A0A077YY61_TRITR Loading...

Abundant larval transcript 2 (Alt2) protein

AlphaFold DB , UniProt , Accession A0A077YY61, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 179 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	48.9	Very low	47.1	Very low	226 Å²	226	153.3 Å²	153.3	100%	1.113	71%	0.709	S	S	*	*				0	-32.5	0	-81.5	178.7	163	0	0	115.4	K3 R4	M1-K3 VanDerWaalsContact C-N 3.25Å; M1-K3 PolarHBondContact O-N 2.89Å; M1-R4 PolarHBondContact O-N 3.13Å
2	L	47.2	Very low	47.7	Very low	130 Å²	130	149.4 Å²	149.4	68%	0.681	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-43.6	-31.4	-170.1	-96.9	63.7	0	0	0	118.5	R4 Q5	L2-R4 VanDerWaalsContact C-N 3.3Å; L2-R4 PolarHBondContact O-N 3.32Å; L2-Q5 PolarHBondContact O-N 3.42Å
3	K	46.4	Very low	48.3	Very low	190 Å²	190	142.8 Å²	142.8	83%	0.826	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-23.9	-171.7	-152.7	172.7	-175.2	179.8	0	114.2	M1	M1-K3 VanDerWaalsContact C-N 3.25Å; M1-K3 PolarHBondContact O-N 2.89Å
4	R	44.2	Very low	48.9	Very low	200 Å²	200	136.4 Å²	136.4	76%	0.755	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-39.9	177	-96.5	-174.2	172	-177.7	-2.5	113.7	M1 L2 R6 I7	M1-R4 PolarHBondContact O-N 3.13Å; L2-R4 VanDerWaalsContact C-N 3.3Å; L2-R4 PolarHBondContact O-N 3.32Å; R4-R6 VanDerWaalsContact C-N 3.33Å; R4-R6 PolarHBondContact O-N 3.4Å; R4-I7 PolarHBondContact O-N 3.26Å; R4-I7 VanDerWaalsContact O-N 3.13Å
5	Q	47.1	Very low	49.4	Very low	144 Å²	144	134.2 Å²	134.2	67%	0.673	65%	0.651	S	S	*	*	H	α-helix	trans	-62.1	-36.8	-175.2	-78.4	174.8	-45.7	0	0	113.2	L2 I7 F8 L9	L2-Q5 PolarHBondContact O-N 3.42Å; Q5-I7 PolarHBondContact O-N 3.36Å; Q5-F8 PolarHBondContact O-N 3.2Å; Q5-L9 PolarHBondContact O-N 3.23Å
6	R	44.9	Very low	49.8	Very low	197 Å²	197	132.1 Å²	132.1	74%	0.743	64%	0.643	S	S	*	*	H	α-helix	trans	-65.1	-18.2	178.1	-69.4	-171.9	177	-174.9	-1.1	114.2	R4	R4-R6 VanDerWaalsContact C-N 3.33Å; R4-R6 PolarHBondContact O-N 3.4Å
7	I	49.6	Very low	50	Low	120 Å²	120	129.4 Å²	129.4	62%	0.615	63%	0.632	S	S	*	*	H	α-helix	trans	-82.1	-47.9	177.4	-57.7	174.9	0	0	0	109.7	R4 Q5 L9 K10 G11	R4-I7 PolarHBondContact O-N 3.26Å; R4-I7 VanDerWaalsContact O-N 3.13Å; Q5-I7 PolarHBondContact O-N 3.36Å; I7-L9 VanDerWaalsContact C-N 3.34Å; I7-L9 PolarHBondContact O-N 3.01Å; I7-K10 PolarHBondContact O-N 3.22Å; I7-G11 PolarHBondContact O-N 3.39Å
8	F	46.5	Very low	50	Low	146 Å²	146	128.6 Å²	128.6	64%	0.64	63%	0.63	S	S	*	*	H	α-helix	trans	-58.4	-43	177.3	-81.8	-85	0	0	0	112.7	Q5 K10 G11 I12	Q5-F8 PolarHBondContact O-N 3.2Å; F8-K10 VanDerWaalsContact C-N 3.29Å; F8-K10 PolarHBondContact O-N 3.32Å; F8-G11 PolarHBondContact O-N 3.35Å; F8-G11 VanDerWaalsContact O-N 3.15Å; F8-I12 WeakPolarHBondContact O-CG1 3.37Å; F8-I12 PolarHBondContact O-N 2.89Å
9	L	49	Very low	49.8	Very low	134 Å²	134	127.7 Å²	127.7	70%	0.702	63%	0.628	S	S	*	*	H	α-helix	trans	-63.6	-34.8	-179.7	-155.8	72.9	0	0	0	112.6	Q5 I7 S13	Q5-L9 PolarHBondContact O-N 3.23Å; I7-L9 VanDerWaalsContact C-N 3.34Å; I7-L9 PolarHBondContact O-N 3.01Å; L9-S13 PolarHBondContact O-N 2.98Å
10	K	48.3	Very low	49.6	Very low	167 Å²	167	126.7 Å²	126.7	73%	0.726	62%	0.624	S	S	*	*	H	α-helix	trans	-70.6	-40.8	172.3	-76	-166.3	170.6	-160.6	0	112.5	I7 F8 S13 A14	I7-K10 PolarHBondContact O-N 3.22Å; F8-K10 VanDerWaalsContact C-N 3.29Å; F8-K10 PolarHBondContact O-N 3.32Å; K10-S13 PolarHBondContact O-N 2.94Å; K10-A14 PolarHBondContact O-N 3.15Å
11	G	45.7	Very low	49.3	Very low	32 Å²	32	127.9 Å²	127.9	33%	0.33	63%	0.626	S	S	.	*	H	α-helix	trans	-60.2	-46.1	176.5	0	0	0	0	0	112.4	I7 F8 S13 A14 I15	I7-G11 PolarHBondContact O-N 3.39Å; F8-G11 PolarHBondContact O-N 3.35Å; F8-G11 VanDerWaalsContact O-N 3.15Å; G11-S13 PolarHBondContact O-N 3.19Å; G11-A14 PolarHBondContact O-N 3.44Å; G11-I15 WeakPolarHBondContact O-CG1 3.41Å; G11-I15 PolarHBondContact O-N 3.36Å
12	I	54.7	Low	48.7	Very low	107 Å²	107	121.3 Å²	121.3	55%	0.549	60%	0.602	S	S	.	*	H	α-helix	trans	-62.5	-42.8	176.6	-64.2	163.2	0	0	0	110.7	F8 A14 I15 L16	F8-I12 WeakPolarHBondContact O-CG1 3.37Å; F8-I12 PolarHBondContact O-N 2.89Å; I12-A14 VanDerWaalsContact C-N 3.34Å; I12-A14 PolarHBondContact O-N 3.25Å; I12-I15 PolarHBondContact O-N 3.48Å; I12-L16 WeakPolarHBondContact O-CB 3.33Å; I12-L16 PolarHBondContact O-N 2.85Å
13	S	55.4	Low	47.8	Very low	64 Å²	64	117.8 Å²	117.8	45%	0.448	60%	0.598	S	S	.	*	H	α-helix	trans	-62.3	-38.5	176.2	-176.8	0	0	0	0	112.9	L9 K10 G11 L17	L9-S13 PolarHBondContact O-N 2.98Å; K10-S13 PolarHBondContact O-N 2.94Å; G11-S13 PolarHBondContact O-N 3.19Å; S13-L17 WeakPolarHBondContact O-CB 3.42Å; S13-L17 WeakPolarHBondContact O-CG 3.36Å; S13-L17 PolarHBondContact O-N 3.49Å
14	A	56.3	Low	47.1	Very low	53 Å²	53	112 Å²	112	44%	0.438	59%	0.585	S	S	.	*	H	α-helix	trans	-71.1	-39.1	177.1	0	0	0	0	0	112.3	K10 G11 I12 L17 L18	K10-A14 PolarHBondContact O-N 3.15Å; G11-A14 PolarHBondContact O-N 3.44Å; I12-A14 VanDerWaalsContact C-N 3.34Å; I12-A14 PolarHBondContact O-N 3.25Å; A14-L17 PolarHBondContact O-N 2.99Å; A14-L18 WeakPolarHBondContact O-CB 3.46Å; A14-L18 PolarHBondContact O-N 2.93Å
15	I	57.5	Low	46.5	Very low	103 Å²	103	106.6 Å²	106.6	53%	0.528	58%	0.578	S	S	.	*	H	α-helix	trans	-67.8	-39.4	175.1	-68	165.3	0	0	0	110.8	G11 I12 L18 L19	G11-I15 WeakPolarHBondContact O-CG1 3.41Å; G11-I15 PolarHBondContact O-N 3.36Å; I12-I15 PolarHBondContact O-N 3.48Å; I15-L18 PolarHBondContact O-N 2.84Å; I15-L19 HydrophobicContact CG2-CD1 4.13Å; I15-L19 WeakPolarHBondContact O-CG 3.25Å; I15-L19 PolarHBondContact O-N 3.1Å
16	L	55.7	Low	45.5	Very low	101 Å²	101	107.1 Å²	107.1	53%	0.529	59%	0.585	S	S	.	*	H	α-helix	trans	-67.3	-41.3	176.1	-166	73.2	0	0	0	111.5	I12 L19 I20	I12-L16 WeakPolarHBondContact O-CB 3.33Å; I12-L16 PolarHBondContact O-N 2.85Å; L16-L19 PolarHBondContact O-N 2.96Å; L16-I20 HydrophobicContact CG-CD1 4.19Å; L16-I20 WeakPolarHBondContact O-CD1 3.21Å; L16-I20 VanDerWaalsContact O-CG1 3.25Å; L16-I20 WeakPolarHBondContact O-CG1 3.33Å; L16-I20 PolarHBondContact O-N 3.33Å
17	L	53.4	Low	44.8	Very low	86 Å²	86	102.9 Å²	102.9	45%	0.45	58%	0.581	S	S	.	*	H	α-helix	trans	-60.6	-44.5	171.1	-84.7	160.8	0	0	0	111.6	S13 A14 L19 I20 F21	S13-L17 WeakPolarHBondContact O-CB 3.42Å; S13-L17 WeakPolarHBondContact O-CG 3.36Å; S13-L17 PolarHBondContact O-N 3.49Å; A14-L17 PolarHBondContact O-N 2.99Å; L17-L19 VanDerWaalsContact C-N 3.33Å; L17-L19 PolarHBondContact O-N 2.88Å; L17-I20 PolarHBondContact O-N 3.2Å; L17-F21 HydrophobicContact CD2-CE2 4.04Å; L17-F21 WeakPolarHBondContact O-CD2 3.27Å; L17-F21 PolarHBondContact O-N 3.45Å
18	L	49	Very low	43.7	Very low	114 Å²	114	103 Å²	103	60%	0.597	59%	0.588	S	S	*	*	H	α-helix	trans	-59.3	-41.8	173.3	-92.4	162.4	0	0	0	112	A14 I15 I20 F21 S22	A14-L18 WeakPolarHBondContact O-CB 3.46Å; A14-L18 PolarHBondContact O-N 2.93Å; I15-L18 PolarHBondContact O-N 2.84Å; L18-I20 VanDerWaalsContact C-N 3.35Å; L18-I20 PolarHBondContact O-N 3.24Å; L18-F21 CarbonylContact O-C 3.6Å; L18-F21 PolarHBondContact O-N 2.9Å; L18-S22 VanDerWaalsContact O-CB 3.29Å; L18-S22 WeakPolarHBondContact O-CB 3.46Å; L18-S22 PolarHBondContact O-N 3.13Å; L18-S22 PolarHBondContact O-OG 2.73Å
19	L	46.6	Very low	43.1	Very low	112 Å²	112	98.8 Å²	98.8	59%	0.586	58%	0.58	S	S	*	*	H	α-helix	trans	-68.5	-30.9	176.1	-73.1	168.9	0	0	0	113.1	I15 L16 L17 G23	I15-L19 HydrophobicContact CG2-CD1 4.13Å; I15-L19 WeakPolarHBondContact O-CG 3.25Å; I15-L19 PolarHBondContact O-N 3.1Å; L16-L19 PolarHBondContact O-N 2.96Å; L17-L19 VanDerWaalsContact C-N 3.33Å; L17-L19 PolarHBondContact O-N 2.88Å; L19-G23 PolarHBondContact O-N 2.87Å
20	I	46.8	Very low	42.2	Very low	107 Å²	107	97.3 Å²	97.3	55%	0.549	57%	0.572	S	S	.	*	H	α-helix	trans	-71.7	-40.8	173.5	-67.9	160.8	0	0	0	110.5	L16 L17 L18 G23 A24	L16-I20 HydrophobicContact CG-CD1 4.19Å; L16-I20 WeakPolarHBondContact O-CD1 3.21Å; L16-I20 VanDerWaalsContact O-CG1 3.25Å; L16-I20 WeakPolarHBondContact O-CG1 3.33Å; L16-I20 PolarHBondContact O-N 3.33Å; L17-I20 PolarHBondContact O-N 3.2Å; L18-I20 VanDerWaalsContact C-N 3.35Å; L18-I20 PolarHBondContact O-N 3.24Å; I20-G23 CarbonylContact O-C 3.38Å; I20-G23 VanDerWaalsContact O-CA 3.27Å; I20-G23 WeakPolarHBondContact O-CA 3.07Å; I20-G23 PolarHBondContact O-N 3.49Å; I20-G23 VanDerWaalsContact O-N 3.13Å; I20-A24 PolarHBondContact O-N 3.36Å
21	F	42.1	Very low	41.5	Very low	153 Å²	153	98.2 Å²	98.2	67%	0.671	58%	0.579	S	S	*	*	H	α-helix	trans	-75.8	-28.2	175.1	-75.2	-64	0	0	0	113.6	L17 L18 A24	L17-F21 HydrophobicContact CD2-CE2 4.04Å; L17-F21 WeakPolarHBondContact O-CD2 3.27Å; L17-F21 PolarHBondContact O-N 3.45Å; L18-F21 CarbonylContact O-C 3.6Å; L18-F21 PolarHBondContact O-N 2.9Å; F21-A24 WeakPolarHBondContact O-CB 3.29Å; F21-A24 PolarHBondContact O-N 3.45Å; F21-A24 VanDerWaalsContact O-N 3.1Å
22	S	36.3	Very low	41	Very low	88 Å²	88	98 Å²	98	62%	0.615	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-15.3	164.2	-59.3	0	0	0	0	112.3	L18	L18-S22 VanDerWaalsContact O-CB 3.29Å; L18-S22 WeakPolarHBondContact O-CB 3.46Å; L18-S22 PolarHBondContact O-N 3.13Å; L18-S22 PolarHBondContact O-OG 2.73Å
23	G	28.4	Very low	40.5	Very low	56 Å²	56	96.9 Å²	96.9	58%	0.577	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	4.9	163.1	0	0	0	0	0	113.2	L19 I20 S25	L19-G23 PolarHBondContact O-N 2.87Å; I20-G23 CarbonylContact O-C 3.38Å; I20-G23 VanDerWaalsContact O-CA 3.27Å; I20-G23 WeakPolarHBondContact O-CA 3.07Å; I20-G23 PolarHBondContact O-N 3.49Å; I20-G23 VanDerWaalsContact O-N 3.13Å; G23-S25 PolarHBondContact O-N 2.82Å
24	A	31.1	Very low	39.7	Very low	69 Å²	69	96.1 Å²	96.1	57%	0.57	56%	0.56	S	S	*	*	S	Bend	trans	-61.9	89.5	154.5	0	0	0	0	0	107.2	I20 F21 N26	I20-A24 PolarHBondContact O-N 3.36Å; F21-A24 WeakPolarHBondContact O-CB 3.29Å; F21-A24 PolarHBondContact O-N 3.45Å; F21-A24 VanDerWaalsContact O-N 3.1Å; A24-N26 PolarHBondContact O-N 3.39Å
25	S	32.5	Very low	39.2	Very low	86 Å²	86	94.4 Å²	94.4	60%	0.601	54%	0.543	S	S	*	.			trans	-12.6	117.6	177.1	45.5	0	0	0	0	114.1	G23 V27	G23-S25 PolarHBondContact O-N 2.82Å; S25-V27 PolarHBondContact O-N 2.72Å; S25-V27 WeakPolarHBondContact OG-CG2 3.44Å
26	N	25.5	Very low	38.5	Very low	155 Å²	155	90.1 Å²	90.1	83%	0.829	52%	0.522	S	S	*	.			trans	-59.9	73.4	141.7	-74.5	-22.7	0	0	0	107.9	A24 T28	A24-N26 PolarHBondContact O-N 3.39Å; N26-T28 PolarHBondContact O-N 2.98Å
27	V	30.6	Very low	38	Very low	107 Å²	107	87.3 Å²	87.3	65%	0.648	51%	0.509	S	S	*	.			trans	-63.8	86.2	140.7	-158.6	0	0	0	0	103	S25 A29	S25-V27 PolarHBondContact O-N 2.72Å; S25-V27 WeakPolarHBondContact OG-CG2 3.44Å; V27-A29 HydrophobicContact CG1-CB 4.19Å; V27-A29 PolarHBondContact O-N 2.92Å
28	T	26.5	Very low	37.6	Very low	123 Å²	123	86.5 Å²	86.5	76%	0.755	50%	0.5	S	S	*	.			trans	-58.7	81.3	143.6	46.3	0	0	0	0	104.4	N26 D30	N26-T28 PolarHBondContact O-N 2.98Å; T28-D30 PolarHBondContact O-N 2.93Å
29	A	32.8	Very low	37.1	Very low	58 Å²	58	85.1 Å²	85.1	48%	0.479	50%	0.498	S	S	.	.			trans	-55.9	111.4	171.5	0	0	0	0	0	103.8	V27 Q31	V27-A29 HydrophobicContact CG1-CB 4.19Å; V27-A29 PolarHBondContact O-N 2.92Å; A29-Q31 PolarHBondContact O-N 3.04Å
30	D	31.7	Very low	36.5	Very low	102 Å²	102	83.6 Å²	83.6	55%	0.545	49%	0.49	S	S	.	.			trans	-53.5	114.4	-172.7	171.2	48.5	0	0	0	107.7	T28 G32 W34	T28-D30 PolarHBondContact O-N 2.93Å; D30-G32 PolarHBondContact O-N 3.29Å; D30-W34 VanDerWaalsContact O-CD1 3.28Å; D30-W34 PolarHBondContact OD2-NE1 3.21Å
31	Q	33.2	Very low	35.7	Very low	186 Å²	186	83.2 Å²	83.2	87%	0.869	49%	0.488	S	S	*	.			trans	-77	21.2	-174.6	-70.5	-170	-41.8	0	0	112.2	A29	A29-Q31 PolarHBondContact O-N 3.04Å
32	G	35.6	Very low	35	Very low	28 Å²	28	79.5 Å²	79.5	29%	0.289	48%	0.479	S	S	.	.	S	Bend	trans	-50.9	142.9	146.6	0	0	0	0	0	109.7	D30 W34	D30-G32 PolarHBondContact O-N 3.29Å; G32-W34 PolarHBondContact O-N 3.44Å
33	N	42.8	Very low	34.6	Very low	83 Å²	83	81 Å²	81	44%	0.444	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	74.9	-174.1	-68.5	-55.5	0	0	0	109.4	T147 S148 G149	N33-T147 WeakPolarHBondContact O-CB 3.22Å; N33-T147 PolarHBondContact O-N 2.97Å; N33-T147 PolarHBondContact O-OG1 2.84Å; N33-S148 PolarHBondContact ND2-O 2.98Å; N33-G149 VanDerWaalsContact CB-CA 3.42Å; N33-G149 WeakPolarHBondContact ND2-CA 3.13Å
34	W	39.9	Very low	34.5	Very low	49 Å²	49	82.2 Å²	82.2	19%	0.186	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	126.8	180	-67.3	100	0	0	0	111.1	D30 G32 G122 E124 Y144 I145 S146	D30-W34 VanDerWaalsContact O-CD1 3.28Å; D30-W34 PolarHBondContact OD2-NE1 3.21Å; G32-W34 PolarHBondContact O-N 3.44Å; W34-G122 WeakPolarHBondContact CH2-O 3.37Å; W34-G122 WeakPolarHBondContact CZ3-O 3.47Å; W34-E124 HydrophobicContact CE3-CB 4.2Å; W34-E124 HydrophobicContact CH2-CB 4.5Å; W34-E124 HydrophobicContact CZ3-CB 3.99Å; W34-Y144 HydrophobicContact CB-CD1 4.4Å; W34-I145 WeakPolarHBondContact CA-O 3.46Å; W34-S146 VanDerWaalsContact CE3-N 3.29Å; W34-S146 WeakPolarHBondContact CZ2-OG 3.29Å
35	I	45.5	Very low	34.3	Very low	17 Å²	17	84.7 Å²	84.7	9%	0.087	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	135.5	-175.9	-56.2	-175.5	0	0	0	110.1	Y144 I145 T147 R164	I35-Y144 WeakPolarHBondContact O-CA 3.49Å; I35-I145 PolarHBondContact N-O 2.87Å; I35-I145 PolarHBondContact O-N 2.95Å; I35-T147 HydrophobicContact CB-CG2 4.05Å; I35-T147 HydrophobicContact CD1-CG2 3.87Å; I35-T147 WeakPolarHBondContact CD1-OG1 3.44Å; I35-T147 HydrophobicContact CG1-CG2 3.92Å; I35-R164 HydrophobicContact CG2-CG 3.71Å
36	P	42.2	Very low	34.1	Very low	13 Å²	13	88.8 Å²	88.8	8%	0.084	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	137.9	-175.1	26.5	-35.9	0	0	0	112.5	Y38 Y134 I142 A143 Y144 S163	P36-Y38 HydrophobicContact CG-CE2 4.05Å; P36-Y38 WeakPolarHBondContact O-CD2 3.47Å; P36-Y134 HydrophobicContact CB-CE2 4.2Å; P36-Y134 HydrophobicContact CG-CE2 4.01Å; P36-Y134 VanDerWaalsContact CG-OH 3.28Å; P36-Y134 WeakPolarHBondContact CG-OH 3.5Å; P36-I142 HydrophobicContact CB-CG2 3.78Å; P36-A143 CarbonylContact C-O 3.05Å; P36-A143 WeakPolarHBondContact CA-O 3.36Å; P36-Y144 HydrophobicContact CB-CD1 4.18Å; P36-Y144 HydrophobicContact CB-CE1 3.95Å; P36-Y144 HydrophobicContact CB-CE2 4.4Å; P36-Y144 HydrophobicContact CB-CG 4.5Å; P36-Y144 HydrophobicContact CG-CE1 4.19Å; P36-S163 PolarHBondContact O-OG 2.94Å
37	V	44.6	Very low	34.2	Very low	42 Å²	42	85.6 Å²	85.6	26%	0.255	49%	0.492	S	S	.	.			trans	-78	130.7	174.8	-177.9	0	0	0	0	109.4	A143 I145	V37-A143 HydrophobicContact CB-CB 4.32Å; V37-A143 HydrophobicContact CG2-CB 4.33Å; V37-A143 PolarHBondContact N-O 3.11Å; V37-I145 HydrophobicContact CG2-CB 4.32Å; V37-I145 HydrophobicContact CG2-CD1 4.22Å; V37-I145 HydrophobicContact CG2-CG1 3.86Å; V37-I145 HydrophobicContact CG2-CG2 3.73Å
38	Y	46.6	Very low	34	Very low	68 Å²	68	89.3 Å²	89.3	27%	0.267	50%	0.503	S	S	.	.	S	Bend	trans	-111.6	157	-179.2	-87.8	-91.8	0	0	0	111.6	P36 L40 Y134 P166	P36-Y38 HydrophobicContact CG-CE2 4.05Å; P36-Y38 WeakPolarHBondContact O-CD2 3.47Å; Y38-L40 HydrophobicContact CD1-CG 4.26Å; Y38-L40 HydrophobicContact CE1-CD1 3.99Å; Y38-L40 HydrophobicContact CE1-CG 4.15Å; Y38-Y134 PolarHBondContact OH-OH 3.02Å; Y38-P166 HydrophobicContact CD1-CG 3.65Å; Y38-P166 HydrophobicContact CG-CG 3.84Å
39	P	37.2	Very low	33.9	Very low	86 Å²	86	91.2 Å²	91.2	56%	0.558	50%	0.503	S	S	*	.	S	Bend	cis	-80.4	158.2	-3.2	32.1	-34.7	0	0	0	113.7	I41	P39-I41 VanDerWaalsContact C-N 3.27Å; P39-I41 HydrophobicContact CG-CD1 4.09Å; P39-I41 HydrophobicContact CG-CG1 4.12Å; P39-I41 PolarHBondContact O-N 2.79Å
40	L	34.8	Very low	33.4	Very low	80 Å²	80	98.8 Å²	98.8	42%	0.419	52%	0.519	S	S	.	.			trans	-75.1	70.7	-178.9	-60.6	162.7	0	0	0	111.6	Y38 P42 Y134 I142	Y38-L40 HydrophobicContact CD1-CG 4.26Å; Y38-L40 HydrophobicContact CE1-CD1 3.99Å; Y38-L40 HydrophobicContact CE1-CG 4.15Å; L40-P42 WeakPolarHBondContact O-CD 3.46Å; L40-Y134 HydrophobicContact CD1-CD1 4.37Å; L40-Y134 HydrophobicContact CD1-CE1 3.64Å; L40-Y134 HydrophobicContact CD2-CE1 4.25Å; L40-I142 HydrophobicContact CD2-CD1 4.37Å; L40-I142 HydrophobicContact CD2-CG1 4.32Å; L40-I142 HydrophobicContact CD2-CG2 4.17Å
41	I	29.3	Very low	33	Very low	99 Å²	99	100.4 Å²	100.4	51%	0.508	53%	0.526	S	S	.	.			trans	-83.3	120.5	175.7	-60.1	174.8	0	0	0	109	P39 V43 Q45	P39-I41 VanDerWaalsContact C-N 3.27Å; P39-I41 HydrophobicContact CG-CD1 4.09Å; P39-I41 HydrophobicContact CG-CG1 4.12Å; P39-I41 PolarHBondContact O-N 2.79Å; I41-V43 PolarHBondContact O-N 2.98Å; I41-Q45 HydrophobicContact CG2-CB 4.49Å; I41-Q45 VanDerWaalsContact CG2-O 3.26Å; I41-Q45 WeakPolarHBondContact CG2-O 3.33Å
42	P	27.1	Very low	32.5	Very low	74 Å²	74	97.1 Å²	97.1	48%	0.481	52%	0.519	S	S	.	.			trans	-60	135.1	174.3	-22.9	34.6	0	0	0	111.1	L40 G44 Q45	L40-P42 WeakPolarHBondContact O-CD 3.46Å; P42-G44 PolarHBondContact O-N 3.42Å; P42-Q45 HydrophobicContact CB-CG 4.31Å; P42-Q45 PolarHBondContact O-N 2.78Å
43	V	28.8	Very low	32	Very low	121 Å²	121	101.4 Å²	101.4	73%	0.733	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	115.4	-173	-178	0	0	0	0	111	I41	I41-V43 PolarHBondContact O-N 2.98Å
44	G	27	Very low	31.4	Very low	80 Å²	80	103 Å²	103	83%	0.825	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	94.6	4.1	179.8	0	0	0	0	0	116.2	P42	P42-G44 PolarHBondContact O-N 3.42Å
45	Q	26.2	Very low	30.7	Very low	121 Å²	121	106.7 Å²	106.7	57%	0.565	58%	0.577	S	S	*	*			trans	-91.9	105.8	170.4	-69.5	-158.3	-38.8	0	0	112.5	I41 P42 V47	I41-Q45 HydrophobicContact CG2-CB 4.49Å; I41-Q45 VanDerWaalsContact CG2-O 3.26Å; I41-Q45 WeakPolarHBondContact CG2-O 3.33Å; P42-Q45 HydrophobicContact CB-CG 4.31Å; P42-Q45 PolarHBondContact O-N 2.78Å; Q45-V47 PolarHBondContact O-N 3.01Å
46	E	29.1	Very low	29.6	Very low	173 Å²	173	113.6 Å²	113.6	81%	0.808	61%	0.609	S	S	*	*			trans	-71.7	112.9	155.4	-69.2	-173	166	0	0	108.7	E48	E46-E48 PolarHBondContact O-N 2.89Å
47	V	26	Very low	28.8	Very low	87 Å²	87	122 Å²	122	53%	0.527	64%	0.644	S	S	.	*			trans	-80.4	103.8	177.6	-177.5	0	0	0	0	108.8	Q45 H49	Q45-V47 PolarHBondContact O-N 3.01Å; V47-H49 PolarHBondContact O-CD2 3.15Å; V47-H49 VanDerWaalsContact O-CD2 3.3Å; V47-H49 PolarHBondContact O-N 2.9Å
48	E	26.5	Very low	27.8	Very low	186 Å²	186	129.4 Å²	129.4	87%	0.869	67%	0.673	S	S	*	*			trans	-58.3	108.4	164.7	-82.7	-158.1	137.5	0	0	109	E46 R50	E46-E48 PolarHBondContact O-N 2.89Å; E48-R50 VanDerWaalsContact C-N 3.26Å; E48-R50 PolarHBondContact O-N 2.9Å
49	H	25.1	Very low	26.7	Very low	163 Å²	163	132 Å²	132	76%	0.755	70%	0.697	S	S	*	*			trans	-66.2	86.5	175	-79	-101.4	0	0	0	109.9	V47 L51	V47-H49 PolarHBondContact O-CD2 3.15Å; V47-H49 VanDerWaalsContact O-CD2 3.3Å; V47-H49 PolarHBondContact O-N 2.9Å; H49-L51 PolarHBondContact O-N 2.9Å
50	R	22.5	Very low	26.1	Very low	216 Å²	216	133 Å²	133	82%	0.815	71%	0.712	S	S	*	*			trans	-65.3	91.8	-176.2	-168.6	-177.1	-169.6	-160	3.8	110.8	E48 T52	E48-R50 VanDerWaalsContact C-N 3.26Å; E48-R50 PolarHBondContact O-N 2.9Å; R50-T52 HydrophobicContact CG-CG2 4.46Å; R50-T52 PolarHBondContact O-N 3.08Å
51	L	23.4	Very low	25.6	Very low	136 Å²	136	133.8 Å²	133.8	71%	0.712	72%	0.724	S	S	*	*			trans	-56.1	97.7	176.9	-78	109.9	0	0	0	111.6	H49 T53	H49-L51 PolarHBondContact O-N 2.9Å; L51-T53 VanDerWaalsContact C-N 3.26Å; L51-T53 PolarHBondContact O-N 2.65Å
52	T	23.4	Very low	25.4	Very low	117 Å²	117	134.8 Å²	134.8	72%	0.718	74%	0.74	S	S	*	*			trans	-89.3	34.9	-176.3	34.9	0	0	0	0	113.6	R50	R50-T52 HydrophobicContact CG-CG2 4.46Å; R50-T52 PolarHBondContact O-N 3.08Å
53	T	24.6	Very low	25.2	Very low	118 Å²	118	142.7 Å²	142.7	72%	0.724	76%	0.76	S	S	*	*	S	Bend	trans	-166.1	156	154.9	11.9	0	0	0	0	109.9	L51 I55	L51-T53 VanDerWaalsContact C-N 3.26Å; L51-T53 PolarHBondContact O-N 2.65Å; T53-I55 PolarHBondContact O-N 2.87Å
54	P	29.9	Very low	24.9	Very low	118 Å²	118	147.6 Å²	147.6	77%	0.766	77%	0.766	S	S	*	*			trans	-78.6	93.4	-164.1	30.3	-35.2	0	0	0	113.8	Q56	P54-Q56 PolarHBondContact O-N 2.97Å
55	I	25.6	Very low	24.7	Very low	126 Å²	126	152.3 Å²	152.3	65%	0.646	77%	0.766	S	S	*	*			trans	28.3	75.9	148.7	-41	177.4	0	0	0	115	T53 K57	T53-I55 PolarHBondContact O-N 2.87Å; I55-K57 HydrophobicContact CG2-CG 4.3Å
56	Q	22.3	Very low	24.7	Very low	161 Å²	161	153.8 Å²	153.8	75%	0.752	78%	0.778	S	S	*	*			trans	-73.4	126.5	145	-70.3	-163.2	1.1	0	0	107.5	P54 F58	P54-Q56 PolarHBondContact O-N 2.97Å; Q56-F58 VanDerWaalsContact O-CD2 3.31Å; Q56-F58 WeakPolarHBondContact O-CD2 3.28Å; Q56-F58 PolarHBondContact O-N 2.96Å
57	K	24	Very low	24.4	Very low	191 Å²	191	152.1 Å²	152.1	83%	0.83	77%	0.765	S	S	*	*			trans	-73	100.1	-179.3	-69	179.9	179.5	-178.7	0	108.9	I55 T59	I55-K57 HydrophobicContact CG2-CG 4.3Å; K57-T59 PolarHBondContact O-N 2.97Å
58	F	23.7	Very low	24.3	Very low	196 Å²	196	156.6 Å²	156.6	86%	0.86	78%	0.779	S	S	*	*			trans	-66.7	98.4	174.7	-68.6	-80.3	0	0	0	110.3	Q56 A60	Q56-F58 VanDerWaalsContact O-CD2 3.31Å; Q56-F58 WeakPolarHBondContact O-CD2 3.28Å; Q56-F58 PolarHBondContact O-N 2.96Å; F58-A60 PolarHBondContact O-N 2.71Å
59	T	24	Very low	24.3	Very low	123 Å²	123	153.2 Å²	153.2	76%	0.755	77%	0.774	S	S	*	*			trans	-61.8	130.9	164.3	-53.8	0	0	0	0	108.3	K57 S61	K57-T59 PolarHBondContact O-N 2.97Å; T59-S61 VanDerWaalsContact C-N 3.33Å; T59-S61 PolarHBondContact O-N 3.49Å
60	A	24.7	Very low	24.2	Very low	106 Å²	106	149.6 Å²	149.6	88%	0.876	76%	0.763	S	S	*	*	S	Bend	trans	-73.2	77.1	-169.7	0	0	0	0	0	113.5	F58	F58-A60 PolarHBondContact O-N 2.71Å
61	S	25.5	Very low	24.3	Very low	98 Å²	98	145.5 Å²	145.5	69%	0.685	76%	0.762	S	S	*	*			trans	-162.2	115	166.9	60.7	0	0	0	0	113.2	T59	T59-S61 VanDerWaalsContact C-N 3.33Å; T59-S61 PolarHBondContact O-N 3.49Å
62	S	24.1	Very low	24.3	Very low	120 Å²	120	146.6 Å²	146.6	84%	0.839	76%	0.763	S	S	*	*				-169.4	154.7	119.8	47	0	0	0	0	112.1
63	R	23	Very low	24.2	Very low	239 Å²	239	150.1 Å²	150.1	90%	0.902	77%	0.772	S	S	*	*			trans	-60.9	139	-176.5	-160	-178.8	-160	157.9	1.5	111.7
64	W	23.4	Very low	24.2	Very low	224 Å²	224	154.3 Å²	154.3	85%	0.848	77%	0.774	S	S	*	*			trans	-72.5	150.8	166.3	-60.3	87	0	0	0	110.2
65	E	23	Very low	23.8	Very low	180 Å²	180	156.3 Å²	156.3	84%	0.841	78%	0.777	S	S	*	*			trans	-117.5	132.8	171.2	-67.6	-173.1	150.4	0	0	109.4
66	D	25.4	Very low	23.6	Very low	152 Å²	152	157.7 Å²	157.7	81%	0.813	78%	0.781	S	S	*	*			trans	-69.9	135.5	-175	-54.1	-58.2	0	0	0	111
67	R	22.4	Very low	23.7	Very low	138 Å²	138	157.4 Å²	157.4	52%	0.521	78%	0.784	S	S	.	*			trans	-124.8	139.6	175.5	-73.6	-173.6	168.4	-143	6.7	110.3	E175 T176	R67-E175 IonicContact CZ-OE1 3.79Å; R67-E175 IonicContact NH1-OE1 2.65Å; R67-E175 PolarHBondContact NH1-OE1 3.38Å; R67-E175 IonicContact NH1-OE2 3.48Å; R67-E175 PolarHBondContact NH1-OE2 3.06Å; R67-T176 PolarHBondContact NH1-OG1 3.05Å; R67-T176 PolarHBondContact NH2-OG1 3.36Å; R67-T176 VanDerWaalsContact NH2-OG1 3.15Å
68	E	24.4	Very low	23.6	Very low	180 Å²	180	157.8 Å²	157.8	84%	0.841	79%	0.789	S	S	*	*			trans	-63.9	141.8	-173.6	-62.1	-177.9	140.8	0	0	111.9
69	P	26	Very low	23.6	Very low	115 Å²	115	150.5 Å²	150.5	75%	0.747	77%	0.769	S	S	*	*			trans	-71.8	133.2	-175.9	28.6	-34.5	0	0	0	111.7	T71	P69-T71 PolarHBondContact O-N 2.76Å
70	V	23.6	Very low	23.5	Very low	87 Å²	87	150.6 Å²	150.6	53%	0.527	77%	0.769	S	S	.	*			trans	-75.2	108.7	171.1	179.6	0	0	0	0	108.3	H72 K174	V70-H72 PolarHBondContact O-N 2.93Å; V70-H72 PolarHBondContact O-ND1 3.45Å; V70-K174 HydrophobicContact CG2-CD 4.08Å
71	T	23.6	Very low	23.5	Very low	130 Å²	130	151.7 Å²	151.7	80%	0.798	77%	0.767	S	S	*	*			trans	-70.8	108.7	177.7	53.7	0	0	0	0	110.1	P69	P69-T71 PolarHBondContact O-N 2.76Å
72	H	24.3	Very low	23.6	Very low	159 Å²	159	156.1 Å²	156.1	74%	0.736	78%	0.775	S	S	*	*			trans	-70.1	148.7	174.2	-66.2	96.2	0	0	0	111	V70 R74	V70-H72 PolarHBondContact O-N 2.93Å; V70-H72 PolarHBondContact O-ND1 3.45Å; H72-R74 PolarHBondContact O-N 2.97Å
73	E	22	Very low	23.6	Very low	192 Å²	192	155 Å²	155	90%	0.897	77%	0.773	S	S	*	*			trans	-70.7	128.2	-171.2	-162.4	162.8	-143.4	0	0	111	L75	E73-L75 PolarHBondContact O-N 2.99Å
74	R	23.4	Very low	23.7	Very low	206 Å²	206	149.2 Å²	149.2	78%	0.777	76%	0.764	S	S	*	*			trans	-60.9	103.6	-170.4	-178.4	-166.6	-170.8	101.9	-0.6	111.2	H72 E76	H72-R74 PolarHBondContact O-N 2.97Å; R74-E76 HydrophobicContact CG-CG 4.32Å; R74-E76 PolarHBondContact O-N 3.06Å
75	L	21.9	Very low	23.8	Very low	159 Å²	159	144.9 Å²	144.9	83%	0.832	77%	0.765	S	S	*	*			trans	-65.1	104.2	165.6	-85.3	168.6	0	0	0	109.3	E73 L77	E73-L75 PolarHBondContact O-N 2.99Å; L75-L77 PolarHBondContact O-N 2.81Å
76	E	20.8	Very low	23.8	Very low	155 Å²	155	141.5 Å²	141.5	72%	0.724	76%	0.756	S	S	*	*			trans	-73.7	91.2	180	-60.8	-163.3	127.6	0	0	110.9	R74 E78	R74-E76 HydrophobicContact CG-CG 4.32Å; R74-E76 PolarHBondContact O-N 3.06Å; E76-E78 VanDerWaalsContact C-N 3.31Å; E76-E78 PolarHBondContact O-N 2.96Å
77	L	24.1	Very low	23.7	Very low	155 Å²	155	142.8 Å²	142.8	81%	0.812	76%	0.757	S	S	*	*			trans	-67.6	92.3	161.8	-91	72.6	0	0	0	109.1	L75 G79	L75-L77 PolarHBondContact O-N 2.81Å; L77-G79 PolarHBondContact O-N 2.84Å
78	E	22.4	Very low	23.7	Very low	200 Å²	200	145.4 Å²	145.4	94%	0.935	78%	0.778	S	S	*	*			trans	-62	83.8	161.7	-73.2	-159.7	125.5	0	0	109.6	E76	E76-E78 VanDerWaalsContact C-N 3.31Å; E76-E78 PolarHBondContact O-N 2.96Å
79	G	22.9	Very low	23.6	Very low	42 Å²	42	143.8 Å²	143.8	43%	0.433	78%	0.78	S	S	.	*	S	Bend	trans	-166.1	57.6	-165.7	0	0	0	0	0	116.5	L77	L77-G79 PolarHBondContact O-N 2.84Å
80	T	23.5	Very low	23.4	Very low	125 Å²	125	141 Å²	141	77%	0.767	77%	0.772	S	S	*	*			trans	63.7	142.5	170.6	54.2	0	0	0	0	117.9	F82	T80-F82 PolarHBondContact O-N 3.03Å
81	P	24.8	Very low	23.3	Very low	129 Å²	129	144.3 Å²	144.3	84%	0.838	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-75.9	116.7	179.7	30.3	-33.5	0	0	0	111.4
82	F	26.6	Very low	23.3	Very low	192 Å²	192	147.9 Å²	147.9	84%	0.842	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-63.5	142.3	168.9	-80.7	-102.5	0	0	0	110.8	T80	T80-F82 PolarHBondContact O-N 3.03Å
83	A	23.9	Very low	23.3	Very low	96 Å²	96	148 Å²	148	79%	0.793	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-67.1	142.5	-175.1	0	0	0	0	0	112.1
84	T	25	Very low	23.6	Very low	118 Å²	118	144.6 Å²	144.6	72%	0.724	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-55.1	124	-172.5	-45.5	0	0	0	0	112.6	T86	T84-T86 VanDerWaalsContact C-N 3.31Å; T84-T86 PolarHBondContact O-N 2.74Å
85	P	25.8	Very low	23.7	Very low	133 Å²	133	141.9 Å²	141.9	86%	0.864	78%	0.782	S	S	*	*			trans	-74.3	82.4	179.4	30.7	-35.3	0	0	0	111.2
86	T	23.1	Very low	23.8	Very low	108 Å²	108	139.7 Å²	139.7	66%	0.663	78%	0.776	S	S	*	*			trans	-112.2	128.9	168.7	-48.2	0	0	0	0	108	T84	T84-T86 VanDerWaalsContact C-N 3.31Å; T84-T86 PolarHBondContact O-N 2.74Å
87	Q	24	Very low	24	Very low	179 Å²	179	136.9 Å²	136.9	84%	0.836	78%	0.779	S	S	*	*			trans	82.1	74.8	-175.3	-49.4	171.9	49.7	0	0	116.4
88	M	22	Very low	23.9	Very low	194 Å²	194	136.8 Å²	136.8	96%	0.956	78%	0.778	S	S	*	*			trans	-138.8	75.4	136.7	-77.2	-148.4	-169.8	0	0	110
89	V	21.6	Very low	23.8	Very low	146 Å²	146	135.5 Å²	135.5	89%	0.885	77%	0.772	S	S	*	*			trans	-97.5	81.4	169.7	-177.7	0	0	0	0	107.9
90	G	22.1	Very low	23.8	Very low	56 Å²	56	139.5 Å²	139.5	58%	0.577	79%	0.787	S	S	*	*			trans	-100.6	97	176.1	0	0	0	0	0	111	F92	G90-F92 PolarHBondContact O-N 3.46Å
91	Q	22.2	Very low	23.6	Very low	156 Å²	156	140 Å²	140	73%	0.729	79%	0.79	S	S	*	*			trans	-74.6	92.5	-179.4	-178.2	175.5	-8.2	0	0	110.9	E93	Q91-E93 HydrophobicContact CG-CG 4.25Å; Q91-E93 PolarHBondContact NE2-OE1 2.85Å; Q91-E93 PolarHBondContact O-N 3.33Å
92	F	22.9	Very low	23.5	Very low	206 Å²	206	141.9 Å²	141.9	90%	0.904	79%	0.787	S	S	*	*			trans	-84.8	93	174.4	-87.6	-87.3	0	0	0	111.5	G90	G90-F92 PolarHBondContact O-N 3.46Å
93	E	25.1	Very low	23.4	Very low	160 Å²	160	140 Å²	140	75%	0.748	78%	0.781	S	S	*	*			trans	-99.6	89.9	167.3	-74.1	178.8	-167.7	0	0	110.8	Q91	Q91-E93 HydrophobicContact CG-CG 4.25Å; Q91-E93 PolarHBondContact NE2-OE1 2.85Å; Q91-E93 PolarHBondContact O-N 3.33Å
94	D	26.7	Very low	23.4	Very low	122 Å²	122	144.6 Å²	144.6	65%	0.652	78%	0.783	S	S	*	*			trans	-150.1	105.5	154.4	-159.9	-39.8	0	0	0	110.7	T96	D94-T96 PolarHBondContact O-N 2.96Å; D94-T96 WeakPolarHBondContact OD1-CG2 3.47Å; D94-T96 PolarHBondContact OD1-N 3.46Å; D94-T96 PolarHBondContact OD1-OG1 2.75Å
95	T	27.3	Very low	23.3	Very low	149 Å²	149	147.2 Å²	147.2	91%	0.914	79%	0.785	S	S	*	*			trans	-98.8	68.9	178.1	56.9	0	0	0	0	111
96	T	24.1	Very low	23.4	Very low	113 Å²	113	147.6 Å²	147.6	69%	0.693	78%	0.779	S	S	*	*			trans	-91.4	116.5	175.3	19.6	0	0	0	0	111.3	D94	D94-T96 PolarHBondContact O-N 2.96Å; D94-T96 WeakPolarHBondContact OD1-CG2 3.47Å; D94-T96 PolarHBondContact OD1-N 3.46Å; D94-T96 PolarHBondContact OD1-OG1 2.75Å
97	A	23	Very low	23.4	Very low	96 Å²	96	148.6 Å²	148.6	79%	0.793	79%	0.785	S	S	*	*			trans	-73.7	128.3	-173.2	0	0	0	0	0	112.7	Q99	A97-Q99 PolarHBondContact O-N 3.36Å
98	I	23.3	Very low	23.4	Very low	153 Å²	153	145.5 Å²	145.5	79%	0.785	78%	0.779	S	S	*	*			trans	-66.3	114.8	177.3	-59	173.9	0	0	0	109.6
99	Q	20.5	Very low	23.4	Very low	173 Å²	173	142.6 Å²	142.6	81%	0.808	78%	0.775	S	S	*	*			trans	-78.3	120.2	170.7	-67.7	-172.5	-2.4	0	0	109.8	A97 V101	A97-Q99 PolarHBondContact O-N 3.36Å; Q99-V101 PolarHBondContact O-N 3.02Å; Q99-V101 VanDerWaalsContact O-N 3.08Å
100	V	22.2	Very low	23.4	Very low	125 Å²	125	140.1 Å²	140.1	76%	0.758	76%	0.76	S	S	*	*			trans	-72.5	99.8	172.9	-179.5	0	0	0	0	108.5	H102	V100-H102 PolarHBondContact O-N 3.26Å
101	V	20.5	Very low	23.4	Very low	136 Å²	136	143.1 Å²	143.1	82%	0.824	77%	0.767	S	S	*	*			trans	-72.7	120.8	177.4	-178.3	0	0	0	0	109.2	Q99	Q99-V101 PolarHBondContact O-N 3.02Å; Q99-V101 VanDerWaalsContact O-N 3.08Å
102	H	22.3	Very low	23.4	Very low	169 Å²	169	144.3 Å²	144.3	78%	0.782	77%	0.771	S	S	*	*			trans	-88.1	175.3	-176.8	-118.4	-91.7	0	0	0	112.7	V100	V100-H102 PolarHBondContact O-N 3.26Å
103	E	23.5	Very low	23.4	Very low	153 Å²	153	139.3 Å²	139.3	72%	0.715	76%	0.757	S	S	*	*			trans	81.3	82.5	163.3	-154.8	172	169.3	0	0	116.6
104	F	25.1	Very low	23.3	Very low	191 Å²	191	137.1 Å²	137.1	84%	0.838	76%	0.759	S	S	*	*			trans	-54.6	135.7	156.7	-68.8	-104.7	0	0	0	110.7
105	K	23	Very low	23.2	Very low	173 Å²	173	139.1 Å²	139.1	75%	0.752	76%	0.764	S	S	*	*			trans	-147.5	146.7	166.3	-153.1	162.1	-165.3	154.5	0	111.2
106	D	26.3	Very low	23.1	Very low	141 Å²	141	137.6 Å²	137.6	75%	0.754	75%	0.754	S	S	*	*			trans	-58.3	158.2	-158.2	-57.2	-84.4	0	0	0	117.4
107	T	24	Very low	23.1	Very low	129 Å²	129	135 Å²	135	79%	0.791	75%	0.749	S	S	*	*	S	Bend	trans	86.9	135.5	161.7	71.8	0	0	0	0	119
108	T	23.4	Very low	23.2	Very low	115 Å²	115	135.4 Å²	135.4	71%	0.706	75%	0.753	S	S	*	*			trans	58.8	123.3	-178.6	48.7	0	0	0	0	116.7	T110	T108-T110 VanDerWaalsContact C-N 3.33Å; T108-T110 PolarHBondContact O-N 3.42Å
109	P	23.1	Very low	23.5	Very low	132 Å²	132	133.3 Å²	133.3	86%	0.857	75%	0.752	S	S	*	*			trans	-75.8	84.5	173.4	32	-34	0	0	0	110.3	T111	P109-T111 PolarHBondContact O-N 3.02Å
110	T	21.1	Very low	24.1	Very low	94 Å²	94	127.4 Å²	127.4	58%	0.577	73%	0.732	S	S	*	*			trans	-72.2	117.9	160.6	27.5	0	0	0	0	108.8	T108 F112	T108-T110 VanDerWaalsContact C-N 3.33Å; T108-T110 PolarHBondContact O-N 3.42Å; T110-F112 WeakPolarHBondContact O-CD2 3.37Å; T110-F112 PolarHBondContact O-N 2.89Å; T110-F112 VanDerWaalsContact O-N 3.09Å; T110-F112 WeakPolarHBondContact OG1-CE2 3.46Å
111	T	22.7	Very low	24.8	Very low	120 Å²	120	127 Å²	127	74%	0.736	74%	0.735	S	S	*	*			trans	-69.3	104.2	-172.6	-42.7	0	0	0	0	111.6	P109	P109-T111 PolarHBondContact O-N 3.02Å
112	F	21	Very low	25.8	Very low	181 Å²	181	122.7 Å²	122.7	79%	0.794	72%	0.719	S	S	*	*			trans	-100.2	108.7	171.9	-67.7	-72.6	0	0	0	110.4	T110 S114	T110-F112 WeakPolarHBondContact O-CD2 3.37Å; T110-F112 PolarHBondContact O-N 2.89Å; T110-F112 VanDerWaalsContact O-N 3.09Å; T110-F112 WeakPolarHBondContact OG1-CE2 3.46Å; F112-S114 PolarHBondContact O-N 2.59Å
113	V	22.6	Very low	27	Very low	101 Å²	101	117.7 Å²	117.7	61%	0.612	71%	0.707	S	S	*	*			trans	-71.2	120.4	175	178.5	0	0	0	0	108.6	H115	V113-H115 PolarHBondContact O-N 2.75Å
114	S	24.2	Very low	28.1	Very low	113 Å²	113	113.8 Å²	113.8	79%	0.79	69%	0.688	S	S	*	*			trans	-69.1	103.2	171.1	-170.9	0	0	0	0	109.1	F112 V116	F112-S114 PolarHBondContact O-N 2.59Å; S114-V116 PolarHBondContact O-N 3.25Å; S114-V116 VanDerWaalsContact O-N 3.08Å
115	H	23.2	Very low	29.4	Very low	164 Å²	164	108.8 Å²	108.8	76%	0.759	67%	0.673	S	S	*	*			trans	-70.5	103.6	179.6	-61	-58.8	0	0	0	110.1	V113 G117	V113-H115 PolarHBondContact O-N 2.75Å; H115-G117 PolarHBondContact O-N 3.35Å
116	V	26.2	Very low	30.7	Very low	118 Å²	118	103.3 Å²	103.3	72%	0.715	65%	0.648	S	S	*	*			trans	-54	135	167.7	-177.5	0	0	0	0	108.7	S114 A118	S114-V116 PolarHBondContact O-N 3.25Å; S114-V116 VanDerWaalsContact O-N 3.08Å; V116-A118 PolarHBondContact O-N 2.66Å
117	G	23	Very low	31.8	Very low	57 Å²	57	100.2 Å²	100.2	59%	0.588	63%	0.631	S	S	*	*	S	Bend	trans	-57.4	119.7	-156.6	0	0	0	0	0	115.9	H115 S119	H115-G117 PolarHBondContact O-N 3.35Å; G117-S119 PolarHBondContact O-N 3.1Å
118	A	26.7	Very low	33	Very low	105 Å²	105	94.6 Å²	94.6	87%	0.868	60%	0.597	S	S	*	*	S	Bend	trans	27.5	72.7	150.1	0	0	0	0	0	118.2	V116	V116-A118 PolarHBondContact O-N 2.66Å
119	S	28.8	Very low	34.3	Very low	110 Å²	110	92.3 Å²	92.3	77%	0.769	59%	0.585	S	S	*	*			trans	177.7	-18.9	145.1	44.1	0	0	0	0	113.8	G117 S121	G117-S119 PolarHBondContact O-N 3.1Å; S119-S121 PolarHBondContact O-N 3.02Å
120	A	33.2	Very low	35.7	Very low	48 Å²	48	89.7 Å²	89.7	40%	0.397	57%	0.57	S	S	.	*			trans	-67.3	76.7	176.5	0	0	0	0	0	112.2	G122 I145	A120-G122 PolarHBondContact O-N 2.94Å; A120-I145 HydrophobicContact CB-CB 4.43Å; A120-I145 HydrophobicContact CB-CG2 4.01Å
121	S	36.5	Very low	37	Very low	117 Å²	117	87.5 Å²	87.5	82%	0.818	56%	0.555	S	S	*	*			trans	-73.5	89.8	-175.2	58.3	0	0	0	0	111.8	S119	S119-S121 PolarHBondContact O-N 3.02Å
122	G	41	Very low	38.3	Very low	46 Å²	46	89.5 Å²	89.5	47%	0.474	56%	0.561	S	S	.	*			trans	113.1	62.2	171.5	0	0	0	0	0	113.4	W34 A120 E124	W34-G122 WeakPolarHBondContact CH2-O 3.37Å; W34-G122 WeakPolarHBondContact CZ3-O 3.47Å; A120-G122 PolarHBondContact O-N 2.94Å; G122-E124 PolarHBondContact O-N 2.85Å
123	A	47.6	Very low	39.6	Very low	64 Å²	64	86.3 Å²	86.3	53%	0.529	55%	0.547	S	S	.	.			trans	-62.7	130.6	167.9	0	0	0	0	0	110.7	Y144 I145	A123-Y144 CarbonylContact C-O 3.35Å; A123-Y144 WeakPolarHBondContact CA-O 3.49Å; A123-I145 HydrophobicContact CB-CG2 3.76Å
124	E	48.1	Very low	40.8	Very low	71 Å²	71	81.9 Å²	81.9	33%	0.332	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	130.2	178.9	-167.7	-164.2	142.7	0	0	109.4	W34 G122 R126 A143 Y144	W34-E124 HydrophobicContact CE3-CB 4.2Å; W34-E124 HydrophobicContact CH2-CB 4.5Å; W34-E124 HydrophobicContact CZ3-CB 3.99Å; G122-E124 PolarHBondContact O-N 2.85Å; E124-R126 HydrophobicContact CG-CG 4.4Å; E124-R126 WeakPolarHBondContact OE1-CG 3.35Å; E124-R126 IonicContact OE1-CZ 3.56Å; E124-R126 IonicContact OE1-NE 2.76Å; E124-R126 PolarHBondContact OE1-NE 2.93Å; E124-R126 IonicContact OE1-NH2 3.49Å; E124-R126 PolarHBondContact OE1-NH2 2.94Å; E124-R126 IonicContact OE2-CZ 3.42Å; E124-R126 IonicContact OE2-NE 3.36Å; E124-R126 PolarHBondContact OE2-NE 3.38Å; E124-R126 IonicContact OE2-NH2 2.71Å; E124-R126 PolarHBondContact OE2-NH2 2.88Å; E124-A143 CarbonylContact O-C 2.83Å; E124-Y144 PolarHBondContact N-O 3.39Å; E124-Y144 PolarHBondContact O-N 3.04Å
125	V	51.4	Low	42.2	Very low	86 Å²	86	79.3 Å²	79.3	52%	0.521	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	122.9	175	-178.1	0	0	0	0	109.4	E141 I142	V125-E141 HydrophobicContact CG1-CB 3.8Å; V125-E141 HydrophobicContact CG1-CG 4.13Å; V125-I142 WeakPolarHBondContact CA-O 3.48Å
126	R	50.1	Low	43.3	Very low	57 Å²	57	78 Å²	78	22%	0.215	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	162.3	178.8	-62.9	-176.7	177.2	160.7	8.3	110.3	E124 I142 Y144	E124-R126 HydrophobicContact CG-CG 4.4Å; E124-R126 WeakPolarHBondContact OE1-CG 3.35Å; E124-R126 IonicContact OE1-CZ 3.56Å; E124-R126 IonicContact OE1-NE 2.76Å; E124-R126 PolarHBondContact OE1-NE 2.93Å; E124-R126 IonicContact OE1-NH2 3.49Å; E124-R126 PolarHBondContact OE1-NH2 2.94Å; E124-R126 IonicContact OE2-CZ 3.42Å; E124-R126 IonicContact OE2-NE 3.36Å; E124-R126 PolarHBondContact OE2-NE 3.38Å; E124-R126 IonicContact OE2-NH2 2.71Å; E124-R126 PolarHBondContact OE2-NH2 2.88Å; R126-I142 PolarHBondContact N-O 3.09Å; R126-I142 PolarHBondContact O-N 3.08Å; R126-Y144 HydrophobicContact CB-CD2 3.94Å; R126-Y144 HydrophobicContact CB-CE2 3.75Å; R126-Y144 HydrophobicContact CG-CD2 3.98Å; R126-Y144 HydrophobicContact CG-CE2 4.18Å
127	L	50.2	Low	44.4	Very low	76 Å²	76	78.6 Å²	78.6	40%	0.398	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	142.8	173.1	-68.5	172.9	0	0	0	110.5	S129 S130 E141	L127-S129 PolarHBondContact O-N 2.7Å; L127-S129 VanDerWaalsContact O-N 3.11Å; L127-S130 PolarHBondContact N-OG 2.77Å; L127-S130 PolarHBondContact O-N 3.43Å; L127-S130 PolarHBondContact O-OG 3.48Å; L127-E141 HydrophobicContact CD2-CG 4.05Å
128	T	49.2	Very low	45.5	Very low	12 Å²	12	84.7 Å²	84.7	7%	0.074	50%	0.503	C	S	.	.	G	3₁₀ helix	trans	-37.2	-45.8	162	38.7	0	0	0	0	113	S130 D131 Y134 A135 Q139 G140 I142	T128-S130 PolarHBondContact O-N 3.21Å; T128-D131 PolarHBondContact O-N 2.96Å; T128-Y134 CarbonylContact O-C 3.46Å; T128-Y134 WeakPolarHBondContact O-CB 3.16Å; T128-A135 PolarHBondContact O-N 2.84Å; T128-Q139 WeakPolarHBondContact OG1-CA 3.26Å; T128-G140 WeakPolarHBondContact CB-O 3.49Å; T128-G140 WeakPolarHBondContact CG2-O 3.11Å; T128-G140 PolarHBondContact N-O 2.86Å; T128-G140 PolarHBondContact OG1-N 3.27Å; T128-G140 PolarHBondContact OG1-O 3.21Å; T128-I142 HydrophobicContact CG2-CD1 3.81Å; T128-I142 HydrophobicContact CG2-CG1 4.01Å
129	S	50.5	Low	46.7	Very low	66 Å²	66	86.6 Å²	86.6	46%	0.462	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-76.7	6.9	-179.4	65	0	0	0	0	115.6	L127 Q139	L127-S129 PolarHBondContact O-N 2.7Å; L127-S129 VanDerWaalsContact O-N 3.11Å; S129-Q139 PolarHBondContact OG-NE2 3.36Å
130	S	52.6	Low	47.9	Very low	77 Å²	77	82.9 Å²	82.9	54%	0.538	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-107.6	2.2	173.7	61.8	0	0	0	0	114	L127 T128	L127-S130 PolarHBondContact N-OG 2.77Å; L127-S130 PolarHBondContact O-N 3.43Å; L127-S130 PolarHBondContact O-OG 3.48Å; T128-S130 PolarHBondContact O-N 3.21Å
131	D	49.1	Very low	48.7	Very low	49 Å²	49	87 Å²	87	26%	0.262	48%	0.484	S	S	.	.	S	Bend	trans	-130	123.9	174.9	-176.8	-51	0	0	0	108.4	T128 F133 Y134 A135 Y144	T128-D131 PolarHBondContact O-N 2.96Å; D131-F133 PolarHBondContact O-N 3.21Å; D131-F133 VanDerWaalsContact O-N 3.15Å; D131-F133 VanDerWaalsContact OD1-CB 3.29Å; D131-F133 WeakPolarHBondContact OD1-CB 3.42Å; D131-F133 PolarHBondContact OD1-N 3.42Å; D131-Y134 HydrophobicContact CB-CD2 3.93Å; D131-Y134 PolarHBondContact O-N 3.44Å; D131-A135 PolarHBondContact O-N 2.59Å; D131-Y144 WeakPolarHBondContact CB-OH 3.36Å; D131-Y144 PolarHBondContact OD2-OH 3.16Å; D131-Y144 VanDerWaalsContact OD2-OH 3.08Å
132	D	49.5	Very low	49.4	Very low	161 Å²	161	81.9 Å²	81.9	86%	0.861	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-25.8	-174.1	-70.7	-31.4	0	0	0	113.3
133	F	47	Very low	49.7	Very low	115 Å²	115	81.7 Å²	81.7	50%	0.504	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-36	175.9	-177.9	-92.9	0	0	0	111.7	D131 Q136	D131-F133 PolarHBondContact O-N 3.21Å; D131-F133 VanDerWaalsContact O-N 3.15Å; D131-F133 VanDerWaalsContact OD1-CB 3.29Å; D131-F133 WeakPolarHBondContact OD1-CB 3.42Å; D131-F133 PolarHBondContact OD1-N 3.42Å; F133-Q136 PolarHBondContact O-NE2 3.3Å
134	Y	48.8	Very low	49.7	Very low	8 Å²	8	78.8 Å²	78.8	3%	0.031	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-12.6	-177.5	-62.8	-65.3	0	0	0	114.3	P36 Y38 L40 T128 D131 Q136 Y137 I142	P36-Y134 HydrophobicContact CB-CE2 4.2Å; P36-Y134 HydrophobicContact CG-CE2 4.01Å; P36-Y134 VanDerWaalsContact CG-OH 3.28Å; P36-Y134 WeakPolarHBondContact CG-OH 3.5Å; Y38-Y134 PolarHBondContact OH-OH 3.02Å; L40-Y134 HydrophobicContact CD1-CD1 4.37Å; L40-Y134 HydrophobicContact CD1-CE1 3.64Å; L40-Y134 HydrophobicContact CD2-CE1 4.25Å; T128-Y134 CarbonylContact O-C 3.46Å; T128-Y134 WeakPolarHBondContact O-CB 3.16Å; D131-Y134 HydrophobicContact CB-CD2 3.93Å; D131-Y134 PolarHBondContact O-N 3.44Å; Y134-Q136 PolarHBondContact O-N 3.27Å; Y134-Y137 HydrophobicContact CD1-CD2 4.04Å; Y134-Y137 AromaticContact CD1-CE2 3.97Å; Y134-Y137 HydrophobicContact CD1-CE2 3.97Å; Y134-Y137 WeakPolarHBondContact O-CD2 3.4Å; Y134-Y137 PolarHBondContact O-N 3.12Å; Y134-I142 HydrophobicContact CD1-CD1 3.76Å; Y134-I142 HydrophobicContact CD2-CD1 3.43Å; Y134-I142 VanDerWaalsContact CD2-CD1 3.43Å; Y134-I142 HydrophobicContact CE1-CD1 4.25Å; Y134-I142 HydrophobicContact CE2-CD1 3.92Å; Y134-I142 HydrophobicContact CG-CD1 3.32Å
135	A	52.5	Low	49.7	Very low	58 Å²	58	76.4 Å²	76.4	48%	0.479	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-9.9	178.5	0	0	0	0	0	115.1	T128 D131	T128-A135 PolarHBondContact O-N 2.84Å; D131-A135 PolarHBondContact O-N 2.59Å
136	Q	47.6	Very low	49.3	Very low	138 Å²	138	75 Å²	75	65%	0.645	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-14.6	174.5	69.3	-174	-57.1	0	0	114.7	F133 Y134	F133-Q136 PolarHBondContact O-NE2 3.3Å; Y134-Q136 PolarHBondContact O-N 3.27Å
137	Y	48.1	Very low	49.1	Very low	129 Å²	129	73.1 Å²	73.1	51%	0.506	39%	0.394	S	S	.	.	S	Bend	trans	-93.4	169.3	-177.8	-60	-72.7	0	0	0	112.1	Y134	Y134-Y137 HydrophobicContact CD1-CD2 4.04Å; Y134-Y137 AromaticContact CD1-CE2 3.97Å; Y134-Y137 HydrophobicContact CD1-CE2 3.97Å; Y134-Y137 WeakPolarHBondContact O-CD2 3.4Å; Y134-Y137 PolarHBondContact O-N 3.12Å
138	E	47.3	Very low	48.6	Very low	186 Å²	186	72.1 Å²	72.1	87%	0.869	39%	0.394	S	S	*	.			trans	-61.4	146.8	170.8	-65.6	-167.3	155.6	0	0	111	G140	E138-G140 PolarHBondContact O-N 3.43Å
139	Q	52.2	Low	48	Very low	145 Å²	145	73.7 Å²	73.7	68%	0.678	41%	0.412	S	S	*	.	S	Bend	trans	-72.9	94.7	-166.8	-166.9	174.1	32.8	0	0	112.5	T128 S129	T128-Q139 WeakPolarHBondContact OG1-CA 3.26Å; S129-Q139 PolarHBondContact OG-NE2 3.36Å
140	G	53.5	Low	47.4	Very low	32 Å²	32	75.4 Å²	75.4	33%	0.33	42%	0.419	S	S	.	.			trans	-117.9	-179.7	172.9	0	0	0	0	0	114.1	T128 E138	T128-G140 WeakPolarHBondContact CB-O 3.49Å; T128-G140 WeakPolarHBondContact CG2-O 3.11Å; T128-G140 PolarHBondContact N-O 2.86Å; T128-G140 PolarHBondContact OG1-N 3.27Å; T128-G140 PolarHBondContact OG1-O 3.21Å; E138-G140 PolarHBondContact O-N 3.43Å
141	E	50.2	Low	46.7	Very low	135 Å²	135	78.9 Å²	78.9	63%	0.631	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.7	146.6	174.1	-70.5	177	-179.2	0	0	111.3	V125 L127	V125-E141 HydrophobicContact CG1-CB 3.8Å; V125-E141 HydrophobicContact CG1-CG 4.13Å; L127-E141 HydrophobicContact CD2-CG 4.05Å
142	I	49.8	Very low	46.2	Very low	9 Å²	9	81.4 Å²	81.4	5%	0.046	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	127.2	178	-58.4	178.2	0	0	0	107.9	P36 L40 V125 R126 T128 Y134 Y144	P36-I142 HydrophobicContact CB-CG2 3.78Å; L40-I142 HydrophobicContact CD2-CD1 4.37Å; L40-I142 HydrophobicContact CD2-CG1 4.32Å; L40-I142 HydrophobicContact CD2-CG2 4.17Å; V125-I142 WeakPolarHBondContact CA-O 3.48Å; R126-I142 PolarHBondContact N-O 3.09Å; R126-I142 PolarHBondContact O-N 3.08Å; T128-I142 HydrophobicContact CG2-CD1 3.81Å; T128-I142 HydrophobicContact CG2-CG1 4.01Å; Y134-I142 HydrophobicContact CD1-CD1 3.76Å; Y134-I142 HydrophobicContact CD2-CD1 3.43Å; Y134-I142 VanDerWaalsContact CD2-CD1 3.43Å; Y134-I142 HydrophobicContact CE1-CD1 4.25Å; Y134-I142 HydrophobicContact CE2-CD1 3.92Å; Y134-I142 HydrophobicContact CG-CD1 3.32Å; I142-Y144 HydrophobicContact CB-CD2 4.47Å; I142-Y144 HydrophobicContact CB-CE2 3.83Å; I142-Y144 HydrophobicContact CG2-CD2 4.03Å; I142-Y144 HydrophobicContact CG2-CE2 3.5Å; I142-Y144 VanDerWaalsContact CG2-CE2 3.5Å
143	A	48.2	Very low	45.3	Very low	41 Å²	41	78.1 Å²	78.1	34%	0.339	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	136.3	170.5	0	0	0	0	0	110.4	P36 V37 E124	P36-A143 CarbonylContact C-O 3.05Å; P36-A143 WeakPolarHBondContact CA-O 3.36Å; V37-A143 HydrophobicContact CB-CB 4.32Å; V37-A143 HydrophobicContact CG2-CB 4.33Å; V37-A143 PolarHBondContact N-O 3.11Å; E124-A143 CarbonylContact O-C 2.83Å
144	Y	48.1	Very low	44.8	Very low	3 Å²	3	75 Å²	75	1%	0.012	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	152.6	171.3	-69.8	-112.1	0	0	0	108.6	W34 I35 P36 A123 E124 R126 D131 I142	W34-Y144 HydrophobicContact CB-CD1 4.4Å; I35-Y144 WeakPolarHBondContact O-CA 3.49Å; P36-Y144 HydrophobicContact CB-CD1 4.18Å; P36-Y144 HydrophobicContact CB-CE1 3.95Å; P36-Y144 HydrophobicContact CB-CE2 4.4Å; P36-Y144 HydrophobicContact CB-CG 4.5Å; P36-Y144 HydrophobicContact CG-CE1 4.19Å; A123-Y144 CarbonylContact C-O 3.35Å; A123-Y144 WeakPolarHBondContact CA-O 3.49Å; E124-Y144 PolarHBondContact N-O 3.39Å; E124-Y144 PolarHBondContact O-N 3.04Å; R126-Y144 HydrophobicContact CB-CD2 3.94Å; R126-Y144 HydrophobicContact CB-CE2 3.75Å; R126-Y144 HydrophobicContact CG-CD2 3.98Å; R126-Y144 HydrophobicContact CG-CE2 4.18Å; D131-Y144 WeakPolarHBondContact CB-OH 3.36Å; D131-Y144 PolarHBondContact OD2-OH 3.16Å; D131-Y144 VanDerWaalsContact OD2-OH 3.08Å; I142-Y144 HydrophobicContact CB-CD2 4.47Å; I142-Y144 HydrophobicContact CB-CE2 3.83Å; I142-Y144 HydrophobicContact CG2-CD2 4.03Å; I142-Y144 HydrophobicContact CG2-CE2 3.5Å; I142-Y144 VanDerWaalsContact CG2-CE2 3.5Å
145	I	47	Very low	43.9	Very low	21 Å²	21	83 Å²	83	11%	0.108	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	150.4	170.6	49.4	170.4	0	0	0	110.9	W34 I35 V37 A120 A123 T162	W34-I145 WeakPolarHBondContact CA-O 3.46Å; I35-I145 PolarHBondContact N-O 2.87Å; I35-I145 PolarHBondContact O-N 2.95Å; V37-I145 HydrophobicContact CG2-CB 4.32Å; V37-I145 HydrophobicContact CG2-CD1 4.22Å; V37-I145 HydrophobicContact CG2-CG1 3.86Å; V37-I145 HydrophobicContact CG2-CG2 3.73Å; A120-I145 HydrophobicContact CB-CB 4.43Å; A120-I145 HydrophobicContact CB-CG2 4.01Å; A123-I145 HydrophobicContact CB-CG2 3.76Å; I145-T162 HydrophobicContact CD1-CG2 4.37Å; I145-T162 WeakPolarHBondContact CD1-O 3.2Å
146	S	43.7	Very low	42.9	Very low	56 Å²	56	85.3 Å²	85.3	39%	0.392	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	130.2	177.9	-142.4	0	0	0	0	109	W34	W34-S146 VanDerWaalsContact CE3-N 3.29Å; W34-S146 WeakPolarHBondContact CZ2-OG 3.29Å
147	T	45.8	Very low	42.2	Very low	19 Å²	19	81.2 Å²	81.2	12%	0.117	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	164.7	175.7	81.8	0	0	0	0	109.9	N33 I35 G149	N33-T147 WeakPolarHBondContact O-CB 3.22Å; N33-T147 PolarHBondContact O-N 2.97Å; N33-T147 PolarHBondContact O-OG1 2.84Å; I35-T147 HydrophobicContact CB-CG2 4.05Å; I35-T147 HydrophobicContact CD1-CG2 3.87Å; I35-T147 WeakPolarHBondContact CD1-OG1 3.44Å; I35-T147 HydrophobicContact CG1-CG2 3.92Å; T147-G149 PolarHBondContact O-N 3.23Å; T147-G149 PolarHBondContact OG1-N 2.76Å; T147-G149 VanDerWaalsContact OG1-N 3.1Å
148	S	40.2	Very low	41.7	Very low	55 Å²	55	82.2 Å²	82.2	39%	0.385	46%	0.458	S	S	.	.			trans	-63.7	-26.3	169.6	56	0	0	0	0	112	N33 V150 E152	N33-S148 PolarHBondContact ND2-O 2.98Å; S148-V150 PolarHBondContact O-N 3.42Å; S148-V150 PolarHBondContact OG-N 3.37Å; S148-E152 PolarHBondContact OG-OE1 3.03Å
149	G	36.4	Very low	41.2	Very low	45 Å²	45	76.7 Å²	76.7	46%	0.464	44%	0.435	S	S	.	.			trans	68.2	7.8	-166.2	0	0	0	0	0	113.6	N33 T147	N33-G149 VanDerWaalsContact CB-CA 3.42Å; N33-G149 WeakPolarHBondContact ND2-CA 3.13Å; T147-G149 PolarHBondContact O-N 3.23Å; T147-G149 PolarHBondContact OG1-N 2.76Å; T147-G149 VanDerWaalsContact OG1-N 3.1Å
150	V	37.5	Very low	40.5	Very low	101 Å²	101	71 Å²	71	61%	0.612	41%	0.41	S	S	*	.	S	Bend	trans	-93.5	134.2	172.6	-178	0	0	0	0	107.4	S148 E152	S148-V150 PolarHBondContact O-N 3.42Å; S148-V150 PolarHBondContact OG-N 3.37Å; V150-E152 PolarHBondContact O-N 2.86Å
151	E	37.9	Very low	39.6	Very low	150 Å²	150	73.2 Å²	73.2	70%	0.701	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-72.9	116.9	171.3	-174.7	174	-149.7	0	0	109	Y161	E151-Y161 HydrophobicContact CG-CE1 4.27Å; E151-Y161 PolarHBondContact OE1-OH 3.45Å; E151-Y161 VanDerWaalsContact OE1-OH 3.12Å
152	E	38.1	Very low	39.2	Very low	103 Å²	103	70.7 Å²	70.7	48%	0.481	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-102	125.4	-175.4	-71.9	180	-151.3	0	0	111	S148 V150 C154	S148-E152 PolarHBondContact OG-OE1 3.03Å; V150-E152 PolarHBondContact O-N 2.86Å; E152-C154 PolarHBondContact O-N 3.48Å
153	G	31.4	Very low	38.6	Very low	92 Å²	92	70.9 Å²	70.9	95%	0.948	41%	0.406	S	S	*	.			trans	-76	81.5	-175.7	0	0	0	0	0	113
154	C	36.2	Very low	37.9	Very low	49 Å²	49	75.7 Å²	75.7	33%	0.331	42%	0.415	S	S	.	.			trans	-93.8	159.5	-177.6	-54.8	0	0	0	0	113.8	E152 F156 D159 C160	E152-C154 PolarHBondContact O-N 3.48Å; C154-F156 PolarHBondContact O-N 2.81Å; C154-D159 HydrophobicContact CB-CB 3.98Å; C154-D159 PolarHBondContact SG-O 2.79Å; C154-C160 HydrophobicContact CB-CB 4.46Å
155	Q	29.7	Very low	37.3	Very low	175 Å²	175	79.4 Å²	79.4	82%	0.818	43%	0.432	S	S	*	.	S	Bend	trans	-74.5	-21.2	-174	-66.6	-177.2	-6.3	0	0	114.5
156	F	31.4	Very low	36.9	Very low	108 Å²	108	80.6 Å²	80.6	47%	0.474	44%	0.442	S	S	.	.	S	Bend	trans	-137.4	142.1	178.7	-50.4	-77.9	0	0	0	110.1	C154 K158 D159 C160	C154-F156 PolarHBondContact O-N 2.81Å; F156-K158 HydrophobicContact CB-CG 4.12Å; F156-K158 PolarHBondContact O-N 2.72Å; F156-K158 VanDerWaalsContact O-N 3.07Å; F156-D159 WeakPolarHBondContact O-CA 3.42Å; F156-D159 PolarHBondContact O-N 3.23Å; F156-C160 PolarHBondContact O-N 2.76Å; F156-C160 PolarHBondContact O-SG 3.44Å
157	H	34.5	Very low	36.3	Very low	51 Å²	51	80.7 Å²	80.7	24%	0.236	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-30.9	-175.3	-174.3	72.1	0	0	0	114.3	D159 C160	H157-D159 PolarHBondContact O-N 3.12Å; H157-C160 PolarHBondContact O-N 3.48Å
158	K	37	Very low	36.1	Very low	150 Å²	150	85.6 Å²	85.6	65%	0.652	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-14.6	174.4	61.9	155.9	-175.1	64.6	0	114.7	F156	F156-K158 HydrophobicContact CB-CG 4.12Å; F156-K158 PolarHBondContact O-N 2.72Å; F156-K158 VanDerWaalsContact O-N 3.07Å
159	D	36.2	Very low	35.5	Very low	71 Å²	71	87.9 Å²	87.9	38%	0.38	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	-13.4	-178.3	-48	-48.1	0	0	0	112.3	C154 F156 H157 Y161	C154-D159 HydrophobicContact CB-CB 3.98Å; C154-D159 PolarHBondContact SG-O 2.79Å; F156-D159 WeakPolarHBondContact O-CA 3.42Å; F156-D159 PolarHBondContact O-N 3.23Å; H157-D159 PolarHBondContact O-N 3.12Å; D159-Y161 PolarHBondContact O-N 3.24Å
160	C	36.9	Very low	35.5	Very low	24 Å²	24	86.4 Å²	86.4	16%	0.162	44%	0.439	C	S	.	.	S	Bend	trans	-58.7	-15.2	-179.1	-74.5	0	0	0	0	114.9	C154 F156 H157	C154-C160 HydrophobicContact CB-CB 4.46Å; F156-C160 PolarHBondContact O-N 2.76Å; F156-C160 PolarHBondContact O-SG 3.44Å; H157-C160 PolarHBondContact O-N 3.48Å
161	Y	36	Very low	35.2	Very low	80 Å²	80	84.8 Å²	84.8	31%	0.314	43%	0.425	S	S	.	.			trans	-149	130	-170.3	-64.2	-72.6	0	0	0	109	E151 D159 S163 R164	E151-Y161 HydrophobicContact CG-CE1 4.27Å; E151-Y161 PolarHBondContact OE1-OH 3.45Å; E151-Y161 VanDerWaalsContact OE1-OH 3.12Å; D159-Y161 PolarHBondContact O-N 3.24Å; Y161-S163 WeakPolarHBondContact CB-O 3.12Å; Y161-S163 PolarHBondContact O-N 3.07Å; Y161-R164 WeakPolarHBondContact CB-O 3.03Å; Y161-R164 WeakPolarHBondContact CD2-O 3.47Å
162	T	41.5	Very low	35.3	Very low	81 Å²	81	83.2 Å²	83.2	50%	0.497	42%	0.421	S	S	.	.	S	Bend	trans	-61.4	-35.3	164.1	-9.5	0	0	0	0	109.6	I145	I145-T162 HydrophobicContact CD1-CG2 4.37Å; I145-T162 WeakPolarHBondContact CD1-O 3.2Å
163	S	36.6	Very low	34.8	Very low	14 Å²	14	83.6 Å²	83.6	10%	0.098	42%	0.424	C	S	.	.	S	Bend	trans	-156.9	167.1	159.7	-169.8	0	0	0	0	113.3	P36 Y161	P36-S163 PolarHBondContact O-OG 2.94Å; Y161-S163 WeakPolarHBondContact CB-O 3.12Å; Y161-S163 PolarHBondContact O-N 3.07Å
164	R	34.8	Very low	34.8	Very low	142 Å²	142	83 Å²	83	54%	0.536	40%	0.395	S	S	.	.	S	Bend	trans	72.7	133.2	-147.4	-58.1	179.7	-173.3	155.8	4.3	111.1	I35 Y161	I35-R164 HydrophobicContact CG2-CG 3.71Å; Y161-R164 WeakPolarHBondContact CB-O 3.03Å; Y161-R164 WeakPolarHBondContact CD2-O 3.47Å
165	E	33.7	Very low	35.2	Very low	80 Å²	80	85.4 Å²	85.4	37%	0.374	40%	0.402	S	S	.	.			cis	-151.2	136.1	-8.9	-112.7	157.9	-119.7	0	0	106	K167 W169	E165-K167 PolarHBondContact O-N 3.02Å; E165-W169 CarbonylContact C-O 3.51Å; E165-W169 VanDerWaalsContact C-O 3.23Å; E165-W169 PolarHBondContact OE2-NE1 3.43Å
166	P	39.5	Very low	35.5	Very low	47 Å²	47	81.1 Å²	81.1	31%	0.305	39%	0.388	S	S	.	.			trans	-91.9	87.5	-150.2	38.4	-44.9	0	0	0	116.4	Y38 E168 W169	Y38-P166 HydrophobicContact CD1-CG 3.65Å; Y38-P166 HydrophobicContact CG-CG 3.84Å; P166-E168 VanDerWaalsContact C-N 3.27Å; P166-E168 CarbonylContact O-C 3.58Å; P166-E168 PolarHBondContact O-N 3.19Å; P166-W169 CarbonylContact C-O 3.6Å; P166-W169 HydrophobicContact CG-CB 4.41Å; P166-W169 VanDerWaalsContact N-O 3.14Å; P166-W169 PolarHBondContact O-N 2.83Å
167	K	32.1	Very low	36	Very low	57 Å²	57	79 Å²	79	25%	0.248	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	21.7	-25.7	169.6	-81.5	-140.4	169.6	-157.7	0	125	E165 W169 Q171 Y178 S179	E165-K167 PolarHBondContact O-N 3.02Å; K167-W169 VanDerWaalsContact C-N 3.29Å; K167-W169 PolarHBondContact N-O 3.1Å; K167-Q171 PolarHBondContact O-NE2 3.27Å; K167-Y178 VanDerWaalsContact C-CD2 3.46Å; K167-Y178 VanDerWaalsContact CD-O 3.26Å; K167-Y178 WeakPolarHBondContact CD-O 3.47Å; K167-Y178 WeakPolarHBondContact CE-O 3.31Å; K167-Y178 PolarHBondContact NZ-O 2.79Å; K167-Y178 WeakPolarHBondContact O-CB 3.25Å; K167-Y178 WeakPolarHBondContact O-CD2 3.47Å; K167-S179 VanDerWaalsContact CE-OXT 3.25Å; K167-S179 WeakPolarHBondContact CE-OXT 3.48Å; K167-S179 PolarHBondContact NZ-OXT 2.73Å
168	E	40.8	Very low	35.6	Very low	122 Å²	122	77.7 Å²	77.7	57%	0.57	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	10	153.6	-86.4	58.1	-141.7	0	0	110.7	P166 Q171 L172	P166-E168 VanDerWaalsContact C-N 3.27Å; P166-E168 CarbonylContact O-C 3.58Å; P166-E168 PolarHBondContact O-N 3.19Å; E168-Q171 HydrophobicContact CG-CB 4.14Å; E168-Q171 VanDerWaalsContact OE1-CG 3.25Å; E168-Q171 WeakPolarHBondContact OE1-CG 3.12Å; E168-Q171 PolarHBondContact OE1-NE2 3.18Å; E168-L172 WeakPolarHBondContact O-CB 3.19Å
169	W	26.7	Very low	35.6	Very low	103 Å²	103	73 Å²	73	39%	0.39	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn		-123.6	101.3	129.5	179.4	-98.9	0	0	0	109.9	E165 P166 K167 L172 M173 Y178	E165-W169 CarbonylContact C-O 3.51Å; E165-W169 VanDerWaalsContact C-O 3.23Å; E165-W169 PolarHBondContact OE2-NE1 3.43Å; P166-W169 CarbonylContact C-O 3.6Å; P166-W169 HydrophobicContact CG-CB 4.41Å; P166-W169 VanDerWaalsContact N-O 3.14Å; P166-W169 PolarHBondContact O-N 2.83Å; K167-W169 VanDerWaalsContact C-N 3.29Å; K167-W169 PolarHBondContact N-O 3.1Å; W169-L172 HydrophobicContact CE3-CB 4.05Å; W169-L172 HydrophobicContact CE3-CD2 3.99Å; W169-L172 HydrophobicContact CZ3-CD2 4.46Å; W169-M173 HydrophobicContact CH2-CE 3.7Å; W169-M173 HydrophobicContact CZ2-CE 3.97Å; W169-M173 HydrophobicContact CZ3-CE 4.33Å; W169-Y178 VanDerWaalsContact C-CE1 3.43Å; W169-Y178 VanDerWaalsContact C-CG 3.41Å; W169-Y178 HydrophobicContact CB-CE2 4.04Å; W169-Y178 HydrophobicContact CD2-CE2 4.22Å; W169-Y178 AromaticContact CD2-CZ 3.95Å; W169-Y178 VanDerWaalsContact CD2-OH 3.29Å; W169-Y178 HydrophobicContact CE3-CE2 4.23Å; W169-Y178 HydrophobicContact CG-CE2 4.17Å
170	C	36.4	Very low	35.6	Very low	14 Å²	14	73.1 Å²	73.1	10%	0.095	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	cis	-60.5	-21.7	9.3	-94.1	0	0	0	0	129.2	L172 M173 K174 H177 Y178	C170-L172 PolarHBondContact O-N 3.2Å; C170-M173 CarbonylContact O-C 3.23Å; C170-M173 WeakPolarHBondContact O-CA 3.25Å; C170-M173 PolarHBondContact O-N 2.65Å; C170-M173 VanDerWaalsContact O-O 3.08Å; C170-M173 WeakPolarHBondContact SG-CB 2.89Å; C170-K174 HydrophobicContact CB-CB 3.82Å; C170-K174 HydrophobicContact CB-CG 4.03Å; C170-K174 PolarHBondContact O-N 2.67Å; C170-K174 PolarHBondContact SG-N 3.46Å; C170-H177 WeakPolarHBondContact O-CB 3.2Å; C170-Y178 VanDerWaalsContact C-CB 3.41Å; C170-Y178 WeakPolarHBondContact CA-OH 2.92Å; C170-Y178 HydrophobicContact CB-CD1 2.64Å; C170-Y178 HydrophobicContact CB-CD2 3.87Å; C170-Y178 HydrophobicContact CB-CE1 2.64Å; C170-Y178 HydrophobicContact CB-CE2 3.83Å; C170-Y178 HydrophobicContact CB-CG 3.27Å; C170-Y178 PolarHBondContact N-OH 3.4Å; C170-Y178 WeakPolarHBondContact SG-CE1 2.86Å
171	Q	32.7	Very low	35.5	Very low	67 Å²	67	75.7 Å²	75.7	31%	0.313	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-39.6	-32.6	145.6	-98.8	72	-96.5	0	0	113.4	K167 E168 M173 Y178	K167-Q171 PolarHBondContact O-NE2 3.27Å; E168-Q171 HydrophobicContact CG-CB 4.14Å; E168-Q171 VanDerWaalsContact OE1-CG 3.25Å; E168-Q171 WeakPolarHBondContact OE1-CG 3.12Å; E168-Q171 PolarHBondContact OE1-NE2 3.18Å; Q171-M173 PolarHBondContact O-N 3.15Å; Q171-Y178 HydrophobicContact CB-CD2 3.93Å
172	L	39.9	Very low	35.5	Very low	117 Å²	117	75.4 Å²	75.4	61%	0.613	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	16.1	168.7	-126.4	74.5	0	0	0	113.4	E168 W169 C170 Y178	E168-L172 WeakPolarHBondContact O-CB 3.19Å; W169-L172 HydrophobicContact CE3-CB 4.05Å; W169-L172 HydrophobicContact CE3-CD2 3.99Å; W169-L172 HydrophobicContact CZ3-CD2 4.46Å; C170-L172 PolarHBondContact O-N 3.2Å; L172-Y178 HydrophobicContact CB-CD2 4.46Å; L172-Y178 HydrophobicContact CB-CE2 3.58Å; L172-Y178 VanDerWaalsContact N-CD2 3.34Å
173	M	27.6	Very low	35.1	Very low	111 Å²	111	75.1 Å²	75.1	55%	0.547	36%	0.363	S	S	.	.	S	Bend	trans	-163.6	-122.5	171.4	-92.3	-162.1	-66.2	0	0	111.5	W169 C170 Q171 E175 H177 Y178	W169-M173 HydrophobicContact CH2-CE 3.7Å; W169-M173 HydrophobicContact CZ2-CE 3.97Å; W169-M173 HydrophobicContact CZ3-CE 4.33Å; C170-M173 CarbonylContact O-C 3.23Å; C170-M173 WeakPolarHBondContact O-CA 3.25Å; C170-M173 PolarHBondContact O-N 2.65Å; C170-M173 VanDerWaalsContact O-O 3.08Å; C170-M173 WeakPolarHBondContact SG-CB 2.89Å; Q171-M173 PolarHBondContact O-N 3.15Å; M173-E175 PolarHBondContact O-N 3.23Å; M173-H177 PolarHBondContact O-ND1 2.93Å; M173-Y178 WeakPolarHBondContact CE-OH 3.25Å
174	K	31.2	Very low	35	Very low	80 Å²	80	78.9 Å²	78.9	35%	0.348	38%	0.38	S	S	.	.	S	Bend	trans	18.4	-121.6	-170	-94.8	-165.8	-93.8	166	0	114.4	V70 C170 H177 S179	V70-K174 HydrophobicContact CG2-CD 4.08Å; C170-K174 HydrophobicContact CB-CB 3.82Å; C170-K174 HydrophobicContact CB-CG 4.03Å; C170-K174 PolarHBondContact O-N 2.67Å; C170-K174 PolarHBondContact SG-N 3.46Å; K174-H177 HydrophobicContact CB-CB 3.78Å; K174-H177 VanDerWaalsContact CB-O 3.25Å; K174-H177 WeakPolarHBondContact CB-O 3.13Å; K174-H177 WeakPolarHBondContact CD-O 3.26Å; K174-H177 WeakPolarHBondContact CE-O 2.82Å; K174-H177 PolarHBondContact NZ-O 2.97Å; K174-H177 VanDerWaalsContact NZ-O 3.12Å; K174-S179 PolarHBondContact NZ-O 3.08Å; K174-S179 PolarHBondContact NZ-OG 2.82Å
175	E	43.9	Very low	35	Very low	100 Å²	100	74.7 Å²	74.7	47%	0.467	37%	0.369	S	S	.	.	S	Bend	trans	-151	-36	-177.8	38.4	60.9	81.5	0	0	114.4	R67 M173 H177	R67-E175 IonicContact CZ-OE1 3.79Å; R67-E175 IonicContact NH1-OE1 2.65Å; R67-E175 PolarHBondContact NH1-OE1 3.38Å; R67-E175 IonicContact NH1-OE2 3.48Å; R67-E175 PolarHBondContact NH1-OE2 3.06Å; M173-E175 PolarHBondContact O-N 3.23Å; E175-H177 VanDerWaalsContact C-ND1 3.31Å; E175-H177 PolarHBondContact O-CE1 3.47Å; E175-H177 PolarHBondContact O-ND1 3.32Å
176	T	35.7	Very low	35.1	Very low	85 Å²	85	74.4 Å²	74.4	52%	0.521	37%	0.369	S	S	.	.	S	Bend	trans	-138.8	21.9	170.1	84.5	0	0	0	0	118.5	R67	R67-T176 PolarHBondContact NH1-OG1 3.05Å; R67-T176 PolarHBondContact NH2-OG1 3.36Å; R67-T176 VanDerWaalsContact NH2-OG1 3.15Å
177	H	43	Very low	34.8	Very low	64 Å²	64	76.5 Å²	76.5	30%	0.296	37%	0.374	S	S	.	.			cis	-153.5	-61.1	-15.1	-33.7	-140.2	0	0	0	111.6	C170 M173 K174 E175 S179	C170-H177 WeakPolarHBondContact O-CB 3.2Å; M173-H177 PolarHBondContact O-ND1 2.93Å; K174-H177 HydrophobicContact CB-CB 3.78Å; K174-H177 VanDerWaalsContact CB-O 3.25Å; K174-H177 WeakPolarHBondContact CB-O 3.13Å; K174-H177 WeakPolarHBondContact CD-O 3.26Å; K174-H177 WeakPolarHBondContact CE-O 2.82Å; K174-H177 PolarHBondContact NZ-O 2.97Å; K174-H177 VanDerWaalsContact NZ-O 3.12Å; E175-H177 VanDerWaalsContact C-ND1 3.31Å; E175-H177 PolarHBondContact O-CE1 3.47Å; E175-H177 PolarHBondContact O-ND1 3.32Å; H177-S179 PolarHBondContact O-N 3.48Å; H177-S179 PolarHBondContact O-OG 3.21Å
178	Y	25	Very low	35	Very low	22 Å²	22	78.1 Å²	78.1	9%	0.086	38%	0.384	C	S	.	.			trans	-75.7	68.3	170	-91.5	-43.3	0	0	0	106.3	K167 W169 C170 Q171 L172 M173	K167-Y178 VanDerWaalsContact C-CD2 3.46Å; K167-Y178 VanDerWaalsContact CD-O 3.26Å; K167-Y178 WeakPolarHBondContact CD-O 3.47Å; K167-Y178 WeakPolarHBondContact CE-O 3.31Å; K167-Y178 PolarHBondContact NZ-O 2.79Å; K167-Y178 WeakPolarHBondContact O-CB 3.25Å; K167-Y178 WeakPolarHBondContact O-CD2 3.47Å; W169-Y178 VanDerWaalsContact C-CE1 3.43Å; W169-Y178 VanDerWaalsContact C-CG 3.41Å; W169-Y178 HydrophobicContact CB-CE2 4.04Å; W169-Y178 HydrophobicContact CD2-CE2 4.22Å; W169-Y178 AromaticContact CD2-CZ 3.95Å; W169-Y178 VanDerWaalsContact CD2-OH 3.29Å; W169-Y178 HydrophobicContact CE3-CE2 4.23Å; W169-Y178 HydrophobicContact CG-CE2 4.17Å; C170-Y178 VanDerWaalsContact C-CB 3.41Å; C170-Y178 WeakPolarHBondContact CA-OH 2.92Å; C170-Y178 HydrophobicContact CB-CD1 2.64Å; C170-Y178 HydrophobicContact CB-CD2 3.87Å; C170-Y178 HydrophobicContact CB-CE1 2.64Å; C170-Y178 HydrophobicContact CB-CE2 3.83Å; C170-Y178 HydrophobicContact CB-CG 3.27Å; C170-Y178 PolarHBondContact N-OH 3.4Å; C170-Y178 WeakPolarHBondContact SG-CE1 2.86Å; Q171-Y178 HydrophobicContact CB-CD2 3.93Å; L172-Y178 HydrophobicContact CB-CD2 4.46Å; L172-Y178 HydrophobicContact CB-CE2 3.58Å; L172-Y178 VanDerWaalsContact N-CD2 3.34Å; M173-Y178 WeakPolarHBondContact CE-OH 3.25Å
179	S	37.6	Very low	34.5	Very low	52 Å²	52	74.1 Å²	74.1	36%	0.364	37%	0.367	S	S	.	.			trans	-78.7	0	164.4	5.2	0	0	0	0	108.6	K167 K174 H177	K167-S179 VanDerWaalsContact CE-OXT 3.25Å; K167-S179 WeakPolarHBondContact CE-OXT 3.48Å; K167-S179 PolarHBondContact NZ-OXT 2.73Å; K174-S179 PolarHBondContact NZ-O 3.08Å; K174-S179 PolarHBondContact NZ-OG 2.82Å; H177-S179 PolarHBondContact O-N 3.48Å; H177-S179 PolarHBondContact O-OG 3.21Å

Retrieved 179 of 179 residues in 38.7 ms (Link to these results)

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