A0A077ZLE1_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZLE1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 158 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	44.3	Very low	42	Very low	244 Å²	244	163.2 Å²	163.2	100%	1.202	86%	0.855	S	S	*	*				0	107.8	0	-71.9	-176.6	150.3	0	0	107.9
2	Q	37.2	Very low	42.5	Very low	200 Å²	200	154.7 Å²	154.7	94%	0.935	84%	0.836	S	S	*	*			trans	-90	112.8	179	-86.7	168.4	-3.2	0	0	108.9
3	S	41.1	Very low	43.2	Very low	111 Å²	111	151.5 Å²	151.5	78%	0.776	83%	0.825	S	S	*	*			trans	-74.4	146.1	174	-60.8	0	0	0	0	110.6
4	P	47.3	Very low	44	Very low	118 Å²	118	152.7 Å²	152.7	77%	0.766	82%	0.822	S	S	*	*			trans	-80.5	138.5	-163.2	28.2	-28.1	0	0	0	112.7	K6	P4-K6 PolarHBondContact O-N 2.9Å; P4-K6 VanDerWaalsContact O-N 3.12Å
5	K	44.8	Very low	45.3	Very low	191 Å²	191	147.2 Å²	147.2	83%	0.83	80%	0.8	S	S	*	*			trans	-58.9	108.4	171.2	-71.5	176.8	176.4	176.8	0	109.1	D7	K5-D7 PolarHBondContact O-N 3.31Å
6	K	43.9	Very low	46.7	Very low	196 Å²	196	147.4 Å²	147.4	85%	0.852	79%	0.791	S	S	*	*			trans	-72.9	103.5	164.5	-82	-178.2	175.4	178.3	0	107.8	P4 Q8	P4-K6 PolarHBondContact O-N 2.9Å; P4-K6 VanDerWaalsContact O-N 3.12Å; K6-Q8 VanDerWaalsContact C-N 3.26Å; K6-Q8 PolarHBondContact O-N 3.48Å
7	D	43.2	Very low	48.1	Very low	149 Å²	149	145.2 Å²	145.2	80%	0.797	78%	0.779	S	S	*	*			trans	-65	85.1	167.5	-70.8	-46.4	0	0	0	109.9	K5 K9	K5-D7 PolarHBondContact O-N 3.31Å; D7-K9 VanDerWaalsContact C-N 3.29Å; D7-K9 PolarHBondContact O-N 3.04Å
8	Q	42.1	Very low	49.2	Very low	186 Å²	186	139.9 Å²	139.9	87%	0.869	76%	0.758	S	S	*	*			trans	-74	85.6	162.4	-93.7	178.9	-2.5	0	0	108.9	K6	K6-Q8 VanDerWaalsContact C-N 3.26Å; K6-Q8 PolarHBondContact O-N 3.48Å
9	K	37.9	Very low	50.2	Low	199 Å²	199	139.3 Å²	139.3	87%	0.865	75%	0.75	S	S	*	*			trans	-113.3	71.4	161.7	-88.8	-171.6	177.1	179	0	109.7	D7	D7-K9 VanDerWaalsContact C-N 3.29Å; D7-K9 PolarHBondContact O-N 3.04Å
10	V	43.1	Very low	50.9	Low	133 Å²	133	141.9 Å²	141.9	81%	0.806	75%	0.748	S	S	*	*			trans	-135.9	32.6	169.6	-156.2	0	0	0	0	111.6
11	G	37.2	Very low	51.6	Low	68 Å²	68	139.1 Å²	139.1	70%	0.701	73%	0.733	S	S	*	*	S	Bend	trans	-108.4	-2.2	-178.3	0	0	0	0	0	116.1
12	G	47.7	Very low	52.4	Low	61 Å²	61	132.1 Å²	132.1	63%	0.629	70%	0.7	S	S	*	*	S	Bend	trans	-96.2	-21.8	-166.4	0	0	0	0	0	116.7
13	T	52	Low	53.4	Low	113 Å²	113	126.2 Å²	126.2	69%	0.693	68%	0.682	S	S	*	*	H	α-helix	trans	-90.8	-32.9	-168.4	31.6	0	0	0	0	114	L17	T13-L17 PolarHBondContact O-N 3.33Å
14	Q	54.8	Low	54.2	Low	169 Å²	169	126.7 Å²	126.7	79%	0.79	68%	0.675	S	S	*	*	H	α-helix	trans	-70.1	-38.6	-179.3	-74.9	-174.8	-17	0	0	112.8	K16 L17 A18	Q14-K16 PolarHBondContact O-N 2.94Å; Q14-L17 PolarHBondContact O-N 3.14Å; Q14-A18 PolarHBondContact O-N 3.24Å; Q14-A18 VanDerWaalsContact O-N 3.15Å
15	S	62.3	Low	54.4	Low	70 Å²	70	126.9 Å²	126.9	49%	0.49	67%	0.665	S	S	.	*	H	α-helix	trans	-61.1	-44.9	179.9	-176.8	0	0	0	0	112.2	L17 A18 E19	S15-L17 VanDerWaalsContact C-N 3.29Å; S15-L17 PolarHBondContact O-N 3.27Å; S15-A18 PolarHBondContact O-N 2.68Å; S15-E19 PolarHBondContact O-N 2.66Å
16	K	68.1	Low	54.6	Low	150 Å²	150	121.7 Å²	121.7	65%	0.652	64%	0.644	S	S	*	*	H	α-helix	trans	-68.1	-28.2	-178.6	-149.2	172.9	-170.2	175.1	0	113.1	Q14 R20	Q14-K16 PolarHBondContact O-N 2.94Å; K16-R20 WeakPolarHBondContact O-CB 3.36Å; K16-R20 PolarHBondContact O-N 3.25Å; K16-R20 VanDerWaalsContact O-N 3.16Å
17	L	70.1	Confident	54.7	Low	111 Å²	111	119.1 Å²	119.1	58%	0.581	63%	0.633	S	S	*	*	H	α-helix	trans	-71.9	-44.6	174	-167	85.2	0	0	0	110.7	T13 Q14 S15 R20 I21	T13-L17 PolarHBondContact O-N 3.33Å; Q14-L17 PolarHBondContact O-N 3.14Å; S15-L17 VanDerWaalsContact C-N 3.29Å; S15-L17 PolarHBondContact O-N 3.27Å; L17-R20 WeakPolarHBondContact O-CB 3.37Å; L17-R20 PolarHBondContact O-N 2.75Å; L17-I21 HydrophobicContact CD2-CD1 4.22Å; L17-I21 HydrophobicContact CG-CD1 4.14Å; L17-I21 WeakPolarHBondContact O-CG1 3.47Å; L17-I21 PolarHBondContact O-N 3.47Å
18	A	69.1	Low	54.7	Low	50 Å²	50	115.5 Å²	115.5	41%	0.413	62%	0.616	S	S	.	*	H	α-helix	trans	-63.1	-42.9	178	0	0	0	0	0	111.8	Q14 S15 R20 I21 N22	Q14-A18 PolarHBondContact O-N 3.24Å; Q14-A18 VanDerWaalsContact O-N 3.15Å; S15-A18 PolarHBondContact O-N 2.68Å; A18-R20 VanDerWaalsContact C-N 3.32Å; A18-R20 PolarHBondContact O-N 2.84Å; A18-I21 PolarHBondContact O-N 2.94Å; A18-N22 WeakPolarHBondContact O-CB 3.47Å; A18-N22 PolarHBondContact O-N 3.43Å
19	E	67.4	Low	54.4	Low	128 Å²	128	114.9 Å²	114.9	60%	0.598	61%	0.606	S	S	*	*	H	α-helix	trans	-60.8	-40.1	172.8	-74.3	178.2	176.2	0	0	112.1	S15 S23	S15-E19 PolarHBondContact O-N 2.66Å; E19-S23 WeakPolarHBondContact O-CB 3.38Å; E19-S23 PolarHBondContact O-N 3.2Å
20	R	64.3	Low	54.3	Low	190 Å²	190	114 Å²	114	72%	0.717	60%	0.597	S	S	*	*	H	α-helix	trans	-64.5	-42.5	174.2	-93.8	-177	168.5	-160.3	-3	112.3	K16 L17 A18 S23 L24	K16-R20 WeakPolarHBondContact O-CB 3.36Å; K16-R20 PolarHBondContact O-N 3.25Å; K16-R20 VanDerWaalsContact O-N 3.16Å; L17-R20 WeakPolarHBondContact O-CB 3.37Å; L17-R20 PolarHBondContact O-N 2.75Å; A18-R20 VanDerWaalsContact C-N 3.32Å; A18-R20 PolarHBondContact O-N 2.84Å; R20-S23 PolarHBondContact O-N 2.99Å; R20-L24 WeakPolarHBondContact O-CB 3.45Å; R20-L24 PolarHBondContact O-N 3.37Å
21	I	66.3	Low	54.2	Low	84 Å²	84	112.5 Å²	112.5	43%	0.431	58%	0.583	S	S	.	*	H	α-helix	trans	-65.8	-46.2	178.2	-68.8	167.1	0	0	0	110.1	L17 A18 S23 L24 Q25	L17-I21 HydrophobicContact CD2-CD1 4.22Å; L17-I21 HydrophobicContact CG-CD1 4.14Å; L17-I21 WeakPolarHBondContact O-CG1 3.47Å; L17-I21 PolarHBondContact O-N 3.47Å; A18-I21 PolarHBondContact O-N 2.94Å; I21-S23 PolarHBondContact O-N 3.44Å; I21-L24 CarbonylContact O-C 3.6Å; I21-L24 WeakPolarHBondContact O-CB 3.19Å; I21-L24 PolarHBondContact O-N 3.43Å; I21-L24 VanDerWaalsContact O-N 3.17Å; I21-Q25 HydrophobicContact CG2-CG 4.3Å; I21-Q25 WeakPolarHBondContact O-CB 3.48Å; I21-Q25 WeakPolarHBondContact O-CG 3.34Å; I21-Q25 PolarHBondContact O-N 3.2Å
22	N	60.3	Low	54.1	Low	97 Å²	97	114.7 Å²	114.7	52%	0.519	57%	0.574	S	S	.	*	H	α-helix	trans	-63.4	-41.8	176.6	-81	-9.8	0	0	0	111.5	A18 L24 Q25 E26	A18-N22 WeakPolarHBondContact O-CB 3.47Å; A18-N22 PolarHBondContact O-N 3.43Å; N22-L24 VanDerWaalsContact C-N 3.31Å; N22-L24 PolarHBondContact O-N 3.23Å; N22-Q25 PolarHBondContact O-N 2.92Å; N22-E26 VanDerWaalsContact O-CB 3.24Å; N22-E26 WeakPolarHBondContact O-CB 3.43Å; N22-E26 PolarHBondContact O-N 3.19Å
23	S	58.8	Low	53.5	Low	77 Å²	77	116.5 Å²	116.5	54%	0.538	57%	0.569	S	S	.	*	H	α-helix	trans	-61.7	-40.7	173.5	-178.5	0	0	0	0	111.5	E19 R20 I21 K27	E19-S23 WeakPolarHBondContact O-CB 3.38Å; E19-S23 PolarHBondContact O-N 3.2Å; R20-S23 PolarHBondContact O-N 2.99Å; I21-S23 PolarHBondContact O-N 3.44Å; S23-K27 WeakPolarHBondContact O-CB 3.34Å; S23-K27 PolarHBondContact O-N 2.93Å
24	L	57.3	Low	53.2	Low	121 Å²	121	111.5 Å²	111.5	63%	0.634	54%	0.54	S	S	*	.	H	α-helix	trans	-65.5	-47.4	175.8	-135.5	97.4	0	0	0	111.2	R20 I21 N22 E26 K27 V28	R20-L24 WeakPolarHBondContact O-CB 3.45Å; R20-L24 PolarHBondContact O-N 3.37Å; I21-L24 CarbonylContact O-C 3.6Å; I21-L24 WeakPolarHBondContact O-CB 3.19Å; I21-L24 PolarHBondContact O-N 3.43Å; I21-L24 VanDerWaalsContact O-N 3.17Å; N22-L24 VanDerWaalsContact C-N 3.31Å; N22-L24 PolarHBondContact O-N 3.23Å; L24-E26 VanDerWaalsContact C-N 3.33Å; L24-E26 PolarHBondContact O-N 2.93Å; L24-K27 PolarHBondContact O-N 2.9Å; L24-V28 WeakPolarHBondContact O-CB 3.44Å; L24-V28 WeakPolarHBondContact O-CG2 3.38Å; L24-V28 PolarHBondContact O-N 3.47Å
25	Q	51	Low	52.7	Low	122 Å²	122	108.7 Å²	108.7	57%	0.57	53%	0.526	S	S	*	.	H	α-helix	trans	-61.9	-41.4	178.3	-76.9	-176.2	-7	0	0	111.2	I21 N22 V28 R29	I21-Q25 HydrophobicContact CG2-CG 4.3Å; I21-Q25 WeakPolarHBondContact O-CB 3.48Å; I21-Q25 WeakPolarHBondContact O-CG 3.34Å; I21-Q25 PolarHBondContact O-N 3.2Å; N22-Q25 PolarHBondContact O-N 2.92Å; Q25-V28 PolarHBondContact O-N 3.26Å; Q25-R29 VanDerWaalsContact O-CB 3.28Å; Q25-R29 WeakPolarHBondContact O-CB 3.09Å; Q25-R29 PolarHBondContact O-N 3.32Å
26	E	49.3	Very low	52	Low	81 Å²	81	108.4 Å²	108.4	38%	0.379	52%	0.516	S	S	.	.	H	α-helix	trans	-72.9	-34	178.8	-162.5	166.3	164.5	0	0	111.7	N22 L24 R29 R30	N22-E26 VanDerWaalsContact O-CB 3.24Å; N22-E26 WeakPolarHBondContact O-CB 3.43Å; N22-E26 PolarHBondContact O-N 3.19Å; L24-E26 VanDerWaalsContact C-N 3.33Å; L24-E26 PolarHBondContact O-N 2.93Å; E26-R29 PolarHBondContact O-N 2.94Å; E26-R30 WeakPolarHBondContact O-CB 3.47Å; E26-R30 VanDerWaalsContact O-CG 3.29Å; E26-R30 WeakPolarHBondContact O-CG 3.42Å; E26-R30 PolarHBondContact O-N 3.37Å; E26-R30 IonicContact OE1-CZ 2.95Å; E26-R30 IonicContact OE1-NE 3.15Å; E26-R30 IonicContact OE1-NH2 2.65Å; E26-R30 PolarHBondContact OE1-NH2 2.9Å
27	K	47.5	Very low	50.7	Low	143 Å²	143	109 Å²	109	62%	0.622	51%	0.514	S	S	*	.	H	α-helix	trans	-64.8	-44.2	170.7	-160.2	176.1	-173.7	-178	0	110.8	S23 L24 R30 I31	S23-K27 WeakPolarHBondContact O-CB 3.34Å; S23-K27 PolarHBondContact O-N 2.93Å; L24-K27 PolarHBondContact O-N 2.9Å; K27-R30 PolarHBondContact O-N 3Å; K27-I31 HydrophobicContact CG-CD1 4.01Å; K27-I31 WeakPolarHBondContact O-CB 3.31Å; K27-I31 WeakPolarHBondContact O-CD1 3.17Å; K27-I31 WeakPolarHBondContact O-CG1 3.29Å; K27-I31 PolarHBondContact O-N 3.24Å
28	V	42.4	Very low	49.3	Very low	73 Å²	73	110.3 Å²	110.3	44%	0.442	51%	0.512	S	S	.	.	H	α-helix	trans	-61.3	-44.5	172.8	171.2	0	0	0	0	110.5	L24 Q25 R30 I31 F32	L24-V28 WeakPolarHBondContact O-CB 3.44Å; L24-V28 WeakPolarHBondContact O-CG2 3.38Å; L24-V28 PolarHBondContact O-N 3.47Å; Q25-V28 PolarHBondContact O-N 3.26Å; V28-R30 VanDerWaalsContact C-N 3.31Å; V28-R30 PolarHBondContact O-N 2.93Å; V28-I31 PolarHBondContact O-N 3.49Å; V28-F32 HydrophobicContact CG1-CD2 4.11Å; V28-F32 HydrophobicContact CG1-CE2 4.36Å; V28-F32 WeakPolarHBondContact O-CD2 3.38Å; V28-F32 PolarHBondContact O-N 3.49Å
29	R	36	Very low	48.2	Very low	172 Å²	172	111 Å²	111	65%	0.649	51%	0.508	S	S	*	.	H	α-helix	trans	-61.4	-38.6	177.5	-164.2	178.8	80	149.9	1.5	112	Q25 E26	Q25-R29 VanDerWaalsContact O-CB 3.28Å; Q25-R29 WeakPolarHBondContact O-CB 3.09Å; Q25-R29 PolarHBondContact O-N 3.32Å; E26-R29 PolarHBondContact O-N 2.94Å
30	R	36.4	Very low	46.9	Very low	182 Å²	182	113.9 Å²	113.9	69%	0.687	52%	0.521	S	S	*	.	H	α-helix	trans	-74.4	-32.9	177.1	-71.8	178.9	-166.1	-145.7	4.9	112.7	E26 K27 V28 F32	E26-R30 WeakPolarHBondContact O-CB 3.47Å; E26-R30 VanDerWaalsContact O-CG 3.29Å; E26-R30 WeakPolarHBondContact O-CG 3.42Å; E26-R30 PolarHBondContact O-N 3.37Å; E26-R30 IonicContact OE1-CZ 2.95Å; E26-R30 IonicContact OE1-NE 3.15Å; E26-R30 IonicContact OE1-NH2 2.65Å; E26-R30 PolarHBondContact OE1-NH2 2.9Å; K27-R30 PolarHBondContact O-N 3Å; V28-R30 VanDerWaalsContact C-N 3.31Å; V28-R30 PolarHBondContact O-N 2.93Å; R30-F32 VanDerWaalsContact C-N 3.33Å; R30-F32 PolarHBondContact O-N 3.44Å
31	I	40.9	Very low	46.1	Very low	101 Å²	101	108.8 Å²	108.8	52%	0.518	53%	0.528	S	S	.	.	H	α-helix	trans	-69.5	-29.5	-179.4	-70.2	162.5	0	0	0	111.9	K27 V28	K27-I31 HydrophobicContact CG-CD1 4.01Å; K27-I31 WeakPolarHBondContact O-CB 3.31Å; K27-I31 WeakPolarHBondContact O-CD1 3.17Å; K27-I31 WeakPolarHBondContact O-CG1 3.29Å; K27-I31 PolarHBondContact O-N 3.24Å; V28-I31 PolarHBondContact O-N 3.49Å
32	F	34.8	Very low	45	Very low	114 Å²	114	107.4 Å²	107.4	50%	0.5	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	20.7	-171.5	-64.8	-73.4	0	0	0	115.8	V28 R30 G34	V28-F32 HydrophobicContact CG1-CD2 4.11Å; V28-F32 HydrophobicContact CG1-CE2 4.36Å; V28-F32 WeakPolarHBondContact O-CD2 3.38Å; V28-F32 PolarHBondContact O-N 3.49Å; R30-F32 VanDerWaalsContact C-N 3.33Å; R30-F32 PolarHBondContact O-N 3.44Å; F32-G34 PolarHBondContact O-N 2.93Å
33	N	35.5	Very low	44.6	Very low	99 Å²	99	108.9 Å²	108.9	53%	0.529	54%	0.537	S	S	.	.			trans	-74.6	18.6	170.1	-96.9	12.7	0	0	0	114	H35 N49	N33-H35 PolarHBondContact O-N 2.77Å; N33-H35 PolarHBondContact O-ND1 2.93Å; N33-H35 VanDerWaalsContact O-ND1 3.14Å; N33-N49 PolarHBondContact O-ND2 3.27Å; N33-N49 VanDerWaalsContact O-ND2 3.1Å
34	G	43.9	Very low	44	Very low	7 Å²	7	107 Å²	107	7%	0.072	53%	0.527	C	S	.	.			trans	-83.1	100	161.7	0	0	0	0	0	110.5	F32 F36 Y47	F32-G34 PolarHBondContact O-N 2.93Å; G34-F36 PolarHBondContact O-N 2.92Å; G34-F36 VanDerWaalsContact O-N 3.16Å; G34-Y47 VanDerWaalsContact CA-OH 3.23Å; G34-Y47 WeakPolarHBondContact CA-OH 3.38Å
35	H	45	Very low	43.3	Very low	110 Å²	110	103.7 Å²	103.7	51%	0.509	51%	0.507	S	S	.	.			trans	-71.8	112.8	-177	-61.8	70.6	0	0	0	108.3	N33 L48	N33-H35 PolarHBondContact O-N 2.77Å; N33-H35 PolarHBondContact O-ND1 2.93Å; N33-H35 VanDerWaalsContact O-ND1 3.14Å; H35-L48 HydrophobicContact CB-CB 4.05Å; H35-L48 HydrophobicContact CB-CD1 3.48Å; H35-L48 VanDerWaalsContact CB-CD1 3.48Å; H35-L48 HydrophobicContact CB-CG 4.39Å; H35-L48 WeakPolarHBondContact O-CB 3.46Å; H35-L48 WeakPolarHBondContact O-CD1 3.37Å; H35-L48 PolarHBondContact O-N 3.49Å
36	F	47.8	Very low	43	Very low	64 Å²	64	104.7 Å²	104.7	28%	0.281	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	122.4	163	-68.8	-88.8	0	0	0	107.2	G34 F45 R46 Y47 M78 Y81	G34-F36 PolarHBondContact O-N 2.92Å; G34-F36 VanDerWaalsContact O-N 3.16Å; F36-F45 HydrophobicContact CB-CB 4.37Å; F36-F45 HydrophobicContact CB-CD1 4.15Å; F36-F45 HydrophobicContact CD1-CB 4.03Å; F36-R46 WeakPolarHBondContact CA-O 3.43Å; F36-Y47 HydrophobicContact CD1-CD2 4.15Å; F36-Y47 HydrophobicContact CD2-CD2 4.12Å; F36-Y47 AromaticContact CE1-CD2 3.7Å; F36-Y47 HydrophobicContact CE1-CD2 3.7Å; F36-Y47 HydrophobicContact CE1-CG 4.41Å; F36-Y47 AromaticContact CE2-CD2 3.65Å; F36-Y47 HydrophobicContact CE2-CD2 3.65Å; F36-Y47 AromaticContact CE2-CE2 3.9Å; F36-Y47 HydrophobicContact CE2-CE2 3.9Å; F36-Y47 HydrophobicContact CG-CD2 4.37Å; F36-Y47 AromaticContact CZ-CD2 3.44Å; F36-Y47 HydrophobicContact CZ-CD2 3.44Å; F36-Y47 VanDerWaalsContact CZ-CD2 3.44Å; F36-Y47 AromaticContact CZ-CE2 3.98Å; F36-Y47 HydrophobicContact CZ-CE2 3.98Å; F36-Y47 HydrophobicContact CZ-CG 4.49Å; F36-M78 HydrophobicContact CE1-CE 4.49Å; F36-Y81 HydrophobicContact CE2-CE1 4.31Å; F36-Y81 AromaticContact CZ-CE1 3.97Å; F36-Y81 HydrophobicContact CZ-CE1 3.97Å
37	R	41.5	Very low	42.8	Very low	162 Å²	162	102.9 Å²	102.9	61%	0.611	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	129.5	171.5	-178.9	178.1	-150.9	-171.8	7	108.4	I39 R46 L48	R37-I39 PolarHBondContact O-N 3.45Å; R37-R46 PolarHBondContact N-O 3.37Å; R37-L48 HydrophobicContact CB-CD1 3.46Å; R37-L48 VanDerWaalsContact CB-CD1 3.46Å; R37-L48 HydrophobicContact CB-CG 4.06Å; R37-L48 HydrophobicContact CG-CD1 4.48Å
38	W	40	Very low	42.8	Very low	139 Å²	139	100.7 Å²	100.7	53%	0.527	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-70.4	121	163.2	-172.5	-94.9	0	0	0	108.2	F45	W38-F45 HydrophobicContact CB-CD1 4.35Å; W38-F45 HydrophobicContact CB-CE1 3.97Å; W38-F45 HydrophobicContact CD2-CZ 4.47Å; W38-F45 HydrophobicContact CE3-CD1 4.03Å; W38-F45 AromaticContact CE3-CD2 3.87Å; W38-F45 HydrophobicContact CE3-CD2 3.87Å; W38-F45 AromaticContact CE3-CE1 3.77Å; W38-F45 HydrophobicContact CE3-CE1 3.77Å; W38-F45 AromaticContact CE3-CE2 3.59Å; W38-F45 HydrophobicContact CE3-CE2 3.59Å; W38-F45 HydrophobicContact CE3-CG 4.08Å; W38-F45 AromaticContact CE3-CZ 3.54Å; W38-F45 HydrophobicContact CE3-CZ 3.54Å; W38-F45 AromaticContact CZ3-CD2 3.96Å; W38-F45 HydrophobicContact CZ3-CD2 3.96Å; W38-F45 AromaticContact CZ3-CE2 3.72Å; W38-F45 HydrophobicContact CZ3-CE2 3.72Å; W38-F45 HydrophobicContact CZ3-CZ 4.13Å
39	I	45.5	Very low	42.9	Very low	66 Å²	66	101.8 Å²	101.8	34%	0.338	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-100.1	122.6	174.7	-58.7	175	0	0	0	106.3	R37 G41 E42 R46	R37-I39 PolarHBondContact O-N 3.45Å; I39-G41 PolarHBondContact O-N 2.86Å; I39-E42 HydrophobicContact CB-CB 4.42Å; I39-E42 HydrophobicContact CB-CG 4.16Å; I39-E42 HydrophobicContact CG2-CG 4.18Å; I39-E42 PolarHBondContact O-N 2.79Å; I39-E42 VanDerWaalsContact O-N 3.08Å; I39-R46 HydrophobicContact CD1-CB 4.46Å; I39-R46 HydrophobicContact CD1-CG 4.43Å
40	E	41	Very low	43.1	Very low	187 Å²	187	96.1 Å²	96.1	87%	0.874	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	126.2	179	-164	170	-157.9	0	0	110
41	G	46.5	Very low	43.2	Very low	83 Å²	83	90.1 Å²	90.1	86%	0.856	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.8	-9.4	-174.7	0	0	0	0	0	115.5	I39	I39-G41 PolarHBondContact O-N 2.86Å
42	E	44.7	Very low	43.4	Very low	56 Å²	56	90.7 Å²	90.7	26%	0.262	48%	0.475	S	S	.	.			trans	-99.1	146.2	174.9	-63.6	-157.5	-171.9	0	0	112.8	I39 A44 R46	I39-E42 HydrophobicContact CB-CB 4.42Å; I39-E42 HydrophobicContact CB-CG 4.16Å; I39-E42 HydrophobicContact CG2-CG 4.18Å; I39-E42 PolarHBondContact O-N 2.79Å; I39-E42 VanDerWaalsContact O-N 3.08Å; E42-A44 VanDerWaalsContact C-N 3.31Å; E42-A44 PolarHBondContact O-N 2.9Å; E42-R46 IonicContact OE1-CZ 3.34Å; E42-R46 IonicContact OE1-NE 3.66Å; E42-R46 PolarHBondContact OE1-NE 2.89Å; E42-R46 IonicContact OE1-NH1 3.13Å; E42-R46 IonicContact OE1-NH2 3.61Å; E42-R46 PolarHBondContact OE1-NH2 2.84Å; E42-R46 IonicContact OE2-CZ 3.12Å; E42-R46 IonicContact OE2-NE 3.88Å; E42-R46 PolarHBondContact OE2-NE 3.31Å; E42-R46 IonicContact OE2-NH2 2.81Å; E42-R46 PolarHBondContact OE2-NH2 3.19Å
43	S	51.2	Low	43.6	Very low	127 Å²	127	95.6 Å²	95.6	89%	0.888	49%	0.492	S	S	*	.	S	Bend	trans	-81.3	-5.4	179.3	55.8	0	0	0	0	114.2
44	A	45.3	Very low	43.8	Very low	38 Å²	38	94.4 Å²	94.4	31%	0.314	50%	0.504	S	S	.	.	S	Bend	trans	-141.7	151	-172.5	0	0	0	0	0	113.6	E42	E42-A44 VanDerWaalsContact C-N 3.31Å; E42-A44 PolarHBondContact O-N 2.9Å
45	F	43.4	Very low	43.6	Very low	51 Å²	51	100 Å²	100	22%	0.224	53%	0.532	C	S	.	.			trans	-70.9	128.5	170.9	-74.8	-87.6	0	0	0	110.5	F36 W38	F36-F45 HydrophobicContact CB-CB 4.37Å; F36-F45 HydrophobicContact CB-CD1 4.15Å; F36-F45 HydrophobicContact CD1-CB 4.03Å; W38-F45 HydrophobicContact CB-CD1 4.35Å; W38-F45 HydrophobicContact CB-CE1 3.97Å; W38-F45 HydrophobicContact CD2-CZ 4.47Å; W38-F45 HydrophobicContact CE3-CD1 4.03Å; W38-F45 AromaticContact CE3-CD2 3.87Å; W38-F45 HydrophobicContact CE3-CD2 3.87Å; W38-F45 AromaticContact CE3-CE1 3.77Å; W38-F45 HydrophobicContact CE3-CE1 3.77Å; W38-F45 AromaticContact CE3-CE2 3.59Å; W38-F45 HydrophobicContact CE3-CE2 3.59Å; W38-F45 HydrophobicContact CE3-CG 4.08Å; W38-F45 AromaticContact CE3-CZ 3.54Å; W38-F45 HydrophobicContact CE3-CZ 3.54Å; W38-F45 AromaticContact CZ3-CD2 3.96Å; W38-F45 HydrophobicContact CZ3-CD2 3.96Å; W38-F45 AromaticContact CZ3-CE2 3.72Å; W38-F45 HydrophobicContact CZ3-CE2 3.72Å; W38-F45 HydrophobicContact CZ3-CZ 4.13Å
46	R	43.8	Very low	43.7	Very low	144 Å²	144	99.5 Å²	99.5	54%	0.543	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	140.2	170.9	-66.5	-163.4	-173.9	-171.8	7.1	111.5	F36 R37 I39 E42 L48	F36-R46 WeakPolarHBondContact CA-O 3.43Å; R37-R46 PolarHBondContact N-O 3.37Å; I39-R46 HydrophobicContact CD1-CB 4.46Å; I39-R46 HydrophobicContact CD1-CG 4.43Å; E42-R46 IonicContact OE1-CZ 3.34Å; E42-R46 IonicContact OE1-NE 3.66Å; E42-R46 PolarHBondContact OE1-NE 2.89Å; E42-R46 IonicContact OE1-NH1 3.13Å; E42-R46 IonicContact OE1-NH2 3.61Å; E42-R46 PolarHBondContact OE1-NH2 2.84Å; E42-R46 IonicContact OE2-CZ 3.12Å; E42-R46 IonicContact OE2-NE 3.88Å; E42-R46 PolarHBondContact OE2-NE 3.31Å; E42-R46 IonicContact OE2-NH2 2.81Å; E42-R46 PolarHBondContact OE2-NH2 3.19Å; R46-L48 PolarHBondContact O-N 3.41Å
47	Y	45	Very low	43.6	Very low	43 Å²	43	100.9 Å²	100.9	17%	0.169	55%	0.546	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	110.8	173.9	-165.1	-103.8	0	0	0	109.9	G34 F36 N49 S50	G34-Y47 VanDerWaalsContact CA-OH 3.23Å; G34-Y47 WeakPolarHBondContact CA-OH 3.38Å; F36-Y47 HydrophobicContact CD1-CD2 4.15Å; F36-Y47 HydrophobicContact CD2-CD2 4.12Å; F36-Y47 AromaticContact CE1-CD2 3.7Å; F36-Y47 HydrophobicContact CE1-CD2 3.7Å; F36-Y47 HydrophobicContact CE1-CG 4.41Å; F36-Y47 AromaticContact CE2-CD2 3.65Å; F36-Y47 HydrophobicContact CE2-CD2 3.65Å; F36-Y47 AromaticContact CE2-CE2 3.9Å; F36-Y47 HydrophobicContact CE2-CE2 3.9Å; F36-Y47 HydrophobicContact CG-CD2 4.37Å; F36-Y47 AromaticContact CZ-CD2 3.44Å; F36-Y47 HydrophobicContact CZ-CD2 3.44Å; F36-Y47 VanDerWaalsContact CZ-CD2 3.44Å; F36-Y47 AromaticContact CZ-CE2 3.98Å; F36-Y47 HydrophobicContact CZ-CE2 3.98Å; F36-Y47 HydrophobicContact CZ-CG 4.49Å; Y47-N49 HydrophobicContact CD1-CB 4.22Å; Y47-N49 HydrophobicContact CE1-CB 3.89Å; Y47-N49 PolarHBondContact O-N 2.89Å; Y47-N49 VanDerWaalsContact O-N 3.12Å; Y47-S50 PolarHBondContact O-N 2.84Å; Y47-S50 VanDerWaalsContact O-N 3.11Å; Y47-S50 PolarHBondContact O-OG 3.08Å
48	L	49.4	Very low	43.7	Very low	96 Å²	96	99.6 Å²	99.6	50%	0.503	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.4	-173.9	-86.6	152.8	0	0	0	114.6	H35 R37 R46	H35-L48 HydrophobicContact CB-CB 4.05Å; H35-L48 HydrophobicContact CB-CD1 3.48Å; H35-L48 VanDerWaalsContact CB-CD1 3.48Å; H35-L48 HydrophobicContact CB-CG 4.39Å; H35-L48 WeakPolarHBondContact O-CB 3.46Å; H35-L48 WeakPolarHBondContact O-CD1 3.37Å; H35-L48 PolarHBondContact O-N 3.49Å; R37-L48 HydrophobicContact CB-CD1 3.46Å; R37-L48 VanDerWaalsContact CB-CD1 3.46Å; R37-L48 HydrophobicContact CB-CG 4.06Å; R37-L48 HydrophobicContact CG-CD1 4.48Å; R46-L48 PolarHBondContact O-N 3.41Å
49	N	42.9	Very low	44.1	Very low	97 Å²	97	98 Å²	98	52%	0.519	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	10.3	179.4	-69.1	-18.5	0	0	0	113.2	N33 Y47 P51	N33-N49 PolarHBondContact O-ND2 3.27Å; N33-N49 VanDerWaalsContact O-ND2 3.1Å; Y47-N49 HydrophobicContact CD1-CB 4.22Å; Y47-N49 HydrophobicContact CE1-CB 3.89Å; Y47-N49 PolarHBondContact O-N 2.89Å; Y47-N49 VanDerWaalsContact O-N 3.12Å; N49-P51 VanDerWaalsContact O-CD 3.26Å; N49-P51 WeakPolarHBondContact O-CD 3.32Å
50	S	39.9	Very low	44.4	Very low	52 Å²	52	102.2 Å²	102.2	36%	0.364	56%	0.56	S	S	.	*	S	Bend	trans	-81.2	113.8	166.2	60.1	0	0	0	0	106.6	Y47	Y47-S50 PolarHBondContact O-N 2.84Å; Y47-S50 VanDerWaalsContact O-N 3.11Å; Y47-S50 PolarHBondContact O-OG 3.08Å
51	P	39.7	Very low	44.6	Very low	56 Å²	56	99.2 Å²	99.2	36%	0.364	55%	0.55	S	S	.	.			trans	-56.2	142.9	169.5	13.8	-16.1	0	0	0	107.7	N49 Y53 Y58	N49-P51 VanDerWaalsContact O-CD 3.26Å; N49-P51 WeakPolarHBondContact O-CD 3.32Å; P51-Y53 PolarHBondContact O-N 2.93Å; P51-Y58 HydrophobicContact CG-CD1 4.03Å; P51-Y58 HydrophobicContact CG-CD2 3.66Å; P51-Y58 HydrophobicContact CG-CE1 4.03Å; P51-Y58 HydrophobicContact CG-CE2 3.66Å; P51-Y58 HydrophobicContact CG-CG 3.85Å
52	P	45.6	Very low	44.4	Very low	113 Å²	113	101.7 Å²	101.7	73%	0.734	53%	0.534	S	S	*	.			trans	-50.2	123.7	-177.7	19.7	-31	0	0	0	108.4	G54	P52-G54 PolarHBondContact O-N 3.49Å
53	Y	39	Very low	44.3	Very low	217 Å²	217	102.5 Å²	102.5	85%	0.851	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.3	111.1	171.5	-95.6	-95.1	0	0	0	108	P51	P51-Y53 PolarHBondContact O-N 2.93Å
54	G	39	Very low	44.2	Very low	75 Å²	75	103.5 Å²	103.5	77%	0.773	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	142.7	-2.2	174.5	0	0	0	0	0	119.3	P52	P52-G54 PolarHBondContact O-N 3.49Å
55	N	38.7	Very low	43.8	Very low	125 Å²	125	106 Å²	106	67%	0.668	55%	0.545	S	S	*	.			trans	-102.5	104.5	172.3	-104.2	-14.7	0	0	0	112	V57 Y58	N55-V57 PolarHBondContact O-N 2.79Å; N55-Y58 PolarHBondContact O-N 2.9Å
56	D	48.1	Very low	43.6	Very low	99 Å²	99	108 Å²	108	53%	0.529	56%	0.564	S	S	.	*	H	α-helix	trans	-49.9	-22.3	-179.8	-153.4	36.6	0	0	0	113.7	K60	D56-K60 WeakPolarHBondContact O-CG 3.19Å; D56-K60 PolarHBondContact O-N 3.42Å; D56-K60 IonicContact OD2-NZ 2.84Å; D56-K60 PolarHBondContact OD2-NZ 3.32Å; D56-K60 VanDerWaalsContact OD2-NZ 3.13Å
57	V	45	Very low	43.5	Very low	93 Å²	93	105.2 Å²	105.2	56%	0.564	57%	0.566	S	S	*	*	H	α-helix	trans	-66.4	-37.6	175.1	-175.2	0	0	0	0	112.5	N55 K60 N61	N55-V57 PolarHBondContact O-N 2.79Å; V57-K60 PolarHBondContact O-N 3.36Å; V57-N61 PolarHBondContact O-N 2.88Å; V57-N61 VanDerWaalsContact O-N 3.13Å
58	Y	44.9	Very low	43.1	Very low	134 Å²	134	109 Å²	109	53%	0.525	59%	0.585	S	S	.	*	H	α-helix	trans	-70.1	-39	-178.9	-171.2	-94.9	0	0	0	111.5	P51 N55 K60 N61 R62	P51-Y58 HydrophobicContact CG-CD1 4.03Å; P51-Y58 HydrophobicContact CG-CD2 3.66Å; P51-Y58 HydrophobicContact CG-CE1 4.03Å; P51-Y58 HydrophobicContact CG-CE2 3.66Å; P51-Y58 HydrophobicContact CG-CG 3.85Å; N55-Y58 PolarHBondContact O-N 2.9Å; Y58-K60 VanDerWaalsContact C-N 3.32Å; Y58-K60 PolarHBondContact O-N 2.82Å; Y58-N61 PolarHBondContact O-N 2.87Å; Y58-R62 PolarHBondContact O-N 3.28Å; Y58-R62 VanDerWaalsContact O-N 3.12Å
59	N	48	Very low	42.4	Very low	107 Å²	107	109.1 Å²	109.1	57%	0.572	58%	0.58	S	S	*	*	H	α-helix	trans	-65.6	-35.1	177.2	-77.5	-21.3	0	0	0	112.4
60	K	51	Low	42.4	Very low	154 Å²	154	108 Å²	108	67%	0.67	58%	0.579	S	S	*	*	H	α-helix	trans	-74	-35.9	178.5	-72.3	176.9	-174.2	167.6	0	113.2	D56 V57 Y58	D56-K60 WeakPolarHBondContact O-CG 3.19Å; D56-K60 PolarHBondContact O-N 3.42Å; D56-K60 IonicContact OD2-NZ 2.84Å; D56-K60 PolarHBondContact OD2-NZ 3.32Å; D56-K60 VanDerWaalsContact OD2-NZ 3.13Å; V57-K60 PolarHBondContact O-N 3.36Å; Y58-K60 VanDerWaalsContact C-N 3.32Å; Y58-K60 PolarHBondContact O-N 2.82Å
61	N	46.4	Very low	42.5	Very low	123 Å²	123	112.8 Å²	112.8	66%	0.658	59%	0.59	S	S	*	*	S	Bend	trans	-98	10.2	-176.4	-64.6	-18.3	0	0	0	113.5	V57 Y58	V57-N61 PolarHBondContact O-N 2.88Å; V57-N61 VanDerWaalsContact O-N 3.13Å; Y58-N61 PolarHBondContact O-N 2.87Å
62	R	42.3	Very low	42.6	Very low	136 Å²	136	112.8 Å²	112.8	51%	0.513	59%	0.592	S	S	.	*			trans	-61.8	130.9	179.5	78.7	-177	-170.4	-176.6	1.1	109.6	Y58 I64	Y58-R62 PolarHBondContact O-N 3.28Å; Y58-R62 VanDerWaalsContact O-N 3.12Å; R62-I64 PolarHBondContact O-N 2.9Å
63	P	41.6	Very low	42.4	Very low	72 Å²	72	109 Å²	109	47%	0.468	57%	0.567	S	S	.	*			trans	-57.3	128.6	168.2	-22.6	33.2	0	0	0	109.3	D65	P63-D65 PolarHBondContact O-N 3.4Å
64	I	49.1	Very low	42.6	Very low	148 Å²	148	102.2 Å²	102.2	76%	0.759	55%	0.55	S	S	*	.			trans	-69.5	-16.8	178	-58	172	0	0	0	110.6	R62 P66	R62-I64 PolarHBondContact O-N 2.9Å; I64-P66 WeakPolarHBondContact O-CD 3.33Å
65	D	36.5	Very low	43	Very low	91 Å²	91	101.1 Å²	101.1	49%	0.487	54%	0.539	S	S	.	.			trans	-65.7	120.8	-178.2	-164.3	-45.4	0	0	0	111.9	P63 S67 H68	P63-D65 PolarHBondContact O-N 3.4Å; D65-S67 VanDerWaalsContact CG-OG 3.3Å; D65-S67 PolarHBondContact O-N 3Å; D65-S67 WeakPolarHBondContact OD1-CB 3.47Å; D65-S67 PolarHBondContact OD1-N 3.46Å; D65-S67 PolarHBondContact OD1-OG 2.87Å; D65-H68 PolarHBondContact O-N 3.49Å; D65-H68 VanDerWaalsContact O-N 3.16Å
66	P	39.4	Very low	43.3	Very low	93 Å²	93	100.1 Å²	100.1	60%	0.604	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-60.5	-18.6	-176.9	-21.8	31.3	0	0	0	116.3	I64 H68 Y69	I64-P66 WeakPolarHBondContact O-CD 3.33Å; P66-H68 PolarHBondContact O-N 3.05Å; P66-H68 VanDerWaalsContact O-N 3.17Å; P66-Y69 VanDerWaalsContact CA-CE2 3.44Å; P66-Y69 HydrophobicContact CB-CD2 3.87Å; P66-Y69 HydrophobicContact CB-CE2 3.93Å; P66-Y69 HydrophobicContact CG-CE2 4.31Å; P66-Y69 WeakPolarHBondContact O-CD2 3.39Å; P66-Y69 PolarHBondContact O-N 3.42Å
67	S	41.6	Very low	43.3	Very low	86 Å²	86	100.9 Å²	100.9	60%	0.601	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-65.5	-13.5	177.4	59.5	0	0	0	0	113.9	D65	D65-S67 VanDerWaalsContact CG-OG 3.3Å; D65-S67 PolarHBondContact O-N 3Å; D65-S67 WeakPolarHBondContact OD1-CB 3.47Å; D65-S67 PolarHBondContact OD1-N 3.46Å; D65-S67 PolarHBondContact OD1-OG 2.87Å
68	H	37.4	Very low	43.4	Very low	121 Å²	121	98.4 Å²	98.4	56%	0.56	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-104.4	0.5	178.8	-61.8	-43.5	0	0	0	114.4	D65 P66 S70	D65-H68 PolarHBondContact O-N 3.49Å; D65-H68 VanDerWaalsContact O-N 3.16Å; P66-H68 PolarHBondContact O-N 3.05Å; P66-H68 VanDerWaalsContact O-N 3.17Å; H68-S70 PolarHBondContact O-N 3.45Å
69	Y	35.2	Very low	43.5	Very low	100 Å²	100	98.2 Å²	98.2	39%	0.392	52%	0.524	S	S	.	.			trans	-70.4	85.3	163.9	-60.2	-63.1	0	0	0	108.1	P66 Y71	P66-Y69 VanDerWaalsContact CA-CE2 3.44Å; P66-Y69 HydrophobicContact CB-CD2 3.87Å; P66-Y69 HydrophobicContact CB-CE2 3.93Å; P66-Y69 HydrophobicContact CG-CE2 4.31Å; P66-Y69 WeakPolarHBondContact O-CD2 3.39Å; P66-Y69 PolarHBondContact O-N 3.42Å; Y69-Y71 PolarHBondContact O-N 2.92Å
70	S	41.9	Very low	43.7	Very low	72 Å²	72	97 Å²	97	50%	0.503	52%	0.516	S	S	.	.			trans	-63.5	74.9	141.5	52.9	0	0	0	0	106	H68 S72	H68-S70 PolarHBondContact O-N 3.45Å; S70-S72 VanDerWaalsContact C-N 3.31Å; S70-S72 PolarHBondContact O-N 3.38Å
71	Y	41.6	Very low	43.8	Very low	153 Å²	153	92.9 Å²	92.9	60%	0.6	50%	0.497	S	S	*	.			trans	-62.3	97.8	-176.5	-165.2	-102	0	0	0	104.7	Y69 P73 P74	Y69-Y71 PolarHBondContact O-N 2.92Å; Y71-P73 VanDerWaalsContact C-N 3.34Å; Y71-P73 HydrophobicContact CD1-CB 4.1Å; Y71-P73 HydrophobicContact CD1-CG 4.17Å; Y71-P73 HydrophobicContact CE1-CB 4.25Å; Y71-P73 WeakPolarHBondContact O-CD 3.4Å; Y71-P73 WeakPolarHBondContact O-CG 3.28Å; Y71-P73 VanDerWaalsContact O-N 3.12Å; Y71-P74 VanDerWaalsContact CE1-CD 3.42Å; Y71-P74 HydrophobicContact CE1-CG 4.41Å
72	S	41.4	Very low	44.3	Very low	57 Å²	57	88.6 Å²	88.6	40%	0.399	47%	0.474	S	S	.	.			trans	-63.4	105	157.7	-66.4	0	0	0	0	103.9	S70	S70-S72 VanDerWaalsContact C-N 3.31Å; S70-S72 PolarHBondContact O-N 3.38Å
73	P	43	Very low	45.1	Very low	33 Å²	33	86.7 Å²	86.7	21%	0.214	47%	0.474	C	S	.	.			trans	-61.8	146.8	-172.1	-24.6	38.7	0	0	0	109.9	Y71 G75 H77 M78	Y71-P73 VanDerWaalsContact C-N 3.34Å; Y71-P73 HydrophobicContact CD1-CB 4.1Å; Y71-P73 HydrophobicContact CD1-CG 4.17Å; Y71-P73 HydrophobicContact CE1-CB 4.25Å; Y71-P73 WeakPolarHBondContact O-CD 3.4Å; Y71-P73 WeakPolarHBondContact O-CG 3.28Å; Y71-P73 VanDerWaalsContact O-N 3.12Å; P73-G75 PolarHBondContact O-N 2.84Å; P73-H77 HydrophobicContact CB-CB 3.16Å; P73-H77 HydrophobicContact CG-CB 4.14Å; P73-M78 VanDerWaalsContact CD-SD 3.58Å; P73-M78 WeakPolarHBondContact O-CG 3.41Å
74	P	42.9	Very low	46	Very low	74 Å²	74	88.6 Å²	88.6	48%	0.481	48%	0.476	S	S	.	.			trans	-47.5	133.4	176	-24.6	30.6	0	0	0	110	Y71 V76 H77	Y71-P74 VanDerWaalsContact CE1-CD 3.42Å; Y71-P74 HydrophobicContact CE1-CG 4.41Å; P74-V76 PolarHBondContact O-N 2.74Å; P74-H77 PolarHBondContact O-N 2.91Å
75	G	46.1	Very low	46.6	Very low	53 Å²	53	85.9 Å²	85.9	55%	0.546	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-37.9	-34.1	-154.7	0	0	0	0	0	118.7	P73 H77 M78 E79	P73-G75 PolarHBondContact O-N 2.84Å; G75-H77 VanDerWaalsContact C-N 3.31Å; G75-H77 PolarHBondContact O-N 3.34Å; G75-M78 WeakPolarHBondContact O-CB 3.43Å; G75-M78 PolarHBondContact O-N 3.29Å; G75-M78 VanDerWaalsContact O-N 3.13Å; G75-E79 PolarHBondContact O-N 2.92Å; G75-E79 VanDerWaalsContact O-N 3.13Å
76	V	44.9	Very low	47.7	Very low	104 Å²	104	88.8 Å²	88.8	63%	0.63	46%	0.46	S	S	*	.	H	α-helix	trans	-58	-40.5	174.6	-175.9	0	0	0	0	112.5	P74 E79 I80	P74-V76 PolarHBondContact O-N 2.74Å; V76-E79 PolarHBondContact O-N 3.4Å; V76-I80 PolarHBondContact O-N 3.24Å
77	H	49.1	Very low	48.8	Very low	114 Å²	114	89 Å²	89	53%	0.528	46%	0.457	S	S	.	.	H	α-helix	trans	-74.7	-27.5	178.4	-76.6	-56.3	0	0	0	112.4	P73 P74 G75 Y81	P73-H77 HydrophobicContact CB-CB 3.16Å; P73-H77 HydrophobicContact CG-CB 4.14Å; P74-H77 PolarHBondContact O-N 2.91Å; G75-H77 VanDerWaalsContact C-N 3.31Å; G75-H77 PolarHBondContact O-N 3.34Å; H77-Y81 WeakPolarHBondContact O-CB 3.17Å; H77-Y81 PolarHBondContact O-N 3.5Å
78	M	46.2	Very low	49.8	Very low	41 Å²	41	90.5 Å²	90.5	20%	0.202	45%	0.454	C	S	.	.	H	α-helix	trans	-67.1	-38.3	171.8	-81.9	-66.5	-69.8	0	0	111.5	F36 P73 G75 Y81 N82	F36-M78 HydrophobicContact CE1-CE 4.49Å; P73-M78 VanDerWaalsContact CD-SD 3.58Å; P73-M78 WeakPolarHBondContact O-CG 3.41Å; G75-M78 WeakPolarHBondContact O-CB 3.43Å; G75-M78 PolarHBondContact O-N 3.29Å; G75-M78 VanDerWaalsContact O-N 3.13Å; M78-Y81 PolarHBondContact O-N 3.21Å; M78-N82 WeakPolarHBondContact O-CB 3.45Å; M78-N82 PolarHBondContact O-N 2.91Å; M78-N82 PolarHBondContact O-ND2 2.85Å
79	E	48.5	Very low	50.7	Low	131 Å²	131	90.3 Å²	90.3	61%	0.612	45%	0.452	S	S	*	.	H	α-helix	trans	-62.4	-49.4	175.9	-71.7	177.4	-174.3	0	0	111.6	G75 V76 Y81 N82 L83	G75-E79 PolarHBondContact O-N 2.92Å; G75-E79 VanDerWaalsContact O-N 3.13Å; V76-E79 PolarHBondContact O-N 3.4Å; E79-Y81 VanDerWaalsContact C-N 3.31Å; E79-Y81 PolarHBondContact O-N 2.88Å; E79-N82 PolarHBondContact O-N 2.87Å; E79-L83 WeakPolarHBondContact O-CB 3.4Å; E79-L83 WeakPolarHBondContact O-CD1 3.29Å; E79-L83 WeakPolarHBondContact O-CG 3.36Å; E79-L83 PolarHBondContact O-N 2.94Å
80	I	51.6	Low	51.9	Low	81 Å²	81	87.9 Å²	87.9	42%	0.415	45%	0.445	S	S	.	.	H	α-helix	trans	-60.7	-43.5	177.1	-62.8	170.6	0	0	0	110.5	V76 L83 Q84	V76-I80 PolarHBondContact O-N 3.24Å; I80-L83 WeakPolarHBondContact O-CB 3.44Å; I80-L83 PolarHBondContact O-N 3.08Å; I80-Q84 WeakPolarHBondContact O-CG 3.19Å; I80-Q84 PolarHBondContact O-N 3.31Å
81	Y	52.8	Low	52.7	Low	68 Å²	68	87.1 Å²	87.1	27%	0.267	44%	0.443	S	S	.	.	H	α-helix	trans	-64.1	-42.3	178.2	-175.4	-100.8	0	0	0	112.3	F36 H77 M78 E79 L83 Q84 R85	F36-Y81 HydrophobicContact CE2-CE1 4.31Å; F36-Y81 AromaticContact CZ-CE1 3.97Å; F36-Y81 HydrophobicContact CZ-CE1 3.97Å; H77-Y81 WeakPolarHBondContact O-CB 3.17Å; H77-Y81 PolarHBondContact O-N 3.5Å; M78-Y81 PolarHBondContact O-N 3.21Å; E79-Y81 VanDerWaalsContact C-N 3.31Å; E79-Y81 PolarHBondContact O-N 2.88Å; Y81-L83 VanDerWaalsContact C-N 3.35Å; Y81-Q84 PolarHBondContact O-N 3.24Å; Y81-R85 HydrophobicContact CD1-CG 4.08Å; Y81-R85 HydrophobicContact CE1-CG 3.77Å; Y81-R85 HydrophobicContact CE2-CG 4.49Å; Y81-R85 WeakPolarHBondContact O-CB 3.3Å; Y81-R85 VanDerWaalsContact O-CG 3.29Å; Y81-R85 WeakPolarHBondContact O-CG 3.22Å; Y81-R85 PolarHBondContact O-N 2.89Å; Y81-R85 PolarHBondContact OH-NE 3.01Å; Y81-R85 PolarHBondContact OH-NH2 3.49Å
82	N	56.8	Low	53.1	Low	33 Å²	33	82.8 Å²	82.8	18%	0.176	44%	0.435	C	S	.	.	H	α-helix	trans	-65.7	-38.3	176.5	-75.6	-19.3	0	0	0	111.6	M78 E79 R86	M78-N82 WeakPolarHBondContact O-CB 3.45Å; M78-N82 PolarHBondContact O-N 2.91Å; M78-N82 PolarHBondContact O-ND2 2.85Å; E79-N82 PolarHBondContact O-N 2.87Å; N82-R86 WeakPolarHBondContact O-CB 3.4Å; N82-R86 PolarHBondContact O-N 3.28Å
83	L	58.6	Low	53.6	Low	96 Å²	96	84.2 Å²	84.2	50%	0.503	44%	0.438	S	S	.	.	H	α-helix	trans	-61.3	-50.9	173.3	-80.8	157.9	0	0	0	111	E79 I80 Y81 R85 R86 D87	E79-L83 WeakPolarHBondContact O-CB 3.4Å; E79-L83 WeakPolarHBondContact O-CD1 3.29Å; E79-L83 WeakPolarHBondContact O-CG 3.36Å; E79-L83 PolarHBondContact O-N 2.94Å; I80-L83 WeakPolarHBondContact O-CB 3.44Å; I80-L83 PolarHBondContact O-N 3.08Å; Y81-L83 VanDerWaalsContact C-N 3.35Å; L83-R85 PolarHBondContact O-N 2.85Å; L83-R86 WeakPolarHBondContact O-CB 3.47Å; L83-R86 PolarHBondContact O-N 3.47Å; L83-D87 PolarHBondContact O-N 3.28Å
84	Q	61.6	Low	54.1	Low	111 Å²	111	91 Å²	91	52%	0.519	46%	0.459	S	S	.	.	H	α-helix	trans	-59.8	-46	177.8	-73	178.6	-14.5	0	0	112.2	I80 Y81 R86 D87 E88	I80-Q84 WeakPolarHBondContact O-CG 3.19Å; I80-Q84 PolarHBondContact O-N 3.31Å; Y81-Q84 PolarHBondContact O-N 3.24Å; Q84-R86 VanDerWaalsContact C-N 3.33Å; Q84-R86 PolarHBondContact O-N 3.37Å; Q84-D87 PolarHBondContact O-N 3.46Å; Q84-E88 WeakPolarHBondContact O-CG 3.49Å; Q84-E88 PolarHBondContact O-N 2.95Å
85	R	61.5	Low	54.8	Low	92 Å²	92	93.3 Å²	93.3	35%	0.347	46%	0.464	S	S	.	.	H	α-helix	trans	-62.2	-39.2	176.4	-75.9	-72.5	-150.5	-171.7	7	112.5	Y81 L83 F89	Y81-R85 HydrophobicContact CD1-CG 4.08Å; Y81-R85 HydrophobicContact CE1-CG 3.77Å; Y81-R85 HydrophobicContact CE2-CG 4.49Å; Y81-R85 WeakPolarHBondContact O-CB 3.3Å; Y81-R85 VanDerWaalsContact O-CG 3.29Å; Y81-R85 WeakPolarHBondContact O-CG 3.22Å; Y81-R85 PolarHBondContact O-N 2.89Å; Y81-R85 PolarHBondContact OH-NE 3.01Å; Y81-R85 PolarHBondContact OH-NH2 3.49Å; L83-R85 PolarHBondContact O-N 2.85Å; R85-F89 WeakPolarHBondContact O-CB 3.32Å; R85-F89 PolarHBondContact O-N 2.93Å
86	R	59.3	Low	55.3	Low	151 Å²	151	93.8 Å²	93.8	57%	0.57	46%	0.456	S	S	*	.	H	α-helix	trans	-64.2	-43.9	175.5	177.2	-175.7	168.2	169.6	-1	110.5	N82 L83 Q84 F89 I90	N82-R86 WeakPolarHBondContact O-CB 3.4Å; N82-R86 PolarHBondContact O-N 3.28Å; L83-R86 WeakPolarHBondContact O-CB 3.47Å; L83-R86 PolarHBondContact O-N 3.47Å; Q84-R86 VanDerWaalsContact C-N 3.33Å; Q84-R86 PolarHBondContact O-N 3.37Å; R86-F89 PolarHBondContact O-N 2.83Å; R86-I90 HydrophobicContact CG-CD1 3.85Å; R86-I90 HydrophobicContact CG-CG1 4.45Å; R86-I90 WeakPolarHBondContact O-CB 3.17Å; R86-I90 VanDerWaalsContact O-CG1 3.29Å; R86-I90 WeakPolarHBondContact O-CG1 3.3Å; R86-I90 PolarHBondContact O-N 3.34Å
87	D	63	Low	55.8	Low	98 Å²	98	94 Å²	94	52%	0.524	45%	0.453	S	S	.	.	H	α-helix	trans	-65.6	-42.6	178.8	-71.5	-18.4	0	0	0	111.7	L83 Q84 F89 I90 A91	L83-D87 PolarHBondContact O-N 3.28Å; Q84-D87 PolarHBondContact O-N 3.46Å; D87-F89 VanDerWaalsContact C-N 3.33Å; D87-F89 PolarHBondContact O-N 3.49Å; D87-I90 PolarHBondContact O-N 2.65Å; D87-A91 VanDerWaalsContact O-CB 3.3Å; D87-A91 WeakPolarHBondContact O-CB 3.44Å; D87-A91 PolarHBondContact O-N 3.46Å
88	E	62.9	Low	56.1	Low	117 Å²	117	93.6 Å²	93.6	55%	0.547	45%	0.454	S	S	.	.	H	α-helix	trans	-58	-44.9	171.7	-74.3	176.1	179.5	0	0	111.7	Q84 A91 S92	Q84-E88 WeakPolarHBondContact O-CG 3.49Å; Q84-E88 PolarHBondContact O-N 2.95Å; E88-A91 PolarHBondContact O-N 2.85Å; E88-S92 WeakPolarHBondContact O-CB 3.33Å; E88-S92 PolarHBondContact O-N 2.92Å
89	F	56.7	Low	56.8	Low	117 Å²	117	96.9 Å²	96.9	51%	0.513	47%	0.472	S	S	.	.	H	α-helix	trans	-63.9	-45.5	177.5	179	-106.7	0	0	0	112	R85 R86 D87 A91 S92 L93	R85-F89 WeakPolarHBondContact O-CB 3.32Å; R85-F89 PolarHBondContact O-N 2.93Å; R86-F89 PolarHBondContact O-N 2.83Å; D87-F89 VanDerWaalsContact C-N 3.33Å; D87-F89 PolarHBondContact O-N 3.49Å; F89-A91 VanDerWaalsContact C-N 3.33Å; F89-A91 PolarHBondContact O-N 3.34Å; F89-S92 PolarHBondContact O-N 2.95Å; F89-L93 HydrophobicContact CD1-CD1 3.93Å; F89-L93 HydrophobicContact CD1-CG 4.47Å; F89-L93 HydrophobicContact CE1-CD1 3.39Å; F89-L93 HydrophobicContact CE1-CG 4.11Å; F89-L93 HydrophobicContact CE2-CD1 4.49Å; F89-L93 HydrophobicContact CE2-CG 4.4Å; F89-L93 HydrophobicContact CZ-CD1 3.72Å; F89-L93 HydrophobicContact CZ-CD2 4.28Å; F89-L93 HydrophobicContact CZ-CG 4.07Å; F89-L93 WeakPolarHBondContact O-CG 3.46Å; F89-L93 PolarHBondContact O-N 2.79Å
90	I	58.6	Low	57.5	Low	50 Å²	50	96.8 Å²	96.8	26%	0.256	47%	0.472	S	S	.	.	H	α-helix	trans	-63.3	-40.5	176.2	-69.9	170.6	0	0	0	110.8	R86 D87 L93 R94	R86-I90 HydrophobicContact CG-CD1 3.85Å; R86-I90 HydrophobicContact CG-CG1 4.45Å; R86-I90 WeakPolarHBondContact O-CB 3.17Å; R86-I90 VanDerWaalsContact O-CG1 3.29Å; R86-I90 WeakPolarHBondContact O-CG1 3.3Å; R86-I90 PolarHBondContact O-N 3.34Å; D87-I90 PolarHBondContact O-N 2.65Å; I90-L93 PolarHBondContact O-N 2.81Å; I90-R94 WeakPolarHBondContact O-CG 3.39Å; I90-R94 PolarHBondContact O-N 3.34Å
91	A	59.6	Low	57.9	Low	55 Å²	55	94.7 Å²	94.7	46%	0.455	46%	0.464	S	S	.	.	H	α-helix	trans	-62	-44.2	175.8	0	0	0	0	0	111.4	D87 E88 F89 L93 R94 E95	D87-A91 VanDerWaalsContact O-CB 3.3Å; D87-A91 WeakPolarHBondContact O-CB 3.44Å; D87-A91 PolarHBondContact O-N 3.46Å; E88-A91 PolarHBondContact O-N 2.85Å; F89-A91 VanDerWaalsContact C-N 3.33Å; F89-A91 PolarHBondContact O-N 3.34Å; A91-L93 PolarHBondContact O-N 3.42Å; A91-R94 PolarHBondContact O-N 3.2Å; A91-E95 PolarHBondContact O-N 2.92Å
92	S	50.5	Low	58.3	Low	62 Å²	62	94.1 Å²	94.1	43%	0.434	47%	0.467	S	S	.	.	H	α-helix	trans	-62.8	-40.7	175.2	-175.9	0	0	0	0	112.5	E88 F89 R94 E95 T96	E88-S92 WeakPolarHBondContact O-CB 3.33Å; E88-S92 PolarHBondContact O-N 2.92Å; F89-S92 PolarHBondContact O-N 2.95Å; S92-R94 PolarHBondContact O-N 2.87Å; S92-E95 PolarHBondContact O-N 3.4Å; S92-T96 WeakPolarHBondContact O-CB 3.46Å; S92-T96 WeakPolarHBondContact O-CG2 3.33Å; S92-T96 PolarHBondContact O-N 2.96Å; S92-T96 PolarHBondContact O-OG1 3.27Å
93	L	51.2	Low	58.8	Low	88 Å²	88	95.2 Å²	95.2	46%	0.461	48%	0.481	S	S	.	.	H	α-helix	trans	-63.4	-40.1	173.5	-73.9	179.8	0	0	0	112.2	F89 I90 A91 T96 N97	F89-L93 HydrophobicContact CD1-CD1 3.93Å; F89-L93 HydrophobicContact CD1-CG 4.47Å; F89-L93 HydrophobicContact CE1-CD1 3.39Å; F89-L93 HydrophobicContact CE1-CG 4.11Å; F89-L93 HydrophobicContact CE2-CD1 4.49Å; F89-L93 HydrophobicContact CE2-CG 4.4Å; F89-L93 HydrophobicContact CZ-CD1 3.72Å; F89-L93 HydrophobicContact CZ-CD2 4.28Å; F89-L93 HydrophobicContact CZ-CG 4.07Å; F89-L93 WeakPolarHBondContact O-CG 3.46Å; F89-L93 PolarHBondContact O-N 2.79Å; I90-L93 PolarHBondContact O-N 2.81Å; A91-L93 PolarHBondContact O-N 3.42Å; L93-T96 WeakPolarHBondContact CA-OG1 3.48Å; L93-T96 PolarHBondContact O-OG1 3.44Å; L93-N97 VanDerWaalsContact O-CB 3.22Å; L93-N97 WeakPolarHBondContact O-CB 3.4Å; L93-N97 PolarHBondContact O-N 3.31Å
94	R	54.6	Low	59.2	Low	175 Å²	175	97.2 Å²	97.2	66%	0.66	49%	0.488	S	S	*	.	H	α-helix	trans	-65.8	-44.5	175.8	-74.1	174.6	179.1	178.3	1.1	111.4	I90 A91 S92 N97 I98	I90-R94 WeakPolarHBondContact O-CG 3.39Å; I90-R94 PolarHBondContact O-N 3.34Å; A91-R94 PolarHBondContact O-N 3.2Å; S92-R94 PolarHBondContact O-N 2.87Å; R94-N97 PolarHBondContact O-N 3.48Å; R94-I98 WeakPolarHBondContact O-CB 3.29Å; R94-I98 WeakPolarHBondContact O-CD1 3.2Å; R94-I98 WeakPolarHBondContact O-CG1 3.39Å; R94-I98 PolarHBondContact O-N 3.44Å
95	E	56.2	Low	59.3	Low	123 Å²	123	98.9 Å²	98.9	58%	0.575	49%	0.494	S	S	*	.	H	α-helix	trans	-62.8	-46.9	178.5	-174.9	177.2	-163.7	0	0	111.6	A91 S92 N97 I98 L99	A91-E95 PolarHBondContact O-N 2.92Å; S92-E95 PolarHBondContact O-N 3.4Å; E95-N97 PolarHBondContact O-N 3.18Å; E95-I98 PolarHBondContact O-N 3.16Å; E95-L99 HydrophobicContact CG-CD1 4.16Å; E95-L99 WeakPolarHBondContact O-CB 3.39Å; E95-L99 VanDerWaalsContact O-CG 3.32Å; E95-L99 WeakPolarHBondContact O-CG 3.46Å; E95-L99 PolarHBondContact O-N 2.82Å
96	T	56.2	Low	59.4	Low	63 Å²	63	103.3 Å²	103.3	39%	0.387	51%	0.51	S	S	.	.	H	α-helix	trans	-63.7	-40.2	177.7	51.1	0	0	0	0	112	S92 L93 L99 Q100	S92-T96 WeakPolarHBondContact O-CB 3.46Å; S92-T96 WeakPolarHBondContact O-CG2 3.33Å; S92-T96 PolarHBondContact O-N 2.96Å; S92-T96 PolarHBondContact O-OG1 3.27Å; L93-T96 WeakPolarHBondContact CA-OG1 3.48Å; L93-T96 PolarHBondContact O-OG1 3.44Å; T96-L99 PolarHBondContact O-N 3.42Å; T96-Q100 WeakPolarHBondContact O-CB 3.42Å; T96-Q100 WeakPolarHBondContact O-CG 3.5Å; T96-Q100 PolarHBondContact O-N 3.13Å
97	N	56.1	Low	60.2	Low	107 Å²	107	101.3 Å²	101.3	57%	0.572	51%	0.507	S	S	*	.	H	α-helix	trans	-66.2	-41.6	175.5	-163.5	-34.6	0	0	0	111.6	L93 R94 E95 Q100 S101	L93-N97 VanDerWaalsContact O-CB 3.22Å; L93-N97 WeakPolarHBondContact O-CB 3.4Å; L93-N97 PolarHBondContact O-N 3.31Å; R94-N97 PolarHBondContact O-N 3.48Å; E95-N97 PolarHBondContact O-N 3.18Å; N97-Q100 PolarHBondContact O-N 3.3Å; N97-S101 WeakPolarHBondContact O-CB 3.19Å; N97-S101 PolarHBondContact O-N 2.8Å
98	I	56.6	Low	60.5	Low	106 Å²	106	99.4 Å²	99.4	54%	0.544	51%	0.505	S	S	.	.	H	α-helix	trans	-61.7	-46.5	173.7	-69.8	163.6	0	0	0	110.5	R94 E95 Q100 S101 V102	R94-I98 WeakPolarHBondContact O-CB 3.29Å; R94-I98 WeakPolarHBondContact O-CD1 3.2Å; R94-I98 WeakPolarHBondContact O-CG1 3.39Å; R94-I98 PolarHBondContact O-N 3.44Å; E95-I98 PolarHBondContact O-N 3.16Å; I98-Q100 PolarHBondContact O-N 2.94Å; I98-S101 PolarHBondContact O-N 3.02Å; I98-V102 HydrophobicContact CG2-CG2 4.1Å; I98-V102 VanDerWaalsContact O-CB 3.3Å; I98-V102 WeakPolarHBondContact O-CB 3.46Å; I98-V102 WeakPolarHBondContact O-CG2 3.23Å; I98-V102 PolarHBondContact O-N 3.12Å
99	L	59.2	Low	60.9	Low	110 Å²	110	99.8 Å²	99.8	58%	0.576	51%	0.51	S	S	*	.	H	α-helix	trans	-62.1	-44.8	179.4	-73.8	172.8	0	0	0	111.8	E95 T96 A103	E95-L99 HydrophobicContact CG-CD1 4.16Å; E95-L99 WeakPolarHBondContact O-CB 3.39Å; E95-L99 VanDerWaalsContact O-CG 3.32Å; E95-L99 WeakPolarHBondContact O-CG 3.46Å; E95-L99 PolarHBondContact O-N 2.82Å; T96-L99 PolarHBondContact O-N 3.42Å; L99-A103 VanDerWaalsContact O-CB 3.28Å; L99-A103 WeakPolarHBondContact O-CB 2.98Å; L99-A103 PolarHBondContact O-N 3Å
100	Q	63.4	Low	61.7	Low	130 Å²	130	98.7 Å²	98.7	61%	0.607	51%	0.508	S	S	*	.	H	α-helix	trans	-63.8	-45.3	175.1	-75.3	-176.5	-7.1	0	0	111.8	T96 N97 I98 V102 A103 Q104	T96-Q100 WeakPolarHBondContact O-CB 3.42Å; T96-Q100 WeakPolarHBondContact O-CG 3.5Å; T96-Q100 PolarHBondContact O-N 3.13Å; N97-Q100 PolarHBondContact O-N 3.3Å; I98-Q100 PolarHBondContact O-N 2.94Å; Q100-V102 PolarHBondContact O-N 3.47Å; Q100-A103 PolarHBondContact O-N 3.4Å; Q100-Q104 WeakPolarHBondContact O-CB 3.18Å; Q100-Q104 WeakPolarHBondContact O-CG 3.42Å; Q100-Q104 PolarHBondContact O-N 3.13Å
101	S	60.7	Low	62.4	Low	36 Å²	36	100.2 Å²	100.2	25%	0.252	52%	0.515	S	S	.	.	H	α-helix	trans	-62.4	-43.3	177.9	-173.1	0	0	0	0	111.9	N97 I98 Q104 K105	N97-S101 WeakPolarHBondContact O-CB 3.19Å; N97-S101 PolarHBondContact O-N 2.8Å; I98-S101 PolarHBondContact O-N 3.02Å; S101-Q104 PolarHBondContact O-N 2.84Å; S101-K105 WeakPolarHBondContact O-CB 3.22Å; S101-K105 VanDerWaalsContact O-CG 3.31Å; S101-K105 WeakPolarHBondContact O-CG 3.47Å; S101-K105 PolarHBondContact O-N 3.11Å
102	V	61.2	Low	63	Low	56 Å²	56	102.5 Å²	102.5	34%	0.339	52%	0.516	S	S	.	.	H	α-helix	trans	-65.2	-42.1	176	170	0	0	0	0	110.7	I98 Q100 K105 R106	I98-V102 HydrophobicContact CG2-CG2 4.1Å; I98-V102 VanDerWaalsContact O-CB 3.3Å; I98-V102 WeakPolarHBondContact O-CB 3.46Å; I98-V102 WeakPolarHBondContact O-CG2 3.23Å; I98-V102 PolarHBondContact O-N 3.12Å; Q100-V102 PolarHBondContact O-N 3.47Å; V102-K105 PolarHBondContact O-N 3.06Å; V102-R106 HydrophobicContact CG1-CG 4.42Å; V102-R106 WeakPolarHBondContact O-CB 3.37Å; V102-R106 WeakPolarHBondContact O-CG 3.28Å; V102-R106 PolarHBondContact O-N 2.75Å
103	A	66.8	Low	63.7	Low	57 Å²	57	107.9 Å²	107.9	47%	0.471	53%	0.527	S	S	.	.	H	α-helix	trans	-61.9	-45.5	175.9	0	0	0	0	0	111.6	L99 Q100 R106 H107	L99-A103 VanDerWaalsContact O-CB 3.28Å; L99-A103 WeakPolarHBondContact O-CB 2.98Å; L99-A103 PolarHBondContact O-N 3Å; Q100-A103 PolarHBondContact O-N 3.4Å; A103-R106 PolarHBondContact O-N 3.3Å; A103-H107 WeakPolarHBondContact O-CB 3.49Å; A103-H107 PolarHBondContact O-N 2.85Å
104	Q	67.2	Low	64.8	Low	137 Å²	137	107.9 Å²	107.9	64%	0.64	52%	0.524	S	S	*	.	H	α-helix	trans	-61.2	-45.4	175.4	-74.4	175.5	-10.5	0	0	111.9	Q100 S101 H107 A108	Q100-Q104 WeakPolarHBondContact O-CB 3.18Å; Q100-Q104 WeakPolarHBondContact O-CG 3.42Å; Q100-Q104 PolarHBondContact O-N 3.13Å; S101-Q104 PolarHBondContact O-N 2.84Å; Q104-H107 PolarHBondContact O-N 3.14Å; Q104-A108 WeakPolarHBondContact O-CB 3.26Å; Q104-A108 PolarHBondContact O-N 3.1Å
105	K	63.6	Low	65.7	Low	146 Å²	146	102.9 Å²	102.9	64%	0.635	51%	0.511	S	S	*	.	H	α-helix	trans	-63.8	-41.2	177.2	-73.9	177.1	-176.3	-180	0	112.1	S101 V102 A108 L109	S101-K105 WeakPolarHBondContact O-CB 3.22Å; S101-K105 VanDerWaalsContact O-CG 3.31Å; S101-K105 WeakPolarHBondContact O-CG 3.47Å; S101-K105 PolarHBondContact O-N 3.11Å; V102-K105 PolarHBondContact O-N 3.06Å; K105-A108 PolarHBondContact O-N 2.83Å; K105-L109 VanDerWaalsContact O-CB 3.29Å; K105-L109 WeakPolarHBondContact O-CB 3.32Å; K105-L109 PolarHBondContact O-N 3.36Å
106	R	64	Low	66.3	Low	186 Å²	186	101.2 Å²	101.2	70%	0.702	50%	0.504	S	S	*	.	H	α-helix	trans	-63.1	-43.1	174.5	-77	177.2	178.1	171.3	1	111.6	V102 A103 L109 M110	V102-R106 HydrophobicContact CG1-CG 4.42Å; V102-R106 WeakPolarHBondContact O-CB 3.37Å; V102-R106 WeakPolarHBondContact O-CG 3.28Å; V102-R106 PolarHBondContact O-N 2.75Å; A103-R106 PolarHBondContact O-N 3.3Å; R106-L109 PolarHBondContact O-N 3.47Å; R106-M110 WeakPolarHBondContact O-CB 3.43Å; R106-M110 PolarHBondContact O-N 3.36Å
107	H	75.8	Confident	67.1	Low	108 Å²	108	101.7 Å²	101.7	50%	0.5	50%	0.504	S	S	.	.	H	α-helix	trans	-63	-47.8	176.2	-177.4	-92.9	0	0	0	111.5	A103 Q104 L109 M110 M111	A103-H107 WeakPolarHBondContact O-CB 3.49Å; A103-H107 PolarHBondContact O-N 2.85Å; Q104-H107 PolarHBondContact O-N 3.14Å; H107-L109 VanDerWaalsContact C-N 3.3Å; H107-L109 PolarHBondContact O-N 3.29Å; H107-M110 WeakPolarHBondContact O-CB 3.42Å; H107-M110 PolarHBondContact O-N 2.76Å; H107-M111 WeakPolarHBondContact O-CG 3.36Å; H107-M111 PolarHBondContact O-N 3.22Å
108	A	70.3	Confident	67.7	Low	59 Å²	59	100.4 Å²	100.4	49%	0.488	50%	0.495	S	S	.	.	H	α-helix	trans	-58.6	-42.7	176.4	0	0	0	0	0	111.8	Q104 K105 M111 H112	Q104-A108 WeakPolarHBondContact O-CB 3.26Å; Q104-A108 PolarHBondContact O-N 3.1Å; K105-A108 PolarHBondContact O-N 2.83Å; A108-M111 PolarHBondContact O-N 3.37Å; A108-H112 WeakPolarHBondContact O-CB 3.46Å; A108-H112 PolarHBondContact O-N 3.38Å
109	L	70	Confident	67.8	Low	125 Å²	125	100.8 Å²	100.8	65%	0.654	50%	0.495	S	S	*	.	H	α-helix	trans	-68.3	-36.3	178.1	-164.6	130.1	0	0	0	112.4	K105 R106 H107 R113	K105-L109 VanDerWaalsContact O-CB 3.29Å; K105-L109 WeakPolarHBondContact O-CB 3.32Å; K105-L109 PolarHBondContact O-N 3.36Å; R106-L109 PolarHBondContact O-N 3.47Å; H107-L109 VanDerWaalsContact C-N 3.3Å; H107-L109 PolarHBondContact O-N 3.29Å; L109-R113 WeakPolarHBondContact O-CB 3.36Å; L109-R113 PolarHBondContact O-N 2.77Å
110	M	73.7	Confident	68.1	Low	93 Å²	93	102.3 Å²	102.3	46%	0.458	50%	0.504	S	S	.	.	H	α-helix	trans	-63.8	-48.2	173.4	-179	-175.3	70.6	0	0	111.5	R106 H107 H112 R113 Q114	R106-M110 WeakPolarHBondContact O-CB 3.43Å; R106-M110 PolarHBondContact O-N 3.36Å; H107-M110 WeakPolarHBondContact O-CB 3.42Å; H107-M110 PolarHBondContact O-N 2.76Å; M110-H112 VanDerWaalsContact C-N 3.34Å; M110-H112 PolarHBondContact O-N 3.46Å; M110-R113 PolarHBondContact O-N 2.86Å; M110-Q114 WeakPolarHBondContact O-CG 3.13Å; M110-Q114 PolarHBondContact O-N 2.87Å
111	M	73.7	Confident	68	Low	83 Å²	83	103.9 Å²	103.9	41%	0.409	51%	0.509	S	S	.	.	H	α-helix	trans	-61.3	-43.1	176.5	-67.7	-57.2	-60.5	0	0	111.4	H107 A108 R113 Q114 L115	H107-M111 WeakPolarHBondContact O-CG 3.36Å; H107-M111 PolarHBondContact O-N 3.22Å; A108-M111 PolarHBondContact O-N 3.37Å; M111-R113 PolarHBondContact O-N 2.92Å; M111-Q114 PolarHBondContact O-N 3.21Å; M111-Q114 PolarHBondContact SD-OE1 2.8Å; M111-L115 WeakPolarHBondContact O-CB 3.35Å; M111-L115 PolarHBondContact O-N 3.15Å
112	H	71.6	Confident	67.9	Low	103 Å²	103	105.2 Å²	105.2	48%	0.477	53%	0.529	S	S	.	.	H	α-helix	trans	-61.8	-43	176.2	-178.3	66.2	0	0	0	111.8	A108 M110 Q114 L115 M116	A108-H112 WeakPolarHBondContact O-CB 3.46Å; A108-H112 PolarHBondContact O-N 3.38Å; M110-H112 VanDerWaalsContact C-N 3.34Å; M110-H112 PolarHBondContact O-N 3.46Å; H112-Q114 PolarHBondContact O-N 2.79Å; H112-L115 WeakPolarHBondContact O-CB 3.37Å; H112-L115 PolarHBondContact O-N 3.35Å; H112-M116 WeakPolarHBondContact O-CG 3.18Å; H112-M116 PolarHBondContact O-N 3.3Å
113	R	66.4	Low	67.6	Low	174 Å²	174	106.2 Å²	106.2	66%	0.657	54%	0.535	S	S	*	.	H	α-helix	trans	-63.7	-40.5	175.8	-174.1	-178.8	-178.6	-167.1	0.5	112.2	L109 M110 M111 M116 N117	L109-R113 WeakPolarHBondContact O-CB 3.36Å; L109-R113 PolarHBondContact O-N 2.77Å; M110-R113 PolarHBondContact O-N 2.86Å; M111-R113 PolarHBondContact O-N 2.92Å; R113-M116 PolarHBondContact O-N 2.76Å; R113-N117 WeakPolarHBondContact O-CB 3.45Å; R113-N117 PolarHBondContact O-N 3.28Å; R113-N117 PolarHBondContact O-ND2 3.24Å
114	Q	72.8	Confident	66.9	Low	88 Å²	88	112.3 Å²	112.3	41%	0.411	55%	0.553	S	S	.	*	H	α-helix	trans	-60.8	-47.8	174.8	-75.4	174	-16.4	0	0	110.8	M110 M111 H112 M116 N117 E118	M110-Q114 WeakPolarHBondContact O-CG 3.13Å; M110-Q114 PolarHBondContact O-N 2.87Å; M111-Q114 PolarHBondContact O-N 3.21Å; M111-Q114 PolarHBondContact SD-OE1 2.8Å; H112-Q114 PolarHBondContact O-N 2.79Å; Q114-M116 PolarHBondContact O-N 2.82Å; Q114-N117 PolarHBondContact O-N 2.87Å; Q114-E118 WeakPolarHBondContact O-CG 3.29Å; Q114-E118 PolarHBondContact O-N 3.17Å
115	L	74.5	Confident	66.1	Low	71 Å²	71	109.2 Å²	109.2	37%	0.372	54%	0.541	S	S	.	.	H	α-helix	trans	-56.9	-48.3	176.6	-174.6	73.7	0	0	0	111.9	M111 H112 N117 E118 M119 L125	M111-L115 WeakPolarHBondContact O-CB 3.35Å; M111-L115 PolarHBondContact O-N 3.15Å; H112-L115 WeakPolarHBondContact O-CB 3.37Å; H112-L115 PolarHBondContact O-N 3.35Å; L115-N117 VanDerWaalsContact C-N 3.34Å; L115-N117 PolarHBondContact O-N 3.45Å; L115-E118 PolarHBondContact O-N 3.19Å; L115-M119 HydrophobicContact CG-SD 4.43Å; L115-M119 WeakPolarHBondContact O-CG 3.43Å; L115-M119 PolarHBondContact O-N 3.45Å; L115-L125 HydrophobicContact CD1-CD1 3.58Å; L115-L125 HydrophobicContact CD1-CD2 3.84Å; L115-L125 HydrophobicContact CD1-CG 4.38Å
116	M	68.8	Low	65.4	Low	87 Å²	87	107.2 Å²	107.2	43%	0.429	54%	0.543	S	S	.	.	H	α-helix	trans	-63	-40.2	178.3	-67.2	-57.6	-132	0	0	112.1	H112 R113 Q114 E118 M119 D120	H112-M116 WeakPolarHBondContact O-CG 3.18Å; H112-M116 PolarHBondContact O-N 3.3Å; R113-M116 PolarHBondContact O-N 2.76Å; Q114-M116 PolarHBondContact O-N 2.82Å; M116-E118 VanDerWaalsContact C-N 3.31Å; M116-E118 PolarHBondContact O-N 2.93Å; M116-M119 PolarHBondContact O-N 3.3Å; M116-M119 HydrophobicContact SD-SD 4.28Å; M116-D120 WeakPolarHBondContact O-CB 3.45Å; M116-D120 PolarHBondContact O-N 2.84Å
117	N	73.4	Confident	64.7	Low	73 Å²	73	106.3 Å²	106.3	39%	0.39	55%	0.552	S	S	.	*	H	α-helix	trans	-66.3	-31.9	175.9	-70.7	-25.8	0	0	0	112.8	R113 Q114 L115 K121	R113-N117 WeakPolarHBondContact O-CB 3.45Å; R113-N117 PolarHBondContact O-N 3.28Å; R113-N117 PolarHBondContact O-ND2 3.24Å; Q114-N117 PolarHBondContact O-N 2.87Å; L115-N117 VanDerWaalsContact C-N 3.34Å; L115-N117 PolarHBondContact O-N 3.45Å; N117-K121 WeakPolarHBondContact O-CB 3.24Å; N117-K121 WeakPolarHBondContact O-CD 3.19Å; N117-K121 WeakPolarHBondContact O-CG 3.46Å; N117-K121 PolarHBondContact O-N 3Å
118	E	69.1	Low	63.1	Low	81 Å²	81	109 Å²	109	38%	0.379	57%	0.565	S	S	.	*	H	α-helix	trans	-74.1	-39.9	176.1	-74.3	178	178.7	0	0	111.3	Q114 L115 M116 K121 G122 V123 L125	Q114-E118 WeakPolarHBondContact O-CG 3.29Å; Q114-E118 PolarHBondContact O-N 3.17Å; L115-E118 PolarHBondContact O-N 3.19Å; M116-E118 VanDerWaalsContact C-N 3.31Å; M116-E118 PolarHBondContact O-N 2.93Å; E118-K121 PolarHBondContact O-N 3.44Å; E118-G122 PolarHBondContact O-N 2.85Å; E118-V123 PolarHBondContact O-N 3.34Å; E118-V123 VanDerWaalsContact O-N 3.14Å; E118-L125 WeakPolarHBondContact OE2-CD2 3.42Å
119	M	58.3	Low	61.9	Low	113 Å²	113	113.3 Å²	113.3	56%	0.557	58%	0.578	S	S	*	*	H	α-helix	trans	-60.6	-45	171.6	-72.8	-179.1	55.1	0	0	111.8	L115 M116 K121 G122 L125	L115-M119 HydrophobicContact CG-SD 4.43Å; L115-M119 WeakPolarHBondContact O-CG 3.43Å; L115-M119 PolarHBondContact O-N 3.45Å; M116-M119 PolarHBondContact O-N 3.3Å; M116-M119 HydrophobicContact SD-SD 4.28Å; M119-K121 PolarHBondContact O-N 3.49Å; M119-G122 PolarHBondContact O-N 3.47Å; M119-L125 HydrophobicContact CG-CD1 4.27Å
120	D	64.4	Low	60.4	Low	143 Å²	143	112.6 Å²	112.6	77%	0.765	58%	0.584	S	S	*	*	H	α-helix	trans	-64.1	-27.7	176.7	-77.9	-13.7	0	0	0	112.5	M116 G122	M116-D120 WeakPolarHBondContact O-CB 3.45Å; M116-D120 PolarHBondContact O-N 2.84Å; D120-G122 VanDerWaalsContact C-N 3.26Å; D120-G122 PolarHBondContact O-N 2.85Å
121	K	62	Low	59	Low	163 Å²	163	113.9 Å²	113.9	71%	0.709	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-0.3	175.8	-73.5	173.9	-176.4	-176.4	0	113.4	N117 E118 M119 V123	N117-K121 WeakPolarHBondContact O-CB 3.24Å; N117-K121 WeakPolarHBondContact O-CD 3.19Å; N117-K121 WeakPolarHBondContact O-CG 3.46Å; N117-K121 PolarHBondContact O-N 3Å; E118-K121 PolarHBondContact O-N 3.44Å; M119-K121 PolarHBondContact O-N 3.49Å; K121-V123 HydrophobicContact CB-CG2 3.88Å; K121-V123 PolarHBondContact O-N 2.93Å
122	G	57.8	Low	57.4	Low	64 Å²	64	115.1 Å²	115.1	66%	0.66	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	62	24.6	-176.5	0	0	0	0	0	113	E118 M119 D120 E124	E118-G122 PolarHBondContact O-N 2.85Å; M119-G122 PolarHBondContact O-N 3.47Å; D120-G122 VanDerWaalsContact C-N 3.26Å; D120-G122 PolarHBondContact O-N 2.85Å; G122-E124 PolarHBondContact O-N 3.13Å
123	V	54.7	Low	55.8	Low	77 Å²	77	115.9 Å²	115.9	47%	0.467	62%	0.616	S	S	.	*			trans	-78.3	108.8	175.6	-179.5	0	0	0	0	106.9	E118 K121 L125	E118-V123 PolarHBondContact O-N 3.34Å; E118-V123 VanDerWaalsContact O-N 3.14Å; K121-V123 HydrophobicContact CB-CG2 3.88Å; K121-V123 PolarHBondContact O-N 2.93Å; V123-L125 PolarHBondContact O-N 2.9Å
124	E	52	Low	54.1	Low	185 Å²	185	112.2 Å²	112.2	86%	0.864	62%	0.617	S	S	*	*			trans	-57.8	104.6	169.6	-73.5	-174	160.7	0	0	108.7	G122 P126	G122-E124 PolarHBondContact O-N 3.13Å; E124-P126 WeakPolarHBondContact O-CD 3.46Å
125	L	52.3	Low	52.4	Low	72 Å²	72	113.8 Å²	113.8	38%	0.377	64%	0.635	S	S	.	*			trans	-63.3	121.1	177	-85.4	129	0	0	0	109	L115 E118 M119 V123 N127	L115-L125 HydrophobicContact CD1-CD1 3.58Å; L115-L125 HydrophobicContact CD1-CD2 3.84Å; L115-L125 HydrophobicContact CD1-CG 4.38Å; E118-L125 WeakPolarHBondContact OE2-CD2 3.42Å; M119-L125 HydrophobicContact CG-CD1 4.27Å; V123-L125 PolarHBondContact O-N 2.9Å; L125-N127 PolarHBondContact O-N 3.12Å
126	P	48.8	Very low	50.7	Low	104 Å²	104	115.8 Å²	115.8	68%	0.675	66%	0.655	S	S	*	*			trans	-62.7	127.2	172.9	24	-30	0	0	0	108.7	E124 Q128	E124-P126 WeakPolarHBondContact O-CD 3.46Å; P126-Q128 PolarHBondContact O-N 3.45Å
127	N	48.7	Very low	49.1	Very low	166 Å²	166	122.1 Å²	122.1	89%	0.888	67%	0.674	S	S	*	*	S	Bend	trans	-52.7	61.1	175.8	-83.6	-30	0	0	0	114.2	L125	L125-N127 PolarHBondContact O-N 3.12Å
128	Q	42.1	Very low	47.3	Very low	166 Å²	166	124.7 Å²	124.7	78%	0.776	70%	0.698	S	S	*	*			trans	-136.1	27.2	-176.9	-76.5	-149.2	62.9	0	0	114.4	P126	P126-Q128 PolarHBondContact O-N 3.45Å
129	L	44.3	Very low	45.7	Very low	148 Å²	148	125.2 Å²	125.2	78%	0.775	72%	0.716	S	S	*	*			trans	-117.8	67.4	153.5	-71.3	168.2	0	0	0	108.1	I131	L129-I131 HydrophobicContact CB-CG1 4.47Å; L129-I131 PolarHBondContact O-N 3.44Å
130	S	38.3	Very low	44.6	Very low	111 Å²	111	125 Å²	125	78%	0.776	73%	0.725	S	S	*	*			trans	-54.7	80.5	144.8	-50.6	0	0	0	0	106.6	S132	S130-S132 PolarHBondContact O-N 2.84Å
131	I	44.1	Very low	43.3	Very low	119 Å²	119	122.9 Å²	122.9	61%	0.61	72%	0.722	S	S	*	*			trans	-60.1	102.1	162.2	-53.4	173.3	0	0	0	102.2	L129 N133	L129-I131 HydrophobicContact CB-CG1 4.47Å; L129-I131 PolarHBondContact O-N 3.44Å; I131-N133 VanDerWaalsContact CG2-CG 3.46Å; I131-N133 WeakPolarHBondContact CG2-OD1 3.42Å; I131-N133 PolarHBondContact O-N 3.32Å
132	S	40.4	Very low	42.2	Very low	109 Å²	109	123.7 Å²	123.7	76%	0.762	73%	0.728	S	S	*	*			trans	-65.3	76.4	170	66.3	0	0	0	0	106.6	S130 S134	S130-S132 PolarHBondContact O-N 2.84Å; S132-S134 PolarHBondContact O-N 3.48Å
133	N	38.4	Very low	41.1	Very low	119 Å²	119	126.7 Å²	126.7	64%	0.636	73%	0.734	S	S	*	*			trans	-78	74.8	168.1	-77.2	-29.9	0	0	0	106.4	I131	I131-N133 VanDerWaalsContact CG2-CG 3.46Å; I131-N133 WeakPolarHBondContact CG2-OD1 3.42Å; I131-N133 PolarHBondContact O-N 3.32Å
134	S	31.2	Very low	40.4	Very low	97 Å²	97	126.7 Å²	126.7	68%	0.678	74%	0.742	S	S	*	*			trans	-165.8	116.7	160.1	-76.9	0	0	0	0	107.6	S132	S132-S134 PolarHBondContact O-N 3.48Å
135	P	37.8	Very low	39.9	Very low	121 Å²	121	122.8 Å²	122.8	79%	0.786	73%	0.73	S	S	*	*				-116	101	53.5	28.3	-14.6	0	0	0	112.4	R137	P135-R137 PolarHBondContact O-N 3.16Å
136	S	38.7	Very low	39.2	Very low	113 Å²	113	127.7 Å²	127.7	79%	0.79	75%	0.751	S	S	*	*			trans	-65.7	81.6	148.1	-62.3	0	0	0	0	107.8
137	R	33.9	Very low	38.6	Very low	220 Å²	220	131 Å²	131	83%	0.83	76%	0.755	S	S	*	*			trans	-142	50.4	161.8	-142	178.8	-171.7	-171	1.7	110.1	P135	P135-R137 PolarHBondContact O-N 3.16Å
138	S	35.4	Very low	38.2	Very low	128 Å²	128	127.6 Å²	127.6	90%	0.895	75%	0.745	S	S	*	*			trans	-106	64.5	162	-56.7	0	0	0	0	108.2
139	A	36.6	Very low	38.5	Very low	91 Å²	91	127.4 Å²	127.4	75%	0.752	75%	0.749	S	S	*	*			trans	-138.7	73.4	158.6	0	0	0	0	0	105.7
140	S	33.8	Very low	38.6	Very low	108 Å²	108	127.9 Å²	127.9	76%	0.755	75%	0.747	S	S	*	*			trans	-121.9	106.9	154.8	-65.3	0	0	0	0	104	E142	S140-E142 PolarHBondContact O-N 3.02Å
141	S	38.1	Very low	38.9	Very low	99 Å²	99	130 Å²	130	69%	0.692	75%	0.75	S	S	*	*			trans	-40.3	129.3	176.5	53.7	0	0	0	0	109.3	T143	S141-T143 PolarHBondContact O-N 3.17Å
142	E	38	Very low	39	Very low	181 Å²	181	128.9 Å²	128.9	85%	0.846	76%	0.758	S	S	*	*				26.9	66.9	115.3	-154.4	169.5	-143.5	0	0	112.7	S140 A144	S140-E142 PolarHBondContact O-N 3.02Å; E142-A144 PolarHBondContact O-N 3.05Å
143	T	36	Very low	39	Very low	126 Å²	126	128.9 Å²	128.9	77%	0.773	75%	0.749	S	S	*	*			trans	-72.9	77.9	148.1	43.3	0	0	0	0	103.8	S141 V145	S141-T143 PolarHBondContact O-N 3.17Å; T143-V145 PolarHBondContact O-N 3.24Å
144	A	38.9	Very low	39.4	Very low	78 Å²	78	133.7 Å²	133.7	65%	0.645	76%	0.76	S	S	*	*			trans	-48.3	101.6	143.5	0	0	0	0	0	103.8	E142 E146	E142-A144 PolarHBondContact O-N 3.05Å; A144-E146 PolarHBondContact O-N 3.3Å
145	V	42.8	Very low	40	Very low	102 Å²	102	134 Å²	134	62%	0.618	75%	0.754	S	S	*	*			trans	-62.7	94.3	164.6	176.8	0	0	0	0	102.4	T143 F147	T143-V145 PolarHBondContact O-N 3.24Å; V145-F147 WeakPolarHBondContact O-CD2 3.4Å; V145-F147 PolarHBondContact O-N 3.16Å
146	E	37.7	Very low	40.1	Very low	175 Å²	175	136 Å²	136	82%	0.818	76%	0.758	S	S	*	*			trans	-57.8	98.1	168.6	-165.3	171.2	-157.3	0	0	104	A144 S148	A144-E146 PolarHBondContact O-N 3.3Å; E146-S148 VanDerWaalsContact C-N 3.28Å; E146-S148 PolarHBondContact O-N 2.73Å
147	F	35.4	Very low	40.1	Very low	174 Å²	174	140.6 Å²	140.6	76%	0.763	76%	0.758	S	S	*	*			trans	-62.5	101	170.1	-71	-88.9	0	0	0	104.6	V145 D149	V145-F147 WeakPolarHBondContact O-CD2 3.4Å; V145-F147 PolarHBondContact O-N 3.16Å; F147-D149 PolarHBondContact O-N 3.13Å; F147-D149 VanDerWaalsContact O-N 3.08Å
148	S	41.1	Very low	40.4	Very low	94 Å²	94	141.3 Å²	141.3	66%	0.657	78%	0.779	S	S	*	*			trans	-58.8	115.7	166	-54.5	0	0	0	0	106.4	E146 E150	E146-S148 VanDerWaalsContact C-N 3.28Å; E146-S148 PolarHBondContact O-N 2.73Å; S148-E150 PolarHBondContact O-N 3.43Å
149	D	47.3	Very low	40.6	Very low	162 Å²	162	142 Å²	142	87%	0.866	77%	0.773	S	S	*	*			trans	-70.5	36.5	173.9	-78	-38.8	0	0	0	111.7	F147	F147-D149 PolarHBondContact O-N 3.13Å; F147-D149 VanDerWaalsContact O-N 3.08Å
150	E	46.1	Very low	40.8	Very low	159 Å²	159	144.6 Å²	144.6	74%	0.743	77%	0.774	S	S	*	*			trans	-132.8	77.6	-172.2	-70.3	178.2	162.9	0	0	108.3	S148	S148-E150 PolarHBondContact O-N 3.43Å
151	D	45	Very low	41.2	Very low	156 Å²	156	146.7 Å²	146.7	83%	0.834	78%	0.775	S	S	*	*			trans	-179.8	44.1	137.6	-87	-23.4	0	0	0	111	N153	D151-N153 PolarHBondContact O-N 2.88Å
152	A	46.1	Very low	41.4	Very low	94 Å²	94	149.5 Å²	149.5	78%	0.777	78%	0.78	S	S	*	*			trans	-82.2	38.8	154.3	0	0	0	0	0	110.3	Y154	A152-Y154 PolarHBondContact O-N 3.06Å
153	N	41.8	Very low	41.6	Very low	109 Å²	109	147.5 Å²	147.5	58%	0.583	78%	0.776	S	S	*	*			trans	-83.2	76.4	166.5	-160.2	-3.3	0	0	0	107.9	D151 N155	D151-N153 PolarHBondContact O-N 2.88Å; N153-N155 PolarHBondContact O-N 3.22Å
154	Y	44.9	Very low	42	Very low	221 Å²	221	148.9 Å²	148.9	87%	0.867	78%	0.776	S	S	*	*			trans	-59.4	78.5	160.3	-94.9	-94	0	0	0	108	A152 N156	A152-Y154 PolarHBondContact O-N 3.06Å; Y154-N156 PolarHBondContact O-N 3.12Å
155	N	44.9	Very low	42.2	Very low	102 Å²	102	154 Å²	154	55%	0.545	79%	0.785	S	S	.	*			trans	-72.9	88.4	171.2	-106.6	-29.2	0	0	0	107.6	N153 R157	N153-N155 PolarHBondContact O-N 3.22Å; N155-R157 VanDerWaalsContact C-N 3.31Å; N155-R157 PolarHBondContact O-N 3.27Å
156	N	40.1	Very low	42.2	Very low	163 Å²	163	158 Å²	158	87%	0.872	80%	0.798	S	S	*	*			trans	-50.2	95.1	157	-140.3	-4.3	0	0	0	107.4	Y154	Y154-N156 PolarHBondContact O-N 3.12Å
157	R	38.3	Very low	42.5	Very low	211 Å²	211	156.6 Å²	156.6	80%	0.796	80%	0.796	S	S	*	*			trans	-119.7	95.9	173.4	-83.4	-172	173.6	-177.6	-0.8	108.8	N155	N155-R157 VanDerWaalsContact C-N 3.31Å; N155-R157 PolarHBondContact O-N 3.27Å
158	N	39.5	Very low	43.2	Very low	234 Å²	234	155 Å²	155	100%	1.251	80%	0.799	S	S	*	*			trans	47.4	0	149	-66.6	-7	0	0	0	118.8

Retrieved 158 of 158 residues in 786.1 ms (Link to these results)

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