydrophobicContact CD1-CD1 3.86Å; L149-I172 HydrophobicContact CD2-CD1 3.51Å; L149-I172 HydrophobicContact CG-CD1 4.19Å; L149-F179 HydrophobicContact CD1-CB 3.45Å; L149-F179 VanDerWaalsContact CD1-CB 3.45Å; L149-F179 HydrophobicContact CD1-CD2 4.1Å; L149-F179 HydrophobicContact CD1-CG 4.03Å; L149-N180 PolarHBondContact N-O 3.15Å; L149-L181 HydrophobicContact CB-CD1 3.65Å; L149-L181 HydrophobicContact CD2-CD1 4.3Å; L149-I182 PolarHBondContact O-N 3.17Å; L149-V206 CarbonylContact C-O 3.41Å; L149-V206 WeakPolarHBondContact CA-O 3.24Å; L149-V206 HydrophobicContact CG-CB 4.34Å; L149-V208 HydrophobicContact CD2-CG2 4.49Å
150	L	89.6	Confident	79	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	120.3	172.8	-59.4	179.6	0	0	0	108.9	L148 I182 A190 L193 V194 I205 V206 T207 V208 L213 V217	L148-L150 HydrophobicContact CD1-CD2 4.47Å; L148-L150 HydrophobicContact CD2-CD2 4.19Å; L148-L150 HydrophobicContact CD2-CG 4.43Å; L148-L150 HydrophobicContact CG-CD2 4.14Å; L148-L150 HydrophobicContact CG-CG 4.36Å; L150-I182 HydrophobicContact CD2-CB 3.89Å; L150-I182 HydrophobicContact CD2-CD1 4.45Å; L150-I182 HydrophobicContact CD2-CG2 4.42Å; L150-A190 HydrophobicContact CD1-CB 4.23Å; L150-L193 HydrophobicContact CD2-CD1 4.39Å; L150-V194 HydrophobicContact CD1-CG2 4.19Å; L150-I205 HydrophobicContact CD1-CG2 4.17Å; L150-I205 HydrophobicContact CG-CG2 4.48Å; L150-V206 PolarHBondContact N-O 3.14Å; L150-T207 CarbonylContact O-C 3.42Å; L150-T207 WeakPolarHBondContact O-CA 3.42Å; L150-V208 PolarHBondContact O-N 2.91Å; L150-L213 HydrophobicContact CB-CD2 4.23Å; L150-L213 WeakPolarHBondContact O-CD2 3.49Å; L150-V217 HydrophobicContact CD1-CG2 3.48Å; L150-V217 VanDerWaalsContact CD1-CG2 3.48Å
151	V	89.3	Confident	79.3	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	127.6	-177.7	-173.9	0	0	0	0	110.5	P153 W161 C164 L181 I182 Q183 T184 V208	V151-P153 WeakPolarHBondContact O-CD 3.5Å; V151-W161 HydrophobicContact CB-CE3 4.48Å; V151-W161 HydrophobicContact CG1-CE3 4.26Å; V151-C164 HydrophobicContact CG1-CB 4.41Å; V151-C164 HydrophobicContact CG2-CB 4.39Å; V151-L181 HydrophobicContact CB-CD1 4.5Å; V151-L181 HydrophobicContact CG2-CD1 3.37Å; V151-I182 PolarHBondContact N-O 3.35Å; V151-Q183 WeakPolarHBondContact O-CA 3.29Å; V151-T184 PolarHBondContact O-N 3.08Å; V151-T184 PolarHBondContact O-OG1 3.28Å; V151-V208 HydrophobicContact CB-CB 4.3Å; V151-V208 HydrophobicContact CG1-CB 4.16Å; V151-V208 HydrophobicContact CG1-CG1 4.4Å; V151-V208 HydrophobicContact CG2-CB 3.83Å; V151-V208 HydrophobicContact CG2-CG2 3.84Å
152	N	86.6	Confident	79.5	Confident	45 Å²	45	57.6 Å²	57.6	24%	0.241	28%	0.279	C	S	.	.			trans	-89.4	110.3	167	-177.1	-9.6	0	0	0	109.4	F154 G155 A160 T184 V208 S209 L213	N152-F154 PolarHBondContact O-N 2.92Å; N152-F154 PolarHBondContact OD1-N 3.24Å; N152-G155 PolarHBondContact O-N 2.7Å; N152-A160 WeakPolarHBondContact O-CB 3.38Å; N152-T184 WeakPolarHBondContact CA-OG1 3.34Å; N152-V208 PolarHBondContact N-O 2.78Å; N152-S209 WeakPolarHBondContact CB-OG 3.42Å; N152-L213 HydrophobicContact CB-CD2 4.33Å
153	P	81.9	Confident	79.8	Confident	16 Å²	16	57.2 Å²	57.2	10%	0.104	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-27.9	-177.1	30.9	-38.3	0	0	0	112.5	V151 G155 W161 Q183 T184	V151-P153 WeakPolarHBondContact O-CD 3.5Å; P153-G155 VanDerWaalsContact C-N 3.27Å; P153-W161 HydrophobicContact CB-CB 4.31Å; P153-Q183 HydrophobicContact CB-CG 4.19Å; P153-Q183 HydrophobicContact CG-CG 3.85Å; P153-T184 WeakPolarHBondContact CD-O 3.42Å
154	F	77.9	Confident	80	Confident	159 Å²	159	49.7 Å²	49.7	70%	0.697	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-5.9	177.9	-55.6	-74.8	0	0	0	112.8	N152	N152-F154 PolarHBondContact O-N 2.92Å; N152-F154 PolarHBondContact OD1-N 3.24Å
155	G	68	Low	80.5	Confident	7 Å²	7	52.7 Å²	52.7	7%	0.072	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	141.4	172.5	0	0	0	0	0	111.5	N152 P153 G158 L159 A160	N152-G155 PolarHBondContact O-N 2.7Å; P153-G155 VanDerWaalsContact C-N 3.27Å; G155-G158 PolarHBondContact O-N 2.95Å; G155-L159 PolarHBondContact O-N 2.9Å; G155-A160 WeakPolarHBondContact O-CB 3.37Å; G155-A160 PolarHBondContact O-N 3.18Å
156	G	62.1	Low	80.6	Confident	17 Å²	17	56.7 Å²	56.7	18%	0.175	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	73.4	169.5	0	0	0	0	0	115.2	G158 L159 C240	G156-G158 PolarHBondContact O-N 3.44Å; G156-L159 PolarHBondContact O-N 2.79Å; G156-C240 WeakPolarHBondContact CA-O 3.47Å; G156-C240 PolarHBondContact N-O 2.91Å
157	R	70.1	Confident	80.3	Confident	219 Å²	219	55.7 Å²	55.7	83%	0.826	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	23.4	-178.6	-58.2	-176.3	178.4	-174	-2	113.8
158	G	74.6	Confident	80	Confident	42 Å²	42	54.7 Å²	54.7	43%	0.433	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	14.1	-175.8	0	0	0	0	0	115.6	G155 G156	G155-G158 PolarHBondContact O-N 2.95Å; G156-G158 PolarHBondContact O-N 3.44Å
159	L	75.6	Confident	79.8	Confident	88 Å²	88	56 Å²	56	46%	0.461	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-5.2	-176.6	-64.4	174.6	0	0	0	113.6	G155 G156 W161 Q162 W163	G155-L159 PolarHBondContact O-N 2.9Å; G156-L159 PolarHBondContact O-N 2.79Å; L159-W161 VanDerWaalsContact C-N 3.3Å; L159-W161 PolarHBondContact O-N 3.29Å; L159-Q162 PolarHBondContact O-N 3.09Å; L159-W163 WeakPolarHBondContact O-CB 3.44Å; L159-W163 PolarHBondContact O-N 3.18Å
160	A	76.6	Confident	79.4	Confident	3 Å²	3	58.4 Å²	58.4	3%	0.025	29%	0.286	C	S	.	.	H	α-helix	trans	-57.2	-40.3	-176	0	0	0	0	0	113.2	N152 G155 W163 C164 C240	N152-A160 WeakPolarHBondContact O-CB 3.38Å; G155-A160 WeakPolarHBondContact O-CB 3.37Å; G155-A160 PolarHBondContact O-N 3.18Å; A160-W163 PolarHBondContact O-N 3.35Å; A160-C164 VanDerWaalsContact O-CB 3.24Å; A160-C164 WeakPolarHBondContact O-CB 3.44Å; A160-C164 PolarHBondContact O-N 3.39Å; A160-C240 HydrophobicContact CB-CB 3.96Å
161	W	83.6	Confident	78.9	Confident	82 Å²	82	58.6 Å²	58.6	31%	0.311	29%	0.287	S	S	.	.	H	α-helix	trans	-62	-51.3	177.5	175.3	-107.5	0	0	0	112.7	V151 P153 L159 W163 C164 K165 L181 Q183	V151-W161 HydrophobicContact CB-CE3 4.48Å; V151-W161 HydrophobicContact CG1-CE3 4.26Å; P153-W161 HydrophobicContact CB-CB 4.31Å; L159-W161 VanDerWaalsContact C-N 3.3Å; L159-W161 PolarHBondContact O-N 3.29Å; W161-W163 VanDerWaalsContact C-N 3.29Å; W161-W163 PolarHBondContact O-N 3.15Å; W161-C164 PolarHBondContact O-N 2.93Å; W161-K165 WeakPolarHBondContact O-CB 3.36Å; W161-K165 PolarHBondContact O-N 3.42Å; W161-L181 HydrophobicContact CH2-CD2 3.6Å; W161-L181 HydrophobicContact CH2-CG 4.32Å; W161-L181 HydrophobicContact CZ3-CD2 3.61Å; W161-L181 HydrophobicContact CZ3-CG 4.03Å; W161-Q183 HydrophobicContact CZ3-CB 4.15Å
162	Q	82.9	Confident	78.4	Confident	115 Å²	115	58.7 Å²	58.7	54%	0.537	29%	0.287	S	S	.	.	H	α-helix	trans	-63	-40.2	179.4	-66.9	-177.2	-6.3	0	0	111	L159 K165 N166	L159-Q162 PolarHBondContact O-N 3.09Å; Q162-K165 PolarHBondContact O-N 3.16Å; Q162-N166 VanDerWaalsContact O-CB 3.28Å; Q162-N166 WeakPolarHBondContact O-CB 3.34Å; Q162-N166 PolarHBondContact O-N 2.83Å; Q162-N166 PolarHBondContact O-ND2 3.29Å
163	W	80.1	Confident	78.2	Confident	52 Å²	52	60.4 Å²	60.4	20%	0.197	30%	0.303	C	S	.	.	H	α-helix	trans	-65.8	-45.9	178.7	-171	88.3	0	0	0	111.8	L159 A160 W161 K165 N166 H167 V168 C240 V308	L159-W163 WeakPolarHBondContact O-CB 3.44Å; L159-W163 PolarHBondContact O-N 3.18Å; A160-W163 PolarHBondContact O-N 3.35Å; W161-W163 VanDerWaalsContact C-N 3.29Å; W161-W163 PolarHBondContact O-N 3.15Å; W163-K165 VanDerWaalsContact C-N 3.34Å; W163-K165 PolarHBondContact O-N 3.26Å; W163-N166 PolarHBondContact O-N 2.68Å; W163-H167 AromaticContact CD1-CD2 3.43Å; W163-H167 VanDerWaalsContact CD1-CD2 3.43Å; W163-H167 AromaticContact CG-CD2 3.96Å; W163-H167 AromaticContact NE1-CD2 3.53Å; W163-H167 WeakPolarHBondContact O-CB 3.2Å; W163-H167 PolarHBondContact O-N 3.46Å; W163-V168 HydrophobicContact CE3-CG2 3.75Å; W163-V168 HydrophobicContact CH2-CG2 3.88Å; W163-V168 HydrophobicContact CZ3-CG2 3.24Å; W163-C240 VanDerWaalsContact CE3-SG 3.58Å; W163-V308 HydrophobicContact CH2-CG2 3.57Å; W163-V308 HydrophobicContact CZ2-CG1 4.42Å; W163-V308 HydrophobicContact CZ2-CG2 3.81Å
164	C	82.4	Confident	78	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.301	C	S	.	.	I	π-helix	trans	-56.5	-50.3	174.2	-173.3	0	0	0	0	110.7	V151 A160 W161 N166 V168 L169 V208	V151-C164 HydrophobicContact CG1-CB 4.41Å; V151-C164 HydrophobicContact CG2-CB 4.39Å; A160-C164 VanDerWaalsContact O-CB 3.24Å; A160-C164 WeakPolarHBondContact O-CB 3.44Å; A160-C164 PolarHBondContact O-N 3.39Å; W161-C164 PolarHBondContact O-N 2.93Å; C164-N166 PolarHBondContact O-N 2.95Å; C164-V168 WeakPolarHBondContact O-CA 3.47Å; C164-V168 WeakPolarHBondContact O-CB 3.49Å; C164-V168 PolarHBondContact O-N 3.35Å; C164-L169 WeakPolarHBondContact O-CG 3.3Å; C164-L169 PolarHBondContact O-N 3.3Å; C164-V208 HydrophobicContact CB-CG1 4.18Å
165	K	85.3	Confident	77.8	Confident	122 Å²	122	53.6 Å²	53.6	53%	0.53	28%	0.275	S	S	.	.	I	π-helix	trans	-62.1	-41.7	-178.8	-169.9	174.1	179.3	176.8	0	113.2	W161 Q162 W163 L169 P170	W161-K165 WeakPolarHBondContact O-CB 3.36Å; W161-K165 PolarHBondContact O-N 3.42Å; Q162-K165 PolarHBondContact O-N 3.16Å; W163-K165 VanDerWaalsContact C-N 3.34Å; W163-K165 PolarHBondContact O-N 3.26Å; K165-L169 HydrophobicContact CB-CD1 4.35Å; K165-L169 HydrophobicContact CG-CD1 4.19Å; K165-P170 WeakPolarHBondContact O-CD 3.19Å
166	N	81.2	Confident	78.1	Confident	106 Å²	106	55 Å²	55	57%	0.567	29%	0.29	S	S	*	.	I	π-helix	trans	-86.2	-25.2	-173.4	-67.9	-19.3	0	0	0	113.8	Q162 W163 C164	Q162-N166 VanDerWaalsContact O-CB 3.28Å; Q162-N166 WeakPolarHBondContact O-CB 3.34Å; Q162-N166 PolarHBondContact O-N 2.83Å; Q162-N166 PolarHBondContact O-ND2 3.29Å; W163-N166 PolarHBondContact O-N 2.68Å; C164-N166 PolarHBondContact O-N 2.95Å
167	H	75.6	Confident	79	Confident	74 Å²	74	55 Å²	55	34%	0.343	29%	0.286	S	S	.	.	I	π-helix	trans	-119.1	-49	-174.2	-62.2	-61.4	0	0	0	113.1	W163 M171	W163-H167 AromaticContact CD1-CD2 3.43Å; W163-H167 VanDerWaalsContact CD1-CD2 3.43Å; W163-H167 AromaticContact CG-CD2 3.96Å; W163-H167 AromaticContact NE1-CD2 3.53Å; W163-H167 WeakPolarHBondContact O-CB 3.2Å; W163-H167 PolarHBondContact O-N 3.46Å; H167-M171 HydrophobicContact CB-CE 4.39Å; H167-M171 WeakPolarHBondContact O-CE 3.38Å; H167-M171 VanDerWaalsContact O-CG 3.3Å; H167-M171 WeakPolarHBondContact O-CG 3.25Å
168	V	79.3	Confident	79.7	Confident	1 Å²	1	47 Å²	47	1%	0.006	26%	0.263	C	S	.	.	I	π-helix	trans	-74.4	-51.5	-173.2	179.2	0	0	0	0	111.5	L149 W163 C164 M171 I172 L238	L149-V168 HydrophobicContact CD2-CG1 4.02Å; W163-V168 HydrophobicContact CE3-CG2 3.75Å; W163-V168 HydrophobicContact CH2-CG2 3.88Å; W163-V168 HydrophobicContact CZ3-CG2 3.24Å; C164-V168 WeakPolarHBondContact O-CA 3.47Å; C164-V168 WeakPolarHBondContact O-CB 3.49Å; C164-V168 PolarHBondContact O-N 3.35Å; V168-M171 PolarHBondContact O-N 3.37Å; V168-M171 VanDerWaalsContact O-N 3.07Å; V168-I172 HydrophobicContact CG1-CD1 3.63Å; V168-I172 HydrophobicContact CG1-CG1 4.27Å; V168-I172 WeakPolarHBondContact O-CG1 3.47Å; V168-I172 PolarHBondContact O-N 3.32Å; V168-L238 HydrophobicContact CB-CD1 4.42Å; V168-L238 HydrophobicContact CG1-CD1 3.55Å; V168-L238 HydrophobicContact CG2-CD1 3.95Å
169	L	83.4	Confident	80.2	Confident	27 Å²	27	48.6 Å²	48.6	14%	0.141	26%	0.258	C	S	.	.	H	α-helix	trans	-59.2	-43.5	-176.5	-53.2	-176.4	0	0	0	113.1	L149 C164 K165 M171 I172 S173 F179 L181	L149-L169 HydrophobicContact CD2-CD2 4.09Å; C164-L169 WeakPolarHBondContact O-CG 3.3Å; C164-L169 PolarHBondContact O-N 3.3Å; K165-L169 HydrophobicContact CB-CD1 4.35Å; K165-L169 HydrophobicContact CG-CD1 4.19Å; L169-M171 VanDerWaalsContact C-N 3.3Å; L169-M171 PolarHBondContact O-N 3.11Å; L169-I172 PolarHBondContact O-N 3.07Å; L169-S173 WeakPolarHBondContact O-CB 3.41Å; L169-S173 PolarHBondContact O-N 2.95Å; L169-F179 HydrophobicContact CB-CE2 4.5Å; L169-F179 HydrophobicContact CB-CZ 4.09Å; L169-F179 HydrophobicContact CD1-CE2 4.43Å; L169-F179 HydrophobicContact CD2-CD2 4.15Å; L169-F179 HydrophobicContact CD2-CE2 3.62Å; L169-F179 HydrophobicContact CD2-CZ 4.04Å; L169-F179 HydrophobicContact CG-CE2 4.38Å; L169-F179 HydrophobicContact CG-CZ 4.46Å; L169-L181 HydrophobicContact CD1-CD2 3.88Å; L169-L181 HydrophobicContact CD2-CD1 4.24Å; L169-L181 HydrophobicContact CD2-CD2 4.22Å
170	P	81.8	Confident	80.9	Confident	52 Å²	52	47.9 Å²	47.9	34%	0.338	26%	0.255	S	S	.	.	H	α-helix	trans	-60.3	-38.5	175.5	-25.4	36.2	0	0	0	112.7	K165 S173 E174	K165-P170 WeakPolarHBondContact O-CD 3.19Å; P170-S173 PolarHBondContact O-N 3.37Å; P170-E174 WeakPolarHBondContact O-CB 3.44Å; P170-E174 WeakPolarHBondContact O-CG 3.5Å; P170-E174 PolarHBondContact O-N 3.32Å
171	M	77.9	Confident	81.6	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.015	26%	0.264	C	S	.	.	H	α-helix	trans	-68.5	-40.2	-179.9	-69.6	-174	-71.5	0	0	112.3	Y84 H167 V168 L169 E174 A175 I304 R307	Y84-M171 HydrophobicContact CE1-SD 4.33Å; Y84-M171 WeakPolarHBondContact OH-CG 3.31Å; H167-M171 HydrophobicContact CB-CE 4.39Å; H167-M171 WeakPolarHBondContact O-CE 3.38Å; H167-M171 VanDerWaalsContact O-CG 3.3Å; H167-M171 WeakPolarHBondContact O-CG 3.25Å; V168-M171 PolarHBondContact O-N 3.37Å; V168-M171 VanDerWaalsContact O-N 3.07Å; L169-M171 VanDerWaalsContact C-N 3.3Å; L169-M171 PolarHBondContact O-N 3.11Å; M171-E174 PolarHBondContact O-N 2.94Å; M171-A175 PolarHBondContact O-N 2.85Å; M171-I304 HydrophobicContact CB-CD1 3.53Å; M171-I304 HydrophobicContact CE-CD1 3.4Å; M171-I304 HydrophobicContact CE-CG2 4.12Å; M171-I304 HydrophobicContact CG-CD1 4.06Å; M171-I304 HydrophobicContact SD-CD1 3.44Å; M171-I304 WeakPolarHBondContact SD-CD1 3.37Å; M171-R307 VanDerWaalsContact SD-CD 3.55Å; M171-R307 PolarHBondContact SD-NH1 3.13Å
172	I	78.9	Confident	81.9	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-64.6	-43.4	176.1	-64.6	174.6	0	0	0	110.4	L149 V168 L169 A175 G176 L177 F179 F300	L149-I172 HydrophobicContact CD1-CD1 3.86Å; L149-I172 HydrophobicContact CD2-CD1 3.51Å; L149-I172 HydrophobicContact CG-CD1 4.19Å; V168-I172 HydrophobicContact CG1-CD1 3.63Å; V168-I172 HydrophobicContact CG1-CG1 4.27Å; V168-I172 WeakPolarHBondContact O-CG1 3.47Å; V168-I172 PolarHBondContact O-N 3.32Å; L169-I172 PolarHBondContact O-N 3.07Å; I172-A175 PolarHBondContact O-N 2.78Å; I172-G176 PolarHBondContact O-N 3.02Å; I172-L177 HydrophobicContact CG2-CB 3.7Å; I172-L177 HydrophobicContact CG2-CD1 4.33Å; I172-L177 PolarHBondContact O-N 2.74Å; I172-F179 HydrophobicContact CB-CD1 4.16Å; I172-F179 HydrophobicContact CB-CE1 4.49Å; I172-F179 HydrophobicContact CG2-CB 4.01Å; I172-F179 HydrophobicContact CG2-CD1 3.41Å; I172-F179 VanDerWaalsContact CG2-CD1 3.41Å; I172-F179 HydrophobicContact CG2-CE1 4.17Å; I172-F179 HydrophobicContact CG2-CG 3.96Å; I172-F300 HydrophobicContact CB-CZ 4.17Å; I172-F300 HydrophobicContact CG1-CE1 3.79Å; I172-F300 HydrophobicContact CG1-CZ 3.47Å; I172-F300 VanDerWaalsContact CG1-CZ 3.47Å
173	S	82.1	Confident	82.3	Confident	81 Å²	81	46 Å²	46	57%	0.566	25%	0.251	S	S	*	.	H	α-helix	trans	-63.6	-40.7	175.9	-178.8	0	0	0	0	112.2	L169 P170 A175 G176	L169-S173 WeakPolarHBondContact O-CB 3.41Å; L169-S173 PolarHBondContact O-N 2.95Å; P170-S173 PolarHBondContact O-N 3.37Å; S173-A175 VanDerWaalsContact C-N 3.3Å; S173-A175 PolarHBondContact O-N 2.89Å; S173-G176 PolarHBondContact O-N 3.17Å
174	E	79.4	Confident	82.7	Confident	14 Å²	14	43.9 Å²	43.9	7%	0.065	24%	0.244	C	C	.	.	H	α-helix	trans	-65.2	-31.2	176.8	-76.1	170.7	-177.6	0	0	113.5	G63 Y82 Y84 R94 P170 M171 G176	G63-E174 WeakPolarHBondContact CA-O 3.3Å; Y82-E174 HydrophobicContact CD1-CG 3.77Å; Y82-E174 HydrophobicContact CD2-CB 3.71Å; Y82-E174 HydrophobicContact CD2-CG 3.67Å; Y82-E174 HydrophobicContact CE1-CG 3.98Å; Y82-E174 HydrophobicContact CE2-CB 4.23Å; Y82-E174 HydrophobicContact CE2-CG 3.87Å; Y82-E174 HydrophobicContact CG-CB 3.88Å; Y82-E174 HydrophobicContact CG-CG 3.62Å; Y84-E174 WeakPolarHBondContact CE2-OE2 3.49Å; Y84-E174 PolarHBondContact OH-OE2 3.4Å; R94-E174 IonicContact CZ-OE1 2.84Å; R94-E174 IonicContact NE-OE1 3.13Å; R94-E174 PolarHBondContact NE-OE1 3.12Å; R94-E174 IonicContact NE-OE2 3.89Å; R94-E174 IonicContact NH2-OE1 3.37Å; R94-E174 PolarHBondContact NH2-OE1 3.38Å; P170-E174 WeakPolarHBondContact O-CB 3.44Å; P170-E174 WeakPolarHBondContact O-CG 3.5Å; P170-E174 PolarHBondContact O-N 3.32Å; M171-E174 PolarHBondContact O-N 2.94Å; E174-G176 PolarHBondContact O-N 3.17Å
175	A	72.7	Confident	83	Confident	18 Å²	18	51.1 Å²	51.1	15%	0.149	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-1	173.8	0	0	0	0	0	113.6	S62 M171 I172 S173 L177 F300	S62-A175 WeakPolarHBondContact O-CA 3.47Å; M171-A175 PolarHBondContact O-N 2.85Å; I172-A175 PolarHBondContact O-N 2.78Å; S173-A175 VanDerWaalsContact C-N 3.3Å; S173-A175 PolarHBondContact O-N 2.89Å; A175-L177 VanDerWaalsContact C-N 3.28Å; A175-L177 HydrophobicContact CB-CD1 4.07Å; A175-L177 HydrophobicContact CB-CG 3.94Å; A175-L177 PolarHBondContact O-N 3.23Å; A175-F300 HydrophobicContact CB-CD2 3.91Å; A175-F300 HydrophobicContact CB-CE2 3.45Å; A175-F300 VanDerWaalsContact CB-CE2 3.45Å; A175-F300 HydrophobicContact CB-CZ 4.48Å
176	G	74.7	Confident	83	Confident	38 Å²	38	52.5 Å²	52.5	39%	0.392	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.4	29.2	-179.7	0	0	0	0	0	113	I172 S173 E174	I172-G176 PolarHBondContact O-N 3.02Å; S173-G176 PolarHBondContact O-N 3.17Å; E174-G176 PolarHBondContact O-N 3.17Å
177	L	81.4	Confident	83.1	Confident	17 Å²	17	55.4 Å²	55.4	9%	0.089	29%	0.289	C	S	.	.			trans	-94.3	138.4	177.2	-55.5	176.6	0	0	0	109.6	P145 L147 I172 A175 F300	P145-L177 HydrophobicContact CB-CD2 4Å; P145-L177 HydrophobicContact CG-CD2 3.56Å; L147-L177 HydrophobicContact CD1-CB 4.46Å; L147-L177 HydrophobicContact CD1-CD1 3.8Å; I172-L177 HydrophobicContact CG2-CB 3.7Å; I172-L177 HydrophobicContact CG2-CD1 4.33Å; I172-L177 PolarHBondContact O-N 2.74Å; A175-L177 VanDerWaalsContact C-N 3.28Å; A175-L177 HydrophobicContact CB-CD1 4.07Å; A175-L177 HydrophobicContact CB-CG 3.94Å; A175-L177 PolarHBondContact O-N 3.23Å; L177-F300 HydrophobicContact CD1-CD1 4.19Å; L177-F300 HydrophobicContact CD1-CD2 3.9Å; L177-F300 HydrophobicContact CD1-CE1 4.06Å; L177-F300 HydrophobicContact CD1-CE2 3.78Å; L177-F300 HydrophobicContact CD1-CG 4.13Å; L177-F300 HydrophobicContact CD1-CZ 3.88Å
178	S	83.9	Confident	83.6	Confident	50 Å²	50	55.7 Å²	55.7	35%	0.35	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	138.6	172.4	-68.5	0	0	0	0	108.5	P145 R146 L147	P145-S178 PolarHBondContact O-N 3.23Å; P145-S178 VanDerWaalsContact O-O 3.1Å; R146-S178 CarbonylContact C-O 3.47Å; R146-S178 WeakPolarHBondContact CA-O 3.49Å; L147-S178 PolarHBondContact N-O 3.1Å
179	F	86.1	Confident	84.1	Confident	76 Å²	76	57.2 Å²	57.2	33%	0.333	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	152.6	-177.5	68.6	-92	0	0	0	113.6	L147 L149 L169 I172	L147-F179 HydrophobicContact CB-CB 4.43Å; L147-F179 CarbonylContact O-C 3.54Å; L147-F179 WeakPolarHBondContact O-CA 3.26Å; L149-F179 HydrophobicContact CD1-CB 3.45Å; L149-F179 VanDerWaalsContact CD1-CB 3.45Å; L149-F179 HydrophobicContact CD1-CD2 4.1Å; L149-F179 HydrophobicContact CD1-CG 4.03Å; L169-F179 HydrophobicContact CB-CE2 4.5Å; L169-F179 HydrophobicContact CB-CZ 4.09Å; L169-F179 HydrophobicContact CD1-CE2 4.43Å; L169-F179 HydrophobicContact CD2-CD2 4.15Å; L169-F179 HydrophobicContact CD2-CE2 3.62Å; L169-F179 HydrophobicContact CD2-CZ 4.04Å; L169-F179 HydrophobicContact CG-CE2 4.38Å; L169-F179 HydrophobicContact CG-CZ 4.46Å; I172-F179 HydrophobicContact CB-CD1 4.16Å; I172-F179 HydrophobicContact CB-CE1 4.49Å; I172-F179 HydrophobicContact CG2-CB 4.01Å; I172-F179 HydrophobicContact CG2-CD1 3.41Å; I172-F179 VanDerWaalsContact CG2-CD1 3.41Å; I172-F179 HydrophobicContact CG2-CE1 4.17Å; I172-F179 HydrophobicContact CG2-CG 3.96Å
180	N	90.6	Very high	84.3	Confident	72 Å²	72	56 Å²	56	39%	0.385	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	129	169.2	-173.3	7.4	0	0	0	109.6	L147 L148 L149 W202	L147-N180 PolarHBondContact O-N 2.88Å; L148-N180 HydrophobicContact CD1-CB 4.38Å; L149-N180 PolarHBondContact N-O 3.15Å; N180-W202 HydrophobicContact CB-CH2 3.31Å; N180-W202 HydrophobicContact CB-CZ2 4.31Å; N180-W202 HydrophobicContact CB-CZ3 3.7Å
181	L	89.9	Confident	84.7	Confident	43 Å²	43	57 Å²	57	23%	0.225	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	115.4	-175.3	-177.5	68.7	0	0	0	109.6	L149 V151 W161 L169	L149-L181 HydrophobicContact CB-CD1 3.65Å; L149-L181 HydrophobicContact CD2-CD1 4.3Å; V151-L181 HydrophobicContact CB-CD1 4.5Å; V151-L181 HydrophobicContact CG2-CD1 3.37Å; W161-L181 HydrophobicContact CH2-CD2 3.6Å; W161-L181 HydrophobicContact CH2-CG 4.32Å; W161-L181 HydrophobicContact CZ3-CD2 3.61Å; W161-L181 HydrophobicContact CZ3-CG 4.03Å; L169-L181 HydrophobicContact CD1-CD2 3.88Å; L169-L181 HydrophobicContact CD2-CD1 4.24Å; L169-L181 HydrophobicContact CD2-CD2 4.22Å
182	I	90.6	Very high	85.3	Confident	37 Å²	37	61 Å²	61	19%	0.19	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.2	175.9	-53.6	-176.3	0	0	0	109.4	L148 L149 L150 V151 L193	L148-I182 HydrophobicContact CD1-CD1 3.72Å; L148-I182 HydrophobicContact CD1-CG1 4.08Å; L149-I182 PolarHBondContact O-N 3.17Å; L150-I182 HydrophobicContact CD2-CB 3.89Å; L150-I182 HydrophobicContact CD2-CD1 4.45Å; L150-I182 HydrophobicContact CD2-CG2 4.42Å; V151-I182 PolarHBondContact N-O 3.35Å; I182-L193 HydrophobicContact CG2-CD1 3.76Å
183	Q	90.9	Very high	85.8	Confident	82 Å²	82	62.8 Å²	62.8	38%	0.383	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	126.8	173.8	-176	178.5	-18.2	0	0	109.5	V151 P153 W161	V151-Q183 WeakPolarHBondContact O-CA 3.29Å; P153-Q183 HydrophobicContact CB-CG 4.19Å; P153-Q183 HydrophobicContact CG-CG 3.85Å; W161-Q183 HydrophobicContact CZ3-CB 4.15Å
184	T	89.3	Confident	86.1	Confident	6 Å²	6	59 Å²	59	4%	0.037	29%	0.292	C	S	.	.			trans	-84.3	127	175.8	61.8	0	0	0	0	110.6	V151 N152 P153 A190 L213	V151-T184 PolarHBondContact O-N 3.08Å; V151-T184 PolarHBondContact O-OG1 3.28Å; N152-T184 WeakPolarHBondContact CA-OG1 3.34Å; P153-T184 WeakPolarHBondContact CD-O 3.42Å; T184-A190 HydrophobicContact CG2-CB 4.15Å; T184-L213 HydrophobicContact CG2-CD1 3.84Å
185	E	87.3	Confident	86.5	Confident	152 Å²	152	61.9 Å²	61.9	71%	0.71	31%	0.306	S	S	*	.			trans	-94.5	-30	-176.8	-59	-177.2	170.5	0	0	114.8	H189	E185-H189 PolarHBondContact N-ND1 2.91Å; E185-H189 VanDerWaalsContact N-ND1 3.19Å
186	R	86.9	Confident	86.9	Confident	151 Å²	151	64.4 Å²	64.4	57%	0.57	33%	0.334	S	S	*	.	S	Bend	trans	-144.1	163.9	-173.2	62.8	-176.6	-172.1	143.9	6.5	111.8	H189 E192	R186-H189 HydrophobicContact CG-CB 3.79Å; R186-H189 WeakPolarHBondContact O-CB 3.49Å; R186-H189 PolarHBondContact O-N 2.97Å; R186-E192 IonicContact CZ-OE1 3.74Å; R186-E192 IonicContact CZ-OE2 2.68Å; R186-E192 IonicContact NE-OE2 2.71Å; R186-E192 IonicContact NH2-OE1 3.64Å; R186-E192 PolarHBondContact NH2-OE1 3.48Å; R186-E192 IonicContact NH2-OE2 2.66Å; R186-E192 PolarHBondContact NH2-OE2 2.77Å
187	Q	83.1	Confident	87.4	Confident	167 Å²	167	64.1 Å²	64.1	78%	0.78	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	142.9	172	-68.6	177.9	-0.9	0	0	110.4	H189	Q187-H189 PolarHBondContact O-N 2.81Å
188	N	86.3	Confident	87.6	Confident	80 Å²	80	65.8 Å²	65.8	43%	0.428	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	3	-174.2	-57.9	-53.6	0	0	0	115.7	A190 R191 E192 E216	N188-A190 VanDerWaalsContact C-N 3.3Å; N188-A190 PolarHBondContact O-N 2.94Å; N188-R191 HydrophobicContact CB-CB 4.46Å; N188-R191 WeakPolarHBondContact O-CB 3.34Å; N188-R191 PolarHBondContact O-N 2.82Å; N188-E192 WeakPolarHBondContact O-CG 3.37Å; N188-E192 PolarHBondContact O-N 3.25Å; N188-E216 VanDerWaalsContact CA-OE2 3.27Å; N188-E216 WeakPolarHBondContact CA-OE2 3.33Å; N188-E216 PolarHBondContact N-OE1 3.48Å; N188-E216 PolarHBondContact N-OE2 3.21Å; N188-E216 VanDerWaalsContact N-OE2 3.07Å
189	H	89.4	Confident	87.4	Confident	34 Å²	34	64.2 Å²	64.2	16%	0.157	32%	0.324	C	S	.	.	H	α-helix	trans	-63.4	-39.7	175.5	-172.6	-175.9	0	0	0	110.9	E185 R186 Q187 R191 E192 L193	E185-H189 PolarHBondContact N-ND1 2.91Å; E185-H189 VanDerWaalsContact N-ND1 3.19Å; R186-H189 HydrophobicContact CG-CB 3.79Å; R186-H189 WeakPolarHBondContact O-CB 3.49Å; R186-H189 PolarHBondContact O-N 2.97Å; Q187-H189 PolarHBondContact O-N 2.81Å; H189-R191 VanDerWaalsContact C-N 3.28Å; H189-R191 PolarHBondContact O-N 2.77Å; H189-E192 PolarHBondContact O-N 3.19Å; H189-L193 WeakPolarHBondContact O-CB 3.22Å; H189-L193 VanDerWaalsContact O-CG 3.26Å; H189-L193 WeakPolarHBondContact O-CG 3.03Å; H189-L193 PolarHBondContact O-N 2.77Å
190	A	87.8	Confident	87.2	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-64.9	-35.8	177.5	0	0	0	0	0	112	L150 T184 N188 V194 L213 E216 V217	L150-A190 HydrophobicContact CD1-CB 4.23Å; T184-A190 HydrophobicContact CG2-CB 4.15Å; N188-A190 VanDerWaalsContact C-N 3.3Å; N188-A190 PolarHBondContact O-N 2.94Å; A190-V194 WeakPolarHBondContact O-CB 3.34Å; A190-V194 WeakPolarHBondContact O-CG2 2.91Å; A190-V194 PolarHBondContact O-N 3.31Å; A190-L213 HydrophobicContact CB-CD1 3.47Å; A190-L213 VanDerWaalsContact CB-CD1 3.47Å; A190-E216 HydrophobicContact CB-CB 3.98Å; A190-E216 PolarHBondContact N-OE2 2.95Å; A190-V217 HydrophobicContact CB-CG2 4.15Å
191	R	89.6	Confident	86.9	Confident	74 Å²	74	66 Å²	66	28%	0.279	34%	0.342	S	S	.	.	H	α-helix	trans	-61.7	-51.9	174.8	179.7	178.1	-179.6	149.1	-3.7	111.2	N188 H189 L193 V194 Q195 E216 D223	N188-R191 HydrophobicContact CB-CB 4.46Å; N188-R191 WeakPolarHBondContact O-CB 3.34Å; N188-R191 PolarHBondContact O-N 2.82Å; H189-R191 VanDerWaalsContact C-N 3.28Å; H189-R191 PolarHBondContact O-N 2.77Å; R191-L193 VanDerWaalsContact C-N 3.33Å; R191-L193 PolarHBondContact O-N 3.03Å; R191-V194 PolarHBondContact O-N 3.33Å; R191-Q195 VanDerWaalsContact O-CG 3.3Å; R191-Q195 WeakPolarHBondContact O-CG 3.14Å; R191-Q195 PolarHBondContact O-N 3.36Å; R191-E216 HydrophobicContact CB-CB 4.35Å; R191-E216 WeakPolarHBondContact CB-O 2.92Å; R191-D223 IonicContact CZ-OD1 3.94Å; R191-D223 IonicContact CZ-OD2 3.81Å; R191-D223 IonicContact NE-OD2 2.61Å; R191-D223 PolarHBondContact NE-OD2 2.91Å; R191-D223 IonicContact NH1-OD2 2.88Å; R191-D223 IonicContact NH2-OD1 3.25Å; R191-D223 PolarHBondContact NH2-OD1 3.06Å; R191-D223 IonicContact NH2-OD2 2.89Å; R191-D223 PolarHBondContact NH2-OD2 2.93Å
192	E	90.3	Very high	86.6	Confident	87 Å²	87	64.9 Å²	64.9	41%	0.407	34%	0.335	S	S	.	.	H	α-helix	trans	-59.4	-43	178.1	-69.5	172.4	178.5	0	0	111.9	R186 N188 H189 Q195 G196	R186-E192 IonicContact CZ-OE1 3.74Å; R186-E192 IonicContact CZ-OE2 2.68Å; R186-E192 IonicContact NE-OE2 2.71Å; R186-E192 IonicContact NH2-OE1 3.64Å; R186-E192 PolarHBondContact NH2-OE1 3.48Å; R186-E192 IonicContact NH2-OE2 2.66Å; R186-E192 PolarHBondContact NH2-OE2 2.77Å; N188-E192 WeakPolarHBondContact O-CG 3.37Å; N188-E192 PolarHBondContact O-N 3.25Å; H189-E192 PolarHBondContact O-N 3.19Å; E192-Q195 PolarHBondContact O-N 3.17Å; E192-G196 PolarHBondContact O-N 3.21Å; E192-G196 VanDerWaalsContact O-N 3.09Å
193	L	89.6	Confident	86.1	Confident	40 Å²	40	65.7 Å²	65.7	21%	0.209	34%	0.34	C	S	.	.	H	α-helix	trans	-59.6	-52.4	176.2	-73.4	168.7	0	0	0	110.9	L150 I182 H189 R191 Q195 G196 L197	L150-L193 HydrophobicContact CD2-CD1 4.39Å; I182-L193 HydrophobicContact CG2-CD1 3.76Å; H189-L193 WeakPolarHBondContact O-CB 3.22Å; H189-L193 VanDerWaalsContact O-CG 3.26Å; H189-L193 WeakPolarHBondContact O-CG 3.03Å; H189-L193 PolarHBondContact O-N 2.77Å; R191-L193 VanDerWaalsContact C-N 3.33Å; R191-L193 PolarHBondContact O-N 3.03Å; L193-Q195 VanDerWaalsContact C-N 3.28Å; L193-Q195 PolarHBondContact O-N 3.24Å; L193-G196 PolarHBondContact O-N 3.44Å; L193-G196 VanDerWaalsContact O-N 3.12Å; L193-L197 HydrophobicContact CB-CD1 4.31Å; L193-L197 WeakPolarHBondContact O-CB 3.33Å; L193-L197 VanDerWaalsContact O-CD1 3.27Å; L193-L197 WeakPolarHBondContact O-CD1 3.44Å; L193-L197 WeakPolarHBondContact O-CG 3.44Å; L193-L197 PolarHBondContact O-N 2.82Å
194	V	88.1	Confident	85.8	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-64.8	-33.3	-177.1	173.1	0	0	0	0	112.1	L150 A190 R191 V217 L221 R224	L150-V194 HydrophobicContact CD1-CG2 4.19Å; A190-V194 WeakPolarHBondContact O-CB 3.34Å; A190-V194 WeakPolarHBondContact O-CG2 2.91Å; A190-V194 PolarHBondContact O-N 3.31Å; R191-V194 PolarHBondContact O-N 3.33Å; V194-V217 HydrophobicContact CG2-CB 4.46Å; V194-V217 HydrophobicContact CG2-CG1 4.15Å; V194-V217 HydrophobicContact CG2-CG2 4.19Å; V194-L221 HydrophobicContact CG1-CB 4.47Å; V194-L221 HydrophobicContact CG1-CD2 3.39Å; V194-L221 HydrophobicContact CG1-CG 3.63Å; V194-R224 PolarHBondContact O-NH1 3.07Å
195	Q	87.2	Confident	85.6	Confident	76 Å²	76	61.8 Å²	61.8	36%	0.355	32%	0.322	S	S	.	.	H	α-helix	trans	-65.6	-39.2	173	-74.4	174.7	-4.7	0	0	112.6	R191 E192 L193 G220 D223 R224	R191-Q195 VanDerWaalsContact O-CG 3.3Å; R191-Q195 WeakPolarHBondContact O-CG 3.14Å; R191-Q195 PolarHBondContact O-N 3.36Å; E192-Q195 PolarHBondContact O-N 3.17Å; L193-Q195 VanDerWaalsContact C-N 3.28Å; L193-Q195 PolarHBondContact O-N 3.24Å; Q195-G220 WeakPolarHBondContact CG-O 3.46Å; Q195-D223 HydrophobicContact CG-CB 4.4Å; Q195-D223 PolarHBondContact NE2-OD2 3.36Å; Q195-R224 HydrophobicContact CG-CG 4.49Å; Q195-R224 PolarHBondContact O-NH1 3.44Å
196	G	82.6	Confident	85.5	Confident	71 Å²	71	55 Å²	55	73%	0.732	29%	0.291	S	S	*	.	H	α-helix	trans	-84.9	-9.1	-179.8	0	0	0	0	0	115.3	E192 L193	E192-G196 PolarHBondContact O-N 3.21Å; E192-G196 VanDerWaalsContact O-N 3.09Å; L193-G196 PolarHBondContact O-N 3.44Å; L193-G196 VanDerWaalsContact O-N 3.12Å
197	L	85.6	Confident	85.5	Confident	32 Å²	32	47.9 Å²	47.9	17%	0.168	26%	0.264	C	S	.	.	S	Bend	trans	-82	143	-173.1	-84.6	162.9	0	0	0	113.4	L148 L193 L199 R224	L148-L197 HydrophobicContact CD2-CD1 3.39Å; L193-L197 HydrophobicContact CB-CD1 4.31Å; L193-L197 WeakPolarHBondContact O-CB 3.33Å; L193-L197 VanDerWaalsContact O-CD1 3.27Å; L193-L197 WeakPolarHBondContact O-CD1 3.44Å; L193-L197 WeakPolarHBondContact O-CG 3.44Å; L193-L197 PolarHBondContact O-N 2.82Å; L197-L199 PolarHBondContact O-N 3.42Å; L197-R224 PolarHBondContact O-NH1 2.84Å; L197-R224 PolarHBondContact O-NH2 3.01Å
198	S	84.9	Confident	85.5	Confident	51 Å²	51	39.9 Å²	39.9	36%	0.357	23%	0.227	S	C	.	.			trans	-78.1	95.8	169.4	22.7	0	0	0	0	109.9	S200 E201	S198-S200 PolarHBondContact O-N 2.8Å; S198-S200 VanDerWaalsContact O-N 3.14Å; S198-E201 WeakPolarHBondContact CB-OE2 3.29Å; S198-E201 PolarHBondContact O-N 2.93Å; S198-E201 VanDerWaalsContact O-N 3.08Å; S198-E201 PolarHBondContact OG-OE2 3.14Å
199	L	80.4	Confident	85.2	Confident	18 Å²	18	36.5 Å²	36.5	9%	0.094	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-58.7	-26.8	-178.9	-64.4	179.2	0	0	0	113.1	L197 E201 W202 I205 L221 A230 M233	L197-L199 PolarHBondContact O-N 3.42Å; L199-E201 PolarHBondContact O-N 3.1Å; L199-W202 PolarHBondContact O-N 3.22Å; L199-I205 HydrophobicContact CD2-CD1 4.47Å; L199-L221 HydrophobicContact CD1-CD2 4.02Å; L199-L221 HydrophobicContact CD2-CD2 3.89Å; L199-A230 HydrophobicContact CD1-CB 3.32Å; L199-M233 HydrophobicContact CB-CE 3.72Å; L199-M233 HydrophobicContact CD2-CE 4.14Å; L199-M233 HydrophobicContact CG-CE 4.43Å; L199-M233 WeakPolarHBondContact O-CE 3.49Å
200	S	80.1	Confident	84.5	Confident	102 Å²	102	35.5 Å²	35.5	71%	0.713	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-63.3	-19.6	176.5	56.3	0	0	0	0	114.7	S198	S198-S200 PolarHBondContact O-N 2.8Å; S198-S200 VanDerWaalsContact O-N 3.14Å
201	E	84.7	Confident	83.8	Confident	82 Å²	82	37.6 Å²	37.6	38%	0.383	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-86.2	-14.7	179.6	-66.3	-169.6	92	0	0	113.7	R146 S198 L199	R146-E201 WeakPolarHBondContact CD-O 3.47Å; R146-E201 IonicContact NH1-OE1 3.07Å; S198-E201 WeakPolarHBondContact CB-OE2 3.29Å; S198-E201 PolarHBondContact O-N 2.93Å; S198-E201 VanDerWaalsContact O-N 3.08Å; S198-E201 PolarHBondContact OG-OE2 3.14Å; L199-E201 PolarHBondContact O-N 3.1Å
202	W	84.3	Confident	83.4	Confident	21 Å²	21	36.4 Å²	36.4	8%	0.08	23%	0.23	C	C	.	.			trans	-116.9	137.2	-173.5	-55.5	100.3	0	0	0	110.1	R146 L147 L148 N180 L199 M233	R146-W202 HydrophobicContact CB-CE3 4.01Å; R146-W202 HydrophobicContact CB-CZ3 4.27Å; L147-W202 WeakPolarHBondContact O-CZ3 3.5Å; L148-W202 HydrophobicContact CB-CD2 4.02Å; L148-W202 HydrophobicContact CB-CE3 3.96Å; L148-W202 HydrophobicContact CB-CG 4.41Å; L148-W202 HydrophobicContact CB-CZ3 4.46Å; L148-W202 HydrophobicContact CD1-CH2 4.47Å; L148-W202 HydrophobicContact CD1-CZ2 4.35Å; N180-W202 HydrophobicContact CB-CH2 3.31Å; N180-W202 HydrophobicContact CB-CZ2 4.31Å; N180-W202 HydrophobicContact CB-CZ3 3.7Å; L199-W202 PolarHBondContact O-N 3.22Å; W202-M233 WeakPolarHBondContact O-CE 3.2Å
203	D	81	Confident	83.1	Confident	54 Å²	54	32.5 Å²	32.5	29%	0.289	21%	0.212	S	C	.	.	S	Bend	trans	-94.5	-7.6	175.4	-52.9	-68.3	0	0	0	111.3	R143 P145 R146 P234	R143-D203 IonicContact NH2-OD1 3.99Å; R143-D203 PolarHBondContact NH2-OD1 3.17Å; R143-D203 VanDerWaalsContact NH2-OD1 3.13Å; P145-D203 VanDerWaalsContact CA-OD2 3.25Å; P145-D203 WeakPolarHBondContact CA-OD2 3.35Å; P145-D203 HydrophobicContact CB-CB 4.27Å; R146-D203 PolarHBondContact N-OD2 2.98Å; R146-D203 PolarHBondContact O-N 3.37Å; D203-P234 WeakPolarHBondContact O-CG 3.14Å
204	G	83.4	Confident	82.9	Confident	3 Å²	3	30.8 Å²	30.8	3%	0.031	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.9	160.1	173.8	0	0	0	0	0	114.5	L147 L148 P234	L147-G204 WeakPolarHBondContact CA-O 3.34Å; L148-G204 PolarHBondContact N-O 2.8Å; G204-P234 WeakPolarHBondContact CA-O 3.11Å
205	I	85.6	Confident	82.7	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.01	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132.8	178.7	-56.2	174.7	0	0	0	108.8	L148 L150 L199 V217 L221 M233 P234 V235 G236	L148-I205 HydrophobicContact CB-CG1 4.35Å; L148-I205 HydrophobicContact CD2-CG1 4.38Å; L148-I205 HydrophobicContact CD2-CG2 4.47Å; L148-I205 CarbonylContact O-C 3.54Å; L148-I205 WeakPolarHBondContact O-CA 3.43Å; L150-I205 HydrophobicContact CD1-CG2 4.17Å; L150-I205 HydrophobicContact CG-CG2 4.48Å; L199-I205 HydrophobicContact CD2-CD1 4.47Å; I205-V217 HydrophobicContact CD1-CG1 4.46Å; I205-V217 HydrophobicContact CG2-CG1 4.23Å; I205-L221 HydrophobicContact CD1-CD2 4.43Å; I205-M233 HydrophobicContact CD1-CG 4.12Å; I205-M233 HydrophobicContact CG1-CG 4.11Å; I205-P234 PolarHBondContact N-O 2.84Å; I205-V235 CarbonylContact O-C 3.55Å; I205-V235 VanDerWaalsContact O-CA 3.3Å; I205-V235 WeakPolarHBondContact O-CA 3.35Å; I205-G236 PolarHBondContact O-N 2.82Å
206	V	85.6	Confident	82.8	Confident	11 Å²	11	34.1 Å²	34.1	7%	0.067	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	125	177.1	-178	0	0	0	0	109.3	L147 L148 L149 L150 G236 L238	L147-V206 HydrophobicContact CD1-CG2 4.43Å; L148-V206 PolarHBondContact O-N 2.99Å; L149-V206 CarbonylContact C-O 3.41Å; L149-V206 WeakPolarHBondContact CA-O 3.24Å; L149-V206 HydrophobicContact CG-CB 4.34Å; L150-V206 PolarHBondContact N-O 3.14Å; V206-G236 CarbonylContact C-O 3.51Å; V206-G236 WeakPolarHBondContact CA-O 3.45Å; V206-L238 HydrophobicContact CG1-CD1 3.67Å; V206-L238 HydrophobicContact CG1-CG 3.94Å
207	T	86.1	Confident	83.1	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	130.8	179.1	58.5	0	0	0	0	110.3	L150 L213 V217 G236 L238	L150-T207 CarbonylContact O-C 3.42Å; L150-T207 WeakPolarHBondContact O-CA 3.42Å; T207-L213 HydrophobicContact CG2-CD2 4.47Å; T207-L213 HydrophobicContact CG2-CG 4.27Å; T207-V217 HydrophobicContact CG2-CB 4.38Å; T207-V217 HydrophobicContact CG2-CG2 3.73Å; T207-G236 PolarHBondContact N-O 2.77Å; T207-G236 PolarHBondContact OG1-O 2.83Å; T207-G236 VanDerWaalsContact OG1-O 3.08Å; T207-L238 PolarHBondContact O-N 3.3Å
208	V	83.6	Confident	83.2	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	86.9	179	-167.4	0	0	0	0	108.7	L149 L150 V151 N152 C164 L238 C240	L149-V208 HydrophobicContact CD2-CG2 4.49Å; L150-V208 PolarHBondContact O-N 2.91Å; V151-V208 HydrophobicContact CB-CB 4.3Å; V151-V208 HydrophobicContact CG1-CB 4.16Å; V151-V208 HydrophobicContact CG1-CG1 4.4Å; V151-V208 HydrophobicContact CG2-CB 3.83Å; V151-V208 HydrophobicContact CG2-CG2 3.84Å; N152-V208 PolarHBondContact N-O 2.78Å; C164-V208 HydrophobicContact CB-CG1 4.18Å; V208-L238 HydrophobicContact CB-CB 4.36Å; V208-L238 HydrophobicContact CG1-CB 4.17Å; V208-L238 HydrophobicContact CG2-CB 4.13Å; V208-L238 HydrophobicContact CG2-CD1 3.73Å; V208-L238 HydrophobicContact CG2-CG 4.48Å; V208-C240 HydrophobicContact CG1-CB 4.43Å; V208-C240 WeakPolarHBondContact CG1-SG 3.43Å
209	S	79.9	Confident	83.4	Confident	8 Å²	8	30.2 Å²	30.2	6%	0.056	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.8	-156.3	-178.5	-161.6	0	0	0	0	110.8	N152 L238 C240	N152-S209 WeakPolarHBondContact CB-OG 3.42Å; S209-L238 PolarHBondContact N-O 2.93Å; S209-C240 PolarHBondContact O-N 3.15Å
210	G	73.3	Confident	83.7	Confident	13 Å²	13	29.3 Å²	29.3	13%	0.134	17%	0.172	C	C	.	.	S	Bend	trans	-93.8	-167.5	160.7	0	0	0	0	0	112.2	G212 L213	G210-G212 PolarHBondContact O-N 2.97Å; G210-G212 VanDerWaalsContact O-N 3.11Å; G210-L213 PolarHBondContact O-N 3Å
211	D	73.4	Confident	84	Confident	44 Å²	44	24.7 Å²	24.7	24%	0.235	14%	0.139	C	C	.	.	H	α-helix	trans	-59.6	-26.2	-172.8	-60.2	-38.9	0	0	0	114.2	L214 H215 G243 A245 L246	D211-L214 PolarHBondContact O-N 2.83Å; D211-H215 PolarHBondContact O-N 3.15Å; D211-H215 VanDerWaalsContact O-N 3.09Å; D211-G243 PolarHBondContact N-O 3.38Å; D211-G243 VanDerWaalsContact OD2-O 3.12Å; D211-A245 PolarHBondContact OD2-N 2.92Å; D211-L246 WeakPolarHBondContact OD1-CB 3.49Å; D211-L246 PolarHBondContact OD1-N 3.27Å
212	G	81	Confident	84.1	Confident	49 Å²	49	23.9 Å²	23.9	51%	0.505	14%	0.137	S	C	.	.	H	α-helix	trans	-64.7	-40.2	-177.4	0	0	0	0	0	114.4	G210 L214 H215 E216	G210-G212 PolarHBondContact O-N 2.97Å; G210-G212 VanDerWaalsContact O-N 3.11Å; G212-L214 VanDerWaalsContact C-N 3.35Å; G212-L214 PolarHBondContact O-N 3.38Å; G212-H215 WeakPolarHBondContact O-CB 3.32Å; G212-H215 PolarHBondContact O-N 2.86Å; G212-E216 PolarHBondContact O-N 2.9Å; G212-E216 VanDerWaalsContact O-N 3.13Å
213	L	84.8	Confident	84.2	Confident	6 Å²	6	26.5 Å²	26.5	3%	0.031	15%	0.152	C	C	.	.	H	α-helix	trans	-68.3	-38.2	-180	-177.7	61.7	0	0	0	111.4	L150 N152 T184 A190 T207 G210 H215 E216 V217	L150-L213 HydrophobicContact CB-CD2 4.23Å; L150-L213 WeakPolarHBondContact O-CD2 3.49Å; N152-L213 HydrophobicContact CB-CD2 4.33Å; T184-L213 HydrophobicContact CG2-CD1 3.84Å; A190-L213 HydrophobicContact CB-CD1 3.47Å; A190-L213 VanDerWaalsContact CB-CD1 3.47Å; T207-L213 HydrophobicContact CG2-CD2 4.47Å; T207-L213 HydrophobicContact CG2-CG 4.27Å; G210-L213 PolarHBondContact O-N 3Å; L213-H215 VanDerWaalsContact C-N 3.32Å; L213-E216 PolarHBondContact O-N 3.43Å; L213-V217 WeakPolarHBondContact O-CG2 3.41Å; L213-V217 PolarHBondContact O-N 3.19Å; L213-V217 VanDerWaalsContact O-N 3.11Å
214	L	84.6	Confident	84.4	Confident	4 Å²	4	25.3 Å²	25.3	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-62.6	-43	173.8	177.1	74.3	0	0	0	111.2	D211 G212 E216 V217 L218 V235 I237 L246	D211-L214 PolarHBondContact O-N 2.83Å; G212-L214 VanDerWaalsContact C-N 3.35Å; G212-L214 PolarHBondContact O-N 3.38Å; L214-E216 VanDerWaalsContact C-N 3.28Å; L214-E216 PolarHBondContact O-N 2.91Å; L214-V217 PolarHBondContact O-N 3.43Å; L214-V217 VanDerWaalsContact O-N 3.12Å; L214-L218 HydrophobicContact CD1-CD1 4.3Å; L214-L218 HydrophobicContact CD1-CG 4.15Å; L214-L218 HydrophobicContact CD2-CD1 4.16Å; L214-L218 HydrophobicContact CG-CD1 3.89Å; L214-L218 HydrophobicContact CG-CG 4.12Å; L214-L218 WeakPolarHBondContact O-CG 3.34Å; L214-L218 PolarHBondContact O-N 3.38Å; L214-V235 HydrophobicContact CD1-CB 4.48Å; L214-V235 HydrophobicContact CD1-CG1 3.42Å; L214-V235 VanDerWaalsContact CD1-CG1 3.42Å; L214-I237 HydrophobicContact CB-CG1 4.42Å; L214-I237 HydrophobicContact CD1-CD1 4.21Å; L214-I237 HydrophobicContact CD1-CG1 3.79Å; L214-I237 HydrophobicContact CD2-CD1 3.34Å; L214-I237 HydrophobicContact CD2-CG1 3.77Å; L214-I237 HydrophobicContact CG-CD1 4.28Å; L214-I237 HydrophobicContact CG-CG1 4.19Å; L214-L246 HydrophobicContact CD2-CD2 3.06Å; L214-L246 HydrophobicContact CD2-CG 4.48Å
215	H	85	Confident	84.4	Confident	114 Å²	114	31.6 Å²	31.6	53%	0.528	18%	0.184	S	C	.	.	H	α-helix	trans	-59.3	-41.4	178.7	-174.8	66.9	0	0	0	111.7	D211 G212 L213 L218 N219	D211-H215 PolarHBondContact O-N 3.15Å; D211-H215 VanDerWaalsContact O-N 3.09Å; G212-H215 WeakPolarHBondContact O-CB 3.32Å; G212-H215 PolarHBondContact O-N 2.86Å; L213-H215 VanDerWaalsContact C-N 3.32Å; H215-L218 PolarHBondContact O-N 2.99Å; H215-N219 PolarHBondContact CD2-ND2 2.7Å; H215-N219 PolarHBondContact CE1-ND2 3.43Å; H215-N219 VanDerWaalsContact CE1-ND2 3.26Å; H215-N219 PolarHBondContact NE2-ND2 3.39Å; H215-N219 WeakPolarHBondContact O-CB 3.39Å; H215-N219 VanDerWaalsContact O-CG 3.25Å; H215-N219 PolarHBondContact O-N 3.5Å; H215-N219 PolarHBondContact O-ND2 2.82Å
216	E	89.3	Confident	84.4	Confident	32 Å²	32	34.5 Å²	34.5	15%	0.15	20%	0.2	C	C	.	.	H	α-helix	trans	-60.5	-44	173.4	-68.7	-174.5	-163.5	0	0	112.3	N188 A190 R191 G212 L213 L214 G220	N188-E216 VanDerWaalsContact CA-OE2 3.27Å; N188-E216 WeakPolarHBondContact CA-OE2 3.33Å; N188-E216 PolarHBondContact N-OE1 3.48Å; N188-E216 PolarHBondContact N-OE2 3.21Å; N188-E216 VanDerWaalsContact N-OE2 3.07Å; A190-E216 HydrophobicContact CB-CB 3.98Å; A190-E216 PolarHBondContact N-OE2 2.95Å; R191-E216 HydrophobicContact CB-CB 4.35Å; R191-E216 WeakPolarHBondContact CB-O 2.92Å; G212-E216 PolarHBondContact O-N 2.9Å; G212-E216 VanDerWaalsContact O-N 3.13Å; L213-E216 PolarHBondContact O-N 3.43Å; L214-E216 VanDerWaalsContact C-N 3.28Å; L214-E216 PolarHBondContact O-N 2.91Å; E216-G220 PolarHBondContact O-N 3.06Å
217	V	88.3	Confident	84.3	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.6	-47.1	177.7	170.2	0	0	0	0	111.6	L150 A190 V194 I205 T207 L213 L214 G220 L221 V235	L150-V217 HydrophobicContact CD1-CG2 3.48Å; L150-V217 VanDerWaalsContact CD1-CG2 3.48Å; A190-V217 HydrophobicContact CB-CG2 4.15Å; V194-V217 HydrophobicContact CG2-CB 4.46Å; V194-V217 HydrophobicContact CG2-CG1 4.15Å; V194-V217 HydrophobicContact CG2-CG2 4.19Å; I205-V217 HydrophobicContact CD1-CG1 4.46Å; I205-V217 HydrophobicContact CG2-CG1 4.23Å; T207-V217 HydrophobicContact CG2-CB 4.38Å; T207-V217 HydrophobicContact CG2-CG2 3.73Å; L213-V217 WeakPolarHBondContact O-CG2 3.41Å; L213-V217 PolarHBondContact O-N 3.19Å; L213-V217 VanDerWaalsContact O-N 3.11Å; L214-V217 PolarHBondContact O-N 3.43Å; L214-V217 VanDerWaalsContact O-N 3.12Å; V217-G220 CarbonylContact O-C 3.48Å; V217-G220 PolarHBondContact O-N 3.47Å; V217-L221 HydrophobicContact CG1-CD1 4.41Å; V217-L221 WeakPolarHBondContact O-CG 3.36Å; V217-L221 PolarHBondContact O-N 3.43Å; V217-V235 HydrophobicContact CG1-CG1 4.36Å
218	L	87.5	Confident	84	Confident	31 Å²	31	45.6 Å²	45.6	16%	0.162	25%	0.246	C	C	.	.	H	α-helix	trans	-63.4	-46.2	-179.7	-70.2	176.9	0	0	0	111.4	L214 H215 G220 L221 L222 I344	L214-L218 HydrophobicContact CD1-CD1 4.3Å; L214-L218 HydrophobicContact CD1-CG 4.15Å; L214-L218 HydrophobicContact CD2-CD1 4.16Å; L214-L218 HydrophobicContact CG-CD1 3.89Å; L214-L218 HydrophobicContact CG-CG 4.12Å; L214-L218 WeakPolarHBondContact O-CG 3.34Å; L214-L218 PolarHBondContact O-N 3.38Å; H215-L218 PolarHBondContact O-N 2.99Å; L218-G220 VanDerWaalsContact C-N 3.27Å; L218-G220 PolarHBondContact O-N 3.45Å; L218-L221 PolarHBondContact O-N 3.31Å; L218-L222 VanDerWaalsContact O-CG 3.31Å; L218-L222 WeakPolarHBondContact O-CG 3.36Å; L218-L222 PolarHBondContact O-N 3.44Å; L218-I344 HydrophobicContact CD2-CG2 3.87Å
219	N	88.6	Confident	83.8	Confident	40 Å²	40	51 Å²	51	21%	0.214	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-40	174.4	-69.7	-23.5	0	0	0	111.1	H215 L221 L222 D223	H215-N219 PolarHBondContact CD2-ND2 2.7Å; H215-N219 PolarHBondContact CE1-ND2 3.43Å; H215-N219 VanDerWaalsContact CE1-ND2 3.26Å; H215-N219 PolarHBondContact NE2-ND2 3.39Å; H215-N219 WeakPolarHBondContact O-CB 3.39Å; H215-N219 VanDerWaalsContact O-CG 3.25Å; H215-N219 PolarHBondContact O-N 3.5Å; H215-N219 PolarHBondContact O-ND2 2.82Å; N219-L221 VanDerWaalsContact C-N 3.32Å; N219-L221 PolarHBondContact O-N 3.05Å; N219-L222 PolarHBondContact O-N 3Å; N219-L222 VanDerWaalsContact O-N 3.13Å; N219-D223 PolarHBondContact O-N 3.37Å
220	G	87.6	Confident	83.8	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.7	-36.1	176	0	0	0	0	0	113.5	Q195 E216 V217 L218 R224	Q195-G220 WeakPolarHBondContact CG-O 3.46Å; E216-G220 PolarHBondContact O-N 3.06Å; V217-G220 CarbonylContact O-C 3.48Å; V217-G220 PolarHBondContact O-N 3.47Å; L218-G220 VanDerWaalsContact C-N 3.27Å; L218-G220 PolarHBondContact O-N 3.45Å; G220-R224 WeakPolarHBondContact O-CG 3.46Å
221	L	86.5	Confident	84	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-70	-37.5	172.7	-67.7	171.9	0	0	0	111.9	V194 L199 I205 V217 L218 N219 A230 V235	V194-L221 HydrophobicContact CG1-CB 4.47Å; V194-L221 HydrophobicContact CG1-CD2 3.39Å; V194-L221 HydrophobicContact CG1-CG 3.63Å; L199-L221 HydrophobicContact CD1-CD2 4.02Å; L199-L221 HydrophobicContact CD2-CD2 3.89Å; I205-L221 HydrophobicContact CD1-CD2 4.43Å; V217-L221 HydrophobicContact CG1-CD1 4.41Å; V217-L221 WeakPolarHBondContact O-CG 3.36Å; V217-L221 PolarHBondContact O-N 3.43Å; L218-L221 PolarHBondContact O-N 3.31Å; N219-L221 VanDerWaalsContact C-N 3.32Å; N219-L221 PolarHBondContact O-N 3.05Å; L221-A230 HydrophobicContact CB-CB 4.28Å; L221-A230 HydrophobicContact CD2-CB 4.04Å; L221-V235 HydrophobicContact CD1-CG2 4.04Å
222	L	86	Confident	84.2	Confident	65 Å²	65	54.1 Å²	54.1	34%	0.34	28%	0.279	S	S	.	.	H	α-helix	trans	-75.6	-29.1	-176.3	-71.5	171.7	0	0	0	113.9	L218 N219 R224 W227	L218-L222 VanDerWaalsContact O-CG 3.31Å; L218-L222 WeakPolarHBondContact O-CG 3.36Å; L218-L222 PolarHBondContact O-N 3.44Å; N219-L222 PolarHBondContact O-N 3Å; N219-L222 VanDerWaalsContact O-N 3.13Å; L222-R224 PolarHBondContact O-N 3.21Å; L222-W227 HydrophobicContact CD2-CE3 4.36Å
223	D	86.9	Confident	84.1	Confident	76 Å²	76	52.8 Å²	52.8	41%	0.406	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-11.4	177.5	-60.5	-47.4	0	0	0	113.7	R191 Q195 N219	R191-D223 IonicContact CZ-OD1 3.94Å; R191-D223 IonicContact CZ-OD2 3.81Å; R191-D223 IonicContact NE-OD2 2.61Å; R191-D223 PolarHBondContact NE-OD2 2.91Å; R191-D223 IonicContact NH1-OD2 2.88Å; R191-D223 IonicContact NH2-OD1 3.25Å; R191-D223 PolarHBondContact NH2-OD1 3.06Å; R191-D223 IonicContact NH2-OD2 2.89Å; R191-D223 PolarHBondContact NH2-OD2 2.93Å; Q195-D223 HydrophobicContact CG-CB 4.4Å; Q195-D223 PolarHBondContact NE2-OD2 3.36Å; N219-D223 PolarHBondContact O-N 3.37Å
224	R	85.4	Confident	83.8	Confident	30 Å²	30	53.8 Å²	53.8	11%	0.113	27%	0.267	C	S	.	.	S	Bend	trans	-72.4	148.9	-176.4	-69	174.2	65.5	106.4	2.3	110.7	V194 Q195 L197 G220 L222 D226 W227	V194-R224 PolarHBondContact O-NH1 3.07Å; Q195-R224 HydrophobicContact CG-CG 4.49Å; Q195-R224 PolarHBondContact O-NH1 3.44Å; L197-R224 PolarHBondContact O-NH1 2.84Å; L197-R224 PolarHBondContact O-NH2 3.01Å; G220-R224 WeakPolarHBondContact O-CG 3.46Å; L222-R224 PolarHBondContact O-N 3.21Å; R224-D226 WeakPolarHBondContact CB-OD1 3.47Å; R224-D226 IonicContact CZ-OD1 2.9Å; R224-D226 IonicContact CZ-OD2 2.7Å; R224-D226 IonicContact NE-OD1 2.79Å; R224-D226 PolarHBondContact NE-OD1 3Å; R224-D226 IonicContact NE-OD2 3.28Å; R224-D226 IonicContact NH2-OD1 2.95Å; R224-D226 PolarHBondContact NH2-OD1 2.97Å; R224-D226 IonicContact NH2-OD2 3.98Å; R224-D226 PolarHBondContact NH2-OD2 3.01Å; R224-D226 PolarHBondContact O-N 3.26Å; R224-W227 WeakPolarHBondContact O-CB 3.48Å; R224-W227 PolarHBondContact O-N 2.78Å
225	P	83	Confident	83.6	Confident	134 Å²	134	53.6 Å²	53.6	87%	0.87	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-27.9	174.7	27	-34.8	0	0	0	112.2
226	D	86.3	Confident	83.2	Confident	63 Å²	63	48.5 Å²	48.5	34%	0.337	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	29.9	177.3	60.7	-28.3	0	0	0	113.4	R224 E228 E229 A230	R224-D226 WeakPolarHBondContact CB-OD1 3.47Å; R224-D226 IonicContact CZ-OD1 2.9Å; R224-D226 IonicContact CZ-OD2 2.7Å; R224-D226 IonicContact NE-OD1 2.79Å; R224-D226 PolarHBondContact NE-OD1 3Å; R224-D226 IonicContact NE-OD2 3.28Å; R224-D226 IonicContact NH2-OD1 2.95Å; R224-D226 PolarHBondContact NH2-OD1 2.97Å; R224-D226 IonicContact NH2-OD2 3.98Å; R224-D226 PolarHBondContact NH2-OD2 3.01Å; R224-D226 PolarHBondContact O-N 3.26Å; D226-E228 PolarHBondContact O-N 2.71Å; D226-E228 VanDerWaalsContact O-N 3.1Å; D226-E229 PolarHBondContact O-N 2.87Å; D226-A230 WeakPolarHBondContact O-CB 3.47Å; D226-A230 PolarHBondContact O-N 2.88Å
227	W	82.8	Confident	82.6	Confident	120 Å²	120	47 Å²	47	46%	0.455	24%	0.237	S	C	.	.	H	α-helix	trans	-53.9	-33.4	-174.3	72.7	-87	0	0	0	114.5	L222 R224 E229 A230 V231	L222-W227 HydrophobicContact CD2-CE3 4.36Å; R224-W227 WeakPolarHBondContact O-CB 3.48Å; R224-W227 PolarHBondContact O-N 2.78Å; W227-E229 VanDerWaalsContact C-N 3.32Å; W227-E229 PolarHBondContact O-N 3.26Å; W227-A230 PolarHBondContact O-N 3.41Å; W227-V231 WeakPolarHBondContact O-CB 3.38Å; W227-V231 PolarHBondContact O-N 3.06Å
228	E	80.4	Confident	82.1	Confident	124 Å²	124	47.1 Å²	47.1	58%	0.579	24%	0.238	S	C	*	.	H	α-helix	trans	-64.4	-34.4	179.8	-68.2	-172.5	179.2	0	0	113	D226 V231 K232	D226-E228 PolarHBondContact O-N 2.71Å; D226-E228 VanDerWaalsContact O-N 3.1Å; E228-V231 WeakPolarHBondContact O-CG1 3.32Å; E228-K232 WeakPolarHBondContact O-CE 3.5Å
229	E	80	Confident	81.2	Confident	115 Å²	115	46.5 Å²	46.5	54%	0.537	24%	0.236	S	C	.	.	H	α-helix	trans	-86	-36.2	172.7	-65.9	-54.7	137	0	0	110.6	D226 W227 V231 K232	D226-E229 PolarHBondContact O-N 2.87Å; W227-E229 VanDerWaalsContact C-N 3.32Å; W227-E229 PolarHBondContact O-N 3.26Å; E229-V231 VanDerWaalsContact C-N 3.31Å; E229-V231 PolarHBondContact O-N 3.11Å; E229-K232 WeakPolarHBondContact O-CB 3.32Å; E229-K232 PolarHBondContact O-N 2.76Å; E229-K232 VanDerWaalsContact O-N 3.13Å; E229-K232 IonicContact OE1-NZ 2.63Å; E229-K232 PolarHBondContact OE1-NZ 2.92Å; E229-K232 IonicContact OE2-NZ 2.8Å; E229-K232 PolarHBondContact OE2-NZ 3.32Å
230	A	79.5	Confident	80.1	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.008	23%	0.228	C	C	.	.	H	α-helix	trans	-61.9	-37.3	-179.2	0	0	0	0	0	113	L199 L221 D226 W227 K232 M233	L199-A230 HydrophobicContact CD1-CB 3.32Å; L221-A230 HydrophobicContact CB-CB 4.28Å; L221-A230 HydrophobicContact CD2-CB 4.04Å; D226-A230 WeakPolarHBondContact O-CB 3.47Å; D226-A230 PolarHBondContact O-N 2.88Å; W227-A230 PolarHBondContact O-N 3.41Å; A230-K232 PolarHBondContact O-N 3.28Å; A230-M233 WeakPolarHBondContact O-CB 3.3Å; A230-M233 PolarHBondContact O-N 3.05Å; A230-M233 VanDerWaalsContact O-N 3.12Å
231	V	78.2	Confident	78.7	Confident	17 Å²	17	45.6 Å²	45.6	10%	0.103	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-20.9	179.4	76.2	0	0	0	0	113.2	W227 E228 E229 M233 I344	W227-V231 WeakPolarHBondContact O-CB 3.38Å; W227-V231 PolarHBondContact O-N 3.06Å; E228-V231 WeakPolarHBondContact O-CG1 3.32Å; E229-V231 VanDerWaalsContact C-N 3.31Å; E229-V231 PolarHBondContact O-N 3.11Å; V231-M233 PolarHBondContact O-N 2.68Å; V231-I344 HydrophobicContact CG2-CB 4.27Å; V231-I344 HydrophobicContact CG2-CD1 4.19Å; V231-I344 HydrophobicContact CG2-CG1 3.6Å; V231-I344 HydrophobicContact CG2-CG2 4.35Å
232	K	76.9	Confident	76.9	Confident	111 Å²	111	51.9 Å²	51.9	48%	0.483	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-16.9	176	-58.5	177.6	-167.9	165.2	0	112.2	E228 E229 A230	E228-K232 WeakPolarHBondContact O-CE 3.5Å; E229-K232 WeakPolarHBondContact O-CB 3.32Å; E229-K232 PolarHBondContact O-N 2.76Å; E229-K232 VanDerWaalsContact O-N 3.13Å; E229-K232 IonicContact OE1-NZ 2.63Å; E229-K232 PolarHBondContact OE1-NZ 2.92Å; E229-K232 IonicContact OE2-NZ 2.8Å; E229-K232 PolarHBondContact OE2-NZ 3.32Å; A230-K232 PolarHBondContact O-N 3.28Å
233	M	77.8	Confident	75.3	Confident	21 Å²	21	50.8 Å²	50.8	10%	0.103	28%	0.283	C	S	.	.	S	Bend	trans	-59.2	123.9	176.7	-172.4	60.8	66.4	0	0	109.9	L199 W202 I205 A230 V231 V235	L199-M233 HydrophobicContact CB-CE 3.72Å; L199-M233 HydrophobicContact CD2-CE 4.14Å; L199-M233 HydrophobicContact CG-CE 4.43Å; L199-M233 WeakPolarHBondContact O-CE 3.49Å; W202-M233 WeakPolarHBondContact O-CE 3.2Å; I205-M233 HydrophobicContact CD1-CG 4.12Å; I205-M233 HydrophobicContact CG1-CG 4.11Å; A230-M233 WeakPolarHBondContact O-CB 3.3Å; A230-M233 PolarHBondContact O-N 3.05Å; A230-M233 VanDerWaalsContact O-N 3.12Å; V231-M233 PolarHBondContact O-N 2.68Å; M233-V235 PolarHBondContact O-N 2.8Å
234	P	79.7	Confident	74	Confident	27 Å²	27	49.5 Å²	49.5	18%	0.175	28%	0.276	C	S	.	.			trans	-68.8	130.5	178	27.1	-32.9	0	0	0	110.4	D203 G204 I205	D203-P234 WeakPolarHBondContact O-CG 3.14Å; G204-P234 WeakPolarHBondContact CA-O 3.11Å; I205-P234 PolarHBondContact N-O 2.84Å
235	V	79.3	Confident	72.6	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.006	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	121.1	179.4	-173.3	0	0	0	0	110.4	I205 L214 V217 L221 M233 N345 V346 F347	I205-V235 CarbonylContact O-C 3.55Å; I205-V235 VanDerWaalsContact O-CA 3.3Å; I205-V235 WeakPolarHBondContact O-CA 3.35Å; L214-V235 HydrophobicContact CD1-CB 4.48Å; L214-V235 HydrophobicContact CD1-CG1 3.42Å; L214-V235 VanDerWaalsContact CD1-CG1 3.42Å; V217-V235 HydrophobicContact CG1-CG1 4.36Å; L221-V235 HydrophobicContact CD1-CG2 4.04Å; M233-V235 PolarHBondContact O-N 2.8Å; V235-N345 PolarHBondContact N-O 2.69Å; V235-V346 WeakPolarHBondContact O-CA 3.44Å; V235-F347 PolarHBondContact O-N 3.2Å
236	G	77.6	Confident	71.3	Confident	6 Å²	6	48.6 Å²	48.6	6%	0.062	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	144.6	176	0	0	0	0	0	112.5	I205 V206 T207 F347	I205-G236 PolarHBondContact O-N 2.82Å; V206-G236 CarbonylContact C-O 3.51Å; V206-G236 WeakPolarHBondContact CA-O 3.45Å; T207-G236 PolarHBondContact N-O 2.77Å; T207-G236 PolarHBondContact OG1-O 2.83Å; T207-G236 VanDerWaalsContact OG1-O 3.08Å; G236-F347 CarbonylContact C-O 3.6Å; G236-F347 VanDerWaalsContact CA-O 3.26Å; G236-F347 WeakPolarHBondContact CA-O 3.32Å
237	I	76.4	Confident	69.7	Low	1 Å²	1	45.8 Å²	45.8	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	124.5	174.4	-53.3	152.6	0	0	0	109.5	L214 L246 V346 F347 I348 C349	L214-I237 HydrophobicContact CB-CG1 4.42Å; L214-I237 HydrophobicContact CD1-CD1 4.21Å; L214-I237 HydrophobicContact CD1-CG1 3.79Å; L214-I237 HydrophobicContact CD2-CD1 3.34Å; L214-I237 HydrophobicContact CD2-CG1 3.77Å; L214-I237 HydrophobicContact CG-CD1 4.28Å; L214-I237 HydrophobicContact CG-CG1 4.19Å; I237-L246 HydrophobicContact CD1-CD2 3.83Å; I237-L246 HydrophobicContact CD1-CG 4.35Å; I237-V346 HydrophobicContact CD1-CG1 3.58Å; I237-V346 HydrophobicContact CG1-CG1 4.35Å; I237-F347 PolarHBondContact N-O 3.36Å; I237-I348 WeakPolarHBondContact O-CG2 3.23Å; I237-C349 PolarHBondContact O-N 3.41Å; I237-C349 VanDerWaalsContact O-O 3.12Å
238	L	77.2	Confident	68.1	Low	3 Å²	3	41.5 Å²	41.5	2%	0.016	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	101.6	171	-75.6	171.1	0	0	0	109.3	V168 V206 T207 V208 S209 C240 I304 C349	V168-L238 HydrophobicContact CB-CD1 4.42Å; V168-L238 HydrophobicContact CG1-CD1 3.55Å; V168-L238 HydrophobicContact CG2-CD1 3.95Å; V206-L238 HydrophobicContact CG1-CD1 3.67Å; V206-L238 HydrophobicContact CG1-CG 3.94Å; T207-L238 PolarHBondContact O-N 3.3Å; V208-L238 HydrophobicContact CB-CB 4.36Å; V208-L238 HydrophobicContact CG1-CB 4.17Å; V208-L238 HydrophobicContact CG2-CB 4.13Å; V208-L238 HydrophobicContact CG2-CD1 3.73Å; V208-L238 HydrophobicContact CG2-CG 4.48Å; S209-L238 PolarHBondContact N-O 2.93Å; L238-C240 PolarHBondContact O-N 2.67Å; L238-C240 VanDerWaalsContact O-N 3.07Å; L238-I304 HydrophobicContact CD2-CB 4.24Å; L238-I304 HydrophobicContact CD2-CG2 3.26Å; L238-C349 HydrophobicContact CD2-CB 3.32Å; L238-C349 WeakPolarHBondContact CD2-O 3.26Å; L238-C349 HydrophobicContact CG-CB 3.64Å
239	P	69.6	Low	66.7	Low	18 Å²	18	37.4 Å²	37.4	12%	0.117	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	110.4	-174	26.4	-32.9	0	0	0	110.8	N244 A247	P239-N244 HydrophobicContact CB-CB 4.16Å; P239-A247 HydrophobicContact CB-CB 3.91Å; P239-A247 HydrophobicContact CG-CB 4.15Å
240	C	65.1	Low	65.4	Low	6 Å²	6	33.8 Å²	33.8	4%	0.041	23%	0.229	C	C	.	.			trans	-114.1	2	176.8	-69.3	0	0	0	0	113	G156 A160 W163 V208 S209 L238	G156-C240 WeakPolarHBondContact CA-O 3.47Å; G156-C240 PolarHBondContact N-O 2.91Å; A160-C240 HydrophobicContact CB-CB 3.96Å; W163-C240 VanDerWaalsContact CE3-SG 3.58Å; V208-C240 HydrophobicContact CG1-CB 4.43Å; V208-C240 WeakPolarHBondContact CG1-SG 3.43Å; S209-C240 PolarHBondContact O-N 3.15Å; L238-C240 PolarHBondContact O-N 2.67Å; L238-C240 VanDerWaalsContact O-N 3.07Å
241	G	58.3	Low	64.2	Low	15 Å²	15	37.2 Å²	37.2	16%	0.155	25%	0.247	C	C	.	.	S	Bend	trans	-115.1	-171.5	-171.9	0	0	0	0	0	115.9	N244	G241-N244 PolarHBondContact O-ND2 3.44Å
242	S	48.8	Very low	62.8	Low	135 Å²	135	43.9 Å²	43.9	94%	0.944	28%	0.277	S	S	*	.	S	Bend	trans	-93.7	-15.8	172.2	56.2	0	0	0	0	113.8
243	G	53	Low	61.4	Low	42 Å²	42	46.5 Å²	46.5	43%	0.433	29%	0.29	S	S	.	.			trans	-109.2	87.5	175	0	0	0	0	0	109.8	D211	D211-G243 PolarHBondContact N-O 3.38Å; D211-G243 VanDerWaalsContact OD2-O 3.12Å
244	N	59.6	Low	59.4	Low	49 Å²	49	48 Å²	48	26%	0.262	31%	0.312	S	S	.	.			trans	-123.6	42.5	-176.2	-61.2	-25.1	0	0	0	109.8	P239 G241 L246 A247 G248	P239-N244 HydrophobicContact CB-CB 4.16Å; G241-N244 PolarHBondContact O-ND2 3.44Å; N244-L246 VanDerWaalsContact C-N 3.3Å; N244-L246 PolarHBondContact O-N 2.73Å; N244-A247 HydrophobicContact CB-CB 4.2Å; N244-A247 PolarHBondContact O-N 3.08Å; N244-G248 PolarHBondContact O-N 3.35Å
245	A	55.8	Low	57.2	Low	78 Å²	78	48.6 Å²	48.6	65%	0.645	32%	0.323	S	S	*	.	H	α-helix	trans	-65.8	-39.1	-174	0	0	0	0	0	110.7	D211 G248 A249	D211-A245 PolarHBondContact OD2-N 2.92Å; A245-G248 PolarHBondContact O-N 3.26Å; A245-A249 PolarHBondContact O-N 3.24Å
246	L	55	Low	54.8	Low	67 Å²	67	52.4 Å²	52.4	35%	0.351	35%	0.348	S	S	.	.	H	α-helix	trans	-72.1	-38.5	178.3	-170	69.9	0	0	0	111.9	D211 L214 I237 N244 G248 A249 V250	D211-L246 WeakPolarHBondContact OD1-CB 3.49Å; D211-L246 PolarHBondContact OD1-N 3.27Å; L214-L246 HydrophobicContact CD2-CD2 3.06Å; L214-L246 HydrophobicContact CD2-CG 4.48Å; I237-L246 HydrophobicContact CD1-CD2 3.83Å; I237-L246 HydrophobicContact CD1-CG 4.35Å; N244-L246 VanDerWaalsContact C-N 3.3Å; N244-L246 PolarHBondContact O-N 2.73Å; L246-G248 PolarHBondContact O-N 3.14Å; L246-A249 PolarHBondContact O-N 3.04Å; L246-V250 PolarHBondContact O-N 2.88Å
247	A	53.3	Low	52.4	Low	5 Å²	5	63 Å²	63	4%	0.041	39%	0.386	C	S	.	.	H	α-helix	trans	-69.3	-20.1	173.1	0	0	0	0	0	113.3	P239 N244 N251 I348	P239-A247 HydrophobicContact CB-CB 3.91Å; P239-A247 HydrophobicContact CG-CB 4.15Å; N244-A247 HydrophobicContact CB-CB 4.2Å; N244-A247 PolarHBondContact O-N 3.08Å; A247-N251 WeakPolarHBondContact O-CB 3.37Å; A247-I348 VanDerWaalsContact C-CD1 3.47Å; A247-I348 VanDerWaalsContact CA-CD1 3.49Å; A247-I348 HydrophobicContact CB-CD1 4.26Å; A247-I348 HydrophobicContact CB-CG1 4.15Å; A247-I348 HydrophobicContact CB-CG2 4.06Å; A247-I348 WeakPolarHBondContact O-CD1 3.28Å
248	G	49.3	Very low	50.2	Low	30 Å²	30	71.4 Å²	71.4	31%	0.309	43%	0.425	S	S	.	.	H	α-helix	trans	-73.4	-48.7	167.2	0	0	0	0	0	111.8	N244 A245 L246 N251 Q252	N244-G248 PolarHBondContact O-N 3.35Å; A245-G248 PolarHBondContact O-N 3.26Å; L246-G248 PolarHBondContact O-N 3.14Å; G248-N251 PolarHBondContact O-N 2.89Å; G248-Q252 WeakPolarHBondContact O-CG 3.28Å; G248-Q252 PolarHBondContact O-N 3.37Å
249	A	51	Low	47.8	Very low	37 Å²	37	78.3 Å²	78.3	31%	0.306	46%	0.462	S	S	.	.	H	α-helix	trans	-65	-47.4	-175.1	0	0	0	0	0	112.9	A245 L246 N251 Q252 H253	A245-A249 PolarHBondContact O-N 3.24Å; L246-A249 PolarHBondContact O-N 3.04Å; A249-N251 PolarHBondContact O-N 3.16Å; A249-Q252 PolarHBondContact O-N 2.98Å; A249-H253 PolarHBondContact O-CD2 3.43Å; A249-H253 PolarHBondContact O-N 2.94Å; A249-H253 VanDerWaalsContact O-N 3.16Å
250	V	52.5	Low	45.8	Very low	39 Å²	39	82.3 Å²	82.3	24%	0.236	49%	0.49	C	S	.	.	H	α-helix	trans	-68.2	-25	-179.4	171.7	0	0	0	0	111.1	L246 H253 G254 I348	L246-V250 PolarHBondContact O-N 2.88Å; V250-H253 PolarHBondContact O-N 3.42Å; V250-G254 PolarHBondContact O-N 2.96Å; V250-I348 HydrophobicContact CB-CD1 3.23Å; V250-I348 HydrophobicContact CB-CG1 3.57Å; V250-I348 HydrophobicContact CG1-CB 4.49Å; V250-I348 HydrophobicContact CG1-CD1 3.6Å; V250-I348 HydrophobicContact CG1-CG1 3.65Å
251	N	53.6	Low	44	Very low	73 Å²	73	89.9 Å²	89.9	39%	0.39	53%	0.53	S	S	.	.	H	α-helix	trans	-74.2	-38.2	177.7	-173.2	60.7	0	0	0	110.6	A247 G248 A249 H253 G254 G255 I348	A247-N251 WeakPolarHBondContact O-CB 3.37Å; G248-N251 PolarHBondContact O-N 2.89Å; A249-N251 PolarHBondContact O-N 3.16Å; N251-H253 VanDerWaalsContact C-N 3.28Å; N251-H253 PolarHBondContact O-N 2.94Å; N251-G254 PolarHBondContact O-N 3.37Å; N251-G255 PolarHBondContact O-N 3.29Å; N251-G255 VanDerWaalsContact O-N 3.1Å; N251-I348 HydrophobicContact CB-CD1 3.76Å
252	Q	48.2	Very low	42.4	Very low	157 Å²	157	94.1 Å²	94.1	73%	0.734	56%	0.557	S	S	*	*	H	α-helix	trans	-65.4	-32	174.8	-69.4	173.2	8.1	0	0	112.3	G248 A249	G248-Q252 WeakPolarHBondContact O-CG 3.28Å; G248-Q252 PolarHBondContact O-N 3.37Å; A249-Q252 PolarHBondContact O-N 2.98Å
253	H	47.5	Very low	41.5	Very low	166 Å²	166	93 Å²	93	77%	0.769	55%	0.55	S	S	*	*	H	α-helix	trans	-89.5	-20.2	178	-67.3	-56.3	0	0	0	114.1	A249 V250 N251	A249-H253 PolarHBondContact O-CD2 3.43Å; A249-H253 PolarHBondContact O-N 2.94Å; A249-H253 VanDerWaalsContact O-N 3.16Å; V250-H253 PolarHBondContact O-N 3.42Å; N251-H253 VanDerWaalsContact C-N 3.28Å; N251-H253 PolarHBondContact O-N 2.94Å
254	G	36.5	Very low	40.1	Very low	53 Å²	53	97.7 Å²	97.7	55%	0.546	57%	0.57	S	S	.	*	H	α-helix	trans	-100	-8.1	-178.9	0	0	0	0	0	115.9	V250 N251	V250-G254 PolarHBondContact O-N 2.96Å; N251-G254 PolarHBondContact O-N 3.37Å
255	G	33.6	Very low	38.5	Very low	40 Å²	40	100.7 Å²	100.7	41%	0.412	60%	0.595	S	S	.	*	S	Bend	trans	-80.8	153.3	177.9	0	0	0	0	0	113.6	N251	N251-G255 PolarHBondContact O-N 3.29Å; N251-G255 VanDerWaalsContact O-N 3.1Å
256	P	28	Very low	36.9	Very low	81 Å²	81	102 Å²	102	53%	0.526	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-61.4	144.2	157.7	-3.8	18.3	0	0	0	108.7	E258	P256-E258 PolarHBondContact O-N 3.42Å
257	R	27.9	Very low	35.5	Very low	228 Å²	228	104.4 Å²	104.4	86%	0.86	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-51.6	117.2	168.4	-73.8	-179.2	157.2	114	0	108.8	D259	R257-D259 VanDerWaalsContact C-N 3.33Å; R257-D259 PolarHBondContact O-N 2.82Å; R257-D259 VanDerWaalsContact O-N 3.12Å
258	E	29.6	Very low	34	Very low	177 Å²	177	108.8 Å²	108.8	83%	0.827	66%	0.658	S	S	*	*			trans	-71.9	96.9	161.3	-74.7	-173.2	154.4	0	0	106.4	P256 S260	P256-E258 PolarHBondContact O-N 3.42Å; E258-S260 PolarHBondContact O-N 3.32Å
259	D	26.8	Very low	32.6	Very low	149 Å²	149	113.2 Å²	113.2	80%	0.797	68%	0.683	S	S	*	*			trans	-67.7	87.8	164	-68.7	-27.9	0	0	0	107.1	R257	R257-D259 VanDerWaalsContact C-N 3.33Å; R257-D259 PolarHBondContact O-N 2.82Å; R257-D259 VanDerWaalsContact O-N 3.12Å
260	S	27.9	Very low	31.6	Very low	102 Å²	102	116.4 Å²	116.4	71%	0.713	70%	0.7	S	S	*	*			trans	-98.1	92.9	167.3	41.6	0	0	0	0	108.1	E258 S262	E258-S260 PolarHBondContact O-N 3.32Å; S260-S262 PolarHBondContact O-N 2.83Å
261	D	27.3	Very low	30.1	Very low	165 Å²	165	122.1 Å²	122.1	88%	0.882	73%	0.729	S	S	*	*			trans	-62.3	108	160.4	-83.8	-29.5	0	0	0	109.1
262	S	25.7	Very low	28.6	Very low	103 Å²	103	130.3 Å²	130.3	72%	0.72	76%	0.755	S	S	*	*				179.2	108.1	129.6	59.6	0	0	0	0	111.2	S260	S260-S262 PolarHBondContact O-N 2.83Å
263	S	28.7	Very low	27.3	Very low	113 Å²	113	129.2 Å²	129.2	79%	0.79	76%	0.759	S	S	*	*			trans	6.8	113.2	147.6	56.7	0	0	0	0	118.7
264	T	24.8	Very low	26.3	Very low	140 Å²	140	127.7 Å²	127.7	86%	0.859	76%	0.761	S	S	*	*				-148.2	110.4	129.1	-33.4	0	0	0	0	109.6
265	S	24.8	Very low	25.7	Very low	111 Å²	111	130 Å²	130	78%	0.776	78%	0.775	S	S	*	*			trans	-68.7	128.4	170.2	50.1	0	0	0	0	110.9
266	S	22.6	Very low	25.3	Very low	106 Å²	106	139.8 Å²	139.8	74%	0.741	80%	0.8	S	S	*	*			trans	176.1	101.6	130.5	51.2	0	0	0	0	112.1
267	S	25.5	Very low	25	Very low	117 Å²	117	140.4 Å²	140.4	82%	0.818	81%	0.806	S	S	*	*			trans	60.5	128.9	133.4	60.3	0	0	0	0	123
268	A	21.7	Very low	24.8	Very low	98 Å²	98	135.9 Å²	135.9	81%	0.81	81%	0.808	S	S	*	*			trans	90.4	123	160.6	0	0	0	0	0	115.9
269	C	21.5	Very low	24.4	Very low	123 Å²	123	132.5 Å²	132.5	83%	0.831	80%	0.801	S	S	*	*			cis	-157.1	159.1	2.9	-116.8	0	0	0	0	109.1
270	P	28.5	Very low	24.4	Very low	103 Å²	103	137.4 Å²	137.4	67%	0.669	81%	0.809	S	S	*	*			trans	-102.4	118.5	-164.2	35	-23.8	0	0	0	111.8
271	L	21.5	Very low	24.2	Very low	159 Å²	159	137.5 Å²	137.5	83%	0.832	82%	0.815	S	S	*	*			trans	-167.8	96.5	159	-103	137.1	0	0	0	107.8
272	W	21.6	Very low	24.2	Very low	246 Å²	246	134.3 Å²	134.3	93%	0.932	81%	0.812	S	S	*	*			trans	163.8	52.1	145	-86.3	31	0	0	0	108.7	T274	W272-T274 VanDerWaalsContact C-N 3.31Å; W272-T274 PolarHBondContact O-N 3.47Å
273	T	22.4	Very low	24	Very low	134 Å²	134	133.7 Å²	133.7	82%	0.822	81%	0.813	S	S	*	*			trans	-90.3	62.3	170	6.1	0	0	0	0	109.6
274	T	24.9	Very low	23.8	Very low	134 Å²	134	133.7 Å²	133.7	82%	0.822	81%	0.813	S	S	*	*			trans	-157.1	81.3	161.6	-2.6	0	0	0	0	111.6	W272	W272-T274 VanDerWaalsContact C-N 3.31Å; W272-T274 PolarHBondContact O-N 3.47Å
275	A	25.4	Very low	23.7	Very low	102 Å²	102	135.5 Å²	135.5	84%	0.843	81%	0.814	S	S	*	*			trans	-136.4	47.3	152.7	0	0	0	0	0	109.3	S277	A275-S277 VanDerWaalsContact C-N 3.28Å; A275-S277 PolarHBondContact O-N 2.99Å
276	R	24	Very low	23.6	Very low	245 Å²	245	136.5 Å²	136.5	93%	0.925	82%	0.817	S	S	*	*			trans	-77.1	87	151.9	-75	-175.3	-163.2	-134.7	1.9	106.7
277	S	23.1	Very low	23.9	Very low	93 Å²	93	134.3 Å²	134.3	65%	0.65	81%	0.812	S	S	*	*			trans	167.5	84.9	154.2	55	0	0	0	0	110.4	A275	A275-S277 VanDerWaalsContact C-N 3.28Å; A275-S277 PolarHBondContact O-N 2.99Å
278	C	21.8	Very low	24	Very low	134 Å²	134	134.5 Å²	134.5	91%	0.905	81%	0.813	S	S	*	*			trans	-93	102.2	134.5	-91.6	0	0	0	0	104.9
279	P	22.8	Very low	24.1	Very low	105 Å²	105	135.4 Å²	135.4	68%	0.682	81%	0.812	S	S	*	*			trans	-64	141.1	173.3	-10.7	25.9	0	0	0	108.8	A281	P279-A281 PolarHBondContact O-N 3.31Å
280	R	26.4	Very low	24.5	Very low	253 Å²	253	134 Å²	134	96%	0.955	80%	0.802	S	S	*	*			trans	-40.9	107.5	149.4	-89.9	167.3	141.2	169.3	-7.7	108.7
281	A	23.6	Very low	24.4	Very low	104 Å²	104	134.1 Å²	134.1	86%	0.86	80%	0.796	S	S	*	*			trans	-116.4	64.2	155.7	0	0	0	0	0	107.3	P279	P279-A281 PolarHBondContact O-N 3.31Å
282	A	26.6	Very low	24.8	Very low	97 Å²	97	129.1 Å²	129.1	80%	0.802	77%	0.77	S	S	*	*			trans	-119.2	80.9	161.6	0	0	0	0	0	106
283	A	22.5	Very low	25.1	Very low	90 Å²	90	120.8 Å²	120.8	74%	0.744	75%	0.747	S	S	*	*			trans	-153.5	111	164.5	0	0	0	0	0	109.1
284	S	24.1	Very low	25.5	Very low	113 Å²	113	117.8 Å²	117.8	79%	0.79	72%	0.724	S	S	*	*			trans	54.8	94.4	154	64	0	0	0	0	119.4
285	M	21.6	Very low	25.7	Very low	179 Å²	179	117 Å²	117	88%	0.882	71%	0.711	S	S	*	*			trans	-132.6	127.7	133.8	-80.5	-72.6	178.6	0	0	106.9
286	P	24	Very low	26.2	Very low	131 Å²	131	114.3 Å²	114.3	85%	0.851	68%	0.682	S	S	*	*			trans	-79.5	124.5	178.2	31.6	-28.6	0	0	0	109
287	G	28.1	Very low	26.7	Very low	60 Å²	60	103.7 Å²	103.7	62%	0.619	65%	0.647	S	S	*	*	S	Bend	trans	115.6	120.3	174.2	0	0	0	0	0	113
288	S	27.4	Very low	27.2	Very low	122 Å²	122	103.2 Å²	103.2	85%	0.853	64%	0.637	S	S	*	*			trans	66.1	96.2	172.2	32.5	0	0	0	0	117	P290	S288-P290 VanDerWaalsContact O-CD 3.22Å; S288-P290 WeakPolarHBondContact O-CD 3.41Å
289	C	24.9	Very low	27.9	Very low	116 Å²	116	99 Å²	99	78%	0.784	62%	0.616	S	S	*	*			trans	-65.2	114.3	168.5	-71.7	0	0	0	0	112.2	L291	C289-L291 VanDerWaalsContact C-N 3.32Å; C289-L291 PolarHBondContact O-N 2.75Å
290	P	28.3	Very low	28.7	Very low	95 Å²	95	95.5 Å²	95.5	62%	0.617	59%	0.59	S	S	*	*			trans	-91.1	14.8	174.1	33.8	-26.5	0	0	0	113.3	S288 P293	S288-P290 VanDerWaalsContact O-CD 3.22Å; S288-P290 WeakPolarHBondContact O-CD 3.41Å; P290-P293 WeakPolarHBondContact O-CD 3.17Å
291	L	28.4	Very low	29.3	Very low	104 Å²	104	83.8 Å²	83.8	55%	0.545	55%	0.547	S	S	.	.	H	α-helix	trans	-78.3	-20.7	-175	-71.5	167.2	0	0	0	114	C289 Q295	C289-L291 VanDerWaalsContact C-N 3.32Å; C289-L291 PolarHBondContact O-N 2.75Å; L291-Q295 WeakPolarHBondContact O-CG 3.47Å; L291-Q295 PolarHBondContact O-N 2.8Å
292	L	28.7	Very low	30.2	Very low	55 Å²	55	84.6 Å²	84.6	29%	0.288	53%	0.528	S	S	.	.	H	α-helix	trans	-67.1	-46.9	-175.1	-134.9	89.5	0	0	0	113.5	L128 Q294 L296	L128-L292 HydrophobicContact CD2-CD1 3.93Å; L128-L292 HydrophobicContact CD2-CD2 4.01Å; L292-Q294 PolarHBondContact O-N 2.86Å; L292-L296 WeakPolarHBondContact O-CB 3.13Å; L292-L296 PolarHBondContact O-N 2.82Å; L292-L296 VanDerWaalsContact O-N 3.11Å
293	P	29.1	Very low	31	Very low	70 Å²	70	80.5 Å²	80.5	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-67.5	-35.4	-179.6	-19.9	32.9	0	0	0	112.9	P290 A297	P290-P293 WeakPolarHBondContact O-CD 3.17Å; P293-A297 VanDerWaalsContact O-CB 3.3Å; P293-A297 WeakPolarHBondContact O-CB 3.25Å; P293-A297 PolarHBondContact O-N 2.96Å
294	Q	30.1	Very low	32.1	Very low	72 Å²	72	76.3 Å²	76.3	34%	0.336	46%	0.457	S	S	.	.	H	α-helix	trans	-70.5	-38.9	179.7	-65.5	-176	-2.5	0	0	112.1	L292 L298 N345	L292-Q294 PolarHBondContact O-N 2.86Å; Q294-L298 WeakPolarHBondContact O-CB 3.47Å; Q294-L298 WeakPolarHBondContact O-CD1 3.3Å; Q294-L298 WeakPolarHBondContact O-CG 3.41Å; Q294-L298 PolarHBondContact O-N 2.97Å; Q294-N345 PolarHBondContact NE2-ND2 3.41Å
295	Q	29.7	Very low	33	Very low	117 Å²	117	71.5 Å²	71.5	55%	0.547	42%	0.422	S	S	.	.	H	α-helix	trans	-69.9	-39	176.2	-75.7	-178.9	-34.6	0	0	112.3	L291 G299	L291-Q295 WeakPolarHBondContact O-CG 3.47Å; L291-Q295 PolarHBondContact O-N 2.8Å; Q295-G299 PolarHBondContact O-N 2.81Å
296	L	35.3	Very low	33.8	Very low	45 Å²	45	64.6 Å²	64.6	24%	0.236	39%	0.389	C	S	.	.	H	α-helix	trans	-62.7	-45.8	172.9	-93	152.2	0	0	0	111.5	R126 L292 F300	R126-L296 HydrophobicContact CG-CD1 4.34Å; R126-L296 HydrophobicContact CG-CD2 4.26Å; L292-L296 WeakPolarHBondContact O-CB 3.13Å; L292-L296 PolarHBondContact O-N 2.82Å; L292-L296 VanDerWaalsContact O-N 3.11Å; L296-F300 WeakPolarHBondContact O-CB 3.5Å; L296-F300 PolarHBondContact O-N 2.83Å
297	A	33.6	Very low	34.6	Very low	23 Å²	23	60.8 Å²	60.8	19%	0.19	36%	0.357	C	S	.	.	H	α-helix	trans	-61.2	-52.9	176.5	0	0	0	0	0	111.1	P293 G299 F300 S301 F347	P293-A297 VanDerWaalsContact O-CB 3.3Å; P293-A297 WeakPolarHBondContact O-CB 3.25Å; P293-A297 PolarHBondContact O-N 2.96Å; A297-G299 PolarHBondContact O-N 3.14Å; A297-F300 PolarHBondContact O-N 2.68Å; A297-S301 WeakPolarHBondContact O-CA 3.28Å; A297-S301 WeakPolarHBondContact O-CB 3.2Å; A297-S301 PolarHBondContact O-N 2.66Å; A297-S301 PolarHBondContact O-OG 2.79Å; A297-F347 HydrophobicContact CB-CD2 4.14Å; A297-F347 HydrophobicContact CB-CE2 4.49Å
298	L	34.6	Very low	35.2	Very low	82 Å²	82	59.7 Å²	59.7	43%	0.429	34%	0.339	S	S	.	.	H	α-helix	trans	-64	-40	-178.8	-76.6	165.5	0	0	0	113.8	Q294 R302 F347	Q294-L298 WeakPolarHBondContact O-CB 3.47Å; Q294-L298 WeakPolarHBondContact O-CD1 3.3Å; Q294-L298 WeakPolarHBondContact O-CG 3.41Å; Q294-L298 PolarHBondContact O-N 2.97Å; L298-R302 VanDerWaalsContact O-CB 3.24Å; L298-R302 WeakPolarHBondContact O-CB 3.49Å; L298-R302 PolarHBondContact O-N 2.76Å; L298-F347 HydrophobicContact CD1-CE1 4.15Å; L298-F347 HydrophobicContact CD2-CD1 3.33Å; L298-F347 HydrophobicContact CD2-CE1 3.5Å; L298-F347 VanDerWaalsContact CD2-CE1 3.5Å; L298-F347 HydrophobicContact CD2-CG 4.19Å; L298-F347 HydrophobicContact CD2-CZ 4.46Å; L298-F347 HydrophobicContact CG-CD1 3.93Å; L298-F347 HydrophobicContact CG-CE1 3.8Å; L298-F347 HydrophobicContact CG-CZ 4.31Å
299	G	35.4	Very low	35.6	Very low	47 Å²	47	59.6 Å²	59.6	49%	0.485	33%	0.329	S	S	.	.	H	α-helix	trans	-69.1	-43.8	178.7	0	0	0	0	0	112.5	Q295 A297 F303	Q295-G299 PolarHBondContact O-N 2.81Å; A297-G299 PolarHBondContact O-N 3.14Å; G299-F303 WeakPolarHBondContact O-CB 3.43Å; G299-F303 PolarHBondContact O-N 3.45Å
300	F	40.5	Very low	35.9	Very low	31 Å²	31	54.9 Å²	54.9	14%	0.136	30%	0.3	C	S	.	.	H	α-helix	trans	-69.7	-41.4	177.3	-167.3	-104.2	0	0	0	111.4	I172 A175 L177 L296 A297 F303 I304	I172-F300 HydrophobicContact CB-CZ 4.17Å; I172-F300 HydrophobicContact CG1-CE1 3.79Å; I172-F300 HydrophobicContact CG1-CZ 3.47Å; I172-F300 VanDerWaalsContact CG1-CZ 3.47Å; A175-F300 HydrophobicContact CB-CD2 3.91Å; A175-F300 HydrophobicContact CB-CE2 3.45Å; A175-F300 VanDerWaalsContact CB-CE2 3.45Å; A175-F300 HydrophobicContact CB-CZ 4.48Å; L177-F300 HydrophobicContact CD1-CD1 4.19Å; L177-F300 HydrophobicContact CD1-CD2 3.9Å; L177-F300 HydrophobicContact CD1-CE1 4.06Å; L177-F300 HydrophobicContact CD1-CE2 3.78Å; L177-F300 HydrophobicContact CD1-CG 4.13Å; L177-F300 HydrophobicContact CD1-CZ 3.88Å; L296-F300 WeakPolarHBondContact O-CB 3.5Å; L296-F300 PolarHBondContact O-N 2.83Å; A297-F300 PolarHBondContact O-N 2.68Å; F300-F303 WeakPolarHBondContact O-CB 3.49Å; F300-F303 PolarHBondContact O-N 3.18Å; F300-I304 HydrophobicContact CD1-CG1 4.33Å; F300-I304 HydrophobicContact CE1-CD1 4.28Å; F300-I304 HydrophobicContact CE1-CG1 3.99Å; F300-I304 HydrophobicContact CE2-CD1 4.48Å; F300-I304 HydrophobicContact CZ-CD1 3.97Å; F300-I304 HydrophobicContact CZ-CG1 4.14Å; F300-I304 WeakPolarHBondContact O-CG1 3.45Å; F300-I304 PolarHBondContact O-N 3.02Å
301	S	38.9	Very low	36	Very low	6 Å²	6	52.3 Å²	52.3	4%	0.042	29%	0.29	C	S	.	.	H	α-helix	trans	-62.1	-48.8	177	-82.8	0	0	0	0	113.1	A297 F303 I304 Q305 I348 C349	A297-S301 WeakPolarHBondContact O-CA 3.28Å; A297-S301 WeakPolarHBondContact O-CB 3.2Å; A297-S301 PolarHBondContact O-N 2.66Å; A297-S301 PolarHBondContact O-OG 2.79Å; S301-F303 PolarHBondContact O-N 3.36Å; S301-F303 VanDerWaalsContact O-N 3.15Å; S301-I304 PolarHBondContact O-N 2.83Å; S301-Q305 WeakPolarHBondContact O-CB 3.46Å; S301-Q305 PolarHBondContact O-N 3.34Å; S301-Q305 VanDerWaalsContact O-N 3.16Å; S301-I348 WeakPolarHBondContact CB-O 3.23Å; S301-I348 PolarHBondContact OG-O 3.09Å; S301-C349 CarbonylContact O-C 3.53Å; S301-C349 PolarHBondContact OG-SG 3.2Å
302	R	42	Very low	35.9	Very low	122 Å²	122	51.4 Å²	51.4	46%	0.46	31%	0.306	S	S	.	.	H	α-helix	trans	-60	-31.4	178	-175.2	172.5	179.8	-175.7	-2.2	112.9	L298 D306	L298-R302 VanDerWaalsContact O-CB 3.24Å; L298-R302 WeakPolarHBondContact O-CB 3.49Å; L298-R302 PolarHBondContact O-N 2.76Å; R302-D306 WeakPolarHBondContact O-CB 3.46Å; R302-D306 PolarHBondContact O-N 3.33Å
303	F	43.3	Very low	35.9	Very low	11 Å²	11	51.8 Å²	51.8	5%	0.048	32%	0.323	C	S	.	.	H	α-helix	trans	-75.9	-40.6	-176.5	-171.5	-96.8	0	0	0	113.3	S62 Y84 G299 F300 S301	S62-F303 VanDerWaalsContact CB-CZ 3.46Å; S62-F303 VanDerWaalsContact OG-CE1 3.22Å; S62-F303 WeakPolarHBondContact OG-CE1 3.11Å; S62-F303 WeakPolarHBondContact OG-CZ 3.46Å; Y84-F303 HydrophobicContact CD1-CE1 4.15Å; Y84-F303 HydrophobicContact CD1-CZ 4.19Å; Y84-F303 AromaticContact CD2-CE1 3.43Å; Y84-F303 HydrophobicContact CD2-CE1 3.43Å; Y84-F303 VanDerWaalsContact CD2-CE1 3.43Å; Y84-F303 HydrophobicContact CD2-CE2 4.05Å; Y84-F303 AromaticContact CD2-CZ 3Å; Y84-F303 HydrophobicContact CD2-CZ 3Å; Y84-F303 HydrophobicContact CE1-CE1 4.47Å; Y84-F303 AromaticContact CE2-CE1 3.73Å; Y84-F303 HydrophobicContact CE2-CE1 3.73Å; Y84-F303 AromaticContact CE2-CZ 3.74Å; Y84-F303 HydrophobicContact CE2-CZ 3.74Å; Y84-F303 AromaticContact CG-CE1 3.58Å; Y84-F303 HydrophobicContact CG-CE1 3.58Å; Y84-F303 AromaticContact CG-CE2 3.97Å; Y84-F303 HydrophobicContact CG-CE2 3.97Å; Y84-F303 AromaticContact CG-CZ 3.21Å; Y84-F303 HydrophobicContact CG-CZ 3.21Å; G299-F303 WeakPolarHBondContact O-CB 3.43Å; G299-F303 PolarHBondContact O-N 3.45Å; F300-F303 WeakPolarHBondContact O-CB 3.49Å; F300-F303 PolarHBondContact O-N 3.18Å; S301-F303 PolarHBondContact O-N 3.36Å; S301-F303 VanDerWaalsContact O-N 3.15Å
304	I	46.3	Very low	35.9	Very low	1 Å²	1	59.3 Å²	59.3	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-70.1	-44.6	177.5	-57.5	-70.5	0	0	0	109.3	M171 L238 F300 S301 D306 R307 V308 C349	M171-I304 HydrophobicContact CB-CD1 3.53Å; M171-I304 HydrophobicContact CE-CD1 3.4Å; M171-I304 HydrophobicContact CE-CG2 4.12Å; M171-I304 HydrophobicContact CG-CD1 4.06Å; M171-I304 HydrophobicContact SD-CD1 3.44Å; M171-I304 WeakPolarHBondContact SD-CD1 3.37Å; L238-I304 HydrophobicContact CD2-CB 4.24Å; L238-I304 HydrophobicContact CD2-CG2 3.26Å; F300-I304 HydrophobicContact CD1-CG1 4.33Å; F300-I304 HydrophobicContact CE1-CD1 4.28Å; F300-I304 HydrophobicContact CE1-CG1 3.99Å; F300-I304 HydrophobicContact CE2-CD1 4.48Å; F300-I304 HydrophobicContact CZ-CD1 3.97Å; F300-I304 HydrophobicContact CZ-CG1 4.14Å; F300-I304 WeakPolarHBondContact O-CG1 3.45Å; F300-I304 PolarHBondContact O-N 3.02Å; S301-I304 PolarHBondContact O-N 2.83Å; I304-D306 PolarHBondContact O-N 2.71Å; I304-R307 WeakPolarHBondContact O-CA 3.45Å; I304-R307 WeakPolarHBondContact O-CB 3.28Å; I304-R307 PolarHBondContact O-N 2.79Å; I304-V308 HydrophobicContact CG2-CG2 4.3Å; I304-V308 WeakPolarHBondContact O-CG2 3.39Å; I304-V308 PolarHBondContact O-N 2.81Å; I304-C349 VanDerWaalsContact C-OXT 3.27Å; I304-C349 WeakPolarHBondContact CB-OXT 2.93Å; I304-C349 WeakPolarHBondContact CG2-OXT 3.24Å
305	Q	43.6	Very low	35.9	Very low	13 Å²	13	60.6 Å²	60.6	6%	0.061	35%	0.351	C	S	.	.	H	α-helix	trans	-60.4	-43.8	-179.2	-169	74.8	-20.7	0	0	112.9	S301 R307 V308 N309 C349	S301-Q305 WeakPolarHBondContact O-CB 3.46Å; S301-Q305 PolarHBondContact O-N 3.34Å; S301-Q305 VanDerWaalsContact O-N 3.16Å; Q305-R307 PolarHBondContact O-N 2.82Å; Q305-V308 PolarHBondContact O-N 2.81Å; Q305-N309 PolarHBondContact O-N 3.39Å; Q305-N309 VanDerWaalsContact O-N 3.14Å; Q305-N309 PolarHBondContact O-ND2 3.46Å; Q305-C349 WeakPolarHBondContact CA-OXT 3.5Å; Q305-C349 WeakPolarHBondContact CB-OXT 3.47Å; Q305-C349 PolarHBondContact N-OXT 3.46Å; Q305-C349 PolarHBondContact OE1-O 3.16Å
306	D	38.6	Very low	35.7	Very low	34 Å²	34	57 Å²	57	18%	0.182	35%	0.346	C	S	.	.	H	α-helix	trans	-61.4	-25.3	176	-86.4	-23.7	0	0	0	112.5	R86 R92 R302 I304 G310	R86-D306 IonicContact CZ-OD1 3.71Å; R86-D306 IonicContact CZ-OD2 3.88Å; R86-D306 VanDerWaalsContact CZ-OD2 3.25Å; R86-D306 IonicContact NE-OD2 3.53Å; R86-D306 IonicContact NH1-OD2 3.17Å; R86-D306 IonicContact NH2-OD1 3.65Å; R86-D306 PolarHBondContact NH2-OD1 3.42Å; R86-D306 IonicContact NH2-OD2 3.29Å; R86-D306 PolarHBondContact NH2-OD2 3.01Å; R92-D306 HydrophobicContact CG-CB 4.14Å; R92-D306 IonicContact CZ-OD2 2.78Å; R92-D306 VanDerWaalsContact CZ-OD2 3.28Å; R92-D306 IonicContact NE-OD2 2.87Å; R92-D306 PolarHBondContact NE-OD2 2.77Å; R92-D306 IonicContact NH2-OD2 3.1Å; R92-D306 PolarHBondContact NH2-OD2 2.78Å; R302-D306 WeakPolarHBondContact O-CB 3.46Å; R302-D306 PolarHBondContact O-N 3.33Å; I304-D306 PolarHBondContact O-N 2.71Å; D306-G310 PolarHBondContact O-N 3.14Å
307	R	40.8	Very low	35.2	Very low	50 Å²	50	59.7 Å²	59.7	19%	0.189	37%	0.368	C	S	.	.	H	α-helix	trans	-88.8	-35.3	176.5	-164.6	-173.7	-176.6	178.8	4.6	112.1	Y84 M171 I304 Q305 N309 G310 G311	Y84-R307 VanDerWaalsContact CE1-CZ 3.45Å; Y84-R307 PolarHBondContact OH-NH1 2.94Å; Y84-R307 VanDerWaalsContact OH-NH1 3.15Å; M171-R307 VanDerWaalsContact SD-CD 3.55Å; M171-R307 PolarHBondContact SD-NH1 3.13Å; I304-R307 WeakPolarHBondContact O-CA 3.45Å; I304-R307 WeakPolarHBondContact O-CB 3.28Å; I304-R307 PolarHBondContact O-N 2.79Å; Q305-R307 PolarHBondContact O-N 2.82Å; R307-N309 VanDerWaalsContact C-N 3.27Å; R307-N309 PolarHBondContact O-N 2.79Å; R307-G310 PolarHBondContact O-N 3.06Å; R307-G311 PolarHBondContact O-N 2.91Å
308	V	40	Very low	34.7	Very low	38 Å²	38	65.9 Å²	65.9	23%	0.23	40%	0.397	C	S	.	.	H	α-helix	trans	-55.9	-45.3	172.4	-177.9	0	0	0	0	110.3	W163 I304 Q305	W163-V308 HydrophobicContact CH2-CG2 3.57Å; W163-V308 HydrophobicContact CZ2-CG1 4.42Å; W163-V308 HydrophobicContact CZ2-CG2 3.81Å; I304-V308 HydrophobicContact CG2-CG2 4.3Å; I304-V308 WeakPolarHBondContact O-CG2 3.39Å; I304-V308 PolarHBondContact O-N 2.81Å; Q305-V308 PolarHBondContact O-N 2.81Å
309	N	35.1	Very low	34.1	Very low	119 Å²	119	66.2 Å²	66.2	64%	0.636	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-21.5	179.1	-68.4	-37.6	0	0	0	113.7	Q305 R307	Q305-N309 PolarHBondContact O-N 3.39Å; Q305-N309 VanDerWaalsContact O-N 3.14Å; Q305-N309 PolarHBondContact O-ND2 3.46Å; R307-N309 VanDerWaalsContact C-N 3.27Å; R307-N309 PolarHBondContact O-N 2.79Å
310	G	31.7	Very low	33.5	Very low	17 Å²	17	70.5 Å²	70.5	18%	0.175	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-30.2	-175.6	0	0	0	0	0	116	A91 D306 R307 G312	A91-G310 VanDerWaalsContact CA-CA 3.5Å; A91-G310 VanDerWaalsContact CB-C 3.5Å; A91-G310 WeakPolarHBondContact CB-O 3.3Å; D306-G310 PolarHBondContact O-N 3.14Å; R307-G310 PolarHBondContact O-N 3.06Å; G310-G312 PolarHBondContact O-N 2.77Å; G310-G312 VanDerWaalsContact O-N 3.11Å
311	G	29.8	Very low	32.6	Very low	41 Å²	41	79.6 Å²	79.6	42%	0.423	46%	0.457	S	S	.	.	S	Bend	trans	-68	109.2	175.5	0	0	0	0	0	109.1	R307 G313	R307-G311 PolarHBondContact O-N 2.91Å; G311-G313 PolarHBondContact O-N 2.93Å
312	G	27	Very low	32.1	Very low	85 Å²	85	82.4 Å²	82.4	88%	0.876	49%	0.487	S	S	*	.	S	Bend	trans	-60.2	23.2	179.2	0	0	0	0	0	116.6	G310 R314	G310-G312 PolarHBondContact O-N 2.77Å; G310-G312 VanDerWaalsContact O-N 3.11Å; G312-R314 PolarHBondContact O-N 3.14Å
313	G	28	Very low	31.1	Very low	63 Å²	63	85.3 Å²	85.3	65%	0.649	51%	0.506	S	S	*	.			trans	-75.1	94.4	151.9	0	0	0	0	0	107.9	G311 I315	G311-G313 PolarHBondContact O-N 2.93Å; G313-I315 PolarHBondContact O-N 2.84Å
314	R	29.3	Very low	30.2	Very low	229 Å²	229	90.6 Å²	90.6	86%	0.864	54%	0.539	S	S	*	.			trans	-58.4	88.3	163	-71.2	178.6	-179.2	176.4	-0.5	108.2	G312 G316	G312-R314 PolarHBondContact O-N 3.14Å; R314-G316 VanDerWaalsContact C-N 3.27Å; R314-G316 PolarHBondContact O-N 2.9Å
315	I	30.7	Very low	29.1	Very low	98 Å²	98	99.6 Å²	99.6	50%	0.503	58%	0.581	S	S	.	*	S	Bend	trans	-72.4	102.6	143.6	-57.7	178.5	0	0	0	102.4	G313 S317	G313-I315 PolarHBondContact O-N 2.84Å; I315-S317 PolarHBondContact O-N 3.47Å; I315-S317 VanDerWaalsContact O-N 3.1Å
316	G	25.6	Very low	28	Very low	43 Å²	43	110.3 Å²	110.3	44%	0.443	62%	0.621	S	S	.	*			trans	-33.8	112.1	-157.7	0	0	0	0	0	114.9	R314 L318	R314-G316 VanDerWaalsContact C-N 3.27Å; R314-G316 PolarHBondContact O-N 2.9Å; G316-L318 PolarHBondContact O-N 3.06Å
317	S	24.9	Very low	27.2	Very low	101 Å²	101	114.8 Å²	114.8	71%	0.706	65%	0.649	S	S	*	*			trans	-56.8	80.4	141.6	152	0	0	0	0	106.8	I315 T319	I315-S317 PolarHBondContact O-N 3.47Å; I315-S317 VanDerWaalsContact O-N 3.1Å; S317-T319 PolarHBondContact O-N 3Å
318	L	22.6	Very low	26.3	Very low	152 Å²	152	120 Å²	120	80%	0.796	68%	0.68	S	S	*	*			trans	-74.8	90.3	147.9	-92.1	144.4	0	0	0	104.1	G316 C320	G316-L318 PolarHBondContact O-N 3.06Å; L318-C320 PolarHBondContact O-N 3.25Å; L318-C320 VanDerWaalsContact O-N 3.15Å
319	T	22.9	Very low	25.4	Very low	90 Å²	90	123.8 Å²	123.8	55%	0.552	71%	0.706	S	S	*	*			trans	-35.1	121.7	143.8	43.5	0	0	0	0	107.1	S317 R321	S317-T319 PolarHBondContact O-N 3Å; T319-R321 PolarHBondContact O-N 2.77Å
320	C	22.7	Very low	24.9	Very low	136 Å²	136	122.5 Å²	122.5	92%	0.919	71%	0.712	S	S	*	*			trans	-59.4	80.8	167	-66.3	0	0	0	0	108	L318	L318-C320 PolarHBondContact O-N 3.25Å; L318-C320 VanDerWaalsContact O-N 3.15Å
321	R	20.6	Very low	24.5	Very low	223 Å²	223	127.6 Å²	127.6	84%	0.842	74%	0.741	S	S	*	*			trans	-79.2	125.9	158.6	-84.3	-170	175.3	-169.7	-1.1	105.5	T319	T319-R321 PolarHBondContact O-N 2.77Å
322	G	28.9	Very low	24.3	Very low	65 Å²	65	130.3 Å²	130.3	67%	0.67	76%	0.76	S	S	*	*			trans	-36.5	128.3	-160.8	0	0	0	0	0	115.7
323	H	21.7	Very low	24.5	Very low	183 Å²	183	138.3 Å²	138.3	85%	0.847	76%	0.764	S	S	*	*			trans	-150.5	109.1	140.2	-95	-53	0	0	0	108.9
324	T	22.7	Very low	24.4	Very low	121 Å²	121	144.3 Å²	144.3	74%	0.742	78%	0.775	S	S	*	*			trans	29.9	107.8	151.1	46.2	0	0	0	0	117.3	R326	T324-R326 PolarHBondContact O-N 3.09Å
325	Q	24.1	Very low	24.5	Very low	191 Å²	191	137.6 Å²	137.6	89%	0.893	78%	0.777	S	S	*	*			trans	-39	112.1	155.5	-73.2	174.2	-21.3	0	0	110.4
326	R	20	Very low	24.3	Very low	238 Å²	238	135.8 Å²	135.8	90%	0.898	78%	0.782	S	S	*	*			trans	-97.3	100	148.9	-84.5	-172.7	178.8	-172.4	0.7	106.3	T324 L328	T324-R326 PolarHBondContact O-N 3.09Å; R326-L328 PolarHBondContact O-N 3.46Å
327	T	22.8	Very low	24.2	Very low	127 Å²	127	137 Å²	137	78%	0.779	79%	0.794	S	S	*	*			trans	-43.7	118.6	160.9	27	0	0	0	0	109.6
328	L	22	Very low	24.2	Very low	160 Å²	160	137.5 Å²	137.5	84%	0.838	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-61.1	138.8	160.9	-76.3	160.9	0	0	0	108	R326 A330	R326-L328 PolarHBondContact O-N 3.46Å; L328-A330 PolarHBondContact O-N 2.87Å
329	P	20.8	Very low	24.3	Very low	118 Å²	118	136.6 Å²	136.6	77%	0.766	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-61.8	130.7	175.9	24.9	-30.3	0	0	0	109.4
330	A	23.4	Very low	24.6	Very low	92 Å²	92	138.9 Å²	138.9	76%	0.76	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-57.7	135.5	175.3	0	0	0	0	0	110.1	L328 A332	L328-A330 PolarHBondContact O-N 2.87Å; A330-A332 PolarHBondContact O-N 3.1Å
331	P	25	Very low	24.9	Very low	123 Å²	123	139.6 Å²	139.6	80%	0.799	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-62.8	136.9	167.1	26.3	-30.7	0	0	0	108.9	R333	P331-R333 PolarHBondContact O-N 3.13Å
332	A	24.1	Very low	25.1	Very low	98 Å²	98	137.1 Å²	137.1	81%	0.81	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-52.3	134.4	176	0	0	0	0	0	110.2	A330 E334	A330-A332 PolarHBondContact O-N 3.1Å; A332-E334 PolarHBondContact O-N 3.23Å
333	R	32.2	Very low	25.1	Very low	254 Å²	254	139.9 Å²	139.9	96%	0.958	78%	0.784	S	S	*	*			trans	-61.6	103.8	172.1	-83.6	176.2	158.4	178.6	-5.5	109.5	P331	P331-R333 PolarHBondContact O-N 3.13Å
334	E	25.8	Very low	25.7	Very low	189 Å²	189	132.8 Å²	132.8	88%	0.883	75%	0.752	S	S	*	*			trans	-132.4	135	144.6	-75	-168.4	155.1	0	0	108.2	A332	A332-E334 PolarHBondContact O-N 3.23Å
335	G	30.1	Very low	26.5	Very low	88 Å²	88	129.4 Å²	129.4	91%	0.907	73%	0.729	S	S	*	*	S	Bend	trans	-63.5	141	-157	0	0	0	0	0	114.9
336	G	26.8	Very low	27.3	Very low	60 Å²	60	121.5 Å²	121.5	62%	0.619	69%	0.694	S	S	*	*			trans	145.8	-6.2	165.2	0	0	0	0	0	117.4	S338	G336-S338 PolarHBondContact O-N 2.92Å
337	G	24.8	Very low	28.5	Very low	67 Å²	67	111.7 Å²	111.7	69%	0.691	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	1.7	-162.9	0	0	0	0	0	119.7
338	S	24.4	Very low	29.3	Very low	113 Å²	113	106.3 Å²	106.3	79%	0.79	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-0.8	-169.3	-167.7	0	0	0	0	116	G336	G336-S338 PolarHBondContact O-N 2.92Å
339	L	25.2	Very low	30.1	Very low	132 Å²	132	99 Å²	99	69%	0.691	59%	0.587	S	S	*	*	S	Bend	trans	-101.6	-9.5	177.5	-109.3	83.3	0	0	0	114.4	L341	L339-L341 PolarHBondContact O-N 3.23Å
340	F	29.3	Very low	30.5	Very low	139 Å²	139	98.1 Å²	98.1	61%	0.61	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-19.2	-159.3	-95.9	-95.1	0	0	0	117.1
341	L	28.2	Very low	30.9	Very low	150 Å²	150	98.4 Å²	98.4	79%	0.785	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	-0.2	-176.2	-82.1	156.3	0	0	0	114.3	L339	L339-L341 PolarHBondContact O-N 3.23Å
342	K	25.8	Very low	31.2	Very low	172 Å²	172	97 Å²	97	75%	0.748	56%	0.555	S	S	*	*	S	Bend	trans	-79.4	-17	-176.3	-74.7	-178.7	177.5	177.5	0	114.2
343	N	27.3	Very low	31.7	Very low	122 Å²	122	96.9 Å²	96.9	65%	0.652	54%	0.54	S	S	*	.	S	Bend	trans	-113.4	1.8	-171.5	-68.3	-6.5	0	0	0	114.3
344	I	35.4	Very low	31.6	Very low	34 Å²	34	87.1 Å²	87.1	17%	0.174	51%	0.514	C	S	.	.			trans	-99.1	116.8	-179.5	-39.3	-169.5	0	0	0	109.3	L218 V231 V346	L218-I344 HydrophobicContact CD2-CG2 3.87Å; V231-I344 HydrophobicContact CG2-CB 4.27Å; V231-I344 HydrophobicContact CG2-CD1 4.19Å; V231-I344 HydrophobicContact CG2-CG1 3.6Å; V231-I344 HydrophobicContact CG2-CG2 4.35Å; I344-V346 VanDerWaalsContact C-N 3.27Å; I344-V346 HydrophobicContact CB-CG2 4.05Å; I344-V346 HydrophobicContact CG2-CG2 3.43Å; I344-V346 VanDerWaalsContact CG2-CG2 3.43Å; I344-V346 PolarHBondContact O-N 2.86Å
345	N	39.8	Very low	32	Very low	50 Å²	50	80.3 Å²	80.3	27%	0.267	49%	0.49	S	S	.	.			trans	-79.4	76.5	173.9	-79.7	-34.9	0	0	0	110.1	V235 Q294 F347	V235-N345 PolarHBondContact N-O 2.69Å; Q294-N345 PolarHBondContact NE2-ND2 3.41Å; N345-F347 HydrophobicContact CB-CE2 3.8Å; N345-F347 HydrophobicContact CB-CZ 4.35Å
346	V	40.6	Very low	32.1	Very low	25 Å²	25	79.8 Å²	79.8	15%	0.152	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	122.5	173.5	-173	0	0	0	0	109.6	V235 I237 I344	V235-V346 WeakPolarHBondContact O-CA 3.44Å; I237-V346 HydrophobicContact CD1-CG1 3.58Å; I237-V346 HydrophobicContact CG1-CG1 4.35Å; I344-V346 VanDerWaalsContact C-N 3.27Å; I344-V346 HydrophobicContact CB-CG2 4.05Å; I344-V346 HydrophobicContact CG2-CG2 3.43Å; I344-V346 VanDerWaalsContact CG2-CG2 3.43Å; I344-V346 PolarHBondContact O-N 2.86Å
347	F	44.6	Very low	32.6	Very low	33 Å²	33	81.3 Å²	81.3	15%	0.145	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	151.1	174.3	-56.7	-73.7	0	0	0	110.3	V235 G236 I237 A297 L298 N345	V235-F347 PolarHBondContact O-N 3.2Å; G236-F347 CarbonylContact C-O 3.6Å; G236-F347 VanDerWaalsContact CA-O 3.26Å; G236-F347 WeakPolarHBondContact CA-O 3.32Å; I237-F347 PolarHBondContact N-O 3.36Å; A297-F347 HydrophobicContact CB-CD2 4.14Å; A297-F347 HydrophobicContact CB-CE2 4.49Å; L298-F347 HydrophobicContact CD1-CE1 4.15Å; L298-F347 HydrophobicContact CD2-CD1 3.33Å; L298-F347 HydrophobicContact CD2-CE1 3.5Å; L298-F347 VanDerWaalsContact CD2-CE1 3.5Å; L298-F347 HydrophobicContact CD2-CG 4.19Å; L298-F347 HydrophobicContact CD2-CZ 4.46Å; L298-F347 HydrophobicContact CG-CD1 3.93Å; L298-F347 HydrophobicContact CG-CE1 3.8Å; L298-F347 HydrophobicContact CG-CZ 4.31Å; N345-F347 HydrophobicContact CB-CE2 3.8Å; N345-F347 HydrophobicContact CB-CZ 4.35Å
348	I	40.3	Very low	33.2	Very low	14 Å²	14	82.5 Å²	82.5	7%	0.072	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	121.4	173.9	-58	153.6	0	0	0	108.4	I237 A247 V250 N251 S301	I237-I348 WeakPolarHBondContact O-CG2 3.23Å; A247-I348 VanDerWaalsContact C-CD1 3.47Å; A247-I348 VanDerWaalsContact CA-CD1 3.49Å; A247-I348 HydrophobicContact CB-CD1 4.26Å; A247-I348 HydrophobicContact CB-CG1 4.15Å; A247-I348 HydrophobicContact CB-CG2 4.06Å; A247-I348 WeakPolarHBondContact O-CD1 3.28Å; V250-I348 HydrophobicContact CB-CD1 3.23Å; V250-I348 HydrophobicContact CB-CG1 3.57Å; V250-I348 HydrophobicContact CG1-CB 4.49Å; V250-I348 HydrophobicContact CG1-CD1 3.6Å; V250-I348 HydrophobicContact CG1-CG1 3.65Å; N251-I348 HydrophobicContact CB-CD1 3.76Å; S301-I348 WeakPolarHBondContact CB-O 3.23Å; S301-I348 PolarHBondContact OG-O 3.09Å
349	C	37.7	Very low	34	Very low	6 Å²	6	79.7 Å²	79.7	4%	0.041	39%	0.394	C	S	.	.			trans	-81.6	0	169.6	-57.1	0	0	0	0	111.9	I237 L238 S301 I304 Q305	I237-C349 PolarHBondContact O-N 3.41Å; I237-C349 VanDerWaalsContact O-O 3.12Å; L238-C349 HydrophobicContact CD2-CB 3.32Å; L238-C349 WeakPolarHBondContact CD2-O 3.26Å; L238-C349 HydrophobicContact CG-CB 3.64Å; S301-C349 CarbonylContact O-C 3.53Å; S301-C349 PolarHBondContact OG-SG 3.2Å; I304-C349 VanDerWaalsContact C-OXT 3.27Å; I304-C349 WeakPolarHBondContact CB-OXT 2.93Å; I304-C349 WeakPolarHBondContact CG2-OXT 3.24Å; Q305-C349 WeakPolarHBondContact CA-OXT 3.5Å; Q305-C349 WeakPolarHBondContact CB-OXT 3.47Å; Q305-C349 PolarHBondContact N-OXT 3.46Å; Q305-C349 PolarHBondContact OE1-O 3.16Å

Retrieved 349 of 349 residues in 293.4 ms (Link to these results)

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