A0A077ZLX9_TRITR Loading...

Asp protease 2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZLX9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 176 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	33.9	Very low	36.3	Very low	236 Å²	236	137.9 Å²	137.9	100%	1.163	78%	0.778	S	S	*	*				0	119.3	0	-75.1	-177.4	-92.5	0	0	106.9
2	S	33.2	Very low	36.6	Very low	101 Å²	101	132 Å²	132	71%	0.706	75%	0.752	S	S	*	*			trans	-79.6	122.7	-179.3	-176.2	0	0	0	0	108.3	T4	S2-T4 PolarHBondContact O-N 3.24Å; S2-T4 WeakPolarHBondContact OG-CG2 3.3Å
3	L	38.5	Very low	37.9	Very low	117 Å²	117	136.2 Å²	136.2	61%	0.613	75%	0.749	S	S	*	*			trans	-74	74.7	167.1	-73.5	166.6	0	0	0	107.4
4	T	40.1	Very low	40.4	Very low	112 Å²	112	139.9 Å²	139.9	69%	0.687	75%	0.746	S	S	*	*			trans	-75.3	125.6	170.5	47.2	0	0	0	0	108.8	S2 G6	S2-T4 PolarHBondContact O-N 3.24Å; S2-T4 WeakPolarHBondContact OG-CG2 3.3Å; T4-G6 PolarHBondContact O-N 3.29Å
5	D	38.3	Very low	43.3	Very low	167 Å²	167	137.3 Å²	137.3	89%	0.893	73%	0.731	S	S	*	*			trans	-29.1	99.8	170.7	-98.6	-34.1	0	0	0	112.9	G7	D5-G7 PolarHBondContact O-N 2.95Å
6	G	34.9	Very low	46.2	Very low	66 Å²	66	129.8 Å²	129.8	68%	0.68	69%	0.693	S	S	*	*			trans	-71.4	105	164.7	0	0	0	0	0	107.9	T4 L8	T4-G6 PolarHBondContact O-N 3.29Å; G6-L8 PolarHBondContact O-N 3.1Å
7	G	28.5	Very low	48.9	Very low	78 Å²	78	127.2 Å²	127.2	80%	0.804	67%	0.672	S	S	*	*			trans	-44.2	107	-173.6	0	0	0	0	0	114.2	D5 S9	D5-G7 PolarHBondContact O-N 2.95Å; G7-S9 PolarHBondContact O-N 2.95Å
8	L	40.9	Very low	51.3	Low	126 Å²	126	120.8 Å²	120.8	66%	0.66	64%	0.638	S	S	*	*			trans	-73.5	120.4	162.1	-68.5	172.8	0	0	0	108	G6 R10	G6-L8 PolarHBondContact O-N 3.1Å; L8-R10 PolarHBondContact O-N 3.16Å
9	S	34.8	Very low	53.6	Low	80 Å²	80	120.3 Å²	120.3	56%	0.559	63%	0.632	S	S	*	*			trans	-41.1	135.3	173.5	167.1	0	0	0	0	111.9	G7 E11 S12	G7-S9 PolarHBondContact O-N 2.95Å; S9-E11 PolarHBondContact O-N 2.83Å; S9-S12 PolarHBondContact O-N 2.84Å; S9-S12 PolarHBondContact O-OG 2.77Å
10	R	36.8	Very low	55.7	Low	259 Å²	259	114.3 Å²	114.3	98%	0.977	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	2.4	-177.2	-149.5	171.9	169.6	-166.6	-3.7	114.4	L8	L8-R10 PolarHBondContact O-N 3.16Å
11	E	39.1	Very low	57.6	Low	175 Å²	175	111.7 Å²	111.7	82%	0.818	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	1.9	176.3	-67.9	-168	147.5	0	0	114.4	S9 R13	S9-E11 PolarHBondContact O-N 2.83Å; E11-R13 PolarHBondContact O-N 3.25Å
12	S	40.8	Very low	60.5	Low	67 Å²	67	100.5 Å²	100.5	47%	0.469	53%	0.531	S	S	.	.	S	Bend	trans	-65.4	101.7	169.2	-60.9	0	0	0	0	109	S9 R14	S9-S12 PolarHBondContact O-N 2.84Å; S9-S12 PolarHBondContact O-OG 2.77Å; S12-R14 PolarHBondContact O-N 2.82Å
13	R	53.2	Low	63.2	Low	187 Å²	187	99.7 Å²	99.7	71%	0.706	53%	0.525	S	S	*	.			trans	-31.9	113.8	166.3	-64.5	179.1	-165.6	-152.7	-2.1	108.2	E11 L15	E11-R13 PolarHBondContact O-N 3.25Å; R13-L15 PolarHBondContact O-N 2.89Å
14	R	72.4	Confident	65.7	Low	187 Å²	187	98 Å²	98	71%	0.706	52%	0.516	S	S	*	.			trans	-46.7	100.7	-168.8	-69.5	178.7	-179.4	172	0.5	109.3	S12 L121	S12-R14 PolarHBondContact O-N 2.82Å; R14-L121 HydrophobicContact CB-CD1 3.56Å; R14-L121 WeakPolarHBondContact O-CD1 3.4Å; R14-L121 WeakPolarHBondContact O-CD2 3.43Å
15	L	84.2	Confident	68.1	Low	101 Å²	101	94.6 Å²	94.6	53%	0.529	50%	0.504	S	S	.	.			trans	-68	142.7	174.2	-68.5	176.4	0	0	0	107.5	R13 Y17 L31	R13-L15 PolarHBondContact O-N 2.89Å; L15-Y17 HydrophobicContact CB-CD2 4.32Å; L15-Y17 HydrophobicContact CB-CE2 3.83Å; L15-Y17 VanDerWaalsContact O-CD2 3.28Å; L15-Y17 WeakPolarHBondContact O-CD2 3.22Å; L15-Y17 PolarHBondContact O-N 2.73Å; L15-L31 HydrophobicContact CB-CD1 3.64Å; L15-L31 HydrophobicContact CD1-CD1 4.03Å; L15-L31 HydrophobicContact CG-CD1 4.34Å
16	P	89.9	Confident	70.7	Confident	18 Å²	18	88.9 Å²	88.9	12%	0.117	47%	0.473	C	S	.	.			trans	-71.6	119.7	-179.4	27.5	-31.1	0	0	0	109.2	V32 L114 L121 V123	P16-V32 HydrophobicContact CB-CB 3.98Å; P16-V32 HydrophobicContact CG-CB 3.91Å; P16-V32 HydrophobicContact CG-CG1 4.31Å; P16-V32 WeakPolarHBondContact CG-O 3.35Å; P16-V32 WeakPolarHBondContact O-CB 3.4Å; P16-V32 PolarHBondContact O-N 2.86Å; P16-L114 HydrophobicContact CB-CD1 3.65Å; P16-L114 HydrophobicContact CG-CD1 4.16Å; P16-L114 HydrophobicContact CG-CD2 4.32Å; P16-L121 HydrophobicContact CB-CD2 3.93Å; P16-L121 HydrophobicContact CG-CD2 4.14Å; P16-V123 HydrophobicContact CB-CG2 4.18Å
17	Y	91.5	Very high	73.5	Confident	85 Å²	85	93.3 Å²	93.3	33%	0.333	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	149.4	173.2	-77.3	-90.6	0	0	0	110	L15 N29 A30 L31	L15-Y17 HydrophobicContact CB-CD2 4.32Å; L15-Y17 HydrophobicContact CB-CE2 3.83Å; L15-Y17 VanDerWaalsContact O-CD2 3.28Å; L15-Y17 WeakPolarHBondContact O-CD2 3.22Å; L15-Y17 PolarHBondContact O-N 2.73Å; Y17-N29 HydrophobicContact CD1-CB 3.98Å; Y17-N29 HydrophobicContact CG-CB 4.44Å; Y17-A30 CarbonylContact C-O 3.55Å; Y17-A30 VanDerWaalsContact CA-O 3.28Å; Y17-A30 WeakPolarHBondContact CA-O 3.34Å; Y17-A30 VanDerWaalsContact CD1-C 3.45Å; Y17-A30 WeakPolarHBondContact CD1-O 3.48Å; Y17-L31 HydrophobicContact CD1-CB 4.23Å; Y17-L31 HydrophobicContact CE1-CB 3.74Å; Y17-L31 HydrophobicContact CE1-CD1 4.32Å; Y17-L31 HydrophobicContact CE2-CD1 4.13Å
18	V	92.7	Very high	76.7	Confident	12 Å²	12	90.8 Å²	90.8	7%	0.073	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	138.6	173	65.9	0	0	0	0	109.6	V20 A30 V32 C81 L82 L102 V123	V18-V20 HydrophobicContact CG1-CG1 4.12Å; V18-V20 PolarHBondContact O-N 3.29Å; V18-A30 PolarHBondContact N-O 2.8Å; V18-A30 PolarHBondContact O-N 3.08Å; V18-V32 HydrophobicContact CB-CG2 4.32Å; V18-V32 HydrophobicContact CG1-CG2 3.92Å; V18-C81 VanDerWaalsContact CG2-SG 3.59Å; V18-L82 HydrophobicContact CG2-CD1 4.36Å; V18-L82 HydrophobicContact CG2-CD2 3.93Å; V18-L82 HydrophobicContact CG2-CG 3.95Å; V18-L102 HydrophobicContact CG1-CD1 3.84Å; V18-V123 HydrophobicContact CB-CG1 4.42Å; V18-V123 HydrophobicContact CG2-CG1 4.48Å
19	E	94.8	Very high	79.2	Confident	111 Å²	111	89.6 Å²	89.6	52%	0.519	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	131.1	173.5	-173.4	178.9	72.1	0	0	109.3
20	V	96	Very high	82.1	Confident	1 Å²	1	85.8 Å²	85.8	1%	0.006	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	147	173.2	-53.8	0	0	0	0	109.9	V18 R27 L28 A30 T80 C81 L100 L102	V18-V20 HydrophobicContact CG1-CG1 4.12Å; V18-V20 PolarHBondContact O-N 3.29Å; V20-R27 WeakPolarHBondContact O-CA 3.36Å; V20-L28 HydrophobicContact CG2-CD2 3.89Å; V20-L28 HydrophobicContact CG2-CG 3.79Å; V20-L28 PolarHBondContact N-O 3.13Å; V20-L28 PolarHBondContact O-N 2.95Å; V20-A30 HydrophobicContact CG1-CB 3.82Å; V20-A30 HydrophobicContact CG2-CB 3.89Å; V20-T80 CarbonylContact C-O 3.59Å; V20-T80 WeakPolarHBondContact CA-O 3.38Å; V20-C81 HydrophobicContact CG1-CB 3.86Å; V20-L100 HydrophobicContact CG2-CD2 3.68Å; V20-L102 HydrophobicContact CG1-CD1 4.23Å
21	E	96.1	Very high	84.9	Confident	59 Å²	59	74.6 Å²	74.6	28%	0.276	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.3	173.6	-169.4	177.2	111.5	0	0	109	M26 R27 L79 T80	E21-M26 CarbonylContact C-O 3.53Å; E21-M26 WeakPolarHBondContact CA-O 3.5Å; E21-R27 HydrophobicContact CB-CG 4.15Å; E21-R27 HydrophobicContact CG-CG 3.98Å; E21-R27 IonicContact OE2-CZ 3.34Å; E21-R27 IonicContact OE2-NE 2.83Å; E21-R27 PolarHBondContact OE2-NE 2.91Å; E21-R27 IonicContact OE2-NH2 2.95Å; E21-R27 PolarHBondContact OE2-NH2 2.82Å; E21-L79 CarbonylContact O-C 3.5Å; E21-L79 VanDerWaalsContact O-CA 3.3Å; E21-L79 WeakPolarHBondContact O-CA 3.44Å; E21-T80 PolarHBondContact N-O 2.56Å; E21-T80 PolarHBondContact O-N 3.25Å
22	V	94.6	Very high	87.5	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.012	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	153.1	171.7	-171.8	0	0	0	0	108.9	N24 G25 M26 L28 C49 I51 L79	V22-N24 PolarHBondContact O-N 3.07Å; V22-G25 PolarHBondContact O-N 3.24Å; V22-M26 PolarHBondContact N-O 3.38Å; V22-L28 HydrophobicContact CG2-CD2 3.65Å; V22-C49 HydrophobicContact CG1-CB 4.45Å; V22-I51 HydrophobicContact CG1-CD1 4.04Å; V22-L79 HydrophobicContact CB-CD2 4.4Å; V22-L79 HydrophobicContact CG2-CD2 3.94Å
23	S	90	Very high	89.9	Confident	84 Å²	84	65.2 Å²	65.2	59%	0.587	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-20	-177.2	59.1	0	0	0	0	116.7	G25 E78	S23-G25 VanDerWaalsContact C-N 3.29Å; S23-E78 PolarHBondContact N-O 3.39Å; S23-E78 VanDerWaalsContact N-O 3.1Å
24	N	89.3	Confident	91.6	Very high	80 Å²	80	58.3 Å²	58.3	43%	0.428	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	4.9	173.1	71.6	-15.5	0	0	0	114.3	V22 M26 C49	V22-N24 PolarHBondContact O-N 3.07Å; N24-M26 WeakPolarHBondContact OD1-CB 3.4Å; N24-M26 PolarHBondContact OD1-N 3.47Å; N24-M26 VanDerWaalsContact OD1-N 3.08Å; N24-C49 WeakPolarHBondContact ND2-CA 3.38Å; N24-C49 PolarHBondContact ND2-SG 3.16Å; N24-C49 VanDerWaalsContact ND2-SG 3.38Å
25	G	91.7	Very high	92.4	Very high	42 Å²	42	50.9 Å²	50.9	43%	0.433	27%	0.274	S	S	.	.	S	Bend	trans	86.7	0.8	-178	0	0	0	0	0	114.8	V22 S23 R27	V22-G25 PolarHBondContact O-N 3.24Å; S23-G25 VanDerWaalsContact C-N 3.29Å; G25-R27 PolarHBondContact O-N 2.78Å
26	M	92.7	Very high	92.5	Very high	47 Å²	47	47.4 Å²	47.4	23%	0.232	26%	0.257	C	S	.	.			trans	-71.7	128.2	177.4	-171	-168.9	-45.5	0	0	110.9	E21 V22 N24 L45 Q48 C49	E21-M26 CarbonylContact C-O 3.53Å; E21-M26 WeakPolarHBondContact CA-O 3.5Å; V22-M26 PolarHBondContact N-O 3.38Å; N24-M26 WeakPolarHBondContact OD1-CB 3.4Å; N24-M26 PolarHBondContact OD1-N 3.47Å; N24-M26 VanDerWaalsContact OD1-N 3.08Å; M26-L45 HydrophobicContact CE-CD1 4.19Å; M26-L45 HydrophobicContact SD-CD1 3.4Å; M26-L45 WeakPolarHBondContact SD-CD1 3.37Å; M26-Q48 HydrophobicContact CE-CB 3.78Å; M26-C49 WeakPolarHBondContact CE-SG 3.48Å
27	R	94.7	Very high	92.5	Very high	159 Å²	159	49.3 Å²	49.3	60%	0.6	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.7	139.7	176.6	-64.2	-176.4	-179.7	179.3	-0.1	111.8	V20 E21 G25	V20-R27 WeakPolarHBondContact O-CA 3.36Å; E21-R27 HydrophobicContact CB-CG 4.15Å; E21-R27 HydrophobicContact CG-CG 3.98Å; E21-R27 IonicContact OE2-CZ 3.34Å; E21-R27 IonicContact OE2-NE 2.83Å; E21-R27 PolarHBondContact OE2-NE 2.91Å; E21-R27 IonicContact OE2-NH2 2.95Å; E21-R27 PolarHBondContact OE2-NH2 2.82Å; G25-R27 PolarHBondContact O-N 2.78Å
28	L	94.4	Very high	92.5	Very high	25 Å²	25	46.2 Å²	46.2	13%	0.131	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	159.9	174.3	64.5	150	0	0	0	111.3	V20 V22 L45 P99 L100	V20-L28 HydrophobicContact CG2-CD2 3.89Å; V20-L28 HydrophobicContact CG2-CG 3.79Å; V20-L28 PolarHBondContact N-O 3.13Å; V20-L28 PolarHBondContact O-N 2.95Å; V22-L28 HydrophobicContact CG2-CD2 3.65Å; L28-L45 HydrophobicContact CD1-CD2 3.82Å; L28-L45 HydrophobicContact CD2-CD1 4.34Å; L28-L45 HydrophobicContact CD2-CD2 4.31Å; L28-P99 HydrophobicContact CD1-CB 3.96Å; L28-L100 HydrophobicContact CD1-CB 3.65Å; L28-L100 HydrophobicContact CD1-CD2 4.14Å
29	N	94.4	Very high	92.5	Very high	101 Å²	101	45.8 Å²	45.8	54%	0.54	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	114.2	169.6	-70.4	-42.3	0	0	0	109.3	Y17	Y17-N29 HydrophobicContact CD1-CB 3.98Å; Y17-N29 HydrophobicContact CG-CB 4.44Å
30	A	95.3	Very high	92.5	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	135.6	174.3	0	0	0	0	0	110.6	Y17 V18 V20 L100 L102	Y17-A30 CarbonylContact C-O 3.55Å; Y17-A30 VanDerWaalsContact CA-O 3.28Å; Y17-A30 WeakPolarHBondContact CA-O 3.34Å; Y17-A30 VanDerWaalsContact CD1-C 3.45Å; Y17-A30 WeakPolarHBondContact CD1-O 3.48Å; V18-A30 PolarHBondContact N-O 2.8Å; V18-A30 PolarHBondContact O-N 3.08Å; V20-A30 HydrophobicContact CG1-CB 3.82Å; V20-A30 HydrophobicContact CG2-CB 3.89Å; A30-L100 CarbonylContact C-O 3.57Å; A30-L100 WeakPolarHBondContact CA-O 3.21Å; A30-L100 HydrophobicContact CB-CB 4.18Å; A30-L100 HydrophobicContact CB-CD2 3.84Å; A30-L100 HydrophobicContact CB-CG 3.86Å; A30-L102 HydrophobicContact CB-CD1 4.18Å; A30-L102 HydrophobicContact CB-CG 3.95Å
31	L	94.6	Very high	92.5	Very high	23 Å²	23	42 Å²	42	12%	0.12	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	131.7	172.8	176.2	65.9	0	0	0	109.2	L15 Y17 D33 L100 A101 L102	L15-L31 HydrophobicContact CB-CD1 3.64Å; L15-L31 HydrophobicContact CD1-CD1 4.03Å; L15-L31 HydrophobicContact CG-CD1 4.34Å; Y17-L31 HydrophobicContact CD1-CB 4.23Å; Y17-L31 HydrophobicContact CE1-CB 3.74Å; Y17-L31 HydrophobicContact CE1-CD1 4.32Å; Y17-L31 HydrophobicContact CE2-CD1 4.13Å; L31-D33 HydrophobicContact CD2-CB 4.48Å; L31-D33 HydrophobicContact CG-CB 4.46Å; L31-D33 PolarHBondContact O-N 2.84Å; L31-L100 PolarHBondContact N-O 2.89Å; L31-A101 HydrophobicContact CB-CB 4.2Å; L31-A101 HydrophobicContact CD2-CB 4.37Å; L31-A101 CarbonylContact O-C 3.57Å; L31-A101 WeakPolarHBondContact O-CA 3.43Å; L31-L102 PolarHBondContact O-N 2.95Å
32	V	93.8	Very high	92.4	Very high	7 Å²	7	41.3 Å²	41.3	4%	0.042	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	103.4	168.4	172.8	0	0	0	0	107.6	P16 V18 T34 L107 V123	P16-V32 HydrophobicContact CB-CB 3.98Å; P16-V32 HydrophobicContact CG-CB 3.91Å; P16-V32 HydrophobicContact CG-CG1 4.31Å; P16-V32 WeakPolarHBondContact CG-O 3.35Å; P16-V32 WeakPolarHBondContact O-CB 3.4Å; P16-V32 PolarHBondContact O-N 2.86Å; V18-V32 HydrophobicContact CB-CG2 4.32Å; V18-V32 HydrophobicContact CG1-CG2 3.92Å; V32-T34 HydrophobicContact CG1-CG2 4.31Å; V32-L107 HydrophobicContact CG1-CD1 3.76Å; V32-L107 HydrophobicContact CG1-CD2 3.85Å; V32-L107 HydrophobicContact CG1-CG 4.48Å; V32-L107 HydrophobicContact CG2-CD2 4.29Å; V32-V123 HydrophobicContact CG2-CG1 4.25Å; V32-V123 HydrophobicContact CG2-CG2 3.97Å
33	D	91.8	Very high	92.3	Very high	38 Å²	38	43.4 Å²	43.4	20%	0.203	25%	0.246	C	C	.	.			trans	-107.6	90.2	-175.4	-176.9	7.9	0	0	0	110.3	L31 G35 T36 A101 L102 G103	L31-D33 HydrophobicContact CD2-CB 4.48Å; L31-D33 HydrophobicContact CG-CB 4.46Å; L31-D33 PolarHBondContact O-N 2.84Å; D33-G35 PolarHBondContact O-N 3.46Å; D33-G35 WeakPolarHBondContact OD1-CA 3.3Å; D33-G35 PolarHBondContact OD1-N 3.1Å; D33-T36 VanDerWaalsContact CG-OG1 3.24Å; D33-T36 WeakPolarHBondContact OD2-CG2 3.35Å; D33-T36 PolarHBondContact OD2-OG1 2.93Å; D33-A101 HydrophobicContact CB-CB 4.2Å; D33-L102 PolarHBondContact N-O 2.84Å; D33-G103 WeakPolarHBondContact O-CA 3.39Å
34	T	89.6	Confident	92.4	Very high	42 Å²	42	40.5 Å²	40.5	26%	0.258	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-8.6	175.8	61.2	0	0	0	0	112.9	V32 T36 M104 L107 L114	V32-T34 HydrophobicContact CG1-CG2 4.31Å; T34-T36 VanDerWaalsContact C-N 3.32Å; T34-M104 HydrophobicContact CG2-SD 4.05Å; T34-L107 HydrophobicContact CG2-CD1 4.03Å; T34-L114 HydrophobicContact CG2-CD2 4.1Å
35	G	88.2	Confident	92.5	Very high	31 Å²	31	37.1 Å²	37.1	32%	0.32	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-10.4	-179.6	0	0	0	0	0	113.6	D33	D33-G35 PolarHBondContact O-N 3.46Å; D33-G35 WeakPolarHBondContact OD1-CA 3.3Å; D33-G35 PolarHBondContact OD1-N 3.1Å
36	T	86.4	Confident	92.6	Very high	29 Å²	29	35.2 Å²	35.2	18%	0.178	19%	0.187	C	C	.	.			trans	-131.4	148	-176.1	66	0	0	0	0	111.5	D33 T34 A38 F40 G103 M104	D33-T36 VanDerWaalsContact CG-OG1 3.24Å; D33-T36 WeakPolarHBondContact OD2-CG2 3.35Å; D33-T36 PolarHBondContact OD2-OG1 2.93Å; T34-T36 VanDerWaalsContact C-N 3.32Å; T36-A38 PolarHBondContact OG1-O 3.4Å; T36-F40 HydrophobicContact CG2-CE2 3.88Å; T36-G103 CarbonylContact O-C 3.52Å; T36-G103 VanDerWaalsContact O-CA 3.28Å; T36-G103 WeakPolarHBondContact O-CA 3.48Å; T36-M104 PolarHBondContact O-N 2.79Å
37	V	89.2	Confident	92.5	Very high	58 Å²	58	39.7 Å²	39.7	35%	0.352	21%	0.208	S	C	.	.	S	Bend	trans	-80.1	-39.2	173.1	170.5	0	0	0	0	111.6	H105 V153	V37-H105 HydrophobicContact CG1-CB 4.37Å; V37-H105 WeakPolarHBondContact O-CB 3.43Å; V37-H105 PolarHBondContact O-N 2.79Å; V37-V153 HydrophobicContact CB-CB 4.43Å; V37-V153 HydrophobicContact CG2-CB 3.43Å; V37-V153 VanDerWaalsContact CG2-CB 3.43Å; V37-V153 HydrophobicContact CG2-CG1 3.31Å; V37-V153 HydrophobicContact CG2-CG2 4.12Å
38	A	91.4	Very high	92.2	Very high	20 Å²	20	36.7 Å²	36.7	17%	0.165	20%	0.201	C	C	.	.	S	Bend	trans	-78.6	145.4	-175.7	0	0	0	0	0	111.9	T36 F40 V91 G103	T36-A38 PolarHBondContact OG1-O 3.4Å; A38-F40 HydrophobicContact CB-CE1 4.37Å; A38-F40 HydrophobicContact CB-CE2 4.25Å; A38-F40 HydrophobicContact CB-CZ 3.98Å; A38-V91 HydrophobicContact CB-CG2 3.98Å; A38-G103 WeakPolarHBondContact O-CA 3.46Å
39	T	94.6	Very high	92.1	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.012	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	134.6	164.8	-64.4	0	0	0	0	108.8	V88 A90 V91 L100 A101 L102 A106	T39-V88 HydrophobicContact CG2-CG2 4.46Å; T39-A90 HydrophobicContact CG2-CB 4Å; T39-A90 CarbonylContact O-C 3.45Å; T39-A90 VanDerWaalsContact O-CA 3.29Å; T39-A90 WeakPolarHBondContact O-CA 3.29Å; T39-V91 PolarHBondContact O-N 3.15Å; T39-L100 HydrophobicContact CG2-CD1 3.69Å; T39-A101 CarbonylContact C-O 3.48Å; T39-A101 VanDerWaalsContact CA-O 3.23Å; T39-A101 WeakPolarHBondContact CA-O 3.13Å; T39-A101 VanDerWaalsContact CG2-O 3.3Å; T39-A101 WeakPolarHBondContact CG2-O 3.31Å; T39-L102 HydrophobicContact CG2-CD2 4.23Å; T39-A106 WeakPolarHBondContact OG1-CB 3.5Å
40	F	94.5	Very high	92	Very high	32 Å²	32	34.9 Å²	34.9	14%	0.14	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	143.8	177.7	-61.2	-80	0	0	0	111	T36 A38 F61 V91 L93 L100 A101	T36-F40 HydrophobicContact CG2-CE2 3.88Å; A38-F40 HydrophobicContact CB-CE1 4.37Å; A38-F40 HydrophobicContact CB-CE2 4.25Å; A38-F40 HydrophobicContact CB-CZ 3.98Å; F40-F61 HydrophobicContact CE1-CE2 4.43Å; F40-V91 WeakPolarHBondContact CA-O 3.48Å; F40-V91 HydrophobicContact CD1-CB 3.64Å; F40-V91 HydrophobicContact CD1-CG1 3.8Å; F40-V91 HydrophobicContact CD1-CG2 4.47Å; F40-V91 HydrophobicContact CE1-CB 3.88Å; F40-V91 HydrophobicContact CE1-CG1 3.86Å; F40-V91 HydrophobicContact CE1-CG2 4.29Å; F40-L93 HydrophobicContact CB-CD1 4.06Å; F40-L93 HydrophobicContact CD1-CD1 3.51Å; F40-L93 HydrophobicContact CD1-CD2 4.35Å; F40-L93 HydrophobicContact CD1-CG 3.89Å; F40-L93 HydrophobicContact CE1-CD1 4.22Å; F40-L93 HydrophobicContact CG-CD1 3.98Å; F40-L100 WeakPolarHBondContact O-CA 3.35Å; F40-L100 WeakPolarHBondContact O-CD1 3.28Å; F40-A101 HydrophobicContact CB-CB 4.43Å; F40-A101 PolarHBondContact N-O 3.39Å; F40-A101 PolarHBondContact O-N 2.78Å
41	V	95.4	Very high	91.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	139.6	-179.9	63	0	0	0	0	111	L45 L46 L77 A90 V91 V92 L93 L100	V41-L45 HydrophobicContact CG2-CB 4.07Å; V41-L45 HydrophobicContact CG2-CD2 3.75Å; V41-L45 HydrophobicContact CG2-CG 4.32Å; V41-L46 HydrophobicContact CG1-CD1 3.93Å; V41-L46 HydrophobicContact CG1-CD2 4.09Å; V41-L46 HydrophobicContact CG1-CG 4.22Å; V41-L46 HydrophobicContact CG2-CD2 3.91Å; V41-L46 HydrophobicContact CG2-CG 4.14Å; V41-L77 HydrophobicContact CB-CD1 4.32Å; V41-L77 HydrophobicContact CG2-CD1 4.38Å; V41-A90 HydrophobicContact CB-CB 4.21Å; V41-A90 HydrophobicContact CG1-CB 3.7Å; V41-V91 PolarHBondContact N-O 3.15Å; V41-V92 HydrophobicContact CG1-CB 4.46Å; V41-V92 HydrophobicContact CG1-CG2 4.03Å; V41-V92 WeakPolarHBondContact O-CA 3.35Å; V41-L93 PolarHBondContact O-N 3.22Å; V41-L100 HydrophobicContact CB-CD1 4.26Å
42	H	94.4	Very high	91.9	Very high	46 Å²	46	40.1 Å²	40.1	21%	0.213	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	134.6	172.3	-165.6	-62.7	0	0	0	110	S44 L45 A94 P96 P99	H42-S44 VanDerWaalsContact C-N 3.29Å; H42-S44 PolarHBondContact CE1-OG 2.99Å; H42-S44 PolarHBondContact ND1-N 3.17Å; H42-S44 VanDerWaalsContact ND1-N 3.16Å; H42-S44 PolarHBondContact ND1-OG 3.4Å; H42-S44 PolarHBondContact O-N 2.83Å; H42-L45 WeakPolarHBondContact O-CB 3.28Å; H42-L45 PolarHBondContact O-N 3.44Å; H42-A94 PolarHBondContact CE1-O 2.91Å; H42-A94 PolarHBondContact NE2-O 2.92Å; H42-P96 HydrophobicContact CB-CG 3.65Å; H42-P96 WeakPolarHBondContact CD2-CD 3.27Å; H42-P99 PolarHBondContact N-O 3.39Å
43	E	92.9	Very high	92	Very high	45 Å²	45	43.1 Å²	43.1	21%	0.21	26%	0.26	C	S	.	.	H	α-helix	trans	-55.5	-40.2	-177.7	67.7	-174.9	140.7	0	0	113.9	L45 L46 E47 K72 V92 L93 A94	E43-L45 PolarHBondContact O-N 2.92Å; E43-L45 VanDerWaalsContact O-N 3.15Å; E43-L46 WeakPolarHBondContact O-CA 3.41Å; E43-L46 WeakPolarHBondContact O-CB 3.4Å; E43-L46 PolarHBondContact O-N 3.29Å; E43-E47 PolarHBondContact O-N 3.46Å; E43-K72 IonicContact OE1-NZ 2.62Å; E43-K72 PolarHBondContact OE1-NZ 3.04Å; E43-K72 WeakPolarHBondContact OE2-CD 3.35Å; E43-K72 WeakPolarHBondContact OE2-CE 3.47Å; E43-K72 IonicContact OE2-NZ 3.02Å; E43-K72 PolarHBondContact OE2-NZ 2.97Å; E43-V92 HydrophobicContact CB-CG1 3.87Å; E43-L93 PolarHBondContact N-O 2.99Å; E43-L93 VanDerWaalsContact N-O 3.12Å; E43-A94 WeakPolarHBondContact OE1-CA 3.37Å
44	S	90.8	Very high	92.1	Very high	24 Å²	24	46.8 Å²	46.8	17%	0.168	28%	0.276	C	S	.	.	H	α-helix	trans	-57.6	-27.9	177.1	68	0	0	0	0	114.1	H42 Q48	H42-S44 VanDerWaalsContact C-N 3.29Å; H42-S44 PolarHBondContact CE1-OG 2.99Å; H42-S44 PolarHBondContact ND1-N 3.17Å; H42-S44 VanDerWaalsContact ND1-N 3.16Å; H42-S44 PolarHBondContact ND1-OG 3.4Å; H42-S44 PolarHBondContact O-N 2.83Å; S44-Q48 WeakPolarHBondContact O-CB 3.47Å; S44-Q48 WeakPolarHBondContact O-CG 3Å; S44-Q48 PolarHBondContact O-N 2.92Å; S44-Q48 VanDerWaalsContact O-N 3.12Å; S44-Q48 PolarHBondContact O-NE2 3.22Å
45	L	91.8	Very high	92.2	Very high	8 Å²	8	49.3 Å²	49.3	4%	0.042	29%	0.293	C	S	.	.	H	α-helix	trans	-68.8	-39.4	174.4	-177.1	62.5	0	0	0	110.4	M26 L28 V41 H42 E43 Q48 C49 L100	M26-L45 HydrophobicContact CE-CD1 4.19Å; M26-L45 HydrophobicContact SD-CD1 3.4Å; M26-L45 WeakPolarHBondContact SD-CD1 3.37Å; L28-L45 HydrophobicContact CD1-CD2 3.82Å; L28-L45 HydrophobicContact CD2-CD1 4.34Å; L28-L45 HydrophobicContact CD2-CD2 4.31Å; V41-L45 HydrophobicContact CG2-CB 4.07Å; V41-L45 HydrophobicContact CG2-CD2 3.75Å; V41-L45 HydrophobicContact CG2-CG 4.32Å; H42-L45 WeakPolarHBondContact O-CB 3.28Å; H42-L45 PolarHBondContact O-N 3.44Å; E43-L45 PolarHBondContact O-N 2.92Å; E43-L45 VanDerWaalsContact O-N 3.15Å; L45-Q48 PolarHBondContact O-N 3.41Å; L45-C49 WeakPolarHBondContact O-CB 3.36Å; L45-C49 PolarHBondContact O-N 3.21Å; L45-C49 PolarHBondContact O-SG 2.93Å; L45-L100 HydrophobicContact CD2-CB 4.41Å
46	L	92.9	Very high	92.3	Very high	2 Å²	2	50 Å²	50	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-69.7	-40.6	179.2	-53.9	178.7	0	0	0	111.6	V41 E43 C49 G50 I51 V53 A75 L77 V92	V41-L46 HydrophobicContact CG1-CD1 3.93Å; V41-L46 HydrophobicContact CG1-CD2 4.09Å; V41-L46 HydrophobicContact CG1-CG 4.22Å; V41-L46 HydrophobicContact CG2-CD2 3.91Å; V41-L46 HydrophobicContact CG2-CG 4.14Å; E43-L46 WeakPolarHBondContact O-CA 3.41Å; E43-L46 WeakPolarHBondContact O-CB 3.4Å; E43-L46 PolarHBondContact O-N 3.29Å; L46-C49 CarbonylContact O-C 3.53Å; L46-C49 PolarHBondContact O-N 3.26Å; L46-G50 PolarHBondContact O-N 3.2Å; L46-I51 HydrophobicContact CB-CB 4.36Å; L46-I51 HydrophobicContact CD2-CB 4.08Å; L46-I51 HydrophobicContact CD2-CD1 4.22Å; L46-I51 HydrophobicContact CD2-CG2 4.07Å; L46-I51 PolarHBondContact O-N 3.13Å; L46-V53 HydrophobicContact CB-CG2 4.35Å; L46-V53 HydrophobicContact CD1-CG2 3.56Å; L46-A75 HydrophobicContact CD1-CB 3.7Å; L46-A75 HydrophobicContact CD2-CB 3.96Å; L46-L77 HydrophobicContact CD2-CD2 3.62Å; L46-V92 HydrophobicContact CD1-CB 4.13Å; L46-V92 HydrophobicContact CD1-CG1 3.62Å; L46-V92 HydrophobicContact CD1-CG2 3.38Å
47	E	91.2	Very high	92.3	Very high	142 Å²	142	57.9 Å²	57.9	66%	0.664	32%	0.318	S	S	*	.	H	α-helix	trans	-60	-46.1	174.5	-67.8	176	168.1	0	0	111.3	E43 C49 G50	E43-E47 PolarHBondContact O-N 3.46Å; E47-C49 VanDerWaalsContact C-N 3.3Å; E47-C49 PolarHBondContact O-N 3.01Å; E47-G50 PolarHBondContact O-N 3.39Å
48	Q	89.4	Confident	92	Very high	95 Å²	95	60 Å²	60	44%	0.444	32%	0.324	S	S	.	.	H	α-helix	trans	-64.4	-34.5	177.3	-74	170.6	68	0	0	112.8	M26 S44 L45	M26-Q48 HydrophobicContact CE-CB 3.78Å; S44-Q48 WeakPolarHBondContact O-CB 3.47Å; S44-Q48 WeakPolarHBondContact O-CG 3Å; S44-Q48 PolarHBondContact O-N 2.92Å; S44-Q48 VanDerWaalsContact O-N 3.12Å; S44-Q48 PolarHBondContact O-NE2 3.22Å; L45-Q48 PolarHBondContact O-N 3.41Å
49	C	90.8	Very high	91.6	Very high	23 Å²	23	62.4 Å²	62.4	16%	0.155	34%	0.344	C	S	.	.	H	α-helix	trans	-85.9	-7.6	178.4	-64.4	0	0	0	0	114.2	V22 N24 M26 L45 L46 E47 I51	V22-C49 HydrophobicContact CG1-CB 4.45Å; N24-C49 WeakPolarHBondContact ND2-CA 3.38Å; N24-C49 PolarHBondContact ND2-SG 3.16Å; N24-C49 VanDerWaalsContact ND2-SG 3.38Å; M26-C49 WeakPolarHBondContact CE-SG 3.48Å; L45-C49 WeakPolarHBondContact O-CB 3.36Å; L45-C49 PolarHBondContact O-N 3.21Å; L45-C49 PolarHBondContact O-SG 2.93Å; L46-C49 CarbonylContact O-C 3.53Å; L46-C49 PolarHBondContact O-N 3.26Å; E47-C49 VanDerWaalsContact C-N 3.3Å; E47-C49 PolarHBondContact O-N 3.01Å; C49-I51 HydrophobicContact CB-CD1 3.54Å; C49-I51 HydrophobicContact CB-CG1 3.6Å; C49-I51 PolarHBondContact O-N 3.26Å
50	G	92.7	Very high	91.2	Very high	65 Å²	65	64.4 Å²	64.4	67%	0.67	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	27.7	-172.1	0	0	0	0	0	113.5	L46 E47	L46-G50 PolarHBondContact O-N 3.2Å; E47-G50 PolarHBondContact O-N 3.39Å
51	I	93.6	Very high	90.6	Very high	27 Å²	27	64.8 Å²	64.8	14%	0.138	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-84.7	124.7	-177.8	-63.9	170.8	0	0	0	109.4	V22 L46 C49 A75 L77	V22-I51 HydrophobicContact CG1-CD1 4.04Å; L46-I51 HydrophobicContact CB-CB 4.36Å; L46-I51 HydrophobicContact CD2-CB 4.08Å; L46-I51 HydrophobicContact CD2-CD1 4.22Å; L46-I51 HydrophobicContact CD2-CG2 4.07Å; L46-I51 PolarHBondContact O-N 3.13Å; C49-I51 HydrophobicContact CB-CD1 3.54Å; C49-I51 HydrophobicContact CB-CG1 3.6Å; C49-I51 PolarHBondContact O-N 3.26Å; I51-A75 HydrophobicContact CG2-CB 4.14Å; I51-L77 HydrophobicContact CD1-CD2 3.69Å; I51-L77 HydrophobicContact CG2-CD2 4.47Å
52	P	94.4	Very high	90.1	Very high	107 Å²	107	71.6 Å²	71.6	70%	0.695	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-68.9	138.4	-178.6	27.7	-34.5	0	0	0	112
53	V	95.2	Very high	89.4	Confident	70 Å²	70	70.2 Å²	70.2	42%	0.424	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-102.1	125.9	176	-178.1	0	0	0	0	109.8	L46 V92	L46-V53 HydrophobicContact CB-CG2 4.35Å; L46-V53 HydrophobicContact CD1-CG2 3.56Å; V53-V92 HydrophobicContact CG1-CB 4.46Å; V53-V92 HydrophobicContact CG1-CG2 3.98Å; V53-V92 HydrophobicContact CG2-CG2 4.34Å
54	Q	94.2	Very high	88.6	Confident	115 Å²	115	74.6 Å²	74.6	54%	0.537	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	140.3	170.1	-61.6	-179	7.5	0	0	109.8	G73 K74	Q54-G73 CarbonylContact O-C 3.58Å; Q54-G73 WeakPolarHBondContact O-CA 3.46Å; Q54-K74 HydrophobicContact CB-CG 3.84Å; Q54-K74 PolarHBondContact N-O 3.28Å; Q54-K74 PolarHBondContact O-N 3.03Å
55	P	92.1	Very high	88.2	Confident	95 Å²	95	79.8 Å²	79.8	62%	0.617	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.4	141.3	179	-25.3	33.8	0	0	0	112.9
56	W	90.3	Very high	87.8	Confident	46 Å²	46	81 Å²	81	17%	0.174	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-74.2	129.9	173	-169.1	-108.5	0	0	0	109.7	Q58 A59 F61 P71 K74 V91	W56-Q58 HydrophobicContact CH2-CB 4.5Å; W56-Q58 HydrophobicContact CZ2-CB 3.64Å; W56-Q58 HydrophobicContact CZ2-CG 4.32Å; W56-Q58 VanDerWaalsContact NE1-C 3.35Å; W56-Q58 PolarHBondContact NE1-O 3.42Å; W56-A59 PolarHBondContact NE1-O 2.84Å; W56-A59 VanDerWaalsContact NE1-O 3.08Å; W56-F61 HydrophobicContact CH2-CE1 4.48Å; W56-F61 HydrophobicContact CH2-CE2 4.07Å; W56-F61 AromaticContact CH2-CZ 3.49Å; W56-F61 HydrophobicContact CH2-CZ 3.49Å; W56-F61 VanDerWaalsContact CH2-CZ 3.49Å; W56-F61 HydrophobicContact CZ2-CE1 4.04Å; W56-F61 AromaticContact CZ2-CE2 3.71Å; W56-F61 HydrophobicContact CZ2-CE2 3.71Å; W56-F61 AromaticContact CZ2-CZ 3.23Å; W56-F61 HydrophobicContact CZ2-CZ 3.23Å; W56-P71 HydrophobicContact CB-CB 4.2Å; W56-P71 HydrophobicContact CD2-CB 3.66Å; W56-P71 HydrophobicContact CD2-CG 3.88Å; W56-P71 HydrophobicContact CE3-CB 4.08Å; W56-P71 HydrophobicContact CE3-CG 4.48Å; W56-P71 HydrophobicContact CG-CB 3.71Å; W56-P71 HydrophobicContact CG-CG 4.12Å; W56-P71 HydrophobicContact CZ2-CG 4.11Å; W56-K74 HydrophobicContact CE3-CB 4.28Å; W56-K74 HydrophobicContact CZ3-CB 4.3Å; W56-V91 HydrophobicContact CH2-CG2 4.1Å; W56-V91 HydrophobicContact CZ3-CG2 4.01Å
57	K	86.5	Confident	87.3	Confident	194 Å²	194	83 Å²	83	84%	0.843	48%	0.477	S	S	*	.			trans	-118	1.6	-178.1	-62.8	-173.1	-179.2	-176.5	0	113.5
58	Q	83.4	Confident	87	Confident	101 Å²	101	82.4 Å²	82.4	47%	0.472	47%	0.474	S	S	.	.	S	Bend	trans	-104.6	172.5	-177.2	-62.8	175.3	-21.7	0	0	110.2	W56	W56-Q58 HydrophobicContact CH2-CB 4.5Å; W56-Q58 HydrophobicContact CZ2-CB 3.64Å; W56-Q58 HydrophobicContact CZ2-CG 4.32Å; W56-Q58 VanDerWaalsContact NE1-C 3.35Å; W56-Q58 PolarHBondContact NE1-O 3.42Å
59	A	83	Confident	86.8	Confident	72 Å²	72	80 Å²	80	60%	0.595	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-63.1	162.9	175.3	0	0	0	0	0	111.8	W56	W56-A59 PolarHBondContact NE1-O 2.84Å; W56-A59 VanDerWaalsContact NE1-O 3.08Å
60	A	85.1	Confident	86.6	Confident	43 Å²	43	83.1 Å²	83.1	36%	0.355	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-65.2	157	167.8	0	0	0	0	0	110.9	V69	A60-V69 WeakPolarHBondContact CB-O 3.21Å
61	F	83.2	Confident	86.6	Confident	40 Å²	40	80.8 Å²	80.8	18%	0.175	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	153.4	174.8	-52.8	-70.1	0	0	0	110.8	F40 W56 Q68 V69 P71 V91 I150	F40-F61 HydrophobicContact CE1-CE2 4.43Å; W56-F61 HydrophobicContact CH2-CE1 4.48Å; W56-F61 HydrophobicContact CH2-CE2 4.07Å; W56-F61 AromaticContact CH2-CZ 3.49Å; W56-F61 HydrophobicContact CH2-CZ 3.49Å; W56-F61 VanDerWaalsContact CH2-CZ 3.49Å; W56-F61 HydrophobicContact CZ2-CE1 4.04Å; W56-F61 AromaticContact CZ2-CE2 3.71Å; W56-F61 HydrophobicContact CZ2-CE2 3.71Å; W56-F61 AromaticContact CZ2-CZ 3.23Å; W56-F61 HydrophobicContact CZ2-CZ 3.23Å; F61-Q68 CarbonylContact O-C 3.58Å; F61-Q68 WeakPolarHBondContact O-CA 3.46Å; F61-Q68 PolarHBondContact O-OE1 2.86Å; F61-Q68 VanDerWaalsContact O-OE1 3.06Å; F61-V69 HydrophobicContact CB-CB 4.28Å; F61-V69 PolarHBondContact N-O 3.16Å; F61-V69 PolarHBondContact O-N 3.49Å; F61-P71 HydrophobicContact CD2-CG 3.65Å; F61-P71 HydrophobicContact CE2-CG 3.3Å; F61-P71 HydrophobicContact CZ-CG 4.35Å; F61-V91 HydrophobicContact CE2-CG1 3.81Å; F61-V91 HydrophobicContact CE2-CG2 4.29Å; F61-V91 HydrophobicContact CZ-CG2 4.34Å; F61-I150 HydrophobicContact CE1-CG2 4.06Å; F61-I150 HydrophobicContact CZ-CG2 4.49Å
62	K	83.7	Confident	86.5	Confident	143 Å²	143	84.7 Å²	84.7	62%	0.622	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.6	120.8	168	-168.9	177.3	179.4	-178.5	0	109.4
63	G	80	Confident	86.4	Confident	17 Å²	17	79.6 Å²	79.6	18%	0.175	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-68.3	166.6	170.6	0	0	0	0	0	112.2	D65 G66 A67	G63-D65 PolarHBondContact O-N 2.94Å; G63-G66 WeakPolarHBondContact O-CA 3.3Å; G63-G66 PolarHBondContact O-N 2.94Å; G63-A67 PolarHBondContact N-O 3.2Å
64	V	77.1	Confident	86.4	Confident	137 Å²	137	81 Å²	81	83%	0.83	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-32.7	178.5	178.8	0	0	0	0	111.7	G66 M154	V64-G66 PolarHBondContact O-N 3.11Å; V64-M154 HydrophobicContact CG2-CE 3.82Å
65	D	81	Confident	86.5	Confident	133 Å²	133	75.8 Å²	75.8	71%	0.711	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-1.2	174.5	62.8	-9.1	0	0	0	113.6	G63 A67	G63-D65 PolarHBondContact O-N 2.94Å; D65-A67 PolarHBondContact O-N 2.8Å; D65-A67 WeakPolarHBondContact OD1-CB 3.47Å; D65-A67 PolarHBondContact OD1-N 3.26Å; D65-A67 WeakPolarHBondContact OD2-CB 3.32Å
66	G	83.2	Confident	86.7	Confident	35 Å²	35	75.3 Å²	75.3	36%	0.361	41%	0.41	S	S	.	.	S	Bend	trans	80.2	-0.9	-174.5	0	0	0	0	0	114.5	G63 V64	G63-G66 WeakPolarHBondContact O-CA 3.3Å; G63-G66 PolarHBondContact O-N 2.94Å; V64-G66 PolarHBondContact O-N 3.11Å
67	A	83.2	Confident	87	Confident	44 Å²	44	73.2 Å²	73.2	36%	0.364	40%	0.402	S	S	.	.			trans	-66.6	150.7	174.6	0	0	0	0	0	110.8	G63 D65	G63-A67 PolarHBondContact N-O 3.2Å; D65-A67 PolarHBondContact O-N 2.8Å; D65-A67 WeakPolarHBondContact OD1-CB 3.47Å; D65-A67 PolarHBondContact OD1-N 3.26Å; D65-A67 WeakPolarHBondContact OD2-CB 3.32Å
68	Q	85.1	Confident	87.5	Confident	128 Å²	128	68.7 Å²	68.7	60%	0.598	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	123.8	172.5	-70.4	-72.1	3	0	0	109.4	F61	F61-Q68 CarbonylContact O-C 3.58Å; F61-Q68 WeakPolarHBondContact O-CA 3.46Å; F61-Q68 PolarHBondContact O-OE1 2.86Å; F61-Q68 VanDerWaalsContact O-OE1 3.06Å
69	V	84.7	Confident	88.1	Confident	44 Å²	44	64 Å²	64	27%	0.267	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	109.1	174.3	180	0	0	0	0	107.5	A60 F61 P71 L93	A60-V69 WeakPolarHBondContact CB-O 3.21Å; F61-V69 HydrophobicContact CB-CB 4.28Å; F61-V69 PolarHBondContact N-O 3.16Å; F61-V69 PolarHBondContact O-N 3.49Å; V69-P71 WeakPolarHBondContact O-CD 3.46Å; V69-L93 HydrophobicContact CG1-CD1 4Å; V69-L93 HydrophobicContact CG1-CD2 3.55Å; V69-L93 HydrophobicContact CG1-CG 4.45Å
70	C	87.6	Confident	88.7	Confident	90 Å²	90	62.6 Å²	62.6	61%	0.608	35%	0.346	S	S	*	.			trans	-97.9	108.1	-179.5	-63.4	0	0	0	0	110.3
71	P	91.2	Very high	89.1	Confident	16 Å²	16	60.7 Å²	60.7	10%	0.104	33%	0.33	C	S	.	.			trans	-68.9	143.8	178.2	-20.9	36.1	0	0	0	112.3	W56 F61 V69 V91 V92 L93	W56-P71 HydrophobicContact CB-CB 4.2Å; W56-P71 HydrophobicContact CD2-CB 3.66Å; W56-P71 HydrophobicContact CD2-CG 3.88Å; W56-P71 HydrophobicContact CE3-CB 4.08Å; W56-P71 HydrophobicContact CE3-CG 4.48Å; W56-P71 HydrophobicContact CG-CB 3.71Å; W56-P71 HydrophobicContact CG-CG 4.12Å; W56-P71 HydrophobicContact CZ2-CG 4.11Å; F61-P71 HydrophobicContact CD2-CG 3.65Å; F61-P71 HydrophobicContact CE2-CG 3.3Å; F61-P71 HydrophobicContact CZ-CG 4.35Å; V69-P71 WeakPolarHBondContact O-CD 3.46Å; P71-V91 HydrophobicContact CB-CG1 3.6Å; P71-V91 HydrophobicContact CG-CG1 3.69Å; P71-V92 WeakPolarHBondContact CA-O 3.38Å; P71-L93 HydrophobicContact CB-CD2 4.34Å; P71-L93 HydrophobicContact CG-CD2 4.42Å
72	K	91.5	Very high	89.5	Confident	109 Å²	109	62 Å²	62	47%	0.474	34%	0.338	S	S	.	.			trans	-78.1	-30.3	170.4	-77	-171.6	154.9	179	0	112	E43 V92 A94	E43-K72 IonicContact OE1-NZ 2.62Å; E43-K72 PolarHBondContact OE1-NZ 3.04Å; E43-K72 WeakPolarHBondContact OE2-CD 3.35Å; E43-K72 WeakPolarHBondContact OE2-CE 3.47Å; E43-K72 IonicContact OE2-NZ 3.02Å; E43-K72 PolarHBondContact OE2-NZ 2.97Å; K72-V92 HydrophobicContact CB-CG1 4.41Å; K72-V92 PolarHBondContact N-O 3.03Å; K72-A94 HydrophobicContact CD-CB 3.78Å; K72-A94 HydrophobicContact CG-CB 4.31Å
73	G	94	Very high	89.9	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.8	-168	-174.8	0	0	0	0	0	113.5	Q54 V92	Q54-G73 CarbonylContact O-C 3.58Å; Q54-G73 WeakPolarHBondContact O-CA 3.46Å; G73-V92 PolarHBondContact O-N 3.03Å
74	K	94.7	Very high	90.5	Very high	98 Å²	98	62.2 Å²	62.2	43%	0.426	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	142.5	168.9	63.4	-174.9	-175	171.7	0	109.4	Q54 W56 A90	Q54-K74 HydrophobicContact CB-CG 3.84Å; Q54-K74 PolarHBondContact N-O 3.28Å; Q54-K74 PolarHBondContact O-N 3.03Å; W56-K74 HydrophobicContact CE3-CB 4.28Å; W56-K74 HydrophobicContact CZ3-CB 4.3Å; K74-A90 CarbonylContact C-O 3.53Å; K74-A90 VanDerWaalsContact CA-O 3.28Å; K74-A90 WeakPolarHBondContact CA-O 3.23Å
75	A	96.1	Very high	91.3	Very high	6 Å²	6	63.9 Å²	63.9	5%	0.05	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	155.7	176.5	0	0	0	0	0	109.3	L46 I51 A90 V92	L46-A75 HydrophobicContact CD1-CB 3.7Å; L46-A75 HydrophobicContact CD2-CB 3.96Å; I51-A75 HydrophobicContact CG2-CB 4.14Å; A75-A90 PolarHBondContact N-O 3.19Å; A75-A90 PolarHBondContact O-N 2.72Å; A75-V92 HydrophobicContact CB-CG2 3.93Å
76	Q	96.5	Very high	91.9	Very high	86 Å²	86	58.4 Å²	58.4	40%	0.402	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123.3	173.1	-168.9	175.9	55.2	0	0	108.5	R87 V88	Q76-R87 HydrophobicContact CG-CG 3.87Å; Q76-R87 VanDerWaalsContact NE2-NE 3.12Å; Q76-V88 WeakPolarHBondContact CA-O 3.39Å
77	L	96.2	Very high	92.5	Very high	2 Å²	2	63.7 Å²	63.7	1%	0.01	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	136.5	-179.3	-56.7	-178.8	0	0	0	109.5	V41 L46 I51 L79 R87 V88 A90 L100	V41-L77 HydrophobicContact CB-CD1 4.32Å; V41-L77 HydrophobicContact CG2-CD1 4.38Å; L46-L77 HydrophobicContact CD2-CD2 3.62Å; I51-L77 HydrophobicContact CD1-CD2 3.69Å; I51-L77 HydrophobicContact CG2-CD2 4.47Å; L77-L79 HydrophobicContact CB-CD1 4.3Å; L77-L79 HydrophobicContact CB-CD2 4.06Å; L77-L79 HydrophobicContact CB-CG 3.97Å; L77-L79 HydrophobicContact CD1-CD1 4.41Å; L77-R87 CarbonylContact O-C 3.45Å; L77-R87 VanDerWaalsContact O-CA 3.31Å; L77-R87 WeakPolarHBondContact O-CA 3.28Å; L77-V88 HydrophobicContact CB-CG2 4.08Å; L77-V88 PolarHBondContact N-O 2.92Å; L77-V88 PolarHBondContact O-N 2.91Å; L77-A90 HydrophobicContact CD1-CB 3.61Å; L77-A90 HydrophobicContact CG-CB 3.91Å; L77-L100 HydrophobicContact CD1-CD1 3.86Å
78	E	96.2	Very high	93.1	Very high	98 Å²	98	61.7 Å²	61.7	46%	0.458	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	115.4	164.6	-70.6	179.2	-177.7	0	0	107.1	S23 L86 R87	S23-E78 PolarHBondContact N-O 3.39Å; S23-E78 VanDerWaalsContact N-O 3.1Å; E78-L86 WeakPolarHBondContact CA-O 3.28Å; E78-R87 HydrophobicContact CG-CG 4.09Å; E78-R87 IonicContact OE1-NE 2.66Å
79	L	96.4	Very high	93.5	Very high	3 Å²	3	60.8 Å²	60.8	2%	0.016	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	144.5	-173	-52.8	175	0	0	0	109.8	E21 V22 L77 Q85 L86 V88 L100 L102	E21-L79 CarbonylContact O-C 3.5Å; E21-L79 VanDerWaalsContact O-CA 3.3Å; E21-L79 WeakPolarHBondContact O-CA 3.44Å; V22-L79 HydrophobicContact CB-CD2 4.4Å; V22-L79 HydrophobicContact CG2-CD2 3.94Å; L77-L79 HydrophobicContact CB-CD1 4.3Å; L77-L79 HydrophobicContact CB-CD2 4.06Å; L77-L79 HydrophobicContact CB-CG 3.97Å; L77-L79 HydrophobicContact CD1-CD1 4.41Å; L79-Q85 CarbonylContact O-C 3.59Å; L79-Q85 WeakPolarHBondContact O-CA 3.49Å; L79-L86 HydrophobicContact CB-CD1 4.28Å; L79-L86 HydrophobicContact CB-CD2 3.98Å; L79-L86 HydrophobicContact CB-CG 3.93Å; L79-L86 HydrophobicContact CD1-CD1 4.21Å; L79-L86 PolarHBondContact N-O 2.94Å; L79-L86 PolarHBondContact O-N 3.03Å; L79-V88 HydrophobicContact CD1-CG2 4.09Å; L79-L100 HydrophobicContact CD1-CD2 4Å; L79-L100 HydrophobicContact CD2-CD2 4.44Å; L79-L102 HydrophobicContact CD1-CD2 4.09Å
80	T	95.8	Very high	94	Very high	43 Å²	43	58.8 Å²	58.8	26%	0.264	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.2	163.1	-56.5	0	0	0	0	108.5	V20 E21 R84	V20-T80 CarbonylContact C-O 3.59Å; V20-T80 WeakPolarHBondContact CA-O 3.38Å; E21-T80 PolarHBondContact N-O 2.56Å; E21-T80 PolarHBondContact O-N 3.25Å; T80-R84 CarbonylContact C-O 3.56Å; T80-R84 VanDerWaalsContact CA-O 3.3Å; T80-R84 WeakPolarHBondContact CA-O 3.38Å
81	C	94.5	Very high	94.4	Very high	2 Å²	2	55 Å²	55	1%	0.014	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	129	-179.6	176.8	0	0	0	0	108.7	V18 V20 G83 R84 L86 L110	V18-C81 VanDerWaalsContact CG2-SG 3.59Å; V20-C81 HydrophobicContact CG1-CB 3.86Å; C81-G83 PolarHBondContact O-N 2.96Å; C81-G83 VanDerWaalsContact O-N 3.16Å; C81-R84 PolarHBondContact N-O 3.5Å; C81-R84 PolarHBondContact O-N 3.47Å; C81-L86 HydrophobicContact CB-CD2 3.99Å; C81-L110 HydrophobicContact CB-CD1 4.03Å; C81-L110 HydrophobicContact CB-CD2 4.02Å
82	L	91	Very high	94.6	Very high	67 Å²	67	54.3 Å²	54.3	35%	0.351	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	39	-176.5	-57.1	173.1	0	0	0	112.8	V18 R84 V112 V123 L125	V18-L82 HydrophobicContact CG2-CD1 4.36Å; V18-L82 HydrophobicContact CG2-CD2 3.93Å; V18-L82 HydrophobicContact CG2-CG 3.95Å; L82-R84 PolarHBondContact O-N 2.93Å; L82-V112 HydrophobicContact CD1-CG1 3.75Å; L82-V123 HydrophobicContact CD1-CG1 4.41Å; L82-L125 HydrophobicContact CB-CD1 4.19Å; L82-L125 HydrophobicContact CB-CD2 4.09Å; L82-L125 HydrophobicContact CB-CG 3.92Å; L82-L125 HydrophobicContact CD1-CD2 4.11Å; L82-L125 HydrophobicContact CD1-CG 4.11Å; L82-L125 WeakPolarHBondContact O-CD1 3.43Å
83	G	91.3	Very high	94.6	Very high	75 Å²	75	50.1 Å²	50.1	77%	0.773	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	1.8	-177.9	0	0	0	0	0	115.6	C81	C81-G83 PolarHBondContact O-N 2.96Å; C81-G83 VanDerWaalsContact O-N 3.16Å
84	R	93	Very high	94.3	Very high	90 Å²	90	52 Å²	52	34%	0.34	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	136.2	175.7	-67.2	-168.8	175.3	-154.8	-3.1	111.6	T80 C81 L82 L110 L125 N127	T80-R84 CarbonylContact C-O 3.56Å; T80-R84 VanDerWaalsContact CA-O 3.3Å; T80-R84 WeakPolarHBondContact CA-O 3.38Å; C81-R84 PolarHBondContact N-O 3.5Å; C81-R84 PolarHBondContact O-N 3.47Å; L82-R84 PolarHBondContact O-N 2.93Å; R84-L110 HydrophobicContact CB-CD2 3.99Å; R84-L110 PolarHBondContact NH1-O 3.01Å; R84-L125 HydrophobicContact CG-CD1 4.08Å; R84-L125 HydrophobicContact CG-CD2 4.28Å; R84-N127 PolarHBondContact NH2-ND2 3.12Å
85	Q	94	Very high	93.7	Very high	173 Å²	173	51.7 Å²	51.7	81%	0.808	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	139.6	170.5	-67.7	-179.4	1.6	0	0	110.4	L79	L79-Q85 CarbonylContact O-C 3.59Å; L79-Q85 WeakPolarHBondContact O-CA 3.49Å
86	L	94.1	Very high	93.1	Very high	18 Å²	18	52.3 Å²	52.3	9%	0.094	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	147.9	177.1	72.6	111.1	0	0	0	110.5	E78 L79 C81 V88 L110	E78-L86 WeakPolarHBondContact CA-O 3.28Å; L79-L86 HydrophobicContact CB-CD1 4.28Å; L79-L86 HydrophobicContact CB-CD2 3.98Å; L79-L86 HydrophobicContact CB-CG 3.93Å; L79-L86 HydrophobicContact CD1-CD1 4.21Å; L79-L86 PolarHBondContact N-O 2.94Å; L79-L86 PolarHBondContact O-N 3.03Å; C81-L86 HydrophobicContact CB-CD2 3.99Å; L86-V88 HydrophobicContact CD1-CB 3.95Å; L86-V88 HydrophobicContact CD1-CG1 3.25Å; L86-V88 HydrophobicContact CD1-CG2 3.57Å; L86-L110 HydrophobicContact CB-CD2 4.41Å; L86-L110 HydrophobicContact CD2-CD1 3.81Å; L86-L110 HydrophobicContact CD2-CD2 3.4Å; L86-L110 VanDerWaalsContact CD2-CD2 3.4Å; L86-L110 HydrophobicContact CD2-CG 3.65Å; L86-L110 HydrophobicContact CG-CD2 4.49Å
87	R	95.7	Very high	92.4	Very high	146 Å²	146	54.6 Å²	54.6	55%	0.551	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	117.6	172.9	-169.8	173.8	-175.1	-169.9	-0.7	108.7	Q76 L77 E78	Q76-R87 HydrophobicContact CG-CG 3.87Å; Q76-R87 VanDerWaalsContact NE2-NE 3.12Å; L77-R87 CarbonylContact O-C 3.45Å; L77-R87 VanDerWaalsContact O-CA 3.31Å; L77-R87 WeakPolarHBondContact O-CA 3.28Å; E78-R87 HydrophobicContact CG-CG 4.09Å; E78-R87 IonicContact OE1-NE 2.66Å
88	V	95.1	Very high	92.1	Very high	2 Å²	2	55 Å²	55	1%	0.012	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	145.3	-174.6	-75.6	0	0	0	0	111.9	T39 Q76 L77 L79 L86 A106 L109	T39-V88 HydrophobicContact CG2-CG2 4.46Å; Q76-V88 WeakPolarHBondContact CA-O 3.39Å; L77-V88 HydrophobicContact CB-CG2 4.08Å; L77-V88 PolarHBondContact N-O 2.92Å; L77-V88 PolarHBondContact O-N 2.91Å; L79-V88 HydrophobicContact CD1-CG2 4.09Å; L86-V88 HydrophobicContact CD1-CB 3.95Å; L86-V88 HydrophobicContact CD1-CG1 3.25Å; L86-V88 HydrophobicContact CD1-CG2 3.57Å; V88-A106 HydrophobicContact CG1-CB 3.83Å; V88-L109 HydrophobicContact CG1-CD1 3.99Å
89	N	94.1	Very high	92	Very high	109 Å²	109	53 Å²	53	58%	0.583	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	120.7	167.9	-63.5	-47.6	0	0	0	108.5
90	A	95.6	Very high	91.9	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.008	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	141	178.3	0	0	0	0	0	111.2	T39 V41 K74 A75 L77	T39-A90 HydrophobicContact CG2-CB 4Å; T39-A90 CarbonylContact O-C 3.45Å; T39-A90 VanDerWaalsContact O-CA 3.29Å; T39-A90 WeakPolarHBondContact O-CA 3.29Å; V41-A90 HydrophobicContact CB-CB 4.21Å; V41-A90 HydrophobicContact CG1-CB 3.7Å; K74-A90 CarbonylContact C-O 3.53Å; K74-A90 VanDerWaalsContact CA-O 3.28Å; K74-A90 WeakPolarHBondContact CA-O 3.23Å; A75-A90 PolarHBondContact N-O 3.19Å; A75-A90 PolarHBondContact O-N 2.72Å; L77-A90 HydrophobicContact CD1-CB 3.61Å; L77-A90 HydrophobicContact CG-CB 3.91Å
91	V	95	Very high	91.9	Very high	10 Å²	10	51 Å²	51	6%	0.061	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	126.4	170.9	176.2	0	0	0	0	108.4	A38 T39 F40 V41 W56 F61 P71 L93	A38-V91 HydrophobicContact CB-CG2 3.98Å; T39-V91 PolarHBondContact O-N 3.15Å; F40-V91 WeakPolarHBondContact CA-O 3.48Å; F40-V91 HydrophobicContact CD1-CB 3.64Å; F40-V91 HydrophobicContact CD1-CG1 3.8Å; F40-V91 HydrophobicContact CD1-CG2 4.47Å; F40-V91 HydrophobicContact CE1-CB 3.88Å; F40-V91 HydrophobicContact CE1-CG1 3.86Å; F40-V91 HydrophobicContact CE1-CG2 4.29Å; V41-V91 PolarHBondContact N-O 3.15Å; W56-V91 HydrophobicContact CH2-CG2 4.1Å; W56-V91 HydrophobicContact CZ3-CG2 4.01Å; F61-V91 HydrophobicContact CE2-CG1 3.81Å; F61-V91 HydrophobicContact CE2-CG2 4.29Å; F61-V91 HydrophobicContact CZ-CG2 4.34Å; P71-V91 HydrophobicContact CB-CG1 3.6Å; P71-V91 HydrophobicContact CG-CG1 3.69Å; V91-L93 HydrophobicContact CG1-CD2 4.03Å
92	V	95.1	Very high	92	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.012	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	122.5	-177.4	-170.5	0	0	0	0	110	V41 E43 L46 V53 P71 K72 G73 A75	V41-V92 HydrophobicContact CG1-CB 4.46Å; V41-V92 HydrophobicContact CG1-CG2 4.03Å; V41-V92 WeakPolarHBondContact O-CA 3.35Å; E43-V92 HydrophobicContact CB-CG1 3.87Å; L46-V92 HydrophobicContact CD1-CB 4.13Å; L46-V92 HydrophobicContact CD1-CG1 3.62Å; L46-V92 HydrophobicContact CD1-CG2 3.38Å; V53-V92 HydrophobicContact CG1-CB 4.46Å; V53-V92 HydrophobicContact CG1-CG2 3.98Å; V53-V92 HydrophobicContact CG2-CG2 4.34Å; P71-V92 WeakPolarHBondContact CA-O 3.38Å; K72-V92 HydrophobicContact CB-CG1 4.41Å; K72-V92 PolarHBondContact N-O 3.03Å; G73-V92 PolarHBondContact O-N 3.03Å; A75-V92 HydrophobicContact CB-CG2 3.93Å
93	L	92.1	Very high	92.1	Very high	21 Å²	21	47.7 Å²	47.7	11%	0.11	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	146.5	178.3	-60.2	-175	0	0	0	110.3	F40 V41 E43 V69 P71 V91 P96	F40-L93 HydrophobicContact CB-CD1 4.06Å; F40-L93 HydrophobicContact CD1-CD1 3.51Å; F40-L93 HydrophobicContact CD1-CD2 4.35Å; F40-L93 HydrophobicContact CD1-CG 3.89Å; F40-L93 HydrophobicContact CE1-CD1 4.22Å; F40-L93 HydrophobicContact CG-CD1 3.98Å; V41-L93 PolarHBondContact O-N 3.22Å; E43-L93 PolarHBondContact N-O 2.99Å; E43-L93 VanDerWaalsContact N-O 3.12Å; V69-L93 HydrophobicContact CG1-CD1 4Å; V69-L93 HydrophobicContact CG1-CD2 3.55Å; V69-L93 HydrophobicContact CG1-CG 4.45Å; P71-L93 HydrophobicContact CB-CD2 4.34Å; P71-L93 HydrophobicContact CG-CD2 4.42Å; V91-L93 HydrophobicContact CG1-CD2 4.03Å; L93-P96 HydrophobicContact CB-CB 4.1Å; L93-P96 HydrophobicContact CB-CG 3.99Å; L93-P96 HydrophobicContact CD1-CB 4.08Å
94	A	87.2	Confident	92.2	Very high	41 Å²	41	47.8 Å²	47.8	34%	0.339	26%	0.262	S	S	.	.	S	Bend	trans	-75.9	-35.7	-178.4	0	0	0	0	0	113.3	H42 E43 K72	H42-A94 PolarHBondContact CE1-O 2.91Å; H42-A94 PolarHBondContact NE2-O 2.92Å; E43-A94 WeakPolarHBondContact OE1-CA 3.37Å; K72-A94 HydrophobicContact CD-CB 3.78Å; K72-A94 HydrophobicContact CG-CB 4.31Å
95	A	82.8	Confident	92.2	Very high	91 Å²	91	47.9 Å²	47.9	75%	0.752	27%	0.266	S	S	*	.	S	Bend	trans	-147.5	57.6	-177.5	0	0	0	0	0	112.1
96	P	83.3	Confident	92.2	Very high	19 Å²	19	39.7 Å²	39.7	12%	0.123	23%	0.228	C	C	.	.			trans	-65.2	155	170	29.7	-35.5	0	0	0	111.3	H42 L93 C98	H42-P96 HydrophobicContact CB-CG 3.65Å; H42-P96 WeakPolarHBondContact CD2-CD 3.27Å; L93-P96 HydrophobicContact CB-CB 4.1Å; L93-P96 HydrophobicContact CB-CG 3.99Å; L93-P96 HydrophobicContact CD1-CB 4.08Å; P96-C98 WeakPolarHBondContact CG-O 3.36Å; P96-C98 PolarHBondContact O-N 2.9Å; P96-C98 VanDerWaalsContact O-N 3.14Å
97	P	82.7	Confident	92.2	Very high	133 Å²	133	39.4 Å²	39.4	86%	0.864	23%	0.226	S	C	*	.	S	Bend	trans	-69	-9	-180	29.3	-36.2	0	0	0	114
98	C	89.1	Confident	92	Very high	12 Å²	12	37.3 Å²	37.3	8%	0.081	23%	0.23	C	C	.	.	S	Bend	trans	-144	157.4	176.6	58.9	0	0	0	0	110.7	P96 L100	P96-C98 WeakPolarHBondContact CG-O 3.36Å; P96-C98 PolarHBondContact O-N 2.9Å; P96-C98 VanDerWaalsContact O-N 3.14Å; C98-L100 VanDerWaalsContact C-N 3.32Å; C98-L100 PolarHBondContact O-N 2.89Å
99	P	93.6	Very high	91.8	Very high	54 Å²	54	41.7 Å²	41.7	35%	0.351	25%	0.253	S	S	.	.	S	Bend	trans	-62.9	-35	-179.4	-24.7	35.3	0	0	0	114.1	L28 H42	L28-P99 HydrophobicContact CD1-CB 3.96Å; H42-P99 PolarHBondContact N-O 3.39Å
100	L	95.7	Very high	91.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	131.4	-178.8	177.6	61.7	0	0	0	109.9	V20 L28 A30 L31 T39 F40 V41 L45 L77 L79 C98 L102	V20-L100 HydrophobicContact CG2-CD2 3.68Å; L28-L100 HydrophobicContact CD1-CB 3.65Å; L28-L100 HydrophobicContact CD1-CD2 4.14Å; A30-L100 CarbonylContact C-O 3.57Å; A30-L100 WeakPolarHBondContact CA-O 3.21Å; A30-L100 HydrophobicContact CB-CB 4.18Å; A30-L100 HydrophobicContact CB-CD2 3.84Å; A30-L100 HydrophobicContact CB-CG 3.86Å; L31-L100 PolarHBondContact N-O 2.89Å; T39-L100 HydrophobicContact CG2-CD1 3.69Å; F40-L100 WeakPolarHBondContact O-CA 3.35Å; F40-L100 WeakPolarHBondContact O-CD1 3.28Å; V41-L100 HydrophobicContact CB-CD1 4.26Å; L45-L100 HydrophobicContact CD2-CB 4.41Å; L77-L100 HydrophobicContact CD1-CD1 3.86Å; L79-L100 HydrophobicContact CD1-CD2 4Å; L79-L100 HydrophobicContact CD2-CD2 4.44Å; C98-L100 VanDerWaalsContact C-N 3.32Å; C98-L100 PolarHBondContact O-N 2.89Å; L100-L102 HydrophobicContact CD2-CD2 4.42Å; L100-L102 HydrophobicContact CG-CD2 4.37Å
101	A	95.4	Very high	91.4	Very high	5 Å²	5	37.5 Å²	37.5	4%	0.041	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	121.2	172.1	0	0	0	0	0	109.8	L31 D33 T39 F40 G103	L31-A101 HydrophobicContact CB-CB 4.2Å; L31-A101 HydrophobicContact CD2-CB 4.37Å; L31-A101 CarbonylContact O-C 3.57Å; L31-A101 WeakPolarHBondContact O-CA 3.43Å; D33-A101 HydrophobicContact CB-CB 4.2Å; T39-A101 CarbonylContact C-O 3.48Å; T39-A101 VanDerWaalsContact CA-O 3.23Å; T39-A101 WeakPolarHBondContact CA-O 3.13Å; T39-A101 VanDerWaalsContact CG2-O 3.3Å; T39-A101 WeakPolarHBondContact CG2-O 3.31Å; F40-A101 HydrophobicContact CB-CB 4.43Å; F40-A101 PolarHBondContact N-O 3.39Å; F40-A101 PolarHBondContact O-N 2.78Å; A101-G103 PolarHBondContact O-N 2.79Å
102	L	95.5	Very high	91	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	105.8	176.6	-59.5	-179.4	0	0	0	109.5	V18 V20 A30 L31 D33 T39 L79 L100 A106 L107 L110	V18-L102 HydrophobicContact CG1-CD1 3.84Å; V20-L102 HydrophobicContact CG1-CD1 4.23Å; A30-L102 HydrophobicContact CB-CD1 4.18Å; A30-L102 HydrophobicContact CB-CG 3.95Å; L31-L102 PolarHBondContact O-N 2.95Å; D33-L102 PolarHBondContact N-O 2.84Å; T39-L102 HydrophobicContact CG2-CD2 4.23Å; L79-L102 HydrophobicContact CD1-CD2 4.09Å; L100-L102 HydrophobicContact CD2-CD2 4.42Å; L100-L102 HydrophobicContact CG-CD2 4.37Å; L102-A106 HydrophobicContact CB-CB 4.25Å; L102-A106 HydrophobicContact CD2-CB 4.16Å; L102-L107 HydrophobicContact CB-CD2 3.97Å; L102-L107 HydrophobicContact CB-CG 4.43Å; L102-L107 HydrophobicContact CD1-CD2 4.44Å; L102-L110 HydrophobicContact CD1-CD1 4.37Å
103	G	93.7	Very high	90.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	24%	0.244	C	C	.	.			trans	-72.7	170.9	171.6	0	0	0	0	0	112.7	D33 T36 A38 A101 H105 A106 L107	D33-G103 WeakPolarHBondContact O-CA 3.39Å; T36-G103 CarbonylContact O-C 3.52Å; T36-G103 VanDerWaalsContact O-CA 3.28Å; T36-G103 WeakPolarHBondContact O-CA 3.48Å; A38-G103 WeakPolarHBondContact O-CA 3.46Å; A101-G103 PolarHBondContact O-N 2.79Å; G103-H105 PolarHBondContact O-N 2.93Å; G103-A106 PolarHBondContact O-N 3.45Å; G103-L107 WeakPolarHBondContact O-CG 3.07Å; G103-L107 PolarHBondContact O-N 2.92Å; G103-L107 VanDerWaalsContact O-N 3.16Å
104	M	93.7	Very high	90.4	Very high	76 Å²	76	40.4 Å²	40.4	37%	0.374	25%	0.251	S	S	.	.	H	α-helix	trans	-52.3	-31.2	-178	-74	-61.4	-61.8	0	0	114.4	T34 T36 L107 T108	T34-M104 HydrophobicContact CG2-SD 4.05Å; T36-M104 PolarHBondContact O-N 2.79Å; M104-L107 PolarHBondContact O-N 2.95Å; M104-L107 HydrophobicContact SD-CD1 4.05Å; M104-T108 WeakPolarHBondContact O-CB 3.34Å; M104-T108 PolarHBondContact O-N 2.78Å; M104-T108 PolarHBondContact O-OG1 2.9Å
105	H	92	Very high	90.4	Very high	93 Å²	93	41.8 Å²	41.8	43%	0.431	25%	0.25	S	S	.	.	H	α-helix	trans	-63.2	-46.2	176	-178.4	64.8	0	0	0	112	V37 G103 L109	V37-H105 HydrophobicContact CG1-CB 4.37Å; V37-H105 WeakPolarHBondContact O-CB 3.43Å; V37-H105 PolarHBondContact O-N 2.79Å; G103-H105 PolarHBondContact O-N 2.93Å; H105-L109 WeakPolarHBondContact O-CG 3.45Å; H105-L109 PolarHBondContact O-N 2.96Å; H105-L109 VanDerWaalsContact O-N 3.13Å
106	A	94.3	Very high	90.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.5	-41.7	177.8	0	0	0	0	0	111.6	T39 V88 L102 G103 T108 L109 L110	T39-A106 WeakPolarHBondContact OG1-CB 3.5Å; V88-A106 HydrophobicContact CG1-CB 3.83Å; L102-A106 HydrophobicContact CB-CB 4.25Å; L102-A106 HydrophobicContact CD2-CB 4.16Å; G103-A106 PolarHBondContact O-N 3.45Å; A106-T108 VanDerWaalsContact C-N 3.33Å; A106-T108 PolarHBondContact O-N 3.33Å; A106-L109 PolarHBondContact O-N 3.19Å; A106-L110 WeakPolarHBondContact O-CG 3.16Å; A106-L110 PolarHBondContact O-N 3.02Å
107	L	93.9	Very high	90.4	Very high	12 Å²	12	43.4 Å²	43.4	6%	0.063	25%	0.25	C	C	.	.	H	α-helix	trans	-62.9	-40.6	178.8	-58.6	174.5	0	0	0	111.8	V32 T34 L102 G103 M104 L110 G111 V112	V32-L107 HydrophobicContact CG1-CD1 3.76Å; V32-L107 HydrophobicContact CG1-CD2 3.85Å; V32-L107 HydrophobicContact CG1-CG 4.48Å; V32-L107 HydrophobicContact CG2-CD2 4.29Å; T34-L107 HydrophobicContact CG2-CD1 4.03Å; L102-L107 HydrophobicContact CB-CD2 3.97Å; L102-L107 HydrophobicContact CB-CG 4.43Å; L102-L107 HydrophobicContact CD1-CD2 4.44Å; G103-L107 WeakPolarHBondContact O-CG 3.07Å; G103-L107 PolarHBondContact O-N 2.92Å; G103-L107 VanDerWaalsContact O-N 3.16Å; M104-L107 PolarHBondContact O-N 2.95Å; M104-L107 HydrophobicContact SD-CD1 4.05Å; L107-L110 PolarHBondContact O-N 3.47Å; L107-G111 PolarHBondContact O-N 2.86Å; L107-V112 HydrophobicContact CB-CG2 3.84Å; L107-V112 HydrophobicContact CD2-CG2 3.83Å; L107-V112 HydrophobicContact CG-CG2 4.41Å; L107-V112 PolarHBondContact O-N 3.3Å
108	T	91.5	Very high	90.4	Very high	102 Å²	102	42 Å²	42	63%	0.626	25%	0.25	S	S	*	.	H	α-helix	trans	-65	-43.3	176	-55.9	0	0	0	0	111.4	M104 A106 L110 G111	M104-T108 WeakPolarHBondContact O-CB 3.34Å; M104-T108 PolarHBondContact O-N 2.78Å; M104-T108 PolarHBondContact O-OG1 2.9Å; A106-T108 VanDerWaalsContact C-N 3.33Å; A106-T108 PolarHBondContact O-N 3.33Å; T108-L110 VanDerWaalsContact C-N 3.32Å; T108-L110 PolarHBondContact O-N 3.29Å; T108-G111 PolarHBondContact O-N 3.45Å; T108-G111 VanDerWaalsContact O-N 3.16Å
109	L	91.9	Very high	89.9	Confident	95 Å²	95	49.2 Å²	49.2	50%	0.497	28%	0.282	S	S	.	.	H	α-helix	trans	-63.4	-37.7	177.3	-72.4	174.2	0	0	0	112.5	V88 H105 A106 G111	V88-L109 HydrophobicContact CG1-CD1 3.99Å; H105-L109 WeakPolarHBondContact O-CG 3.45Å; H105-L109 PolarHBondContact O-N 2.96Å; H105-L109 VanDerWaalsContact O-N 3.13Å; A106-L109 PolarHBondContact O-N 3.19Å; L109-G111 VanDerWaalsContact C-N 3.28Å
110	L	91.1	Very high	89.2	Confident	4 Å²	4	47.5 Å²	47.5	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-67.3	-32.1	175.3	-79.6	169.8	0	0	0	112.5	C81 R84 L86 L102 A106 L107 T108 V112	C81-L110 HydrophobicContact CB-CD1 4.03Å; C81-L110 HydrophobicContact CB-CD2 4.02Å; R84-L110 HydrophobicContact CB-CD2 3.99Å; R84-L110 PolarHBondContact NH1-O 3.01Å; L86-L110 HydrophobicContact CB-CD2 4.41Å; L86-L110 HydrophobicContact CD2-CD1 3.81Å; L86-L110 HydrophobicContact CD2-CD2 3.4Å; L86-L110 VanDerWaalsContact CD2-CD2 3.4Å; L86-L110 HydrophobicContact CD2-CG 3.65Å; L86-L110 HydrophobicContact CG-CD2 4.49Å; L102-L110 HydrophobicContact CD1-CD1 4.37Å; A106-L110 WeakPolarHBondContact O-CG 3.16Å; A106-L110 PolarHBondContact O-N 3.02Å; L107-L110 PolarHBondContact O-N 3.47Å; T108-L110 VanDerWaalsContact C-N 3.32Å; T108-L110 PolarHBondContact O-N 3.29Å; L110-V112 HydrophobicContact CB-CG1 3.85Å; L110-V112 HydrophobicContact CD1-CG1 4.47Å
111	G	89.4	Confident	88.6	Confident	17 Å²	17	50.7 Å²	50.7	18%	0.175	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	55.1	-170.8	0	0	0	0	0	110.6	L107 T108 L109 M126	L107-G111 PolarHBondContact O-N 2.86Å; T108-G111 PolarHBondContact O-N 3.45Å; T108-G111 VanDerWaalsContact O-N 3.16Å; L109-G111 VanDerWaalsContact C-N 3.28Å; G111-M126 WeakPolarHBondContact O-CB 3.19Å; G111-M126 WeakPolarHBondContact O-CG 3.47Å; G111-M126 PolarHBondContact O-N 3.26Å
112	V	87.8	Confident	88	Confident	27 Å²	27	53.9 Å²	53.9	16%	0.164	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	154.9	178.4	-68.5	0	0	0	0	112.9	L82 L107 L110 V123 Q124 L125	L82-V112 HydrophobicContact CD1-CG1 3.75Å; L107-V112 HydrophobicContact CB-CG2 3.84Å; L107-V112 HydrophobicContact CD2-CG2 3.83Å; L107-V112 HydrophobicContact CG-CG2 4.41Å; L107-V112 PolarHBondContact O-N 3.3Å; L110-V112 HydrophobicContact CB-CG1 3.85Å; L110-V112 HydrophobicContact CD1-CG1 4.47Å; V112-V123 HydrophobicContact CB-CG1 4.35Å; V112-V123 HydrophobicContact CG1-CG1 4.41Å; V112-Q124 CarbonylContact C-O 3.53Å; V112-Q124 WeakPolarHBondContact CA-O 3.49Å; V112-Q124 WeakPolarHBondContact CB-O 3.45Å; V112-L125 HydrophobicContact CG1-CD2 4.03Å
113	T	86.7	Confident	87.4	Confident	20 Å²	20	54.8 Å²	54.8	12%	0.123	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	139.3	164.5	58.6	0	0	0	0	109.2	V123 Q124 M126 R129	T113-V123 WeakPolarHBondContact O-CA 3.33Å; T113-Q124 PolarHBondContact N-O 2.84Å; T113-Q124 PolarHBondContact O-N 2.88Å; T113-Q124 PolarHBondContact OG1-O 2.74Å; T113-M126 HydrophobicContact CG2-CB 4.31Å; T113-M126 HydrophobicContact CG2-CE 4.5Å; T113-M126 HydrophobicContact CG2-CG 3.42Å; T113-M126 VanDerWaalsContact CG2-CG 3.42Å; T113-R129 PolarHBondContact OG1-NH2 3.43Å
114	L	87.9	Confident	87.1	Confident	47 Å²	47	58 Å²	58	25%	0.246	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	114.7	167.5	176.3	66.4	0	0	0	107.5	P16 T34 L116 L122 V123	P16-L114 HydrophobicContact CB-CD1 3.65Å; P16-L114 HydrophobicContact CG-CD1 4.16Å; P16-L114 HydrophobicContact CG-CD2 4.32Å; T34-L114 HydrophobicContact CG2-CD2 4.1Å; L114-L116 HydrophobicContact CD1-CD2 4.22Å; L114-L116 HydrophobicContact CD2-CD2 4.29Å; L114-L116 HydrophobicContact CG-CD2 4.07Å; L114-L122 WeakPolarHBondContact CA-O 3.11Å; L114-V123 HydrophobicContact CD1-CG2 3.8Å
115	E	86.7	Confident	86.6	Confident	70 Å²	70	55.1 Å²	55.1	33%	0.327	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	132.6	173	-65.4	-177.3	-147.5	0	0	110.2	L121 L122 R129	E115-L121 WeakPolarHBondContact O-CA 3.46Å; E115-L122 HydrophobicContact CB-CB 4.24Å; E115-L122 PolarHBondContact N-O 2.84Å; E115-L122 PolarHBondContact O-N 2.9Å; E115-R129 IonicContact OE1-CZ 2.56Å; E115-R129 IonicContact OE1-NE 2.95Å; E115-R129 PolarHBondContact OE1-NE 3.24Å; E115-R129 IonicContact OE1-NH2 3.8Å; E115-R129 PolarHBondContact OE1-NH2 2.88Å
116	L	85	Confident	86	Confident	81 Å²	81	56.1 Å²	56.1	42%	0.424	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	122.9	174.5	-53.5	-179.6	0	0	0	108.1	L114 L121 Y159	L114-L116 HydrophobicContact CD1-CD2 4.22Å; L114-L116 HydrophobicContact CD2-CD2 4.29Å; L114-L116 HydrophobicContact CG-CD2 4.07Å; L116-L121 HydrophobicContact CD2-CB 4.21Å; L116-L121 HydrophobicContact CD2-CD2 3.23Å; L116-L121 HydrophobicContact CD2-CG 3.57Å; L116-Y159 HydrophobicContact CD1-CD1 3.9Å; L116-Y159 HydrophobicContact CD1-CD2 4.42Å; L116-Y159 HydrophobicContact CD1-CE1 3.47Å; L116-Y159 VanDerWaalsContact CD1-CE1 3.47Å; L116-Y159 HydrophobicContact CD1-CE2 4.01Å; L116-Y159 HydrophobicContact CD1-CG 4.37Å
117	S	80.4	Confident	84.7	Confident	63 Å²	63	62 Å²	62	44%	0.441	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	166.7	179.6	71.6	0	0	0	0	110.6	Q119 G120	S117-Q119 PolarHBondContact O-N 3.34Å; S117-Q119 PolarHBondContact OG-N 3.16Å; S117-Q119 PolarHBondContact OG-OE1 3.14Å; S117-G120 PolarHBondContact N-O 3.12Å; S117-G120 PolarHBondContact O-N 2.92Å; S117-G120 VanDerWaalsContact O-N 3.11Å; S117-G120 PolarHBondContact OG-N 3.23Å; S117-G120 VanDerWaalsContact OG-N 3.15Å; S117-G120 PolarHBondContact OG-O 3.26Å
118	A	82.3	Confident	83	Confident	105 Å²	105	67.3 Å²	67.3	87%	0.868	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.1	170.7	0	0	0	0	0	112.3
119	Q	79.6	Confident	81	Confident	162 Å²	162	68 Å²	68	76%	0.757	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-21.6	178.6	-65.3	72.5	25.4	0	0	112.5	S117	S117-Q119 PolarHBondContact O-N 3.34Å; S117-Q119 PolarHBondContact OG-N 3.16Å; S117-Q119 PolarHBondContact OG-OE1 3.14Å
120	G	78.3	Confident	78.5	Confident	18 Å²	18	72 Å²	72	19%	0.186	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	146.7	-170.1	179.2	0	0	0	0	0	113.6	S117	S117-G120 PolarHBondContact N-O 3.12Å; S117-G120 PolarHBondContact O-N 2.92Å; S117-G120 VanDerWaalsContact O-N 3.11Å; S117-G120 PolarHBondContact OG-N 3.23Å; S117-G120 VanDerWaalsContact OG-N 3.15Å; S117-G120 PolarHBondContact OG-O 3.26Å
121	L	83	Confident	76.1	Confident	68 Å²	68	77.7 Å²	77.7	36%	0.356	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	142.9	175.1	-58.3	93.1	0	0	0	109.7	R14 P16 E115 L116	R14-L121 HydrophobicContact CB-CD1 3.56Å; R14-L121 WeakPolarHBondContact O-CD1 3.4Å; R14-L121 WeakPolarHBondContact O-CD2 3.43Å; P16-L121 HydrophobicContact CB-CD2 3.93Å; P16-L121 HydrophobicContact CG-CD2 4.14Å; E115-L121 WeakPolarHBondContact O-CA 3.46Å; L116-L121 HydrophobicContact CD2-CB 4.21Å; L116-L121 HydrophobicContact CD2-CD2 3.23Å; L116-L121 HydrophobicContact CD2-CG 3.57Å
122	L	83.2	Confident	73.9	Confident	71 Å²	71	83.4 Å²	83.4	37%	0.372	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	130.6	-179.6	176.6	63.3	0	0	0	109.8	L114 E115 Q124	L114-L122 WeakPolarHBondContact CA-O 3.11Å; E115-L122 HydrophobicContact CB-CB 4.24Å; E115-L122 PolarHBondContact N-O 2.84Å; E115-L122 PolarHBondContact O-N 2.9Å; L122-Q124 HydrophobicContact CD1-CG 3.81Å; L122-Q124 HydrophobicContact CD2-CG 4.24Å; L122-Q124 HydrophobicContact CG-CG 3.78Å
123	V	83.8	Confident	71.3	Confident	20 Å²	20	89.8 Å²	89.8	12%	0.121	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	118.9	176.5	-175.4	0	0	0	0	107.7	P16 V18 V32 L82 V112 T113 L114	P16-V123 HydrophobicContact CB-CG2 4.18Å; V18-V123 HydrophobicContact CB-CG1 4.42Å; V18-V123 HydrophobicContact CG2-CG1 4.48Å; V32-V123 HydrophobicContact CG2-CG1 4.25Å; V32-V123 HydrophobicContact CG2-CG2 3.97Å; L82-V123 HydrophobicContact CD1-CG1 4.41Å; V112-V123 HydrophobicContact CB-CG1 4.35Å; V112-V123 HydrophobicContact CG1-CG1 4.41Å; T113-V123 WeakPolarHBondContact O-CA 3.33Å; L114-V123 HydrophobicContact CD1-CG2 3.8Å
124	Q	85.6	Confident	69.4	Low	67 Å²	67	98.5 Å²	98.5	31%	0.313	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	158	-175.2	-74.8	-179.7	-19.9	0	0	111.6	V112 T113 L122	V112-Q124 CarbonylContact C-O 3.53Å; V112-Q124 WeakPolarHBondContact CA-O 3.49Å; V112-Q124 WeakPolarHBondContact CB-O 3.45Å; T113-Q124 PolarHBondContact N-O 2.84Å; T113-Q124 PolarHBondContact O-N 2.88Å; T113-Q124 PolarHBondContact OG1-O 2.74Å; L122-Q124 HydrophobicContact CD1-CG 3.81Å; L122-Q124 HydrophobicContact CD2-CG 4.24Å; L122-Q124 HydrophobicContact CG-CG 3.78Å
125	L	83.8	Confident	66.9	Low	15 Å²	15	104.5 Å²	104.5	8%	0.079	55%	0.553	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.6	140.8	172.5	-65.3	175.8	0	0	0	110.8	L82 R84 V112 N127 D128	L82-L125 HydrophobicContact CB-CD1 4.19Å; L82-L125 HydrophobicContact CB-CD2 4.09Å; L82-L125 HydrophobicContact CB-CG 3.92Å; L82-L125 HydrophobicContact CD1-CD2 4.11Å; L82-L125 HydrophobicContact CD1-CG 4.11Å; L82-L125 WeakPolarHBondContact O-CD1 3.43Å; R84-L125 HydrophobicContact CG-CD1 4.08Å; R84-L125 HydrophobicContact CG-CD2 4.28Å; V112-L125 HydrophobicContact CG1-CD2 4.03Å; L125-N127 PolarHBondContact O-N 2.97Å; L125-N127 VanDerWaalsContact O-N 3.13Å; L125-D128 PolarHBondContact O-N 3.32Å
126	M	79	Confident	64.9	Low	114 Å²	114	109 Å²	109	56%	0.562	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-57.5	-27.9	178.6	-77.3	-179.5	103.3	0	0	113.1	G111 T113	G111-M126 WeakPolarHBondContact O-CB 3.19Å; G111-M126 WeakPolarHBondContact O-CG 3.47Å; G111-M126 PolarHBondContact O-N 3.26Å; T113-M126 HydrophobicContact CG2-CB 4.31Å; T113-M126 HydrophobicContact CG2-CE 4.5Å; T113-M126 HydrophobicContact CG2-CG 3.42Å; T113-M126 VanDerWaalsContact CG2-CG 3.42Å
127	N	67.9	Low	62.7	Low	124 Å²	124	111.8 Å²	111.8	66%	0.663	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-87.4	-7.7	-174.3	-65.4	-3.8	0	0	0	114.1	R84 L125 R129	R84-N127 PolarHBondContact NH2-ND2 3.12Å; L125-N127 PolarHBondContact O-N 2.97Å; L125-N127 VanDerWaalsContact O-N 3.13Å; N127-R129 VanDerWaalsContact C-N 3.29Å
128	D	57.6	Low	61	Low	124 Å²	124	114.5 Å²	114.5	66%	0.663	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-84.8	-4	177.9	-74.6	-23.7	0	0	0	112.9	L125	L125-D128 PolarHBondContact O-N 3.32Å
129	R	50.3	Low	59	Low	115 Å²	115	116.1 Å²	116.1	43%	0.434	61%	0.607	S	S	.	*			trans	-87.4	110.2	169.3	-66.3	-164.5	-167.3	145.6	11.4	109.7	T113 E115 N127	T113-R129 PolarHBondContact OG1-NH2 3.43Å; E115-R129 IonicContact OE1-CZ 2.56Å; E115-R129 IonicContact OE1-NE 2.95Å; E115-R129 PolarHBondContact OE1-NE 3.24Å; E115-R129 IonicContact OE1-NH2 3.8Å; E115-R129 PolarHBondContact OE1-NH2 2.88Å; N127-R129 VanDerWaalsContact C-N 3.29Å
130	Q	40.1	Very low	56.9	Low	179 Å²	179	118.2 Å²	118.2	84%	0.836	61%	0.608	S	S	*	*			trans	-56.5	127.6	153.4	-107.2	-158.4	-32.8	0	0	107.5	T132	Q130-T132 PolarHBondContact O-N 2.71Å
131	P	40.3	Very low	55.2	Low	124 Å²	124	122 Å²	122	81%	0.805	64%	0.638	S	S	*	*			trans	-69.3	102.6	-179.5	28.3	-33.3	0	0	0	108.8
132	T	43	Very low	53	Low	138 Å²	138	125.4 Å²	125.4	85%	0.847	65%	0.652	S	S	*	*			trans	-77.4	120.6	157.5	25.6	0	0	0	0	107.7	Q130 K134	Q130-T132 PolarHBondContact O-N 2.71Å; T132-K134 PolarHBondContact O-N 2.66Å; T132-K134 VanDerWaalsContact O-N 3.1Å
133	D	33.7	Very low	50.7	Low	160 Å²	160	127.3 Å²	127.3	86%	0.856	67%	0.671	S	S	*	*	S	Bend	trans	-36.1	108.5	-178	-76.2	-45.8	0	0	0	114
134	K	45.9	Very low	48.5	Very low	203 Å²	203	135.9 Å²	135.9	88%	0.883	70%	0.701	S	S	*	*			trans	177.9	119.8	133.4	-94.4	161.5	-171	-172.4	0	110.1	T132	T132-K134 PolarHBondContact O-N 2.66Å; T132-K134 VanDerWaalsContact O-N 3.1Å
135	E	35.9	Very low	46.2	Very low	174 Å²	174	138.6 Å²	138.6	81%	0.813	72%	0.723	S	S	*	*			trans	-41.4	132.8	178	-67	168.8	122	0	0	115.1
136	I	44.8	Very low	44.1	Very low	165 Å²	165	142.6 Å²	142.6	85%	0.846	76%	0.758	S	S	*	*			trans	-138.1	106	134.6	-55.2	-179.3	0	0	0	106.7
137	L	39.3	Very low	42.5	Very low	138 Å²	138	146.3 Å²	146.3	72%	0.723	77%	0.774	S	S	*	*			trans	-59.3	130.5	171.1	-86.8	142	0	0	0	109.8	T139	L137-T139 PolarHBondContact O-N 2.62Å
138	P	44.3	Very low	41.4	Very low	120 Å²	120	146.4 Å²	146.4	78%	0.779	77%	0.77	S	S	*	*			trans	-69.2	117.9	169.8	26.2	-29.1	0	0	0	109.1	R140	P138-R140 PolarHBondContact O-N 2.9Å
139	T	40.4	Very low	40.6	Very low	140 Å²	140	144.5 Å²	144.5	86%	0.859	77%	0.765	S	S	*	*			trans	-59.5	107.8	168.5	-48.2	0	0	0	0	108.6	L137 A141	L137-T139 PolarHBondContact O-N 2.62Å; T139-A141 PolarHBondContact O-N 2.94Å
140	R	35	Very low	40.3	Very low	205 Å²	205	143.7 Å²	143.7	77%	0.774	77%	0.768	S	S	*	*			trans	-3.1	101.3	163.1	-168.6	179.9	-174	-179.4	-0.7	114.4	P138 E142	P138-R140 PolarHBondContact O-N 2.9Å; R140-E142 PolarHBondContact O-N 3.08Å
141	A	42	Very low	40.4	Very low	99 Å²	99	140.4 Å²	140.4	82%	0.818	76%	0.761	S	S	*	*			trans	-74.2	106.7	161.2	0	0	0	0	0	107.7	T139	T139-A141 PolarHBondContact O-N 2.94Å
142	E	38.3	Very low	40.2	Very low	139 Å²	139	138.4 Å²	138.4	65%	0.65	75%	0.749	S	S	*	*			trans	-61	135.2	171.8	-66.4	-177.3	155.6	0	0	109.5	R140 W144	R140-E142 PolarHBondContact O-N 3.08Å; E142-W144 PolarHBondContact O-N 2.9Å; E142-W144 PolarHBondContact O-NE1 3.35Å
143	S	33	Very low	40	Very low	111 Å²	111	135.9 Å²	135.9	78%	0.776	73%	0.734	S	S	*	*			trans	-60.1	115.6	-178.8	49.2	0	0	0	0	111.1	T145	S143-T145 PolarHBondContact O-N 2.76Å
144	W	38	Very low	40	Very low	199 Å²	199	133.8 Å²	133.8	75%	0.754	72%	0.72	S	S	*	*			trans	-82.7	108.4	173.4	-66.9	88.1	0	0	0	109.9	E142 E148	E142-W144 PolarHBondContact O-N 2.9Å; E142-W144 PolarHBondContact O-NE1 3.35Å; W144-E148 VanDerWaalsContact CZ3-CD 3.48Å; W144-E148 WeakPolarHBondContact CZ3-OE2 3.49Å
145	T	37.5	Very low	39.5	Very low	124 Å²	124	126.9 Å²	126.9	76%	0.761	70%	0.701	S	S	*	*			trans	-68.5	139.5	167.3	41.4	0	0	0	0	110.2	S143 E147	S143-T145 PolarHBondContact O-N 2.76Å; T145-E147 PolarHBondContact O-N 3.06Å
146	A	40	Very low	39.2	Very low	99 Å²	99	122.3 Å²	122.3	82%	0.818	70%	0.701	S	S	*	*	S	Bend	trans	-66.5	88	-175.5	0	0	0	0	0	112.2
147	E	46.1	Very low	38.6	Very low	193 Å²	193	118.3 Å²	118.3	90%	0.902	68%	0.684	S	S	*	*			trans	-170.7	24.7	158.6	-113.5	174.3	-156.4	0	0	116.1	T145	T145-E147 PolarHBondContact O-N 3.06Å
148	E	43.2	Very low	38.2	Very low	125 Å²	125	118.6 Å²	118.6	58%	0.584	69%	0.691	S	S	*	*			trans	-94.2	132.8	174.7	-73.2	-155.7	167.6	0	0	113.8	W144	W144-E148 VanDerWaalsContact CZ3-CD 3.48Å; W144-E148 WeakPolarHBondContact CZ3-OE2 3.49Å
149	P	41	Very low	37.6	Very low	85 Å²	85	120.1 Å²	120.1	55%	0.552	68%	0.683	S	S	*	*			trans	-67.2	140.6	177.7	28.8	-32.3	0	0	0	109.8	T151	P149-T151 PolarHBondContact O-N 2.78Å
150	I	45.6	Very low	37	Very low	97 Å²	97	116.7 Å²	116.7	50%	0.497	68%	0.676	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.2	15.4	-178.7	-60	164	0	0	0	112.7	F61	F61-I150 HydrophobicContact CE1-CG2 4.06Å; F61-I150 HydrophobicContact CZ-CG2 4.49Å
151	T	41	Very low	36.6	Very low	111 Å²	111	115.9 Å²	115.9	68%	0.681	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-1.5	-171.4	47.9	0	0	0	0	115.5	P149	P149-T151 PolarHBondContact O-N 2.78Å
152	S	37.1	Very low	36	Very low	81 Å²	81	118.1 Å²	118.1	57%	0.566	67%	0.674	S	S	*	*	S	Bend	trans	-142.8	54.8	-173.2	63.5	0	0	0	0	115.1
153	V	37.4	Very low	35.4	Very low	86 Å²	86	119.6 Å²	119.6	52%	0.521	69%	0.685	S	S	.	*			trans	-143.4	78.9	163.4	-163.7	0	0	0	0	110.8	V37	V37-V153 HydrophobicContact CB-CB 4.43Å; V37-V153 HydrophobicContact CG2-CB 3.43Å; V37-V153 VanDerWaalsContact CG2-CB 3.43Å; V37-V153 HydrophobicContact CG2-CG1 3.31Å; V37-V153 HydrophobicContact CG2-CG2 4.12Å
154	M	34.3	Very low	35.1	Very low	115 Å²	115	118.6 Å²	118.6	57%	0.567	68%	0.676	S	S	*	*			trans	-103.5	86.9	157.4	-75.2	-95.8	-81.9	0	0	105.8	V64 G156	V64-M154 HydrophobicContact CG2-CE 3.82Å; M154-G156 PolarHBondContact O-N 3.33Å
155	A	36.5	Very low	34.5	Very low	59 Å²	59	118.7 Å²	118.7	49%	0.488	68%	0.677	S	S	.	*			trans	-81.6	104.3	173.1	0	0	0	0	0	107.9	V157	A155-V157 PolarHBondContact O-N 2.97Å
156	G	28.3	Very low	34.1	Very low	78 Å²	78	123.2 Å²	123.2	80%	0.804	69%	0.687	S	S	*	*			trans	-61.8	117.1	172	0	0	0	0	0	110.4	M154	M154-G156 PolarHBondContact O-N 3.33Å
157	V	33.1	Very low	33.4	Very low	80 Å²	80	124.4 Å²	124.4	49%	0.485	68%	0.684	S	S	.	*			trans	-106.5	90.5	163.9	-171.5	0	0	0	0	107.5	A155 Y159	A155-V157 PolarHBondContact O-N 2.97Å; V157-Y159 HydrophobicContact CB-CE2 4.36Å; V157-Y159 HydrophobicContact CG1-CD2 3.66Å; V157-Y159 HydrophobicContact CG1-CE2 3.32Å; V157-Y159 HydrophobicContact CG1-CG 4.48Å; V157-Y159 PolarHBondContact O-N 3.46Å
158	T	29.5	Very low	32.5	Very low	144 Å²	144	118.7 Å²	118.7	88%	0.883	67%	0.67	S	S	*	*			trans	-73.3	100.8	163.9	23.8	0	0	0	0	108.5
159	Y	33	Very low	32	Very low	152 Å²	152	123.4 Å²	123.4	60%	0.596	68%	0.684	S	S	*	*			trans	-73.7	128.2	162.4	-80.6	-81	0	0	0	109.2	L116 V157	L116-Y159 HydrophobicContact CD1-CD1 3.9Å; L116-Y159 HydrophobicContact CD1-CD2 4.42Å; L116-Y159 HydrophobicContact CD1-CE1 3.47Å; L116-Y159 VanDerWaalsContact CD1-CE1 3.47Å; L116-Y159 HydrophobicContact CD1-CE2 4.01Å; L116-Y159 HydrophobicContact CD1-CG 4.37Å; V157-Y159 HydrophobicContact CB-CE2 4.36Å; V157-Y159 HydrophobicContact CG1-CD2 3.66Å; V157-Y159 HydrophobicContact CG1-CE2 3.32Å; V157-Y159 HydrophobicContact CG1-CG 4.48Å; V157-Y159 PolarHBondContact O-N 3.46Å
160	G	26.4	Very low	31.5	Very low	69 Å²	69	128.1 Å²	128.1	71%	0.711	70%	0.696	S	S	*	*	S	Bend	trans	-60.1	159.3	-176.4	0	0	0	0	0	113.8
161	E	28.4	Very low	31	Very low	187 Å²	187	131.4 Å²	131.4	87%	0.874	71%	0.714	S	S	*	*			trans	75.8	79.5	171.5	-52	-166.4	156.9	0	0	116.1
162	Q	29.4	Very low	30.7	Very low	146 Å²	146	131.9 Å²	131.9	68%	0.682	72%	0.717	S	S	*	*				179.6	82	129.2	-95.8	169.4	8.9	0	0	109.7
163	I	25.4	Very low	30.8	Very low	170 Å²	170	132.8 Å²	132.8	87%	0.872	73%	0.729	S	S	*	*			trans	-106.4	109.6	155.2	-58.4	174.3	0	0	0	105.7
164	P	25.5	Very low	30.6	Very low	91 Å²	91	136.6 Å²	136.6	59%	0.591	75%	0.746	S	S	*	*			trans	-131.3	127.9	140.5	38.2	-25.9	0	0	0	109.4
165	Y	25.6	Very low	30.7	Very low	200 Å²	200	136.6 Å²	136.6	78%	0.784	75%	0.754	S	S	*	*			trans	70.3	106.1	167.8	-59	-85	0	0	0	117.4
166	F	28.5	Very low	31.1	Very low	219 Å²	219	147.1 Å²	147.1	96%	0.961	79%	0.789	S	S	*	*				-154	121.5	116.4	-103.9	-77.4	0	0	0	109.7
167	T	26.7	Very low	31.2	Very low	124 Å²	124	150.6 Å²	150.6	76%	0.761	79%	0.789	S	S	*	*			trans	-100.4	146.4	178.6	-61.8	0	0	0	0	109.7
168	A	27.6	Very low	31.1	Very low	73 Å²	73	154.3 Å²	154.3	60%	0.603	81%	0.805	S	S	*	*			trans	73.5	134.5	164.5	0	0	0	0	0	116.1
169	Y	32.5	Very low	31.2	Very low	225 Å²	225	154.9 Å²	154.9	88%	0.882	80%	0.8	S	S	*	*			cis	-140.5	144.8	47.7	-89.5	-98.3	0	0	0	115.2
170	K	30.1	Very low	31.1	Very low	183 Å²	183	155.1 Å²	155.1	80%	0.796	81%	0.812	S	S	*	*			trans	-44.3	138	164.3	-68.9	170.4	171.9	176.6	0	111.9
171	N	35.6	Very low	31.4	Very low	166 Å²	166	160.4 Å²	160.4	89%	0.888	82%	0.819	S	S	*	*			trans	-129.2	94	140.8	-134.8	-2.1	0	0	0	109	A173	N171-A173 PolarHBondContact O-N 3.48Å
172	T	34.7	Very low	31.6	Very low	122 Å²	122	158.7 Å²	158.7	75%	0.748	82%	0.815	S	S	*	*			trans	-69.3	113.6	164.1	37.2	0	0	0	0	108.8
173	A	38.9	Very low	31.7	Very low	99 Å²	99	159.6 Å²	159.6	82%	0.818	82%	0.824	S	S	*	*			trans	-155.9	102.9	150.5	0	0	0	0	0	108.7	N171	N171-A173 PolarHBondContact O-N 3.48Å
174	L	31.8	Very low	32.2	Very low	166 Å²	166	158.8 Å²	158.8	87%	0.869	82%	0.821	S	S	*	*			trans	-130.2	158.3	162.6	-90.8	167.4	0	0	0	105.7
175	P	36.9	Very low	32.8	Very low	115 Å²	115	164.4 Å²	164.4	75%	0.747	84%	0.84	S	S	*	*				-110.3	-164	-76	24.3	-1.8	0	0	0	109.1
176	K	44.1	Very low	33.4	Very low	281 Å²	281	161.2 Å²	161.2	100%	1.222	85%	0.845	S	S	*	*			trans	-58.7	0	167.1	-78.9	-174.8	178.5	178.8	0	112

Retrieved 176 of 176 residues in 239.1 ms (Link to these results)

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