A0A087WZS4_HUMAN Loading...

Neural cell adhesion molecule 1

AlphaFold DB , UniProt , Accession A0A087WZS4, Species HUMAN (Homo sapiens, Human), Gene NCAM1, Length 135 aa.

						>A0A087WZS4_HUMAN|A0A087WZS4|NCAM1
MLQTKDLIWTLFFLGTAGEPSAPKLEGQMGEDGNSIKVNLIKQDDGGSPIRHYLVRYRALSSEWKPEIRLPSGSDHVMLKSLDWNAEYEVYVVAENQQGKSKAAHFVFRTSAQPTAIPANGSPTSGLSTGAIVGI
					

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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	50.2	Low	53.1	Low	239 Å²	239	137.8 Å²	137.8	100%	1.177	69%	0.692	S	S	*	*				0	91.6	0	-158.2	168.6	-170.5	0	0	105.9
2	L	47.9	Very low	53.3	Low	176 Å²	176	141.3 Å²	141.3	92%	0.921	70%	0.699	S	S	*	*			trans	-66.9	134	-167.9	-76.1	152.4	0	0	0	110	T4	L2-T4 PolarHBondContact O-N 3.47Å
3	Q	50.2	Low	53.2	Low	126 Å²	126	143.2 Å²	143.2	59%	0.589	70%	0.702	S	S	*	*			trans	-69.2	128.7	-168	-63.7	-142.4	-71.9	0	0	111	K5 D6	Q3-K5 HydrophobicContact CB-CB 4.29Å; Q3-K5 PolarHBondContact O-N 3.35Å; Q3-D6 PolarHBondContact O-N 2.93Å
4	T	56.3	Low	53	Low	117 Å²	117	142.2 Å²	142.2	72%	0.718	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	6.7	167.7	33.1	0	0	0	0	113.9	L2	L2-T4 PolarHBondContact O-N 3.47Å
5	K	53.2	Low	53.2	Low	130 Å²	130	137.1 Å²	137.1	57%	0.565	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-18.9	177.3	-64.7	175.9	110.1	173.5	0	112.7	Q3 I8	Q3-K5 HydrophobicContact CB-CB 4.29Å; Q3-K5 PolarHBondContact O-N 3.35Å; K5-I8 VanDerWaalsContact O-CG1 3.26Å; K5-I8 WeakPolarHBondContact O-CG1 3.19Å
6	D	54.8	Low	53.6	Low	106 Å²	106	136.5 Å²	136.5	57%	0.567	70%	0.704	S	S	*	*	H	α-helix	trans	-80.5	-18.9	178.7	-59.9	-75.1	0	0	0	112.9	Q3 T10	Q3-D6 PolarHBondContact O-N 2.93Å; D6-T10 PolarHBondContact O-OG1 2.88Å
7	L	55.7	Low	54.3	Low	121 Å²	121	129.9 Å²	129.9	63%	0.634	67%	0.674	S	S	*	*	H	α-helix	trans	-81.4	-25.8	179.4	-79.8	154.5	0	0	0	113.6
8	I	57.7	Low	55.5	Low	94 Å²	94	124.2 Å²	124.2	48%	0.482	65%	0.653	S	S	.	*	H	α-helix	trans	-83.8	-21.4	176.7	46	171.8	0	0	0	112.1	K5 L11 F12	K5-I8 VanDerWaalsContact O-CG1 3.26Å; K5-I8 WeakPolarHBondContact O-CG1 3.19Å; I8-L11 PolarHBondContact O-N 2.7Å; I8-F12 WeakPolarHBondContact O-CD2 3.26Å; I8-F12 PolarHBondContact O-N 3.47Å
9	W	53	Low	57.1	Low	180 Å²	180	124.8 Å²	124.8	68%	0.682	65%	0.652	S	S	*	*	H	α-helix	trans	-68.9	-36.3	170.6	-86.8	64.9	0	0	0	112.1	L11 F12 F13	W9-L11 VanDerWaalsContact C-N 3.3Å; W9-L11 PolarHBondContact O-N 3.45Å; W9-F12 PolarHBondContact O-N 3.38Å; W9-F13 AromaticContact CE3-CE2 3.91Å; W9-F13 HydrophobicContact CE3-CE2 3.91Å; W9-F13 HydrophobicContact CZ3-CE2 4.17Å; W9-F13 WeakPolarHBondContact O-CD2 3.24Å; W9-F13 PolarHBondContact O-N 2.89Å
10	T	51.7	Low	58.6	Low	95 Å²	95	118.9 Å²	118.9	58%	0.583	62%	0.621	S	S	*	*	H	α-helix	trans	-68	-29	176.3	-46.1	0	0	0	0	112.9	D6	D6-T10 PolarHBondContact O-OG1 2.88Å
11	L	53.1	Low	60.1	Low	132 Å²	132	115.9 Å²	115.9	69%	0.691	61%	0.61	S	S	*	*	H	α-helix	trans	-77.1	-27	177.4	-98.8	117.5	0	0	0	114	I8 W9	I8-L11 PolarHBondContact O-N 2.7Å; W9-L11 VanDerWaalsContact C-N 3.3Å; W9-L11 PolarHBondContact O-N 3.45Å
12	F	55.2	Low	61.9	Low	179 Å²	179	106 Å²	106	79%	0.785	57%	0.566	S	S	*	*	H	α-helix	trans	-83	-17.7	177.4	-81.2	-74.8	0	0	0	114.1	I8 W9	I8-F12 WeakPolarHBondContact O-CD2 3.26Å; I8-F12 PolarHBondContact O-N 3.47Å; W9-F12 PolarHBondContact O-N 3.38Å
13	F	52	Low	63.8	Low	167 Å²	167	97.8 Å²	97.8	73%	0.732	52%	0.524	S	S	*	.	S	Bend	trans	-90.8	-4.8	175.3	-83.5	-82.5	0	0	0	114.4	W9 G15	W9-F13 AromaticContact CE3-CE2 3.91Å; W9-F13 HydrophobicContact CE3-CE2 3.91Å; W9-F13 HydrophobicContact CZ3-CE2 4.17Å; W9-F13 WeakPolarHBondContact O-CD2 3.24Å; W9-F13 PolarHBondContact O-N 2.89Å; F13-G15 PolarHBondContact O-N 2.84Å; F13-G15 VanDerWaalsContact O-N 3.14Å
14	L	51.3	Low	65.8	Low	129 Å²	129	97.2 Å²	97.2	68%	0.675	52%	0.519	S	S	*	.			trans	-85.1	62.5	163.1	-72.6	158.9	0	0	0	108.6	T16	L14-T16 VanDerWaalsContact C-N 3.25Å; L14-T16 PolarHBondContact O-N 2.83Å
15	G	55.8	Low	67.5	Low	66 Å²	66	92.5 Å²	92.5	68%	0.68	49%	0.489	S	S	*	.			trans	-56.6	103.3	158	0	0	0	0	0	105.3	F13 A17	F13-G15 PolarHBondContact O-N 2.84Å; F13-G15 VanDerWaalsContact O-N 3.14Å; G15-A17 PolarHBondContact O-N 3.14Å
16	T	59.5	Low	69.3	Low	127 Å²	127	91 Å²	91	78%	0.779	48%	0.484	S	S	*	.			trans	-53.8	109.9	-178.3	48.9	0	0	0	0	105.9	L14 G18	L14-T16 VanDerWaalsContact C-N 3.25Å; L14-T16 PolarHBondContact O-N 2.83Å; T16-G18 PolarHBondContact O-N 3.49Å
17	A	64.8	Low	70.9	Confident	24 Å²	24	87.4 Å²	87.4	20%	0.198	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-53.4	122.7	177.3	0	0	0	0	0	106.7	G15 G46 S48 Q98	G15-A17 PolarHBondContact O-N 3.14Å; A17-G46 CarbonylContact C-O 3.53Å; A17-G46 WeakPolarHBondContact CA-O 3.47Å; A17-S48 WeakPolarHBondContact CB-OG 3.34Å; A17-Q98 HydrophobicContact CB-CG 3.75Å; A17-Q98 VanDerWaalsContact O-CG 3.24Å; A17-Q98 WeakPolarHBondContact O-CG 3.22Å; A17-Q98 PolarHBondContact O-NE2 3.47Å
18	G	76.8	Confident	72.6	Confident	28 Å²	28	87.4 Å²	87.4	29%	0.289	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-82.2	172.4	-177	0	0	0	0	0	111.4	T16 G46 N96	T16-G18 PolarHBondContact O-N 3.49Å; G18-G46 PolarHBondContact N-O 3.42Å; G18-N96 PolarHBondContact O-ND2 2.99Å
19	E	85.1	Confident	74	Confident	136 Å²	136	87.1 Å²	87.1	64%	0.636	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-58.1	146.7	158	-69	151.9	94.1	0	0	109.3
20	P	88.3	Confident	75.5	Confident	6 Å²	6	79.6 Å²	79.6	4%	0.039	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-67.7	158.4	177.5	19.2	-12.3	0	0	0	109.9	I50 A94 N96 S101	P20-I50 HydrophobicContact CB-CD1 3.5Å; P20-I50 VanDerWaalsContact CB-CD1 3.5Å; P20-I50 HydrophobicContact CG-CD1 4.03Å; P20-A94 HydrophobicContact CB-CB 4.46Å; P20-A94 HydrophobicContact CG-CB 4.32Å; P20-N96 VanDerWaalsContact CD-CG 3.47Å; P20-N96 WeakPolarHBondContact CD-ND2 3.41Å; P20-N96 HydrophobicContact CG-CB 3.92Å; P20-S101 VanDerWaalsContact C-CB 3.48Å; P20-S101 VanDerWaalsContact O-CA 3.23Å; P20-S101 WeakPolarHBondContact O-CA 3.37Å; P20-S101 WeakPolarHBondContact O-CB 3.38Å
21	S	88.6	Confident	76.9	Confident	55 Å²	55	85 Å²	85	39%	0.385	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-73.3	154.6	167.1	-78.3	0	0	0	0	111	D44 S101	S21-D44 WeakPolarHBondContact CB-O 3.12Å; S21-D44 PolarHBondContact N-O 3.16Å; S21-S101 VanDerWaalsContact C-CB 3.46Å; S21-S101 VanDerWaalsContact O-CB 3.25Å; S21-S101 WeakPolarHBondContact O-CB 3.41Å; S21-S101 PolarHBondContact O-OG 3.11Å
22	A	88.8	Confident	78.1	Confident	32 Å²	32	83.4 Å²	83.4	26%	0.264	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-57.7	131.9	172.9	0	0	0	0	0	109.1	Q43 K102 A104	A22-Q43 VanDerWaalsContact O-CG 3.27Å; A22-Q43 WeakPolarHBondContact O-CG 3.43Å; A22-K102 WeakPolarHBondContact CA-O 3.24Å; A22-K102 HydrophobicContact CB-CB 3.99Å; A22-K102 WeakPolarHBondContact CB-O 3.41Å; A22-A104 HydrophobicContact CB-CB 4.33Å
23	P	88.3	Confident	79.3	Confident	4 Å²	4	75.4 Å²	75.4	3%	0.026	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-63.8	148.6	172.4	27	-30.7	0	0	0	108.9	I41 Y53 V92 A94 A104	P23-I41 CarbonylContact C-O 3.54Å; P23-I41 WeakPolarHBondContact CA-O 3.42Å; P23-Y53 HydrophobicContact CB-CE1 4.05Å; P23-Y53 HydrophobicContact CG-CD1 4.19Å; P23-Y53 HydrophobicContact CG-CE1 4.16Å; P23-V92 HydrophobicContact CG-CB 4.12Å; P23-V92 HydrophobicContact CG-CG1 3.61Å; P23-A94 HydrophobicContact CG-CB 4.47Å; P23-A104 HydrophobicContact CG-CB 4.15Å; P23-A104 WeakPolarHBondContact O-CB 3.44Å
24	K	90.8	Very high	80.9	Confident	114 Å²	114	69 Å²	69	50%	0.496	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	135.1	171.9	-172.9	178.8	-176.8	-172.6	0	108.7	I41 Q43	K24-I41 HydrophobicContact CB-CB 4.12Å; K24-I41 HydrophobicContact CB-CD1 4.49Å; K24-I41 PolarHBondContact N-O 3.1Å; K24-I41 PolarHBondContact O-N 2.81Å; K24-Q43 HydrophobicContact CB-CG 4.39Å
25	L	92.3	Very high	82.8	Confident	17 Å²	17	63.1 Å²	63.1	9%	0.089	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.7	-178.3	-59.1	177.5	0	0	0	110.2	V38 N39 L40 V92 A104 F106	L25-V38 HydrophobicContact CB-CG1 4.19Å; L25-V38 HydrophobicContact CD2-CG1 3.95Å; L25-N39 WeakPolarHBondContact CA-O 3.4Å; L25-L40 HydrophobicContact CD2-CG 4.18Å; L25-V92 HydrophobicContact CD1-CB 3.94Å; L25-V92 HydrophobicContact CD1-CG2 3.61Å; L25-V92 HydrophobicContact CD2-CB 3.65Å; L25-V92 HydrophobicContact CD2-CG1 4.18Å; L25-V92 HydrophobicContact CD2-CG2 3.38Å; L25-V92 HydrophobicContact CG-CB 4.27Å; L25-V92 HydrophobicContact CG-CG2 4.11Å; L25-A104 HydrophobicContact CD1-CB 3.64Å; L25-A104 WeakPolarHBondContact CD1-O 3.29Å; L25-A104 HydrophobicContact CD2-CB 4.43Å; L25-A104 HydrophobicContact CG-CB 3.69Å; L25-F106 HydrophobicContact CB-CB 3.86Å; L25-F106 HydrophobicContact CB-CD2 4.44Å; L25-F106 HydrophobicContact CB-CG 4.23Å; L25-F106 HydrophobicContact CD1-CB 3.75Å; L25-F106 HydrophobicContact CG-CB 4.48Å
26	E	91.1	Very high	84.4	Confident	98 Å²	98	60.1 Å²	60.1	46%	0.458	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	113.7	172.2	-68.5	-163.7	128.7	0	0	109.8	V38 N39 I41	E26-V38 CarbonylContact O-C 3.56Å; E26-V38 WeakPolarHBondContact O-CA 3.47Å; E26-N39 HydrophobicContact CB-CB 4.41Å; E26-N39 PolarHBondContact N-O 3.23Å; E26-N39 PolarHBondContact O-N 2.77Å; E26-N39 PolarHBondContact O-ND2 3.41Å; E26-I41 HydrophobicContact CB-CD1 4.45Å; E26-I41 HydrophobicContact CG-CD1 3.68Å; E26-I41 VanDerWaalsContact OE2-CD1 3.29Å; E26-I41 WeakPolarHBondContact OE2-CD1 3.19Å
27	G	90.1	Very high	86	Confident	32 Å²	32	57.6 Å²	57.6	33%	0.33	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	122.2	175.5	0	0	0	0	0	111.8
28	Q	90.8	Very high	87.3	Confident	120 Å²	120	56.4 Å²	56.4	56%	0.561	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	114.4	169.7	-177.3	180	-28.7	0	0	108.8	G30 I36 K37	Q28-G30 PolarHBondContact O-N 3.4Å; Q28-I36 WeakPolarHBondContact O-CG1 2.84Å; Q28-K37 HydrophobicContact CB-CB 4.48Å; Q28-K37 PolarHBondContact N-O 3.36Å; Q28-K37 PolarHBondContact O-N 3Å
29	M	87.5	Confident	88.1	Confident	89 Å²	89	56.3 Å²	56.3	44%	0.438	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	133.2	175.7	-74.8	-121.1	-143.9	0	0	110.4	R109	M29-R109 WeakPolarHBondContact CE-O 3.22Å
30	G	83.1	Confident	88.3	Confident	21 Å²	21	49.9 Å²	49.9	22%	0.216	27%	0.267	C	S	.	.			trans	-73	161.1	170.8	0	0	0	0	0	111	Q28 D32 G33 S35	Q28-G30 PolarHBondContact O-N 3.4Å; G30-D32 PolarHBondContact O-N 3.16Å; G30-D32 VanDerWaalsContact O-N 3.16Å; G30-G33 PolarHBondContact O-N 2.9Å; G30-S35 PolarHBondContact N-O 3.19Å
31	E	80.8	Confident	88.4	Confident	209 Å²	209	52 Å²	52	98%	0.977	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-28.6	178.6	-125.7	166.5	94.4	0	0	112.6	G33	E31-G33 PolarHBondContact O-N 2.75Å
32	D	79.8	Confident	88.2	Confident	98 Å²	98	55.1 Å²	55.1	52%	0.524	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-18.3	177.1	-46.3	-78.2	0	0	0	113.3	G30 N34 S35 W84	G30-D32 PolarHBondContact O-N 3.16Å; G30-D32 VanDerWaalsContact O-N 3.16Å; D32-N34 PolarHBondContact O-N 3.39Å; D32-S35 PolarHBondContact OD2-OG 2.73Å; D32-W84 WeakPolarHBondContact O-CH2 3.37Å; D32-W84 WeakPolarHBondContact O-CZ3 3.3Å
33	G	80.4	Confident	88.1	Confident	11 Å²	11	58.8 Å²	58.8	11%	0.113	30%	0.296	C	S	.	.	S	Bend	trans	70.1	-17.9	-175.6	0	0	0	0	0	116.2	G30 E31 S111	G30-G33 PolarHBondContact O-N 2.9Å; E31-G33 PolarHBondContact O-N 2.75Å; G33-S111 PolarHBondContact O-N 3.13Å; G33-S111 VanDerWaalsContact O-N 3.11Å
34	N	86.1	Confident	88	Confident	32 Å²	32	63.1 Å²	63.1	17%	0.171	32%	0.319	C	S	.	.	S	Bend	trans	-99.5	-9	169.8	151.5	-41.1	0	0	0	112.4	D32 S81 L82 W84	D32-N34 PolarHBondContact O-N 3.39Å; N34-S81 WeakPolarHBondContact OD1-CA 3.17Å; N34-S81 PolarHBondContact OD1-N 3.37Å; N34-L82 PolarHBondContact ND2-O 3.03Å; N34-L82 WeakPolarHBondContact O-CB 3.39Å; N34-L82 WeakPolarHBondContact O-CD1 3.49Å; N34-L82 WeakPolarHBondContact O-CG 3.35Å; N34-L82 PolarHBondContact O-N 2.87Å; N34-L82 PolarHBondContact OD1-N 3.06Å; N34-L82 VanDerWaalsContact OD1-N 3.09Å; N34-W84 HydrophobicContact CB-CD2 3.93Å; N34-W84 HydrophobicContact CB-CE3 4.05Å; N34-W84 HydrophobicContact CB-CH2 3.77Å; N34-W84 HydrophobicContact CB-CZ2 3.53Å; N34-W84 HydrophobicContact CB-CZ3 3.99Å
35	S	89.5	Confident	87.5	Confident	7 Å²	7	60 Å²	60	5%	0.049	31%	0.308	C	S	.	.			trans	-103.2	144	176.2	-59.2	0	0	0	0	110.2	G30 D32 L79	G30-S35 PolarHBondContact N-O 3.19Å; D32-S35 PolarHBondContact OD2-OG 2.73Å; S35-L79 CarbonylContact C-O 3.51Å; S35-L79 WeakPolarHBondContact CA-O 3.29Å
36	I	90.6	Very high	87	Confident	3 Å²	3	59.9 Å²	59.9	2%	0.015	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	135.5	165.5	-166	167.9	0	0	0	110	Q28 V38 L79 L82 F106 F108	Q28-I36 WeakPolarHBondContact O-CG1 2.84Å; I36-V38 HydrophobicContact CG1-CG2 4.45Å; I36-V38 HydrophobicContact CG2-CG2 4.02Å; I36-L79 HydrophobicContact CG2-CB 3.84Å; I36-L79 HydrophobicContact CG2-CD1 4.11Å; I36-L79 HydrophobicContact CG2-CG 4.34Å; I36-L79 PolarHBondContact N-O 2.84Å; I36-L79 PolarHBondContact O-N 3.09Å; I36-L82 HydrophobicContact CB-CD1 4.39Å; I36-L82 HydrophobicContact CG2-CD1 3.76Å; I36-F106 HydrophobicContact CD1-CE1 4.24Å; I36-F108 HydrophobicContact CB-CE2 4.07Å; I36-F108 HydrophobicContact CB-CZ 4.29Å; I36-F108 HydrophobicContact CD1-CB 3.95Å; I36-F108 HydrophobicContact CD1-CD1 3.79Å; I36-F108 HydrophobicContact CD1-CD2 3.43Å; I36-F108 VanDerWaalsContact CD1-CD2 3.43Å; I36-F108 HydrophobicContact CD1-CE1 4.13Å; I36-F108 HydrophobicContact CD1-CE2 3.81Å; I36-F108 HydrophobicContact CD1-CG 3.42Å; I36-F108 VanDerWaalsContact CD1-CG 3.42Å; I36-F108 HydrophobicContact CD1-CZ 4.15Å; I36-F108 HydrophobicContact CG2-CD2 4.48Å; I36-F108 HydrophobicContact CG2-CE1 3.98Å; I36-F108 HydrophobicContact CG2-CE2 3.75Å; I36-F108 HydrophobicContact CG2-CZ 3.46Å; I36-F108 VanDerWaalsContact CG2-CZ 3.46Å
37	K	92.5	Very high	86.6	Confident	73 Å²	73	58.7 Å²	58.7	32%	0.317	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	108.3	167.8	-174.2	-176.6	-178.8	-168.8	0	107.7	Q28 N39 H76	Q28-K37 HydrophobicContact CB-CB 4.48Å; Q28-K37 PolarHBondContact N-O 3.36Å; Q28-K37 PolarHBondContact O-N 3Å; K37-N39 VanDerWaalsContact CE-OD1 3.24Å; K37-N39 WeakPolarHBondContact CE-OD1 3.48Å; K37-H76 HydrophobicContact CG-CB 4.3Å
38	V	92.6	Very high	86.3	Confident	0 Å²	0	58 Å²	58	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	112.1	173	-177.1	0	0	0	0	107.1	L25 E26 I36 L40 H76 V77 L79	L25-V38 HydrophobicContact CB-CG1 4.19Å; L25-V38 HydrophobicContact CD2-CG1 3.95Å; E26-V38 CarbonylContact O-C 3.56Å; E26-V38 WeakPolarHBondContact O-CA 3.47Å; I36-V38 HydrophobicContact CG1-CG2 4.45Å; I36-V38 HydrophobicContact CG2-CG2 4.02Å; V38-L40 WeakPolarHBondContact O-CD1 3.41Å; V38-H76 CarbonylContact O-C 3.55Å; V38-H76 VanDerWaalsContact O-CA 3.3Å; V38-H76 WeakPolarHBondContact O-CA 3.21Å; V38-V77 HydrophobicContact CB-CG1 3.68Å; V38-V77 HydrophobicContact CG1-CG1 4.37Å; V38-V77 HydrophobicContact CG2-CG1 4.41Å; V38-V77 PolarHBondContact N-O 3.39Å; V38-V77 PolarHBondContact O-N 3.46Å; V38-L79 HydrophobicContact CG2-CD1 4.12Å
39	N	92.3	Very high	86	Confident	26 Å²	26	57.1 Å²	57.1	14%	0.139	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	132.2	172.3	-54.1	-69.3	0	0	0	108.8	L25 E26 K37 D75	L25-N39 WeakPolarHBondContact CA-O 3.4Å; E26-N39 HydrophobicContact CB-CB 4.41Å; E26-N39 PolarHBondContact N-O 3.23Å; E26-N39 PolarHBondContact O-N 2.77Å; E26-N39 PolarHBondContact O-ND2 3.41Å; K37-N39 VanDerWaalsContact CE-OD1 3.24Å; K37-N39 WeakPolarHBondContact CE-OD1 3.48Å; N39-D75 CarbonylContact C-O 3.51Å; N39-D75 WeakPolarHBondContact CA-O 3.4Å
40	L	90.8	Very high	86.1	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	99.9	178.1	-69.3	81.6	0	0	0	108	L25 V38 K42 Y53 V55 L70 D75 V77 V92	L25-L40 HydrophobicContact CD2-CG 4.18Å; V38-L40 WeakPolarHBondContact O-CD1 3.41Å; L40-K42 PolarHBondContact O-N 2.82Å; L40-Y53 HydrophobicContact CD2-CD1 3.95Å; L40-Y53 HydrophobicContact CD2-CD2 4.16Å; L40-Y53 HydrophobicContact CD2-CG 3.7Å; L40-V55 HydrophobicContact CD2-CG2 4.29Å; L40-L70 HydrophobicContact CD1-CD1 4.23Å; L40-L70 HydrophobicContact CD2-CD1 4.04Å; L40-D75 PolarHBondContact N-O 2.78Å; L40-V77 HydrophobicContact CD1-CB 4.14Å; L40-V77 HydrophobicContact CD1-CG1 3.82Å; L40-V92 HydrophobicContact CD2-CG1 3.56Å; L40-V92 HydrophobicContact CG-CG1 4.22Å
41	I	89.4	Confident	86.4	Confident	51 Å²	51	59.3 Å²	59.3	26%	0.262	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	106.5	178.4	-57.9	155.1	0	0	0	107.6	P23 K24 E26 Q43	P23-I41 CarbonylContact C-O 3.54Å; P23-I41 WeakPolarHBondContact CA-O 3.42Å; K24-I41 HydrophobicContact CB-CB 4.12Å; K24-I41 HydrophobicContact CB-CD1 4.49Å; K24-I41 PolarHBondContact N-O 3.1Å; K24-I41 PolarHBondContact O-N 2.81Å; E26-I41 HydrophobicContact CB-CD1 4.45Å; E26-I41 HydrophobicContact CG-CD1 3.68Å; E26-I41 VanDerWaalsContact OE2-CD1 3.29Å; E26-I41 WeakPolarHBondContact OE2-CD1 3.19Å; I41-Q43 PolarHBondContact O-N 2.87Å
42	K	84.6	Confident	86.9	Confident	120 Å²	120	53.1 Å²	53.1	52%	0.522	29%	0.288	S	S	.	.			trans	-54.8	137.8	170.8	61.8	177.5	176.5	-71.9	0	110.4	L40	L40-K42 PolarHBondContact O-N 2.82Å
43	Q	87.6	Confident	87.4	Confident	109 Å²	109	48.8 Å²	48.8	51%	0.509	26%	0.264	S	S	.	.			trans	-103.3	-106.6	178.2	-67.6	-65.1	-77.7	0	0	108.4	A22 K24 I41	A22-Q43 VanDerWaalsContact O-CG 3.27Å; A22-Q43 WeakPolarHBondContact O-CG 3.43Å; K24-Q43 HydrophobicContact CB-CG 4.39Å; I41-Q43 PolarHBondContact O-N 2.87Å
44	D	85.7	Confident	88	Confident	95 Å²	95	49 Å²	49	51%	0.508	26%	0.263	S	S	.	.			trans	-105.8	132.9	173.9	-179.3	-94.7	0	0	0	109.3	S21 G46	S21-D44 WeakPolarHBondContact CB-O 3.12Å; S21-D44 PolarHBondContact N-O 3.16Å; D44-G46 VanDerWaalsContact C-N 3.29Å; D44-G46 VanDerWaalsContact OD1-CA 3.25Å; D44-G46 WeakPolarHBondContact OD1-CA 3.29Å; D44-G46 PolarHBondContact OD1-N 2.78Å
45	D	81	Confident	88.3	Confident	48 Å²	48	47.4 Å²	47.4	26%	0.257	25%	0.254	S	S	.	.			trans	-90.2	6.1	-178	-55.9	-55.9	0	0	0	112.5	G47 S48 I50 N96	D45-G47 PolarHBondContact O-N 3.05Å; D45-S48 VanDerWaalsContact CB-O 3.3Å; D45-S48 WeakPolarHBondContact CB-O 2.84Å; D45-S48 PolarHBondContact O-N 2.92Å; D45-I50 HydrophobicContact CB-CG1 4.28Å; D45-I50 WeakPolarHBondContact OD1-CD1 3.47Å; D45-I50 WeakPolarHBondContact OD1-CG1 3.33Å; D45-N96 PolarHBondContact O-ND2 2.79Å
46	G	81.3	Confident	88.4	Confident	15 Å²	15	51.4 Å²	51.4	16%	0.155	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	13.1	-175.7	0	0	0	0	0	113.3	A17 G18 D44	A17-G46 CarbonylContact C-O 3.53Å; A17-G46 WeakPolarHBondContact CA-O 3.47Å; G18-G46 PolarHBondContact N-O 3.42Å; D44-G46 VanDerWaalsContact C-N 3.29Å; D44-G46 VanDerWaalsContact OD1-CA 3.25Å; D44-G46 WeakPolarHBondContact OD1-CA 3.29Å; D44-G46 PolarHBondContact OD1-N 2.78Å
47	G	82.1	Confident	88.5	Confident	72 Å²	72	53 Å²	53	74%	0.742	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.9	11.6	-172.8	0	0	0	0	0	114.7	D45	D45-G47 PolarHBondContact O-N 3.05Å
48	S	84.4	Confident	88.5	Confident	18 Å²	18	52.9 Å²	52.9	13%	0.126	27%	0.272	C	S	.	.	S	Bend	trans	-133.1	133	170.8	-81.8	0	0	0	0	111.4	A17 D45 I50	A17-S48 WeakPolarHBondContact CB-OG 3.34Å; D45-S48 VanDerWaalsContact CB-O 3.3Å; D45-S48 WeakPolarHBondContact CB-O 2.84Å; D45-S48 PolarHBondContact O-N 2.92Å; S48-I50 PolarHBondContact O-N 2.8Å
49	P	84.6	Confident	88.4	Confident	102 Å²	102	53.2 Å²	53.2	66%	0.662	28%	0.275	S	S	*	.			trans	-59.9	136.3	-177.6	25.8	-34	0	0	0	111.2
50	I	88.6	Confident	88.2	Confident	13 Å²	13	56.3 Å²	56.3	7%	0.067	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	141.9	173.1	-50.2	-108.9	0	0	0	107.8	P20 D45 S48 Y53 S72 A94 E95	P20-I50 HydrophobicContact CB-CD1 3.5Å; P20-I50 VanDerWaalsContact CB-CD1 3.5Å; P20-I50 HydrophobicContact CG-CD1 4.03Å; D45-I50 HydrophobicContact CB-CG1 4.28Å; D45-I50 WeakPolarHBondContact OD1-CD1 3.47Å; D45-I50 WeakPolarHBondContact OD1-CG1 3.33Å; S48-I50 PolarHBondContact O-N 2.8Å; I50-Y53 HydrophobicContact CD1-CE1 4.27Å; I50-Y53 HydrophobicContact CG2-CD1 4.43Å; I50-Y53 HydrophobicContact CG2-CD2 4.35Å; I50-Y53 HydrophobicContact CG2-CE1 4.02Å; I50-Y53 HydrophobicContact CG2-CE2 3.92Å; I50-S72 VanDerWaalsContact C-CB 3.46Å; I50-S72 WeakPolarHBondContact O-CB 3.23Å; I50-S72 PolarHBondContact O-OG 2.8Å; I50-S72 VanDerWaalsContact O-OG 3.05Å; I50-A94 HydrophobicContact CD1-CB 3.35Å; I50-A94 HydrophobicContact CG2-CB 4.1Å; I50-E95 WeakPolarHBondContact CG2-O 3.35Å
51	R	89.3	Confident	87.9	Confident	142 Å²	142	62.2 Å²	62.2	54%	0.536	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	-47.4	176.9	-59.9	-172.8	73.4	160.8	4.6	111	S72 E95	R51-S72 WeakPolarHBondContact O-CB 3.33Å; R51-S72 PolarHBondContact O-N 2.74Å; R51-S72 VanDerWaalsContact O-N 3.1Å; R51-E95 PolarHBondContact N-O 2.87Å
52	H	91	Very high	87.9	Confident	80 Å²	80	62.9 Å²	62.9	37%	0.37	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	150.5	-175.4	-58.2	-68.1	0	0	0	111.7	L70 E95	H52-L70 CarbonylContact C-O 3.34Å; H52-L70 VanDerWaalsContact CA-O 3.29Å; H52-L70 WeakPolarHBondContact CA-O 2.84Å; H52-E95 PolarHBondContact N-O 3.38Å; H52-E95 VanDerWaalsContact N-O 3.16Å; H52-E95 PolarHBondContact O-N 2.86Å
53	Y	91.6	Very high	88.1	Confident	6 Å²	6	65.1 Å²	65.1	2%	0.024	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	127.7	163.9	-63.8	-83.5	0	0	0	109.6	P23 L40 I50 L70 V92 V93 A94	P23-Y53 HydrophobicContact CB-CE1 4.05Å; P23-Y53 HydrophobicContact CG-CD1 4.19Å; P23-Y53 HydrophobicContact CG-CE1 4.16Å; L40-Y53 HydrophobicContact CD2-CD1 3.95Å; L40-Y53 HydrophobicContact CD2-CD2 4.16Å; L40-Y53 HydrophobicContact CD2-CG 3.7Å; I50-Y53 HydrophobicContact CD1-CE1 4.27Å; I50-Y53 HydrophobicContact CG2-CD1 4.43Å; I50-Y53 HydrophobicContact CG2-CD2 4.35Å; I50-Y53 HydrophobicContact CG2-CE1 4.02Å; I50-Y53 HydrophobicContact CG2-CE2 3.92Å; Y53-L70 PolarHBondContact N-O 2.92Å; Y53-L70 PolarHBondContact O-N 3.15Å; Y53-V92 HydrophobicContact CD1-CG1 4.22Å; Y53-V93 CarbonylContact C-O 3.53Å; Y53-V93 WeakPolarHBondContact CA-O 2.84Å; Y53-A94 HydrophobicContact CD1-CB 3.56Å; Y53-A94 HydrophobicContact CE1-CB 3.38Å
54	L	91.9	Very high	88.2	Confident	15 Å²	15	64.3 Å²	64.3	8%	0.079	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	102	177.6	-56.2	160.9	0	0	0	107.2	E67 R69 V92 V93 K100	L54-E67 HydrophobicContact CB-CG 4.27Å; L54-E67 HydrophobicContact CD2-CG 4.26Å; L54-E67 VanDerWaalsContact CD2-OE1 3.3Å; L54-E67 WeakPolarHBondContact CD2-OE1 3.25Å; L54-R69 HydrophobicContact CD2-CG 4.01Å; L54-V92 WeakPolarHBondContact O-CA 2.91Å; L54-V93 HydrophobicContact CB-CB 4.22Å; L54-V93 HydrophobicContact CD1-CB 4.32Å; L54-V93 HydrophobicContact CD1-CG1 4.23Å; L54-V93 PolarHBondContact N-O 3.26Å; L54-V93 PolarHBondContact O-N 2.79Å; L54-K100 HydrophobicContact CD1-CD 4.48Å
55	V	92.9	Very high	88.4	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	121.5	177.6	-178.6	0	0	0	0	108.7	L40 E67 I68 L70 V77 V90 Y91 V92	L40-V55 HydrophobicContact CD2-CG2 4.29Å; V55-E67 CarbonylContact O-C 3.54Å; V55-I68 HydrophobicContact CB-CB 4.22Å; V55-I68 PolarHBondContact N-O 2.98Å; V55-I68 PolarHBondContact O-N 2.95Å; V55-L70 HydrophobicContact CG2-CD1 3.48Å; V55-L70 VanDerWaalsContact CG2-CD1 3.48Å; V55-L70 HydrophobicContact CG2-CG 4.21Å; V55-V77 HydrophobicContact CG1-CG1 4.24Å; V55-V77 HydrophobicContact CG2-CG1 4.43Å; V55-V90 HydrophobicContact CG1-CG1 3.98Å; V55-Y91 CarbonylContact C-O 3.59Å; V55-Y91 WeakPolarHBondContact CA-O 3.43Å; V55-V92 HydrophobicContact CB-CG2 4.28Å; V55-V92 HydrophobicContact CG1-CG2 4.05Å; V55-V92 HydrophobicContact CG2-CG1 4.1Å; V55-V92 HydrophobicContact CG2-CG2 3.85Å
56	R	92.6	Very high	88.8	Confident	91 Å²	91	66.4 Å²	66.4	34%	0.343	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	145.8	168	-53.5	-166	-33.1	-158.6	4.1	109.3	W64 E67 V90 Y91	R56-W64 HydrophobicContact CB-CE3 3.94Å; R56-W64 HydrophobicContact CB-CZ3 4.13Å; R56-W64 VanDerWaalsContact NH2-CZ2 3.27Å; R56-E67 HydrophobicContact CG-CB 4.05Å; R56-E67 HydrophobicContact CG-CG 4Å; R56-V90 CarbonylContact O-C 3.53Å; R56-V90 WeakPolarHBondContact O-CA 3.3Å; R56-Y91 PolarHBondContact N-O 3.09Å; R56-Y91 PolarHBondContact O-N 3.28Å
57	Y	91.8	Very high	89.3	Confident	35 Å²	35	69.4 Å²	69.4	14%	0.137	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	150.7	174.6	63	-72.2	0	0	0	109.7	K65 I68 L79 L82 E89	Y57-K65 HydrophobicContact CD1-CB 4.11Å; Y57-K65 HydrophobicContact CD2-CB 4.18Å; Y57-K65 HydrophobicContact CD2-CG 3.96Å; Y57-K65 HydrophobicContact CE1-CB 3.74Å; Y57-K65 HydrophobicContact CE1-CG 4.4Å; Y57-K65 HydrophobicContact CE2-CB 3.9Å; Y57-K65 HydrophobicContact CE2-CD 4.41Å; Y57-K65 HydrophobicContact CE2-CG 3.61Å; Y57-K65 HydrophobicContact CG-CB 4.29Å; Y57-K65 WeakPolarHBondContact O-CB 3.31Å; Y57-K65 PolarHBondContact O-N 2.81Å; Y57-I68 HydrophobicContact CD1-CD1 4.27Å; Y57-I68 HydrophobicContact CE1-CD1 3.58Å; Y57-I68 HydrophobicContact CE1-CG1 4.25Å; Y57-L79 HydrophobicContact CD1-CD1 4.37Å; Y57-L79 HydrophobicContact CD1-CD2 3.81Å; Y57-L79 HydrophobicContact CD2-CD1 4.21Å; Y57-L79 HydrophobicContact CD2-CD2 4.5Å; Y57-L79 HydrophobicContact CE1-CD2 3.81Å; Y57-L79 HydrophobicContact CE2-CD2 4.43Å; Y57-L79 HydrophobicContact CG-CD1 3.98Å; Y57-L79 HydrophobicContact CG-CD2 4.2Å; Y57-L82 HydrophobicContact CD2-CD2 4.14Å; Y57-L82 HydrophobicContact CE2-CD2 4.05Å; Y57-E89 CarbonylContact C-O 3.53Å; Y57-E89 WeakPolarHBondContact CA-O 3.39Å
58	R	92.2	Very high	89.7	Confident	72 Å²	72	68.5 Å²	68.5	27%	0.272	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	153.2	172.2	69.9	172.6	176.4	178.4	4.8	110.4	E63 W64 Y88 E89	R58-E63 WeakPolarHBondContact CB-O 3.45Å; R58-W64 HydrophobicContact CB-CD2 4.21Å; R58-W64 HydrophobicContact CB-CE3 3.96Å; R58-W64 HydrophobicContact CB-CZ3 4.41Å; R58-W64 VanDerWaalsContact CD-CE2 3.48Å; R58-W64 HydrophobicContact CG-CD2 4.05Å; R58-W64 HydrophobicContact CG-CE3 3.86Å; R58-W64 HydrophobicContact CG-CH2 4.14Å; R58-W64 HydrophobicContact CG-CZ2 4.34Å; R58-W64 HydrophobicContact CG-CZ3 3.91Å; R58-W64 VanDerWaalsContact CZ-CZ2 3.42Å; R58-W64 VanDerWaalsContact NE-CZ2 3.3Å; R58-Y88 CarbonylContact O-C 3.56Å; R58-Y88 VanDerWaalsContact O-CA 3.31Å; R58-Y88 WeakPolarHBondContact O-CA 3.47Å; R58-Y88 WeakPolarHBondContact O-CD1 3.36Å; R58-E89 HydrophobicContact CG-CG 3.52Å; R58-E89 IonicContact CZ-OE1 2.66Å; R58-E89 PolarHBondContact N-O 3.27Å; R58-E89 VanDerWaalsContact NE-CD 3.28Å; R58-E89 IonicContact NE-OE1 3.84Å; R58-E89 PolarHBondContact NE-OE1 2.83Å; R58-E89 IonicContact NE-OE2 3.89Å; R58-E89 IonicContact NH2-OE1 3.53Å; R58-E89 PolarHBondContact NH2-OE1 2.84Å; R58-E89 IonicContact NH2-OE2 3.16Å; R58-E89 PolarHBondContact O-N 2.89Å
59	A	90.7	Very high	90	Very high	7 Å²	7	76.3 Å²	76.3	6%	0.058	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	143.6	161.8	0	0	0	0	0	107.4	S61 S62 E87 Y88	A59-S61 PolarHBondContact O-N 3.38Å; A59-S61 VanDerWaalsContact O-N 3.11Å; A59-S62 CarbonylContact O-C 3.59Å; A59-S62 PolarHBondContact O-N 2.74Å; A59-E87 WeakPolarHBondContact CA-O 2.92Å; A59-Y88 HydrophobicContact CB-CD1 4.02Å; A59-Y88 HydrophobicContact CB-CE1 3.64Å; A59-Y88 HydrophobicContact CB-CE2 4.46Å
60	L	88.5	Confident	90.3	Very high	91 Å²	91	72.5 Å²	72.5	48%	0.476	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-24.5	174.8	-80.2	147.2	0	0	0	112.5	E87 E89 V107	L60-E87 HydrophobicContact CD1-CB 3.67Å; L60-E87 HydrophobicContact CD1-CG 3.41Å; L60-E87 VanDerWaalsContact CD1-CG 3.41Å; L60-E87 WeakPolarHBondContact CD1-OE1 3.15Å; L60-E87 PolarHBondContact N-O 3.42Å; L60-E89 WeakPolarHBondContact CD2-OE1 3.43Å; L60-V107 HydrophobicContact CD1-CG1 4.5Å
61	S	84.9	Confident	90.3	Very high	124 Å²	124	75.5 Å²	75.5	87%	0.867	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	6.2	175	-162.5	0	0	0	0	114	A59	A59-S61 PolarHBondContact O-N 3.38Å; A59-S61 VanDerWaalsContact O-N 3.11Å
62	S	88.4	Confident	90	Very high	65 Å²	65	71.6 Å²	71.6	46%	0.455	36%	0.362	S	S	.	.	S	Bend	trans	-142.1	175	-171.2	-155.5	0	0	0	0	112.5	A59	A59-S62 CarbonylContact O-C 3.59Å; A59-S62 PolarHBondContact O-N 2.74Å
63	E	90.1	Very high	89.5	Confident	167 Å²	167	71.3 Å²	71.3	78%	0.78	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-82.3	166.4	-179.8	-57	-168.8	106	0	0	112.1	R58 K65	R58-E63 WeakPolarHBondContact CB-O 3.45Å; E63-K65 PolarHBondContact O-N 3.24Å
64	W	89.4	Confident	89.4	Confident	92 Å²	92	72.4 Å²	72.4	35%	0.348	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-60.2	122.6	174.8	-66.8	98.6	0	0	0	111.3	R56 R58 E89 Y91	R56-W64 HydrophobicContact CB-CE3 3.94Å; R56-W64 HydrophobicContact CB-CZ3 4.13Å; R56-W64 VanDerWaalsContact NH2-CZ2 3.27Å; R58-W64 HydrophobicContact CB-CD2 4.21Å; R58-W64 HydrophobicContact CB-CE3 3.96Å; R58-W64 HydrophobicContact CB-CZ3 4.41Å; R58-W64 VanDerWaalsContact CD-CE2 3.48Å; R58-W64 HydrophobicContact CG-CD2 4.05Å; R58-W64 HydrophobicContact CG-CE3 3.86Å; R58-W64 HydrophobicContact CG-CH2 4.14Å; R58-W64 HydrophobicContact CG-CZ2 4.34Å; R58-W64 HydrophobicContact CG-CZ3 3.91Å; R58-W64 VanDerWaalsContact CZ-CZ2 3.42Å; R58-W64 VanDerWaalsContact NE-CZ2 3.3Å; W64-E89 HydrophobicContact CH2-CG 4.31Å; W64-Y91 AromaticContact CH2-CD2 3.34Å; W64-Y91 HydrophobicContact CH2-CD2 3.34Å; W64-Y91 AromaticContact CH2-CE2 3.4Å; W64-Y91 HydrophobicContact CH2-CE2 3.4Å; W64-Y91 VanDerWaalsContact CH2-CE2 3.4Å; W64-Y91 HydrophobicContact CH2-CG 4.04Å; W64-Y91 HydrophobicContact CZ2-CE2 4.47Å; W64-Y91 AromaticContact CZ3-CD2 3.53Å; W64-Y91 HydrophobicContact CZ3-CD2 3.53Å; W64-Y91 HydrophobicContact CZ3-CE2 4.02Å; W64-Y91 HydrophobicContact CZ3-CG 4.21Å
65	K	89.3	Confident	89.1	Confident	88 Å²	88	75.4 Å²	75.4	38%	0.383	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-66.3	158.9	169.1	-66.7	-75.4	-174.5	-179.7	0	109.4	Y57 E63 E67	Y57-K65 HydrophobicContact CD1-CB 4.11Å; Y57-K65 HydrophobicContact CD2-CB 4.18Å; Y57-K65 HydrophobicContact CD2-CG 3.96Å; Y57-K65 HydrophobicContact CE1-CB 3.74Å; Y57-K65 HydrophobicContact CE1-CG 4.4Å; Y57-K65 HydrophobicContact CE2-CB 3.9Å; Y57-K65 HydrophobicContact CE2-CD 4.41Å; Y57-K65 HydrophobicContact CE2-CG 3.61Å; Y57-K65 HydrophobicContact CG-CB 4.29Å; Y57-K65 WeakPolarHBondContact O-CB 3.31Å; Y57-K65 PolarHBondContact O-N 2.81Å; E63-K65 PolarHBondContact O-N 3.24Å; K65-E67 PolarHBondContact O-N 2.75Å
66	P	89.3	Confident	89	Confident	99 Å²	99	80 Å²	80	64%	0.643	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-50.2	135.9	175.9	19.7	-33.7	0	0	0	111.2	I68	P66-I68 PolarHBondContact O-N 3.26Å
67	E	90.9	Very high	88.9	Confident	78 Å²	78	76.1 Å²	76.1	36%	0.364	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-62.8	119.1	174.2	178.7	-176.4	86.1	0	0	109.4	L54 V55 R56 K65 R69	L54-E67 HydrophobicContact CB-CG 4.27Å; L54-E67 HydrophobicContact CD2-CG 4.26Å; L54-E67 VanDerWaalsContact CD2-OE1 3.3Å; L54-E67 WeakPolarHBondContact CD2-OE1 3.25Å; V55-E67 CarbonylContact O-C 3.54Å; R56-E67 HydrophobicContact CG-CB 4.05Å; R56-E67 HydrophobicContact CG-CG 4Å; K65-E67 PolarHBondContact O-N 2.75Å; E67-R69 IonicContact OE1-CZ 3.15Å; E67-R69 IonicContact OE1-NE 2.8Å; E67-R69 PolarHBondContact OE1-NE 3.48Å; E67-R69 VanDerWaalsContact OE1-NE 3.16Å; E67-R69 IonicContact OE1-NH2 3.4Å; E67-R69 PolarHBondContact OE1-NH2 3.44Å
68	I	90.7	Very high	88.8	Confident	54 Å²	54	79 Å²	79	28%	0.277	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	122.3	174.8	-59.5	173.3	0	0	0	107.6	V55 Y57 P66 L70 L79	V55-I68 HydrophobicContact CB-CB 4.22Å; V55-I68 PolarHBondContact N-O 2.98Å; V55-I68 PolarHBondContact O-N 2.95Å; Y57-I68 HydrophobicContact CD1-CD1 4.27Å; Y57-I68 HydrophobicContact CE1-CD1 3.58Å; Y57-I68 HydrophobicContact CE1-CG1 4.25Å; P66-I68 PolarHBondContact O-N 3.26Å; I68-L70 HydrophobicContact CG2-CD2 3.96Å; I68-L70 HydrophobicContact CG2-CG 4.17Å; I68-L79 HydrophobicContact CD1-CD2 3.9Å
69	R	91.4	Very high	88.7	Confident	182 Å²	182	75.6 Å²	75.6	69%	0.687	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	112.2	175.8	-60.7	-170.9	175.3	173.3	-0.1	109.6	L54 E67	L54-R69 HydrophobicContact CD2-CG 4.01Å; E67-R69 IonicContact OE1-CZ 3.15Å; E67-R69 IonicContact OE1-NE 2.8Å; E67-R69 PolarHBondContact OE1-NE 3.48Å; E67-R69 VanDerWaalsContact OE1-NE 3.16Å; E67-R69 IonicContact OE1-NH2 3.4Å; E67-R69 PolarHBondContact OE1-NH2 3.44Å
70	L	90.7	Very high	88.6	Confident	21 Å²	21	81 Å²	81	11%	0.11	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	143.7	176.1	-60	169.4	0	0	0	110.1	L40 H52 Y53 V55 I68 V77	L40-L70 HydrophobicContact CD1-CD1 4.23Å; L40-L70 HydrophobicContact CD2-CD1 4.04Å; H52-L70 CarbonylContact C-O 3.34Å; H52-L70 VanDerWaalsContact CA-O 3.29Å; H52-L70 WeakPolarHBondContact CA-O 2.84Å; Y53-L70 PolarHBondContact N-O 2.92Å; Y53-L70 PolarHBondContact O-N 3.15Å; V55-L70 HydrophobicContact CG2-CD1 3.48Å; V55-L70 VanDerWaalsContact CG2-CD1 3.48Å; V55-L70 HydrophobicContact CG2-CG 4.21Å; I68-L70 HydrophobicContact CG2-CD2 3.96Å; I68-L70 HydrophobicContact CG2-CG 4.17Å; L70-V77 HydrophobicContact CD1-CB 3.74Å; L70-V77 HydrophobicContact CD1-CG1 4.48Å; L70-V77 HydrophobicContact CD1-CG2 4.09Å; L70-V77 HydrophobicContact CD2-CG2 4.37Å
71	P	89.6	Confident	88.5	Confident	77 Å²	77	81.8 Å²	81.8	50%	0.5	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	158.3	167.9	29.4	-34.2	0	0	0	110.6	G73 S74	P71-G73 PolarHBondContact O-N 2.77Å; P71-G73 VanDerWaalsContact O-N 3.15Å; P71-S74 WeakPolarHBondContact CD-OG 3.35Å; P71-S74 WeakPolarHBondContact CG-OG 3.25Å; P71-S74 VanDerWaalsContact O-CB 3.29Å; P71-S74 WeakPolarHBondContact O-CB 3.44Å; P71-S74 PolarHBondContact O-N 2.66Å; P71-S74 PolarHBondContact O-OG 3.47Å
72	S	83.1	Confident	88.7	Confident	60 Å²	60	76 Å²	76	42%	0.42	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-20.2	-179.4	58	0	0	0	0	115.7	I50 R51 S74	I50-S72 VanDerWaalsContact C-CB 3.46Å; I50-S72 WeakPolarHBondContact O-CB 3.23Å; I50-S72 PolarHBondContact O-OG 2.8Å; I50-S72 VanDerWaalsContact O-OG 3.05Å; R51-S72 WeakPolarHBondContact O-CB 3.33Å; R51-S72 PolarHBondContact O-N 2.74Å; R51-S72 VanDerWaalsContact O-N 3.1Å; S72-S74 PolarHBondContact O-N 2.86Å
73	G	80.2	Confident	88.7	Confident	74 Å²	74	77.7 Å²	77.7	76%	0.763	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-6.5	172.7	0	0	0	0	0	114.2	P71 D75	P71-G73 PolarHBondContact O-N 2.77Å; P71-G73 VanDerWaalsContact O-N 3.15Å; G73-D75 PolarHBondContact O-N 2.93Å
74	S	87.8	Confident	88.6	Confident	29 Å²	29	73.3 Å²	73.3	20%	0.203	39%	0.39	C	S	.	.			trans	-80.1	111.4	177.7	-68.6	0	0	0	0	111.1	P71 S72	P71-S74 WeakPolarHBondContact CD-OG 3.35Å; P71-S74 WeakPolarHBondContact CG-OG 3.25Å; P71-S74 VanDerWaalsContact O-CB 3.29Å; P71-S74 WeakPolarHBondContact O-CB 3.44Å; P71-S74 PolarHBondContact O-N 2.66Å; P71-S74 PolarHBondContact O-OG 3.47Å; S72-S74 PolarHBondContact O-N 2.86Å
75	D	87.4	Confident	88.5	Confident	78 Å²	78	73.3 Å²	73.3	42%	0.417	40%	0.397	S	S	.	.			trans	-93.2	-6.3	174.7	-162.9	-98.2	0	0	0	112.2	N39 L40 G73	N39-D75 CarbonylContact C-O 3.51Å; N39-D75 WeakPolarHBondContact CA-O 3.4Å; L40-D75 PolarHBondContact N-O 2.78Å; G73-D75 PolarHBondContact O-N 2.93Å
76	H	89.4	Confident	88.6	Confident	96 Å²	96	70.2 Å²	70.2	44%	0.444	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	156.3	176.1	63.1	-85.4	0	0	0	112.2	K37 V38	K37-H76 HydrophobicContact CG-CB 4.3Å; V38-H76 CarbonylContact O-C 3.55Å; V38-H76 VanDerWaalsContact O-CA 3.3Å; V38-H76 WeakPolarHBondContact O-CA 3.21Å
77	V	90.4	Very high	88.7	Confident	9 Å²	9	70.1 Å²	70.1	6%	0.055	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	133.7	171.1	64	0	0	0	0	109.4	V38 L40 V55 L70 L79	V38-V77 HydrophobicContact CB-CG1 3.68Å; V38-V77 HydrophobicContact CG1-CG1 4.37Å; V38-V77 HydrophobicContact CG2-CG1 4.41Å; V38-V77 PolarHBondContact N-O 3.39Å; V38-V77 PolarHBondContact O-N 3.46Å; L40-V77 HydrophobicContact CD1-CB 4.14Å; L40-V77 HydrophobicContact CD1-CG1 3.82Å; V55-V77 HydrophobicContact CG1-CG1 4.24Å; V55-V77 HydrophobicContact CG2-CG1 4.43Å; L70-V77 HydrophobicContact CD1-CB 3.74Å; L70-V77 HydrophobicContact CD1-CG1 4.48Å; L70-V77 HydrophobicContact CD1-CG2 4.09Å; L70-V77 HydrophobicContact CD2-CG2 4.37Å; V77-L79 HydrophobicContact CG2-CD2 4.11Å
78	M	90.4	Very high	88.7	Confident	95 Å²	95	66.6 Å²	66.6	47%	0.468	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	106.8	177.2	-161.6	170.5	-176.8	0	0	108.5	K80	M78-K80 HydrophobicContact CE-CG 4.5Å; M78-K80 HydrophobicContact CG-CG 4.04Å; M78-K80 WeakPolarHBondContact SD-CE 3.32Å
79	L	89.9	Confident	88.8	Confident	2 Å²	2	64.3 Å²	64.3	1%	0.01	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	118	172.2	-56	178.5	0	0	0	107.3	S35 I36 V38 Y57 I68 V77 L82 V90	S35-L79 CarbonylContact C-O 3.51Å; S35-L79 WeakPolarHBondContact CA-O 3.29Å; I36-L79 HydrophobicContact CG2-CB 3.84Å; I36-L79 HydrophobicContact CG2-CD1 4.11Å; I36-L79 HydrophobicContact CG2-CG 4.34Å; I36-L79 PolarHBondContact N-O 2.84Å; I36-L79 PolarHBondContact O-N 3.09Å; V38-L79 HydrophobicContact CG2-CD1 4.12Å; Y57-L79 HydrophobicContact CD1-CD1 4.37Å; Y57-L79 HydrophobicContact CD1-CD2 3.81Å; Y57-L79 HydrophobicContact CD2-CD1 4.21Å; Y57-L79 HydrophobicContact CD2-CD2 4.5Å; Y57-L79 HydrophobicContact CE1-CD2 3.81Å; Y57-L79 HydrophobicContact CE2-CD2 4.43Å; Y57-L79 HydrophobicContact CG-CD1 3.98Å; Y57-L79 HydrophobicContact CG-CD2 4.2Å; I68-L79 HydrophobicContact CD1-CD2 3.9Å; V77-L79 HydrophobicContact CG2-CD2 4.11Å; L79-L82 HydrophobicContact CB-CD1 4.12Å; L79-L82 HydrophobicContact CB-CD2 4.44Å; L79-V90 HydrophobicContact CD1-CG2 4.01Å
80	K	88.6	Confident	88.9	Confident	121 Å²	121	55.7 Å²	55.7	53%	0.526	32%	0.318	S	S	.	.			trans	-117.8	167.4	178.9	-57.3	-176.2	-178.2	-173.7	0	109.4	M78 L82	M78-K80 HydrophobicContact CE-CG 4.5Å; M78-K80 HydrophobicContact CG-CG 4.04Å; M78-K80 WeakPolarHBondContact SD-CE 3.32Å; K80-L82 VanDerWaalsContact C-N 3.32Å; K80-L82 PolarHBondContact O-N 2.81Å
81	S	86.4	Confident	89	Confident	106 Å²	106	57.1 Å²	57.1	74%	0.741	32%	0.322	S	S	*	.	S	Bend	trans	60.5	42.4	177.8	-52	0	0	0	0	112.2	N34	N34-S81 WeakPolarHBondContact OD1-CA 3.17Å; N34-S81 PolarHBondContact OD1-N 3.37Å
82	L	89.1	Confident	89.1	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-85.8	146.6	173.4	-56.8	161.1	0	0	0	109.9	N34 I36 Y57 L79 K80 Y88 F108 T110	N34-L82 PolarHBondContact ND2-O 3.03Å; N34-L82 WeakPolarHBondContact O-CB 3.39Å; N34-L82 WeakPolarHBondContact O-CD1 3.49Å; N34-L82 WeakPolarHBondContact O-CG 3.35Å; N34-L82 PolarHBondContact O-N 2.87Å; N34-L82 PolarHBondContact OD1-N 3.06Å; N34-L82 VanDerWaalsContact OD1-N 3.09Å; I36-L82 HydrophobicContact CB-CD1 4.39Å; I36-L82 HydrophobicContact CG2-CD1 3.76Å; Y57-L82 HydrophobicContact CD2-CD2 4.14Å; Y57-L82 HydrophobicContact CE2-CD2 4.05Å; L79-L82 HydrophobicContact CB-CD1 4.12Å; L79-L82 HydrophobicContact CB-CD2 4.44Å; K80-L82 VanDerWaalsContact C-N 3.32Å; K80-L82 PolarHBondContact O-N 2.81Å; L82-Y88 HydrophobicContact CB-CD2 4.5Å; L82-Y88 HydrophobicContact CB-CE2 3.88Å; L82-Y88 HydrophobicContact CD2-CD1 3.89Å; L82-Y88 HydrophobicContact CD2-CD2 4.44Å; L82-Y88 HydrophobicContact CD2-CE1 3.68Å; L82-Y88 HydrophobicContact CD2-CE2 4.22Å; L82-Y88 HydrophobicContact CD2-CG 4.28Å; L82-F108 HydrophobicContact CD1-CE2 3.84Å; L82-F108 HydrophobicContact CD1-CZ 3.74Å; L82-T110 HydrophobicContact CB-CG2 3.72Å; L82-T110 HydrophobicContact CD1-CG2 4.18Å
83	D	88	Confident	89.6	Confident	100 Å²	100	52 Å²	52	54%	0.535	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-61.7	138.9	173.5	-72.4	-86.4	0	0	0	110.2	A86 Y88 T110	D83-A86 HydrophobicContact CB-CB 3.85Å; D83-Y88 HydrophobicContact CB-CE2 4.29Å; D83-Y88 WeakPolarHBondContact CB-OH 3.45Å; D83-Y88 PolarHBondContact N-OH 2.76Å; D83-Y88 PolarHBondContact OD2-OH 2.88Å; D83-T110 WeakPolarHBondContact O-CB 3.05Å; D83-T110 WeakPolarHBondContact O-CG2 3.21Å; D83-T110 PolarHBondContact O-OG1 2.95Å
84	W	89	Confident	90.1	Very high	74 Å²	74	48.4 Å²	48.4	28%	0.28	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	150	179.8	-58.6	92.5	0	0	0	111.4	D32 N34 A86 Q113 P114	D32-W84 WeakPolarHBondContact O-CH2 3.37Å; D32-W84 WeakPolarHBondContact O-CZ3 3.3Å; N34-W84 HydrophobicContact CB-CD2 3.93Å; N34-W84 HydrophobicContact CB-CE3 4.05Å; N34-W84 HydrophobicContact CB-CH2 3.77Å; N34-W84 HydrophobicContact CB-CZ2 3.53Å; N34-W84 HydrophobicContact CB-CZ3 3.99Å; W84-A86 PolarHBondContact O-N 3.01Å; W84-Q113 HydrophobicContact CB-CB 3.83Å; W84-Q113 HydrophobicContact CD2-CB 3.81Å; W84-Q113 HydrophobicContact CD2-CG 4.1Å; W84-Q113 VanDerWaalsContact CE3-CA 3.42Å; W84-Q113 HydrophobicContact CE3-CB 4.21Å; W84-Q113 HydrophobicContact CG-CB 3.67Å; W84-Q113 HydrophobicContact CG-CG 4.14Å; W84-Q113 HydrophobicContact CZ2-CG 4.46Å; W84-P114 HydrophobicContact CH2-CG 3.91Å; W84-P114 HydrophobicContact CZ3-CG 4.29Å
85	N	87.6	Confident	90.2	Very high	93 Å²	93	49.6 Å²	49.6	50%	0.497	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	24.5	-179.7	-167.7	51.5	0	0	0	113.8	R109 T110 S111	N85-R109 PolarHBondContact OD1-NE 3.11Å; N85-R109 PolarHBondContact OD1-NH2 2.87Å; N85-T110 PolarHBondContact N-OG1 2.91Å; N85-T110 VanDerWaalsContact N-OG1 3.09Å; N85-S111 PolarHBondContact N-O 2.88Å
86	A	89.8	Confident	90.3	Very high	23 Å²	23	46.2 Å²	46.2	19%	0.19	23%	0.234	C	C	.	.			trans	-108.7	150	179.8	0	0	0	0	0	110.9	D83 W84 Y88 R109 T110	D83-A86 HydrophobicContact CB-CB 3.85Å; W84-A86 PolarHBondContact O-N 3.01Å; A86-Y88 HydrophobicContact CB-CD2 4.29Å; A86-Y88 HydrophobicContact CB-CE2 3.75Å; A86-R109 WeakPolarHBondContact O-CA 3.41Å; A86-T110 PolarHBondContact N-OG1 3.16Å; A86-T110 PolarHBondContact O-N 2.73Å; A86-T110 PolarHBondContact O-OG1 2.81Å; A86-T110 VanDerWaalsContact O-OG1 3.08Å
87	E	92.1	Very high	90.2	Very high	97 Å²	97	48.5 Å²	48.5	45%	0.453	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	128.4	176.3	-164.6	172.4	94.6	0	0	109.9	A59 L60 V107	A59-E87 WeakPolarHBondContact CA-O 2.92Å; L60-E87 HydrophobicContact CD1-CB 3.67Å; L60-E87 HydrophobicContact CD1-CG 3.41Å; L60-E87 VanDerWaalsContact CD1-CG 3.41Å; L60-E87 WeakPolarHBondContact CD1-OE1 3.15Å; L60-E87 PolarHBondContact N-O 3.42Å; E87-V107 HydrophobicContact CG-CG1 3.61Å
88	Y	91.4	Very high	90	Very high	3 Å²	3	53.3 Å²	53.3	1%	0.012	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	138.4	-175.5	-79.6	-89.9	0	0	0	110.4	R58 A59 L82 D83 A86 V107 F108 T110	R58-Y88 CarbonylContact O-C 3.56Å; R58-Y88 VanDerWaalsContact O-CA 3.31Å; R58-Y88 WeakPolarHBondContact O-CA 3.47Å; R58-Y88 WeakPolarHBondContact O-CD1 3.36Å; A59-Y88 HydrophobicContact CB-CD1 4.02Å; A59-Y88 HydrophobicContact CB-CE1 3.64Å; A59-Y88 HydrophobicContact CB-CE2 4.46Å; L82-Y88 HydrophobicContact CB-CD2 4.5Å; L82-Y88 HydrophobicContact CB-CE2 3.88Å; L82-Y88 HydrophobicContact CD2-CD1 3.89Å; L82-Y88 HydrophobicContact CD2-CD2 4.44Å; L82-Y88 HydrophobicContact CD2-CE1 3.68Å; L82-Y88 HydrophobicContact CD2-CE2 4.22Å; L82-Y88 HydrophobicContact CD2-CG 4.28Å; D83-Y88 HydrophobicContact CB-CE2 4.29Å; D83-Y88 WeakPolarHBondContact CB-OH 3.45Å; D83-Y88 PolarHBondContact N-OH 2.76Å; D83-Y88 PolarHBondContact OD2-OH 2.88Å; A86-Y88 HydrophobicContact CB-CD2 4.29Å; A86-Y88 HydrophobicContact CB-CE2 3.75Å; Y88-V107 WeakPolarHBondContact O-CA 3.27Å; Y88-V107 WeakPolarHBondContact O-CG1 3.3Å; Y88-F108 HydrophobicContact CD2-CE2 4.34Å; Y88-F108 HydrophobicContact CD2-CZ 4.36Å; Y88-F108 HydrophobicContact CG-CE2 4.38Å; Y88-F108 AromaticContact CG-CZ 3.97Å; Y88-F108 HydrophobicContact CG-CZ 3.97Å; Y88-F108 PolarHBondContact N-O 2.9Å; Y88-F108 PolarHBondContact O-N 2.91Å; Y88-F108 VanDerWaalsContact O-O 3.12Å; Y88-T110 HydrophobicContact CD2-CG2 3.84Å; Y88-T110 HydrophobicContact CE2-CG2 3.91Å
89	E	93.2	Very high	89.9	Confident	7 Å²	7	49.9 Å²	49.9	3%	0.033	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	138.5	170.4	66.3	-174.5	122.3	0	0	110.1	Y57 R58 L60 W64 Y91 F106 V107	Y57-E89 CarbonylContact C-O 3.53Å; Y57-E89 WeakPolarHBondContact CA-O 3.39Å; R58-E89 HydrophobicContact CG-CG 3.52Å; R58-E89 IonicContact CZ-OE1 2.66Å; R58-E89 PolarHBondContact N-O 3.27Å; R58-E89 VanDerWaalsContact NE-CD 3.28Å; R58-E89 IonicContact NE-OE1 3.84Å; R58-E89 PolarHBondContact NE-OE1 2.83Å; R58-E89 IonicContact NE-OE2 3.89Å; R58-E89 IonicContact NH2-OE1 3.53Å; R58-E89 PolarHBondContact NH2-OE1 2.84Å; R58-E89 IonicContact NH2-OE2 3.16Å; R58-E89 PolarHBondContact O-N 2.89Å; L60-E89 WeakPolarHBondContact CD2-OE1 3.43Å; W64-E89 HydrophobicContact CH2-CG 4.31Å; E89-Y91 HydrophobicContact CB-CE2 4.04Å; E89-Y91 HydrophobicContact CG-CD2 4.48Å; E89-Y91 HydrophobicContact CG-CE2 3.85Å; E89-Y91 WeakPolarHBondContact OE2-CE2 3.46Å; E89-Y91 PolarHBondContact OE2-OH 3.48Å; E89-F106 CarbonylContact C-O 3.55Å; E89-F106 WeakPolarHBondContact CA-O 3.31Å; E89-V107 HydrophobicContact CB-CG2 4.34Å
90	V	92.9	Very high	89.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	133.2	-179.9	-170.2	0	0	0	0	108.7	V55 R56 L79 V92 F106 F108	V55-V90 HydrophobicContact CG1-CG1 3.98Å; R56-V90 CarbonylContact O-C 3.53Å; R56-V90 WeakPolarHBondContact O-CA 3.3Å; L79-V90 HydrophobicContact CD1-CG2 4.01Å; V90-V92 HydrophobicContact CG1-CG2 4.01Å; V90-F106 HydrophobicContact CB-CB 4.5Å; V90-F106 PolarHBondContact N-O 3.46Å; V90-F106 PolarHBondContact O-N 2.74Å; V90-F108 HydrophobicContact CG2-CD1 4.05Å; V90-F108 HydrophobicContact CG2-CE1 3.49Å; V90-F108 VanDerWaalsContact CG2-CE1 3.49Å
91	Y	92.7	Very high	90	Very high	52 Å²	52	50 Å²	50	20%	0.204	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	124	177.2	-73.8	-107.7	0	0	0	107.9	V55 R56 W64 E89 A103 A104 H105	V55-Y91 CarbonylContact C-O 3.59Å; V55-Y91 WeakPolarHBondContact CA-O 3.43Å; R56-Y91 PolarHBondContact N-O 3.09Å; R56-Y91 PolarHBondContact O-N 3.28Å; W64-Y91 AromaticContact CH2-CD2 3.34Å; W64-Y91 HydrophobicContact CH2-CD2 3.34Å; W64-Y91 AromaticContact CH2-CE2 3.4Å; W64-Y91 HydrophobicContact CH2-CE2 3.4Å; W64-Y91 VanDerWaalsContact CH2-CE2 3.4Å; W64-Y91 HydrophobicContact CH2-CG 4.04Å; W64-Y91 HydrophobicContact CZ2-CE2 4.47Å; W64-Y91 AromaticContact CZ3-CD2 3.53Å; W64-Y91 HydrophobicContact CZ3-CD2 3.53Å; W64-Y91 HydrophobicContact CZ3-CE2 4.02Å; W64-Y91 HydrophobicContact CZ3-CG 4.21Å; E89-Y91 HydrophobicContact CB-CE2 4.04Å; E89-Y91 HydrophobicContact CG-CD2 4.48Å; E89-Y91 HydrophobicContact CG-CE2 3.85Å; E89-Y91 WeakPolarHBondContact OE2-CE2 3.46Å; E89-Y91 PolarHBondContact OE2-OH 3.48Å; Y91-A103 HydrophobicContact CD1-CB 3.96Å; Y91-A104 CarbonylContact C-O 3.58Å; Y91-A104 WeakPolarHBondContact CA-O 2.85Å; Y91-H105 HydrophobicContact CE1-CB 4.41Å; Y91-H105 AromaticContact CE1-ND1 3.9Å; Y91-H105 AromaticContact CZ-ND1 3.43Å; Y91-H105 PolarHBondContact OH-CE1 2.8Å; Y91-H105 PolarHBondContact OH-ND1 2.89Å; Y91-H105 VanDerWaalsContact OH-ND1 3.09Å
92	V	92.5	Very high	90.1	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	121.3	175.9	-177.5	0	0	0	0	109.4	P23 L25 L40 Y53 L54 V55 V90 A104	P23-V92 HydrophobicContact CG-CB 4.12Å; P23-V92 HydrophobicContact CG-CG1 3.61Å; L25-V92 HydrophobicContact CD1-CB 3.94Å; L25-V92 HydrophobicContact CD1-CG2 3.61Å; L25-V92 HydrophobicContact CD2-CB 3.65Å; L25-V92 HydrophobicContact CD2-CG1 4.18Å; L25-V92 HydrophobicContact CD2-CG2 3.38Å; L25-V92 HydrophobicContact CG-CB 4.27Å; L25-V92 HydrophobicContact CG-CG2 4.11Å; L40-V92 HydrophobicContact CD2-CG1 3.56Å; L40-V92 HydrophobicContact CG-CG1 4.22Å; Y53-V92 HydrophobicContact CD1-CG1 4.22Å; L54-V92 WeakPolarHBondContact O-CA 2.91Å; V55-V92 HydrophobicContact CB-CG2 4.28Å; V55-V92 HydrophobicContact CG1-CG2 4.05Å; V55-V92 HydrophobicContact CG2-CG1 4.1Å; V55-V92 HydrophobicContact CG2-CG2 3.85Å; V90-V92 HydrophobicContact CG1-CG2 4.01Å; V92-A104 HydrophobicContact CB-CB 4.36Å; V92-A104 PolarHBondContact N-O 3.09Å; V92-A104 WeakPolarHBondContact O-CB 3.43Å; V92-A104 PolarHBondContact O-N 3.01Å
93	V	92.3	Very high	90.1	Very high	28 Å²	28	55.6 Å²	55.6	17%	0.17	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	133.4	174.7	174.6	0	0	0	0	107.9	Y53 L54 K100 S101 A103	Y53-V93 CarbonylContact C-O 3.53Å; Y53-V93 WeakPolarHBondContact CA-O 2.84Å; L54-V93 HydrophobicContact CB-CB 4.22Å; L54-V93 HydrophobicContact CD1-CB 4.32Å; L54-V93 HydrophobicContact CD1-CG1 4.23Å; L54-V93 PolarHBondContact N-O 3.26Å; L54-V93 PolarHBondContact O-N 2.79Å; V93-K100 HydrophobicContact CG1-CB 3.82Å; V93-K100 HydrophobicContact CG1-CG 4.24Å; V93-S101 WeakPolarHBondContact CG1-O 3.2Å; V93-A103 HydrophobicContact CG2-CB 3.5Å; V93-A103 VanDerWaalsContact CG2-CB 3.5Å
94	A	90.9	Very high	90.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	138	170.3	0	0	0	0	0	109.8	P20 P23 I50 Y53 K100 S101	P20-A94 HydrophobicContact CB-CB 4.46Å; P20-A94 HydrophobicContact CG-CB 4.32Å; P23-A94 HydrophobicContact CG-CB 4.47Å; I50-A94 HydrophobicContact CD1-CB 3.35Å; I50-A94 HydrophobicContact CG2-CB 4.1Å; Y53-A94 HydrophobicContact CD1-CB 3.56Å; Y53-A94 HydrophobicContact CE1-CB 3.38Å; A94-K100 CarbonylContact O-C 3.53Å; A94-K100 WeakPolarHBondContact O-CA 3.21Å; A94-S101 WeakPolarHBondContact CA-OG 3.41Å; A94-S101 VanDerWaalsContact CB-OG 3.31Å; A94-S101 WeakPolarHBondContact CB-OG 3.34Å; A94-S101 PolarHBondContact N-OG 2.81Å; A94-S101 PolarHBondContact O-N 2.93Å; A94-S101 PolarHBondContact O-OG 3.38Å
95	E	90.7	Very high	90.4	Very high	54 Å²	54	52.8 Å²	52.8	25%	0.252	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	119.8	179.4	-173.9	177.5	83.3	0	0	108.8	I50 R51 H52 G99 K100	I50-E95 WeakPolarHBondContact CG2-O 3.35Å; R51-E95 PolarHBondContact N-O 2.87Å; H52-E95 PolarHBondContact N-O 3.38Å; H52-E95 VanDerWaalsContact N-O 3.16Å; H52-E95 PolarHBondContact O-N 2.86Å; E95-G99 WeakPolarHBondContact CA-O 3.45Å; E95-K100 HydrophobicContact CB-CG 4.29Å; E95-K100 HydrophobicContact CG-CG 4.01Å; E95-K100 WeakPolarHBondContact OE2-CE 3.4Å; E95-K100 IonicContact OE2-NZ 3.76Å
96	N	89.7	Confident	90.5	Very high	6 Å²	6	50.8 Å²	50.8	3%	0.032	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-173.7	171.4	75.4	3.5	0	0	0	110	G18 P20 D45 Q98 G99	G18-N96 PolarHBondContact O-ND2 2.99Å; P20-N96 VanDerWaalsContact CD-CG 3.47Å; P20-N96 WeakPolarHBondContact CD-ND2 3.41Å; P20-N96 HydrophobicContact CG-CB 3.92Å; D45-N96 PolarHBondContact O-ND2 2.79Å; N96-Q98 VanDerWaalsContact C-N 3.26Å; N96-Q98 PolarHBondContact O-N 3.08Å; N96-Q98 WeakPolarHBondContact OD1-CA 3Å; N96-Q98 WeakPolarHBondContact OD1-CB 3.07Å; N96-Q98 PolarHBondContact OD1-N 2.8Å; N96-G99 PolarHBondContact N-O 2.79Å; N96-G99 PolarHBondContact OD1-N 2.81Å; N96-G99 PolarHBondContact OD1-O 2.84Å; N96-G99 VanDerWaalsContact OD1-O 3.13Å
97	Q	87.4	Confident	90.6	Very high	145 Å²	145	52.5 Å²	52.5	68%	0.678	26%	0.261	S	S	*	.	S	Bend	trans	-66.4	-26	178.6	-178.4	171.2	-1.6	0	0	113.8
98	Q	86	Confident	90.5	Very high	110 Å²	110	48.7 Å²	48.7	51%	0.514	24%	0.243	S	C	.	.	S	Bend	trans	-83.1	-35	-178.5	-69.9	-70.7	94.9	0	0	112.1	A17 N96	A17-Q98 HydrophobicContact CB-CG 3.75Å; A17-Q98 VanDerWaalsContact O-CG 3.24Å; A17-Q98 WeakPolarHBondContact O-CG 3.22Å; A17-Q98 PolarHBondContact O-NE2 3.47Å; N96-Q98 VanDerWaalsContact C-N 3.26Å; N96-Q98 PolarHBondContact O-N 3.08Å; N96-Q98 WeakPolarHBondContact OD1-CA 3Å; N96-Q98 WeakPolarHBondContact OD1-CB 3.07Å; N96-Q98 PolarHBondContact OD1-N 2.8Å
99	G	87.3	Confident	90.4	Very high	23 Å²	23	55 Å²	55	24%	0.237	27%	0.267	C	S	.	.			trans	169.2	-156.9	-179.6	0	0	0	0	0	113.9	E95 N96	E95-G99 WeakPolarHBondContact CA-O 3.45Å; N96-G99 PolarHBondContact N-O 2.79Å; N96-G99 PolarHBondContact OD1-N 2.81Å; N96-G99 PolarHBondContact OD1-O 2.84Å; N96-G99 VanDerWaalsContact OD1-O 3.13Å
100	K	90.5	Very high	90.1	Very high	116 Å²	116	55 Å²	55	50%	0.504	27%	0.267	S	S	.	.	B	Isolated β-bridge	trans	-107.1	137.9	-178.2	-69.5	171.6	-177.1	166.1	0	109.6	L54 V93 A94 E95	L54-K100 HydrophobicContact CD1-CD 4.48Å; V93-K100 HydrophobicContact CG1-CB 3.82Å; V93-K100 HydrophobicContact CG1-CG 4.24Å; A94-K100 CarbonylContact O-C 3.53Å; A94-K100 WeakPolarHBondContact O-CA 3.21Å; E95-K100 HydrophobicContact CB-CG 4.29Å; E95-K100 HydrophobicContact CG-CG 4.01Å; E95-K100 WeakPolarHBondContact OE2-CE 3.4Å; E95-K100 IonicContact OE2-NZ 3.76Å
101	S	89.8	Confident	89.7	Confident	10 Å²	10	57.8 Å²	57.8	7%	0.07	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-72.8	171.7	171.7	69.1	0	0	0	0	111.8	P20 S21 V93 A94	P20-S101 VanDerWaalsContact C-CB 3.48Å; P20-S101 VanDerWaalsContact O-CA 3.23Å; P20-S101 WeakPolarHBondContact O-CA 3.37Å; P20-S101 WeakPolarHBondContact O-CB 3.38Å; S21-S101 VanDerWaalsContact C-CB 3.46Å; S21-S101 VanDerWaalsContact O-CB 3.25Å; S21-S101 WeakPolarHBondContact O-CB 3.41Å; S21-S101 PolarHBondContact O-OG 3.11Å; V93-S101 WeakPolarHBondContact CG1-O 3.2Å; A94-S101 WeakPolarHBondContact CA-OG 3.41Å; A94-S101 VanDerWaalsContact CB-OG 3.31Å; A94-S101 WeakPolarHBondContact CB-OG 3.34Å; A94-S101 PolarHBondContact N-OG 2.81Å; A94-S101 PolarHBondContact O-N 2.93Å; A94-S101 PolarHBondContact O-OG 3.38Å
102	K	89.2	Confident	89	Confident	176 Å²	176	58.1 Å²	58.1	77%	0.765	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-59	142.9	165.9	-71.8	177.2	-177.4	178.4	0	110.1	A22 A104	A22-K102 WeakPolarHBondContact CA-O 3.24Å; A22-K102 HydrophobicContact CB-CB 3.99Å; A22-K102 WeakPolarHBondContact CB-O 3.41Å; K102-A104 PolarHBondContact O-N 2.92Å
103	A	89.1	Confident	88.2	Confident	50 Å²	50	64.1 Å²	64.1	41%	0.413	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-70.1	119.9	174.1	0	0	0	0	0	109.9	Y91 V93 H105	Y91-A103 HydrophobicContact CD1-CB 3.96Å; V93-A103 HydrophobicContact CG2-CB 3.5Å; V93-A103 VanDerWaalsContact CG2-CB 3.5Å; A103-H105 PolarHBondContact O-N 3.03Å
104	A	91.3	Very high	87.1	Confident	9 Å²	9	67 Å²	67	7%	0.074	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	124.1	169.1	0	0	0	0	0	109	A22 P23 L25 Y91 V92 K102	A22-A104 HydrophobicContact CB-CB 4.33Å; P23-A104 HydrophobicContact CG-CB 4.15Å; P23-A104 WeakPolarHBondContact O-CB 3.44Å; L25-A104 HydrophobicContact CD1-CB 3.64Å; L25-A104 WeakPolarHBondContact CD1-O 3.29Å; L25-A104 HydrophobicContact CD2-CB 4.43Å; L25-A104 HydrophobicContact CG-CB 3.69Å; Y91-A104 CarbonylContact C-O 3.58Å; Y91-A104 WeakPolarHBondContact CA-O 2.85Å; V92-A104 HydrophobicContact CB-CB 4.36Å; V92-A104 PolarHBondContact N-O 3.09Å; V92-A104 WeakPolarHBondContact O-CB 3.43Å; V92-A104 PolarHBondContact O-N 3.01Å; K102-A104 PolarHBondContact O-N 2.92Å
105	H	91.5	Very high	85.3	Confident	107 Å²	107	72.8 Å²	72.8	50%	0.495	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130.6	-179.2	176.7	133.9	0	0	0	108.7	Y91 A103 V107	Y91-H105 HydrophobicContact CE1-CB 4.41Å; Y91-H105 AromaticContact CE1-ND1 3.9Å; Y91-H105 AromaticContact CZ-ND1 3.43Å; Y91-H105 PolarHBondContact OH-CE1 2.8Å; Y91-H105 PolarHBondContact OH-ND1 2.89Å; Y91-H105 VanDerWaalsContact OH-ND1 3.09Å; A103-H105 PolarHBondContact O-N 3.03Å; H105-V107 WeakPolarHBondContact NE2-CG2 2.85Å
106	F	91.1	Very high	83.3	Confident	50 Å²	50	74.4 Å²	74.4	22%	0.219	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	129.6	173.4	-175.9	-102.3	0	0	0	110.5	L25 I36 E89 V90 F108	L25-F106 HydrophobicContact CB-CB 3.86Å; L25-F106 HydrophobicContact CB-CD2 4.44Å; L25-F106 HydrophobicContact CB-CG 4.23Å; L25-F106 HydrophobicContact CD1-CB 3.75Å; L25-F106 HydrophobicContact CG-CB 4.48Å; I36-F106 HydrophobicContact CD1-CE1 4.24Å; E89-F106 CarbonylContact C-O 3.55Å; E89-F106 WeakPolarHBondContact CA-O 3.31Å; V90-F106 HydrophobicContact CB-CB 4.5Å; V90-F106 PolarHBondContact N-O 3.46Å; V90-F106 PolarHBondContact O-N 2.74Å; F106-F108 HydrophobicContact CD1-CB 4.42Å; F106-F108 AromaticContact CD1-CD1 3.99Å; F106-F108 HydrophobicContact CD1-CD1 3.99Å; F106-F108 HydrophobicContact CE1-CB 3.74Å; F106-F108 AromaticContact CE1-CD1 3.95Å; F106-F108 HydrophobicContact CE1-CD1 3.95Å; F106-F108 HydrophobicContact CE1-CG 4.18Å; F106-F108 HydrophobicContact CZ-CB 4.39Å
107	V	91.6	Very high	81.7	Confident	59 Å²	59	81.4 Å²	81.4	36%	0.358	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	135.8	175.5	-168.1	0	0	0	0	108.7	L60 E87 Y88 E89 H105	L60-V107 HydrophobicContact CD1-CG1 4.5Å; E87-V107 HydrophobicContact CG-CG1 3.61Å; Y88-V107 WeakPolarHBondContact O-CA 3.27Å; Y88-V107 WeakPolarHBondContact O-CG1 3.3Å; E89-V107 HydrophobicContact CB-CG2 4.34Å; H105-V107 WeakPolarHBondContact NE2-CG2 2.85Å
108	F	89.2	Confident	80	Confident	18 Å²	18	79.7 Å²	79.7	8%	0.079	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	156.2	172.5	69.3	-82.7	0	0	0	109.8	I36 L82 Y88 V90 F106 T110	I36-F108 HydrophobicContact CB-CE2 4.07Å; I36-F108 HydrophobicContact CB-CZ 4.29Å; I36-F108 HydrophobicContact CD1-CB 3.95Å; I36-F108 HydrophobicContact CD1-CD1 3.79Å; I36-F108 HydrophobicContact CD1-CD2 3.43Å; I36-F108 VanDerWaalsContact CD1-CD2 3.43Å; I36-F108 HydrophobicContact CD1-CE1 4.13Å; I36-F108 HydrophobicContact CD1-CE2 3.81Å; I36-F108 HydrophobicContact CD1-CG 3.42Å; I36-F108 VanDerWaalsContact CD1-CG 3.42Å; I36-F108 HydrophobicContact CD1-CZ 4.15Å; I36-F108 HydrophobicContact CG2-CD2 4.48Å; I36-F108 HydrophobicContact CG2-CE1 3.98Å; I36-F108 HydrophobicContact CG2-CE2 3.75Å; I36-F108 HydrophobicContact CG2-CZ 3.46Å; I36-F108 VanDerWaalsContact CG2-CZ 3.46Å; L82-F108 HydrophobicContact CD1-CE2 3.84Å; L82-F108 HydrophobicContact CD1-CZ 3.74Å; Y88-F108 HydrophobicContact CD2-CE2 4.34Å; Y88-F108 HydrophobicContact CD2-CZ 4.36Å; Y88-F108 HydrophobicContact CG-CE2 4.38Å; Y88-F108 AromaticContact CG-CZ 3.97Å; Y88-F108 HydrophobicContact CG-CZ 3.97Å; Y88-F108 PolarHBondContact N-O 2.9Å; Y88-F108 PolarHBondContact O-N 2.91Å; Y88-F108 VanDerWaalsContact O-O 3.12Å; V90-F108 HydrophobicContact CG2-CD1 4.05Å; V90-F108 HydrophobicContact CG2-CE1 3.49Å; V90-F108 VanDerWaalsContact CG2-CE1 3.49Å; F106-F108 HydrophobicContact CD1-CB 4.42Å; F106-F108 AromaticContact CD1-CD1 3.99Å; F106-F108 HydrophobicContact CD1-CD1 3.99Å; F106-F108 HydrophobicContact CE1-CB 3.74Å; F106-F108 AromaticContact CE1-CD1 3.95Å; F106-F108 HydrophobicContact CE1-CD1 3.95Å; F106-F108 HydrophobicContact CE1-CG 4.18Å; F106-F108 HydrophobicContact CZ-CB 4.39Å; F108-T110 HydrophobicContact CE2-CG2 3.88Å
109	R	89.5	Confident	78.3	Confident	136 Å²	136	79.1 Å²	79.1	51%	0.513	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	127.8	172.1	-176.3	175.1	176.9	169.6	-1.5	108.3	M29 N85 A86	M29-R109 WeakPolarHBondContact CE-O 3.22Å; N85-R109 PolarHBondContact OD1-NE 3.11Å; N85-R109 PolarHBondContact OD1-NH2 2.87Å; A86-R109 WeakPolarHBondContact O-CA 3.41Å
110	T	87.3	Confident	76.4	Confident	5 Å²	5	84.5 Å²	84.5	3%	0.031	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-64.8	156.6	174.3	52.7	0	0	0	0	111.1	L82 D83 N85 A86 Y88 F108	L82-T110 HydrophobicContact CB-CG2 3.72Å; L82-T110 HydrophobicContact CD1-CG2 4.18Å; D83-T110 WeakPolarHBondContact O-CB 3.05Å; D83-T110 WeakPolarHBondContact O-CG2 3.21Å; D83-T110 PolarHBondContact O-OG1 2.95Å; N85-T110 PolarHBondContact N-OG1 2.91Å; N85-T110 VanDerWaalsContact N-OG1 3.09Å; A86-T110 PolarHBondContact N-OG1 3.16Å; A86-T110 PolarHBondContact O-N 2.73Å; A86-T110 PolarHBondContact O-OG1 2.81Å; A86-T110 VanDerWaalsContact O-OG1 3.08Å; Y88-T110 HydrophobicContact CD2-CG2 3.84Å; Y88-T110 HydrophobicContact CE2-CG2 3.91Å; F108-T110 HydrophobicContact CE2-CG2 3.88Å
111	S	83.6	Confident	74.5	Confident	59 Å²	59	82.1 Å²	82.1	41%	0.413	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-63.6	161.4	176.3	-156.8	0	0	0	0	111.5	G33 N85	G33-S111 PolarHBondContact O-N 3.13Å; G33-S111 VanDerWaalsContact O-N 3.11Å; N85-S111 PolarHBondContact N-O 2.88Å
112	A	78.3	Confident	72.5	Confident	60 Å²	60	85.5 Å²	85.5	50%	0.496	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-65.6	145.6	168.2	0	0	0	0	0	109.2
113	Q	76.7	Confident	70.8	Confident	125 Å²	125	82.6 Å²	82.6	58%	0.584	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-56.3	125.8	174.7	-173.6	174.3	-11.1	0	0	108.4	W84 T115	W84-Q113 HydrophobicContact CB-CB 3.83Å; W84-Q113 HydrophobicContact CD2-CB 3.81Å; W84-Q113 HydrophobicContact CD2-CG 4.1Å; W84-Q113 VanDerWaalsContact CE3-CA 3.42Å; W84-Q113 HydrophobicContact CE3-CB 4.21Å; W84-Q113 HydrophobicContact CG-CB 3.67Å; W84-Q113 HydrophobicContact CG-CG 4.14Å; W84-Q113 HydrophobicContact CZ2-CG 4.46Å; Q113-T115 PolarHBondContact O-N 3.27Å
114	P	68.1	Low	69	Low	88 Å²	88	86.4 Å²	86.4	57%	0.571	53%	0.53	S	S	*	.			trans	-60.2	109.7	171.3	23.3	-29.3	0	0	0	105.9	W84 A116	W84-P114 HydrophobicContact CH2-CG 3.91Å; W84-P114 HydrophobicContact CZ3-CG 4.29Å; P114-A116 PolarHBondContact O-N 3.01Å
115	T	53.8	Low	67.3	Low	123 Å²	123	91 Å²	91	76%	0.755	56%	0.562	S	S	*	*			trans	-59.2	107.8	174.6	-46.2	0	0	0	0	105.8	Q113 I117	Q113-T115 PolarHBondContact O-N 3.27Å; T115-I117 VanDerWaalsContact C-N 3.35Å; T115-I117 PolarHBondContact O-N 2.87Å
116	A	47.9	Very low	65.4	Low	87 Å²	87	89.4 Å²	89.4	72%	0.719	57%	0.574	S	S	*	*			trans	-55.3	108.7	165.9	0	0	0	0	0	105.3	P114 P118	P114-A116 PolarHBondContact O-N 3.01Å; A116-P118 VanDerWaalsContact O-CD 3.31Å; A116-P118 WeakPolarHBondContact O-CD 3.31Å
117	I	56.4	Low	64	Low	153 Å²	153	94.4 Å²	94.4	79%	0.785	60%	0.602	S	S	*	*			trans	-55	119.9	170.6	-51.8	131.5	0	0	0	103.7	T115 A119	T115-I117 VanDerWaalsContact C-N 3.35Å; T115-I117 PolarHBondContact O-N 2.87Å; I117-A119 PolarHBondContact O-N 2.84Å
118	P	51.2	Low	62.2	Low	110 Å²	110	97 Å²	97	71%	0.714	62%	0.624	S	S	*	*			trans	-59.9	109.7	174.3	23.5	-30.3	0	0	0	105.6	A116 N120	A116-P118 VanDerWaalsContact O-CD 3.31Å; A116-P118 WeakPolarHBondContact O-CD 3.31Å; P118-N120 PolarHBondContact O-N 2.74Å
119	A	50.3	Low	61	Low	98 Å²	98	101.8 Å²	101.8	81%	0.81	65%	0.654	S	S	*	*			trans	-65.6	82.1	163.8	0	0	0	0	0	105.5	I117 G121	I117-A119 PolarHBondContact O-N 2.84Å; A119-G121 PolarHBondContact O-N 2.82Å
120	N	47.9	Very low	59.2	Low	135 Å²	135	98 Å²	98	72%	0.722	66%	0.657	S	S	*	*			trans	-63.4	95	163.9	-170.9	60.1	0	0	0	105	P118 S122	P118-N120 PolarHBondContact O-N 2.74Å; N120-S122 PolarHBondContact O-N 2.84Å
121	G	50	Low	57.8	Low	67 Å²	67	102.4 Å²	102.4	69%	0.691	70%	0.695	S	S	*	*			trans	-52.1	102.9	176	0	0	0	0	0	108.7	A119	A119-G121 PolarHBondContact O-N 2.82Å
122	S	49	Very low	56.9	Low	80 Å²	80	107.7 Å²	107.7	56%	0.559	72%	0.716	S	S	*	*			trans	-113.4	94.9	163	-55.5	0	0	0	0	104.9	N120 T124	N120-S122 PolarHBondContact O-N 2.84Å; S122-T124 PolarHBondContact O-N 2.89Å
123	P	53.8	Low	56.1	Low	116 Å²	116	111.6 Å²	111.6	75%	0.753	73%	0.734	S	S	*	*			trans	-66.2	92.1	157.6	28.6	-28.8	0	0	0	104.9	S125	P123-S125 PolarHBondContact O-N 2.8Å
124	T	50.4	Low	54.9	Low	130 Å²	130	108.5 Å²	108.5	80%	0.798	74%	0.736	S	S	*	*			trans	-58.5	102.7	162.4	23.7	0	0	0	0	105.2	S122 G126	S122-T124 PolarHBondContact O-N 2.89Å; T124-G126 PolarHBondContact O-N 2.92Å
125	S	54.8	Low	54.5	Low	106 Å²	106	116.1 Å²	116.1	74%	0.741	77%	0.769	S	S	*	*			trans	-47.3	108.4	176	-66.1	0	0	0	0	107	P123 L127	P123-S125 PolarHBondContact O-N 2.8Å; S125-L127 PolarHBondContact O-N 2.96Å
126	G	53	Low	54.5	Low	73 Å²	73	115.8 Å²	115.8	75%	0.753	77%	0.769	S	S	*	*			trans	-59.4	108	169.7	0	0	0	0	0	106.8	T124 S128	T124-G126 PolarHBondContact O-N 2.92Å; G126-S128 PolarHBondContact O-N 2.94Å
127	L	61.4	Low	54.9	Low	154 Å²	154	117.3 Å²	117.3	81%	0.806	77%	0.772	S	S	*	*			trans	-57.9	92	163.9	-94.3	81.8	0	0	0	107.5	S125 T129	S125-L127 PolarHBondContact O-N 2.96Å; L127-T129 PolarHBondContact O-N 2.82Å
128	S	53.2	Low	54.8	Low	115 Å²	115	115.3 Å²	115.3	80%	0.804	77%	0.771	S	S	*	*			trans	-81.8	82.8	154.3	-171.1	0	0	0	0	106.3	G126 G130	G126-S128 PolarHBondContact O-N 2.94Å; S128-G130 PolarHBondContact O-N 3.25Å
129	T	63.6	Low	55	Low	118 Å²	118	115.6 Å²	115.6	72%	0.724	78%	0.775	S	S	*	*			trans	-75.2	76.7	164.6	-44.6	0	0	0	0	107.1	L127 A131	L127-T129 PolarHBondContact O-N 2.82Å; T129-A131 VanDerWaalsContact C-N 3.35Å; T129-A131 PolarHBondContact O-N 3.08Å; T129-A131 VanDerWaalsContact O-N 3.08Å
130	G	52.8	Low	55.3	Low	56 Å²	56	116.7 Å²	116.7	58%	0.577	77%	0.773	S	S	*	*			trans	-70.2	93.5	165.2	0	0	0	0	0	108.4	S128 I132	S128-G130 PolarHBondContact O-N 3.25Å; G130-I132 PolarHBondContact O-N 2.97Å
131	A	57.1	Low	55.8	Low	98 Å²	98	115.5 Å²	115.5	81%	0.81	78%	0.776	S	S	*	*			trans	-65.2	98.4	169.2	0	0	0	0	0	109	T129	T129-A131 VanDerWaalsContact C-N 3.35Å; T129-A131 PolarHBondContact O-N 3.08Å; T129-A131 VanDerWaalsContact O-N 3.08Å
132	I	65.9	Low	56.2	Low	169 Å²	169	118.9 Å²	118.9	87%	0.867	78%	0.782	S	S	*	*			trans	-67.9	119.5	157.7	17.1	165.6	0	0	0	108	G130	G130-I132 PolarHBondContact O-N 2.97Å
133	V	61.6	Low	56.8	Low	142 Å²	142	121.9 Å²	121.9	86%	0.861	80%	0.799	S	S	*	*			trans	-132.6	110.3	149	90.5	0	0	0	0	108
134	G	51	Low	57	Low	61 Å²	61	122.4 Å²	122.4	63%	0.629	80%	0.803	S	S	*	*			trans	-99.7	130	155.8	0	0	0	0	0	106.9
135	I	59.2	Low	57.6	Low	247 Å²	247	121.7 Å²	121.7	100%	1.267	80%	0.803	S	S	*	*				-179.9	0	119.9	48.1	161.6	0	0	0	108.3

Retrieved 135 of 135 residues in 208.9 ms (Link to these results)

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