A0A077Z1A3_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z1A3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 126 aa.

						>A0A077Z1A3_TRITR|A0A077Z1A3
MNHIQEGSMLKEWRLQFLNHTNPVQLRCVACNEFCDNLYKLQLHVSSTRHKYCLRALEKVRNGPQSSQADKTNAPDSTSDLRNRDQRALYCVLCRFATTERKRMFGNEQLFHSYVFRRNQFASELQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	36.2	Very low	47.4	Very low	207 Å²	207	145.4 Å²	145.4	100%	1.02	74%	0.739	S	S	*	*				0	99.2	0	-75.4	-61.9	-174.9	0	0	108.4
2	N	44.7	Very low	46.8	Very low	124 Å²	124	145.4 Å²	145.4	66%	0.663	73%	0.734	S	S	*	*			trans	-173.8	84.8	157.5	-90.5	-27.7	0	0	0	107.1	I4 L18	N2-I4 PolarHBondContact O-N 3.09Å; N2-L18 WeakPolarHBondContact ND2-CD2 2.99Å
3	H	48.9	Very low	47.2	Very low	175 Å²	175	149.1 Å²	149.1	81%	0.81	73%	0.734	S	S	*	*			trans	-80.7	104.6	173.8	-62.5	-87.5	0	0	0	107.5
4	I	56.6	Low	47.1	Very low	122 Å²	122	153.1 Å²	153.1	63%	0.626	74%	0.737	S	S	*	*			trans	-95.3	105.3	167.7	-61.4	178	0	0	0	106.8	N2 L18	N2-I4 PolarHBondContact O-N 3.09Å; I4-L18 HydrophobicContact CD1-CD1 4.14Å
5	Q	51.8	Low	47.4	Very low	182 Å²	182	147.5 Å²	147.5	85%	0.85	71%	0.712	S	S	*	*			trans	-71.8	125.1	-179.8	-168.1	172.5	-8.8	0	0	109.5	G7	Q5-G7 PolarHBondContact O-N 3.11Å; Q5-G7 VanDerWaalsContact O-N 3.17Å
6	E	44.8	Very low	47.5	Very low	191 Å²	191	149 Å²	149	89%	0.893	72%	0.717	S	S	*	*			trans	-57.9	114.8	177.2	-66.4	-178.2	155.4	0	0	110.7
7	G	41.3	Very low	47.1	Very low	35 Å²	35	152.4 Å²	152.4	36%	0.361	73%	0.729	S	S	.	*			trans	-79.4	126.8	173.1	0	0	0	0	0	111.2	Q5	Q5-G7 PolarHBondContact O-N 3.11Å; Q5-G7 VanDerWaalsContact O-N 3.17Å
8	S	48.2	Very low	47.1	Very low	81 Å²	81	148.6 Å²	148.6	57%	0.566	71%	0.712	S	S	*	*			trans	-75.5	162.2	168.5	85	0	0	0	0	111.2	L10 K11	S8-L10 PolarHBondContact O-N 3.4Å; S8-K11 PolarHBondContact O-N 2.94Å; S8-K11 VanDerWaalsContact O-N 3.15Å
9	M	50.1	Low	47	Very low	158 Å²	158	147.6 Å²	147.6	78%	0.778	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	1.9	-168.3	-66.8	-125.7	124.1	0	0	117.5	R61	M9-R61 PolarHBondContact SD-NH1 3.35Å
10	L	52.6	Low	47.2	Very low	167 Å²	167	150.6 Å²	150.6	87%	0.874	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.4	3.9	-178.4	-68.4	172	0	0	0	114	S8	S8-L10 PolarHBondContact O-N 3.4Å
11	K	45.7	Very low	47.7	Very low	157 Å²	157	149.1 Å²	149.1	68%	0.683	72%	0.724	S	S	*	*	S	Bend	trans	-116.6	120.4	-178.5	-72.9	-173.5	175.5	-176.8	0	111.6	S8 W13	S8-K11 PolarHBondContact O-N 2.94Å; S8-K11 VanDerWaalsContact O-N 3.15Å; K11-W13 PolarHBondContact O-N 2.95Å
12	E	40.3	Very low	48.4	Very low	146 Å²	146	145.5 Å²	145.5	68%	0.682	71%	0.709	S	S	*	*			trans	-43.9	123.8	174.4	-60.3	176.6	159.8	0	0	111.4	R14	E12-R14 VanDerWaalsContact C-N 3.3Å; E12-R14 PolarHBondContact O-N 3.47Å; E12-R14 IonicContact OE2-CZ 3.78Å; E12-R14 IonicContact OE2-NE 3.52Å; E12-R14 IonicContact OE2-NH2 3.11Å; E12-R14 PolarHBondContact OE2-NH2 3.33Å; E12-R14 VanDerWaalsContact OE2-NH2 3.11Å
13	W	51.8	Low	49.1	Very low	193 Å²	193	144.3 Å²	144.3	73%	0.731	71%	0.708	S	S	*	*			trans	-70.6	83.9	174.9	-66.7	83.2	0	0	0	109.9	K11 L15	K11-W13 PolarHBondContact O-N 2.95Å; W13-L15 VanDerWaalsContact C-N 3.33Å; W13-L15 PolarHBondContact O-N 3.33Å
14	R	46.9	Very low	49.9	Very low	205 Å²	205	139 Å²	139	77%	0.774	69%	0.688	S	S	*	*			trans	-82.7	84.3	165.6	-63.7	-173.8	-171.8	-165.5	1.6	108.1	E12 Q16	E12-R14 VanDerWaalsContact C-N 3.3Å; E12-R14 PolarHBondContact O-N 3.47Å; E12-R14 IonicContact OE2-CZ 3.78Å; E12-R14 IonicContact OE2-NE 3.52Å; E12-R14 IonicContact OE2-NH2 3.11Å; E12-R14 PolarHBondContact OE2-NH2 3.33Å; E12-R14 VanDerWaalsContact OE2-NH2 3.11Å; R14-Q16 PolarHBondContact O-N 2.96Å; R14-Q16 VanDerWaalsContact O-N 3.07Å
15	L	50.9	Low	50.5	Low	70 Å²	70	140.1 Å²	140.1	37%	0.366	69%	0.691	S	S	.	*			trans	-63.6	106.3	164.8	-98.8	99.6	0	0	0	108	W13 F17 L38	W13-L15 VanDerWaalsContact C-N 3.33Å; W13-L15 PolarHBondContact O-N 3.33Å; L15-F17 PolarHBondContact O-N 3.06Å; L15-L38 HydrophobicContact CB-CD1 4.46Å; L15-L38 HydrophobicContact CD1-CD2 4.09Å
16	Q	49.2	Very low	51.4	Low	171 Å²	171	132.9 Å²	132.9	80%	0.799	66%	0.657	S	S	*	*			trans	-66.2	124.8	162.3	-74.5	178.2	-10.1	0	0	107.7	R14 L18	R14-Q16 PolarHBondContact O-N 2.96Å; R14-Q16 VanDerWaalsContact O-N 3.07Å; Q16-L18 PolarHBondContact O-N 3.35Å; Q16-L18 VanDerWaalsContact O-N 3.08Å
17	F	40.1	Very low	53.1	Low	207 Å²	207	128 Å²	128	91%	0.908	63%	0.631	S	S	*	*			trans	-35.4	105.4	-178	-70.6	-100.3	0	0	0	113.8	L15	L15-F17 PolarHBondContact O-N 3.06Å
18	L	48	Very low	54.8	Low	83 Å²	83	126.8 Å²	126.8	44%	0.435	62%	0.617	S	S	.	*			trans	-97	111.4	165	-97.6	102.3	0	0	0	109.5	N2 I4 Q16	N2-L18 WeakPolarHBondContact ND2-CD2 2.99Å; I4-L18 HydrophobicContact CD1-CD1 4.14Å; Q16-L18 PolarHBondContact O-N 3.35Å; Q16-L18 VanDerWaalsContact O-N 3.08Å
19	N	44.7	Very low	56.1	Low	131 Å²	131	127.8 Å²	127.8	70%	0.701	62%	0.619	S	S	*	*			trans	-2.7	134.6	166.1	-67.1	-19.1	0	0	0	119.7	T21	N19-T21 PolarHBondContact O-N 3.35Å
20	H	52	Low	57.3	Low	207 Å²	207	121.2 Å²	121.2	96%	0.958	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	10.8	179.1	-85.1	53.4	0	0	0	117.5
21	T	56	Low	58.6	Low	120 Å²	120	113.9 Å²	113.9	74%	0.736	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.7	-2.9	-171.7	47.2	0	0	0	0	114.8	N19	N19-T21 PolarHBondContact O-N 3.35Å
22	N	52.2	Low	60.2	Low	131 Å²	131	110 Å²	110	70%	0.701	54%	0.539	S	S	*	.	S	Bend	trans	-125.7	117.3	172.3	-105.5	-51.8	0	0	0	109.7	V24	N22-V24 PolarHBondContact O-N 3.37Å
23	P	59.5	Low	61.8	Low	99 Å²	99	106.5 Å²	106.5	64%	0.643	52%	0.523	S	S	*	.			trans	-65.6	104.8	173.7	27	-31.5	0	0	0	108.4	Q25	P23-Q25 PolarHBondContact O-N 3.4Å
24	V	65	Low	63	Low	63 Å²	63	103.3 Å²	103.3	38%	0.382	51%	0.514	S	S	.	.			trans	-66.9	105.4	177.1	179	0	0	0	0	108.1	N22 L26 D36	N22-V24 PolarHBondContact O-N 3.37Å; V24-L26 HydrophobicContact CG1-CD2 3.65Å; V24-L26 HydrophobicContact CG1-CG 4.02Å; V24-L26 PolarHBondContact O-N 3.32Å; V24-D36 CarbonylContact O-C 3.39Å
25	Q	69.8	Low	64.5	Low	146 Å²	146	94.1 Å²	94.1	68%	0.682	48%	0.481	S	S	*	.			trans	-82.4	103.5	171.2	-67.2	-172.5	-16.5	0	0	109.6	P23 C35	P23-Q25 PolarHBondContact O-N 3.4Å; Q25-C35 CarbonylContact C-O 3.58Å
26	L	70.9	Confident	65.6	Low	29 Å²	29	94.5 Å²	94.5	15%	0.152	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	132.6	173.3	-57.7	170.4	0	0	0	109.2	V24 F34 C35 L38 L41	V24-L26 HydrophobicContact CG1-CD2 3.65Å; V24-L26 HydrophobicContact CG1-CG 4.02Å; V24-L26 PolarHBondContact O-N 3.32Å; L26-F34 CarbonylContact O-C 3.59Å; L26-F34 VanDerWaalsContact O-CA 3.31Å; L26-F34 WeakPolarHBondContact O-CA 3.42Å; L26-C35 HydrophobicContact CB-CB 4.27Å; L26-C35 PolarHBondContact N-O 3.44Å; L26-C35 PolarHBondContact O-N 3.11Å; L26-L38 HydrophobicContact CD1-CB 4.42Å; L26-L38 HydrophobicContact CD1-CD2 3.47Å; L26-L38 VanDerWaalsContact CD1-CD2 3.47Å; L26-L38 HydrophobicContact CD1-CG 3.92Å; L26-L41 HydrophobicContact CB-CD2 4.15Å; L26-L41 HydrophobicContact CD1-CB 4.09Å; L26-L41 HydrophobicContact CD1-CD2 3.89Å
27	R	79	Confident	66.7	Low	89 Å²	89	89.3 Å²	89.3	34%	0.336	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	123.9	178.2	-177.1	-177.4	171.2	-85.2	2.1	110.9	V29 N32 E33 F34	R27-V29 PolarHBondContact O-N 3.27Å; R27-N32 PolarHBondContact NE-OD1 3.06Å; R27-N32 VanDerWaalsContact NH2-CG 3.34Å; R27-N32 PolarHBondContact NH2-OD1 3.18Å; R27-E33 WeakPolarHBondContact CA-O 3.36Å; R27-F34 HydrophobicContact CB-CD1 3.98Å; R27-F34 HydrophobicContact CB-CE1 3.94Å; R27-F34 HydrophobicContact CG-CD1 4.25Å; R27-F34 HydrophobicContact CG-CE1 3.98Å; R27-F34 HydrophobicContact CG-CZ 4.25Å
28	C	77.7	Confident	68.5	Low	9 Å²	9	83.4 Å²	83.4	6%	0.061	44%	0.439	C	S	.	.			trans	-71.9	119.5	169.1	-178.1	0	0	0	0	110.2	A30 C31 N32 E33 L41 H44 H50	C28-A30 VanDerWaalsContact C-N 3.32Å; C28-A30 PolarHBondContact O-N 3.07Å; C28-C31 HydrophobicContact CB-CB 4.26Å; C28-C31 PolarHBondContact SG-N 2.83Å; C28-C31 VanDerWaalsContact SG-N 3.44Å; C28-N32 WeakPolarHBondContact O-CA 3.42Å; C28-N32 PolarHBondContact O-N 2.79Å; C28-E33 PolarHBondContact N-O 2.86Å; C28-L41 HydrophobicContact CB-CD1 4.44Å; C28-H44 VanDerWaalsContact CB-NE2 3.35Å; C28-H44 WeakPolarHBondContact CB-NE2 3.33Å; C28-H44 PolarHBondContact SG-NE2 2.86Å; C28-H50 PolarHBondContact SG-CE1 3.3Å; C28-H50 PolarHBondContact SG-ND1 3.34Å; C28-H50 VanDerWaalsContact SG-ND1 3.42Å
29	V	75.8	Confident	69.8	Low	102 Å²	102	86.7 Å²	86.7	62%	0.618	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-34.7	178.6	178.3	0	0	0	0	112.1	R27 L57	R27-V29 PolarHBondContact O-N 3.27Å; V29-L57 HydrophobicContact CG1-CD2 4.44Å
30	A	76.1	Confident	71.4	Confident	20 Å²	20	85.2 Å²	85.2	17%	0.165	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-43	-179.7	0	0	0	0	0	112.6	C28 C53 L54 L57	C28-A30 VanDerWaalsContact C-N 3.32Å; C28-A30 PolarHBondContact O-N 3.07Å; A30-C53 HydrophobicContact CB-CB 4.28Å; A30-C53 WeakPolarHBondContact O-CB 3.25Å; A30-L54 HydrophobicContact CB-CD2 3.56Å; A30-L54 HydrophobicContact CB-CG 3.94Å; A30-L57 HydrophobicContact CB-CD2 4.14Å
31	C	78.3	Confident	72.7	Confident	13 Å²	13	77.3 Å²	77.3	9%	0.088	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-14.3	-173.3	-57.1	0	0	0	0	114.2	C28 E33 H44 H50 C53	C28-C31 HydrophobicContact CB-CB 4.26Å; C28-C31 PolarHBondContact SG-N 2.83Å; C28-C31 VanDerWaalsContact SG-N 3.44Å; C31-E33 HydrophobicContact CB-CB 4.25Å; C31-E33 HydrophobicContact CB-CG 3.7Å; C31-E33 PolarHBondContact O-N 2.77Å; C31-H44 VanDerWaalsContact CB-CE1 3.43Å; C31-H44 WeakPolarHBondContact CB-CE1 3.34Å; C31-H44 PolarHBondContact SG-CE1 3.07Å; C31-H44 PolarHBondContact SG-NE2 3.44Å; C31-H50 VanDerWaalsContact SG-CA 3.55Å; C31-C53 HydrophobicContact CB-CB 4.49Å; C31-C53 WeakPolarHBondContact SG-CB 3.46Å
32	N	79	Confident	73.9	Confident	76 Å²	76	78.1 Å²	78.1	41%	0.406	39%	0.394	S	S	.	.			trans	57.2	25.4	-167.6	-169	42.2	0	0	0	113.6	R27 C28	R27-N32 PolarHBondContact NE-OD1 3.06Å; R27-N32 VanDerWaalsContact NH2-CG 3.34Å; R27-N32 PolarHBondContact NH2-OD1 3.18Å; C28-N32 WeakPolarHBondContact O-CA 3.42Å; C28-N32 PolarHBondContact O-N 2.79Å
33	E	74.3	Confident	75.4	Confident	72 Å²	72	76.1 Å²	76.1	34%	0.336	38%	0.383	S	S	.	.			trans	-89.5	136.9	176.4	-64.6	-63.9	156.7	0	0	110.2	R27 C28 C31 R49	R27-E33 WeakPolarHBondContact CA-O 3.36Å; C28-E33 PolarHBondContact N-O 2.86Å; C31-E33 HydrophobicContact CB-CB 4.25Å; C31-E33 HydrophobicContact CB-CG 3.7Å; C31-E33 PolarHBondContact O-N 2.77Å; E33-R49 IonicContact OE1-CZ 3.76Å; E33-R49 IonicContact OE1-NE 3.06Å; E33-R49 IonicContact OE1-NH2 3.47Å; E33-R49 PolarHBondContact OE1-NH2 2.82Å
34	F	78.1	Confident	76.5	Confident	127 Å²	127	72.5 Å²	72.5	56%	0.557	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	138.1	173.9	-65.7	-90	0	0	0	110.1	L26 R27	L26-F34 CarbonylContact O-C 3.59Å; L26-F34 VanDerWaalsContact O-CA 3.31Å; L26-F34 WeakPolarHBondContact O-CA 3.42Å; R27-F34 HydrophobicContact CB-CD1 3.98Å; R27-F34 HydrophobicContact CB-CE1 3.94Å; R27-F34 HydrophobicContact CG-CD1 4.25Å; R27-F34 HydrophobicContact CG-CE1 3.98Å; R27-F34 HydrophobicContact CG-CZ 4.25Å
35	C	77.4	Confident	77.2	Confident	11 Å²	11	72.8 Å²	72.8	7%	0.074	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	132	175.8	-66.2	0	0	0	0	107.6	Q25 L26 N37 K40 L41	Q25-C35 CarbonylContact C-O 3.58Å; L26-C35 HydrophobicContact CB-CB 4.27Å; L26-C35 PolarHBondContact N-O 3.44Å; L26-C35 PolarHBondContact O-N 3.11Å; C35-N37 VanDerWaalsContact C-N 3.33Å; C35-K40 HydrophobicContact CB-CB 4.16Å; C35-L41 HydrophobicContact CB-CB 3.97Å; C35-L41 HydrophobicContact CB-CD1 4.45Å
36	D	74.3	Confident	77.8	Confident	78 Å²	78	69.5 Å²	69.5	42%	0.417	35%	0.352	S	S	.	.	S	Bend	trans	-84.6	-8.4	-178.5	56.7	-0.7	0	0	0	113.4	V24 K40	V24-D36 CarbonylContact O-C 3.39Å; D36-K40 WeakPolarHBondContact OD1-CD 3.43Å; D36-K40 WeakPolarHBondContact OD1-CE 3.35Å; D36-K40 IonicContact OD1-NZ 3.5Å; D36-K40 PolarHBondContact OD1-NZ 3.4Å; D36-K40 IonicContact OD2-NZ 2.77Å; D36-K40 PolarHBondContact OD2-NZ 3.25Å
37	N	73.1	Confident	78.3	Confident	62 Å²	62	69.9 Å²	69.9	33%	0.332	36%	0.357	S	S	.	.	S	Bend	trans	-153.4	164.6	173.9	63.4	58.6	0	0	0	111.5	C35 Y39 K40 L41	C35-N37 VanDerWaalsContact C-N 3.33Å; N37-Y39 VanDerWaalsContact C-N 3.28Å; N37-Y39 PolarHBondContact O-N 3.23Å; N37-Y39 WeakPolarHBondContact OD1-CA 3.28Å; N37-Y39 WeakPolarHBondContact OD1-CB 3.33Å; N37-Y39 PolarHBondContact OD1-N 3.47Å; N37-Y39 VanDerWaalsContact OD1-N 3.09Å; N37-K40 PolarHBondContact O-N 3.41Å; N37-K40 WeakPolarHBondContact OD1-CG 3.36Å; N37-K40 PolarHBondContact OD1-N 3.44Å; N37-L41 PolarHBondContact O-N 3.09Å
38	L	76.7	Confident	78.3	Confident	83 Å²	83	70.4 Å²	70.4	44%	0.435	37%	0.371	S	S	.	.	H	α-helix	trans	-62.7	-34.3	-179.9	-71.6	168.8	0	0	0	112.6	L15 L26 L41 Q42	L15-L38 HydrophobicContact CB-CD1 4.46Å; L15-L38 HydrophobicContact CD1-CD2 4.09Å; L26-L38 HydrophobicContact CD1-CB 4.42Å; L26-L38 HydrophobicContact CD1-CD2 3.47Å; L26-L38 VanDerWaalsContact CD1-CD2 3.47Å; L26-L38 HydrophobicContact CD1-CG 3.92Å; L38-L41 WeakPolarHBondContact O-CB 3.5Å; L38-L41 PolarHBondContact O-N 3.44Å; L38-Q42 WeakPolarHBondContact O-CG 3.46Å; L38-Q42 PolarHBondContact O-N 3.26Å
39	Y	76.8	Confident	78.4	Confident	153 Å²	153	76.6 Å²	76.6	60%	0.6	39%	0.392	S	S	*	.	H	α-helix	trans	-64.4	-44.8	-179.7	177.8	-103.1	0	0	0	112	N37 L41 Q42 L43	N37-Y39 VanDerWaalsContact C-N 3.28Å; N37-Y39 PolarHBondContact O-N 3.23Å; N37-Y39 WeakPolarHBondContact OD1-CA 3.28Å; N37-Y39 WeakPolarHBondContact OD1-CB 3.33Å; N37-Y39 PolarHBondContact OD1-N 3.47Å; N37-Y39 VanDerWaalsContact OD1-N 3.09Å; Y39-L41 VanDerWaalsContact C-N 3.29Å; Y39-L41 PolarHBondContact O-N 3.1Å; Y39-Q42 PolarHBondContact O-N 2.73Å; Y39-L43 HydrophobicContact CD1-CD1 3.98Å; Y39-L43 HydrophobicContact CE1-CD1 3.42Å; Y39-L43 VanDerWaalsContact CE1-CD1 3.42Å; Y39-L43 HydrophobicContact CE1-CG 4.26Å; Y39-L43 WeakPolarHBondContact O-CG 3.48Å; Y39-L43 PolarHBondContact O-N 2.72Å
40	K	77.9	Confident	78.7	Confident	100 Å²	100	72.3 Å²	72.3	44%	0.435	37%	0.366	S	S	.	.	H	α-helix	trans	-63.9	-35.7	173.4	-69.5	-162.2	-158.7	165.5	0	111.7	C35 D36 N37 H44	C35-K40 HydrophobicContact CB-CB 4.16Å; D36-K40 WeakPolarHBondContact OD1-CD 3.43Å; D36-K40 WeakPolarHBondContact OD1-CE 3.35Å; D36-K40 IonicContact OD1-NZ 3.5Å; D36-K40 PolarHBondContact OD1-NZ 3.4Å; D36-K40 IonicContact OD2-NZ 2.77Å; D36-K40 PolarHBondContact OD2-NZ 3.25Å; N37-K40 PolarHBondContact O-N 3.41Å; N37-K40 WeakPolarHBondContact OD1-CG 3.36Å; N37-K40 PolarHBondContact OD1-N 3.44Å; K40-H44 WeakPolarHBondContact O-CB 3.33Å; K40-H44 PolarHBondContact O-N 3.33Å
41	L	78.4	Confident	78.7	Confident	41 Å²	41	77.1 Å²	77.1	22%	0.215	38%	0.383	C	S	.	.	H	α-helix	trans	-66.2	-41.9	173.9	-174.6	66.6	0	0	0	111.8	L26 C28 C35 N37 L38 Y39 H44 V45	L26-L41 HydrophobicContact CB-CD2 4.15Å; L26-L41 HydrophobicContact CD1-CB 4.09Å; L26-L41 HydrophobicContact CD1-CD2 3.89Å; C28-L41 HydrophobicContact CB-CD1 4.44Å; C35-L41 HydrophobicContact CB-CB 3.97Å; C35-L41 HydrophobicContact CB-CD1 4.45Å; N37-L41 PolarHBondContact O-N 3.09Å; L38-L41 WeakPolarHBondContact O-CB 3.5Å; L38-L41 PolarHBondContact O-N 3.44Å; Y39-L41 VanDerWaalsContact C-N 3.29Å; Y39-L41 PolarHBondContact O-N 3.1Å; L41-H44 WeakPolarHBondContact O-CB 3.24Å; L41-H44 PolarHBondContact O-N 3.22Å; L41-V45 WeakPolarHBondContact O-CG2 3.36Å; L41-V45 PolarHBondContact O-N 3.49Å
42	Q	81.5	Confident	78.9	Confident	136 Å²	136	84.6 Å²	84.6	64%	0.636	41%	0.411	S	S	*	.	H	α-helix	trans	-62.5	-44.8	176.5	-75.2	175.8	-28.9	0	0	111.7	L38 Y39 H44 V45 S46	L38-Q42 WeakPolarHBondContact O-CG 3.46Å; L38-Q42 PolarHBondContact O-N 3.26Å; Y39-Q42 PolarHBondContact O-N 2.73Å; Q42-H44 VanDerWaalsContact C-N 3.3Å; Q42-H44 PolarHBondContact O-N 3.14Å; Q42-V45 PolarHBondContact O-N 2.79Å; Q42-S46 PolarHBondContact O-N 3.12Å
43	L	83.3	Confident	78.9	Confident	89 Å²	89	82.7 Å²	82.7	47%	0.466	40%	0.403	S	S	.	.	H	α-helix	trans	-63	-36.5	172.3	-71	176.9	0	0	0	112.2	Y39 S46 S47	Y39-L43 HydrophobicContact CD1-CD1 3.98Å; Y39-L43 HydrophobicContact CE1-CD1 3.42Å; Y39-L43 VanDerWaalsContact CE1-CD1 3.42Å; Y39-L43 HydrophobicContact CE1-CG 4.26Å; Y39-L43 WeakPolarHBondContact O-CG 3.48Å; Y39-L43 PolarHBondContact O-N 2.72Å; L43-S46 PolarHBondContact O-N 2.81Å; L43-S46 PolarHBondContact O-OG 3.33Å; L43-S47 PolarHBondContact O-N 2.79Å
44	H	82.3	Confident	79.1	Confident	23 Å²	23	82.1 Å²	82.1	11%	0.106	40%	0.402	C	S	.	.	H	α-helix	trans	-63.7	-44.1	176.1	170.9	80.8	0	0	0	111.7	C28 C31 K40 L41 Q42 S46 S47 H50	C28-H44 VanDerWaalsContact CB-NE2 3.35Å; C28-H44 WeakPolarHBondContact CB-NE2 3.33Å; C28-H44 PolarHBondContact SG-NE2 2.86Å; C31-H44 VanDerWaalsContact CB-CE1 3.43Å; C31-H44 WeakPolarHBondContact CB-CE1 3.34Å; C31-H44 PolarHBondContact SG-CE1 3.07Å; C31-H44 PolarHBondContact SG-NE2 3.44Å; K40-H44 WeakPolarHBondContact O-CB 3.33Å; K40-H44 PolarHBondContact O-N 3.33Å; L41-H44 WeakPolarHBondContact O-CB 3.24Å; L41-H44 PolarHBondContact O-N 3.22Å; Q42-H44 VanDerWaalsContact C-N 3.3Å; Q42-H44 PolarHBondContact O-N 3.14Å; H44-S46 VanDerWaalsContact C-N 3.28Å; H44-S46 PolarHBondContact O-N 3Å; H44-S47 VanDerWaalsContact O-CB 3.24Å; H44-S47 WeakPolarHBondContact O-CB 3.45Å; H44-S47 PolarHBondContact O-N 3.18Å; H44-S47 VanDerWaalsContact O-N 3.09Å; H44-S47 PolarHBondContact O-OG 2.81Å; H44-H50 AromaticContact CD2-ND1 3.51Å; H44-H50 AromaticContact NE2-CG 3.97Å; H44-H50 AromaticContact NE2-ND1 3.15Å; H44-H50 PolarHBondContact NE2-ND1 3.42Å; H44-H50 VanDerWaalsContact NE2-ND1 3.15Å; H44-H50 WeakPolarHBondContact O-CB 3.43Å
45	V	81.1	Confident	79	Confident	69 Å²	69	84.3 Å²	84.3	42%	0.418	41%	0.406	S	S	.	.	H	α-helix	trans	-64.9	-30.3	-178.8	171.5	0	0	0	0	112.4	L41 Q42 S47 H50	L41-V45 WeakPolarHBondContact O-CG2 3.36Å; L41-V45 PolarHBondContact O-N 3.49Å; Q42-V45 PolarHBondContact O-N 2.79Å; V45-S47 VanDerWaalsContact C-N 3.31Å; V45-H50 PolarHBondContact O-CD2 3.34Å
46	S	82.9	Confident	79	Confident	77 Å²	77	86.3 Å²	86.3	54%	0.538	42%	0.424	S	S	.	.	H	α-helix	trans	-78.6	-13.2	175.9	65.1	0	0	0	0	113.8	Q42 L43 H44	Q42-S46 PolarHBondContact O-N 3.12Å; L43-S46 PolarHBondContact O-N 2.81Å; L43-S46 PolarHBondContact O-OG 3.33Å; H44-S46 VanDerWaalsContact C-N 3.28Å; H44-S46 PolarHBondContact O-N 3Å
47	S	81.1	Confident	79.1	Confident	37 Å²	37	85.8 Å²	85.8	26%	0.259	42%	0.42	S	S	.	.	S	Bend	trans	-65.2	148.6	-178.4	76.4	0	0	0	0	113.3	L43 H44 V45 R49 H50 K51	L43-S47 PolarHBondContact O-N 2.79Å; H44-S47 VanDerWaalsContact O-CB 3.24Å; H44-S47 WeakPolarHBondContact O-CB 3.45Å; H44-S47 PolarHBondContact O-N 3.18Å; H44-S47 VanDerWaalsContact O-N 3.09Å; H44-S47 PolarHBondContact O-OG 2.81Å; V45-S47 VanDerWaalsContact C-N 3.31Å; S47-R49 VanDerWaalsContact C-N 3.31Å; S47-R49 PolarHBondContact O-N 3.04Å; S47-H50 PolarHBondContact O-N 3.17Å; S47-H50 WeakPolarHBondContact OG-CB 3.34Å; S47-H50 PolarHBondContact OG-N 3.31Å; S47-H50 VanDerWaalsContact OG-N 3.14Å; S47-K51 PolarHBondContact O-N 2.8Å
48	T	78.7	Confident	79.2	Confident	101 Å²	101	87.7 Å²	87.7	62%	0.62	43%	0.428	S	S	*	.	H	α-helix	trans	-60.3	-42	174.7	50	0	0	0	0	111.4	H50 K51 Y52	T48-H50 VanDerWaalsContact C-N 3.29Å; T48-H50 PolarHBondContact O-N 2.06Å; T48-K51 WeakPolarHBondContact O-CB 3.36Å; T48-K51 PolarHBondContact O-N 3.29Å; T48-K51 VanDerWaalsContact O-N 3.1Å; T48-Y52 WeakPolarHBondContact O-CD2 3.2Å; T48-Y52 PolarHBondContact O-N 2.65Å; T48-Y52 VanDerWaalsContact O-N 3.09Å
49	R	79.5	Confident	79	Confident	138 Å²	138	91.5 Å²	91.5	52%	0.521	44%	0.441	S	S	.	.	H	α-helix	trans	-51.3	-48.2	174.1	179.8	179.5	171.2	101.6	-10	111.2	E33 S47 K51 Y52 C53	E33-R49 IonicContact OE1-CZ 3.76Å; E33-R49 IonicContact OE1-NE 3.06Å; E33-R49 IonicContact OE1-NH2 3.47Å; E33-R49 PolarHBondContact OE1-NH2 2.82Å; S47-R49 VanDerWaalsContact C-N 3.31Å; S47-R49 PolarHBondContact O-N 3.04Å; R49-K51 PolarHBondContact O-N 3.44Å; R49-Y52 PolarHBondContact O-N 3.09Å; R49-C53 PolarHBondContact O-N 2.99Å; R49-C53 PolarHBondContact O-SG 3.45Å; R49-C53 VanDerWaalsContact O-SG 3.41Å
50	H	82.4	Confident	78.8	Confident	12 Å²	12	89.4 Å²	89.4	6%	0.056	44%	0.444	C	S	.	.	H	α-helix	trans	-61	-42.8	178.6	-176.6	86.8	0	0	0	112.8	C28 C31 H44 V45 S47 T48 Y52 C53 L54	C28-H50 PolarHBondContact SG-CE1 3.3Å; C28-H50 PolarHBondContact SG-ND1 3.34Å; C28-H50 VanDerWaalsContact SG-ND1 3.42Å; C31-H50 VanDerWaalsContact SG-CA 3.55Å; H44-H50 AromaticContact CD2-ND1 3.51Å; H44-H50 AromaticContact NE2-CG 3.97Å; H44-H50 AromaticContact NE2-ND1 3.15Å; H44-H50 PolarHBondContact NE2-ND1 3.42Å; H44-H50 VanDerWaalsContact NE2-ND1 3.15Å; H44-H50 WeakPolarHBondContact O-CB 3.43Å; V45-H50 PolarHBondContact O-CD2 3.34Å; S47-H50 PolarHBondContact O-N 3.17Å; S47-H50 WeakPolarHBondContact OG-CB 3.34Å; S47-H50 PolarHBondContact OG-N 3.31Å; S47-H50 VanDerWaalsContact OG-N 3.14Å; T48-H50 VanDerWaalsContact C-N 3.29Å; T48-H50 PolarHBondContact O-N 2.06Å; H50-Y52 VanDerWaalsContact C-N 3.33Å; H50-Y52 PolarHBondContact O-N 3.45Å; H50-C53 PolarHBondContact O-N 3.17Å; H50-L54 WeakPolarHBondContact CD2-CD1 3.46Å; H50-L54 WeakPolarHBondContact NE2-CD1 3.26Å; H50-L54 WeakPolarHBondContact NE2-CG 3.23Å; H50-L54 WeakPolarHBondContact O-CB 3.45Å; H50-L54 WeakPolarHBondContact O-CG 3.35Å; H50-L54 PolarHBondContact O-N 3.48Å
51	K	76.7	Confident	78.5	Confident	122 Å²	122	92.8 Å²	92.8	53%	0.53	45%	0.453	S	S	.	.	H	α-helix	trans	-60.2	-40.7	176.5	-63	176.8	-175.1	179	0	112.5	S47 T48 R49 R55	S47-K51 PolarHBondContact O-N 2.8Å; T48-K51 WeakPolarHBondContact O-CB 3.36Å; T48-K51 PolarHBondContact O-N 3.29Å; T48-K51 VanDerWaalsContact O-N 3.1Å; R49-K51 PolarHBondContact O-N 3.44Å; K51-R55 WeakPolarHBondContact O-CG 2.98Å; K51-R55 PolarHBondContact O-N 3.15Å; K51-R55 VanDerWaalsContact O-N 3.07Å
52	Y	80.7	Confident	77.9	Confident	170 Å²	170	95.8 Å²	95.8	67%	0.667	47%	0.47	S	S	*	.	H	α-helix	trans	-68	-46.3	176.6	-67.8	-68.2	0	0	0	112.2	T48 R49 H50 R55 A56	T48-Y52 WeakPolarHBondContact O-CD2 3.2Å; T48-Y52 PolarHBondContact O-N 2.65Å; T48-Y52 VanDerWaalsContact O-N 3.09Å; R49-Y52 PolarHBondContact O-N 3.09Å; H50-Y52 VanDerWaalsContact C-N 3.33Å; H50-Y52 PolarHBondContact O-N 3.45Å; Y52-R55 PolarHBondContact O-N 3.35Å; Y52-A56 PolarHBondContact O-N 2.93Å
53	C	78.7	Confident	76.9	Confident	36 Å²	36	90.9 Å²	90.9	24%	0.243	46%	0.456	C	S	.	.	H	α-helix	trans	-63.3	-40.8	177.9	-70.6	0	0	0	0	112.1	A30 C31 R49 H50 A56 L57	A30-C53 HydrophobicContact CB-CB 4.28Å; A30-C53 WeakPolarHBondContact O-CB 3.25Å; C31-C53 HydrophobicContact CB-CB 4.49Å; C31-C53 WeakPolarHBondContact SG-CB 3.46Å; R49-C53 PolarHBondContact O-N 2.99Å; R49-C53 PolarHBondContact O-SG 3.45Å; R49-C53 VanDerWaalsContact O-SG 3.41Å; H50-C53 PolarHBondContact O-N 3.17Å; C53-A56 PolarHBondContact O-N 3.42Å; C53-L57 WeakPolarHBondContact O-CB 3.43Å; C53-L57 PolarHBondContact O-N 3.48Å
54	L	79.2	Confident	75.7	Confident	60 Å²	60	91.5 Å²	91.5	31%	0.314	47%	0.465	S	S	.	.	H	α-helix	trans	-60.4	-49	173.2	-83.3	-178.2	0	0	0	111.8	A30 H50 A56 L57 E58	A30-L54 HydrophobicContact CB-CD2 3.56Å; A30-L54 HydrophobicContact CB-CG 3.94Å; H50-L54 WeakPolarHBondContact CD2-CD1 3.46Å; H50-L54 WeakPolarHBondContact NE2-CD1 3.26Å; H50-L54 WeakPolarHBondContact NE2-CG 3.23Å; H50-L54 WeakPolarHBondContact O-CB 3.45Å; H50-L54 WeakPolarHBondContact O-CG 3.35Å; H50-L54 PolarHBondContact O-N 3.48Å; L54-A56 VanDerWaalsContact C-N 3.28Å; L54-A56 PolarHBondContact O-N 3.17Å; L54-L57 CarbonylContact O-C 3.47Å; L54-L57 WeakPolarHBondContact O-CB 3.16Å; L54-L57 PolarHBondContact O-N 2.92Å; L54-L57 VanDerWaalsContact O-N 3.12Å; L54-E58 WeakPolarHBondContact O-CB 3.19Å; L54-E58 WeakPolarHBondContact O-CG 3.33Å; L54-E58 PolarHBondContact O-N 3.35Å
55	R	76.4	Confident	74.3	Confident	172 Å²	172	97.7 Å²	97.7	65%	0.649	49%	0.494	S	S	*	.	H	α-helix	trans	-59.9	-39.6	177.4	-77	-178.5	-177.1	-151.6	1.1	112.2	K51 Y52 K59	K51-R55 WeakPolarHBondContact O-CG 2.98Å; K51-R55 PolarHBondContact O-N 3.15Å; K51-R55 VanDerWaalsContact O-N 3.07Å; Y52-R55 PolarHBondContact O-N 3.35Å; R55-K59 WeakPolarHBondContact O-CG 3.43Å; R55-K59 PolarHBondContact O-N 3.33Å
56	A	76.9	Confident	72.7	Confident	54 Å²	54	99.4 Å²	99.4	45%	0.446	51%	0.509	S	S	.	.	H	α-helix	trans	-64.6	-45	175	0	0	0	0	0	111.1	Y52 C53 L54 E58 K59 V60	Y52-A56 PolarHBondContact O-N 2.93Å; C53-A56 PolarHBondContact O-N 3.42Å; L54-A56 VanDerWaalsContact C-N 3.28Å; L54-A56 PolarHBondContact O-N 3.17Å; A56-E58 PolarHBondContact O-N 3.22Å; A56-K59 PolarHBondContact O-N 3.21Å; A56-V60 WeakPolarHBondContact O-CG2 3.34Å; A56-V60 PolarHBondContact O-N 3.02Å; A56-V60 VanDerWaalsContact O-N 3.07Å
57	L	76.9	Confident	71	Confident	66 Å²	66	102.2 Å²	102.2	35%	0.346	53%	0.529	S	S	.	.	H	α-helix	trans	-62.1	-42.4	177.3	-173.8	72.1	0	0	0	111.8	V29 A30 C53 L54 V60 R61	V29-L57 HydrophobicContact CG1-CD2 4.44Å; A30-L57 HydrophobicContact CB-CD2 4.14Å; C53-L57 WeakPolarHBondContact O-CB 3.43Å; C53-L57 PolarHBondContact O-N 3.48Å; L54-L57 CarbonylContact O-C 3.47Å; L54-L57 WeakPolarHBondContact O-CB 3.16Å; L54-L57 PolarHBondContact O-N 2.92Å; L54-L57 VanDerWaalsContact O-N 3.12Å; L57-V60 PolarHBondContact O-N 3.26Å; L57-R61 VanDerWaalsContact O-CB 3.23Å; L57-R61 WeakPolarHBondContact O-CB 3.39Å; L57-R61 PolarHBondContact O-N 2.64Å
58	E	75.1	Confident	69.3	Low	103 Å²	103	109.2 Å²	109.2	48%	0.481	56%	0.558	S	S	.	*	H	α-helix	trans	-62.2	-44.9	176.3	-76.3	171.8	173.8	0	0	111.8	L54 A56 V60 R61 N62	L54-E58 WeakPolarHBondContact O-CB 3.19Å; L54-E58 WeakPolarHBondContact O-CG 3.33Å; L54-E58 PolarHBondContact O-N 3.35Å; A56-E58 PolarHBondContact O-N 3.22Å; E58-V60 VanDerWaalsContact C-N 3.3Å; E58-V60 PolarHBondContact O-N 2.7Å; E58-R61 PolarHBondContact O-N 2.84Å; E58-N62 VanDerWaalsContact O-CB 3.26Å; E58-N62 WeakPolarHBondContact O-CB 3.08Å; E58-N62 VanDerWaalsContact O-CG 3.3Å; E58-N62 PolarHBondContact O-N 3.45Å
59	K	72.5	Confident	67.8	Low	163 Å²	163	108.9 Å²	108.9	71%	0.709	57%	0.565	S	S	*	*	H	α-helix	trans	-60.8	-39.8	175.8	-74.5	178.1	179.8	-170.7	0	112.2	R55 A56 G63	R55-K59 WeakPolarHBondContact O-CG 3.43Å; R55-K59 PolarHBondContact O-N 3.33Å; A56-K59 PolarHBondContact O-N 3.21Å; K59-G63 PolarHBondContact O-N 3.14Å
60	V	72.4	Confident	66	Low	109 Å²	109	110 Å²	110	66%	0.661	58%	0.581	S	S	*	*	H	α-helix	trans	-69.5	-39.6	176.1	174.5	0	0	0	0	110.8	A56 L57 E58	A56-V60 WeakPolarHBondContact O-CG2 3.34Å; A56-V60 PolarHBondContact O-N 3.02Å; A56-V60 VanDerWaalsContact O-N 3.07Å; L57-V60 PolarHBondContact O-N 3.26Å; E58-V60 VanDerWaalsContact C-N 3.3Å; E58-V60 PolarHBondContact O-N 2.7Å
61	R	72.4	Confident	64.4	Low	170 Å²	170	119.1 Å²	119.1	64%	0.642	62%	0.621	S	S	*	*	H	α-helix	trans	-71.4	-40.4	-178.6	-174.2	176.6	-175.6	177.8	0.6	112.9	M9 L57 E58 G63	M9-R61 PolarHBondContact SD-NH1 3.35Å; L57-R61 VanDerWaalsContact O-CB 3.23Å; L57-R61 WeakPolarHBondContact O-CB 3.39Å; L57-R61 PolarHBondContact O-N 2.64Å; E58-R61 PolarHBondContact O-N 2.84Å; R61-G63 VanDerWaalsContact C-N 3.34Å
62	N	65	Low	63	Low	104 Å²	104	118.9 Å²	118.9	56%	0.556	63%	0.629	S	S	*	*	H	α-helix	trans	-87.6	-5.6	-175.4	-63.9	-15.6	0	0	0	112.6	E58	E58-N62 VanDerWaalsContact O-CB 3.26Å; E58-N62 WeakPolarHBondContact O-CB 3.08Å; E58-N62 VanDerWaalsContact O-CG 3.3Å; E58-N62 PolarHBondContact O-N 3.45Å
63	G	61	Low	61.1	Low	33 Å²	33	118 Å²	118	34%	0.34	64%	0.637	S	S	.	*	T	Hydrogen-bonded Turn	trans	58	-173.5	-173.8	0	0	0	0	0	112.2	K59 R61 Q65	K59-G63 PolarHBondContact O-N 3.14Å; R61-G63 VanDerWaalsContact C-N 3.34Å; G63-Q65 PolarHBondContact O-N 2.84Å
64	P	58	Low	59.7	Low	103 Å²	103	120.9 Å²	120.9	67%	0.669	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	46.3	179.4	32.3	-35.7	0	0	0	112.8
65	Q	52.6	Low	58	Low	152 Å²	152	124.1 Å²	124.1	71%	0.71	69%	0.688	S	S	*	*			trans	-106.1	123.7	177	-61.4	-160.2	1.1	0	0	110.7	G63	G63-Q65 PolarHBondContact O-N 2.84Å
66	S	47	Very low	56.5	Low	106 Å²	106	123.1 Å²	123.1	74%	0.741	70%	0.695	S	S	*	*			trans	65.5	64.1	171.7	62.3	0	0	0	0	118.3	Q68	S66-Q68 VanDerWaalsContact C-N 3.28Å; S66-Q68 PolarHBondContact O-N 3.47Å; S66-Q68 VanDerWaalsContact O-N 3.11Å
67	S	47.8	Very low	55.3	Low	136 Å²	136	124.7 Å²	124.7	95%	0.951	70%	0.703	S	S	*	*			trans	-59.8	95.8	134.8	-55	0	0	0	0	108.3
68	Q	46.3	Very low	53.8	Low	184 Å²	184	127.8 Å²	127.8	86%	0.86	73%	0.725	S	S	*	*			trans	-131.6	72.2	173.3	-151.3	179.1	38.5	0	0	109.4	S66	S66-Q68 VanDerWaalsContact C-N 3.28Å; S66-Q68 PolarHBondContact O-N 3.47Å; S66-Q68 VanDerWaalsContact O-N 3.11Å
69	A	45.3	Very low	52.4	Low	93 Å²	93	128 Å²	128	77%	0.769	74%	0.737	S	S	*	*			trans	-168.8	68.9	161	0	0	0	0	0	109.5
70	D	43.3	Very low	51	Low	163 Å²	163	126.6 Å²	126.6	87%	0.872	74%	0.738	S	S	*	*				-167.8	128.1	129.3	-116.5	-24.2	0	0	0	111.5
71	K	47.6	Very low	50.1	Low	203 Å²	203	130.1 Å²	130.1	88%	0.883	75%	0.752	S	S	*	*			trans	-93.5	109	177.9	-70.1	174.6	174.9	178.8	0	107.6
72	T	47.5	Very low	49	Very low	116 Å²	116	133.7 Å²	133.7	71%	0.712	77%	0.765	S	S	*	*			trans	-160.8	102.4	155.7	9	0	0	0	0	111
73	N	41.9	Very low	48.2	Very low	153 Å²	153	134.6 Å²	134.6	82%	0.818	77%	0.77	S	S	*	*			trans	37.9	104.4	133.6	-51.6	-35.7	0	0	0	118.5
74	A	49.6	Very low	47.6	Very low	96 Å²	96	143.4 Å²	143.4	79%	0.793	79%	0.793	S	S	*	*			trans	-179.5	117.9	133.6	0	0	0	0	0	109.4
75	P	43.3	Very low	47.3	Very low	128 Å²	128	144.5 Å²	144.5	83%	0.831	79%	0.793	S	S	*	*			trans	-95.1	107.1	169	33	-21	0	0	0	108.1
76	D	45.1	Very low	47.4	Very low	150 Å²	150	144.2 Å²	144.2	80%	0.802	79%	0.792	S	S	*	*			trans	-162.2	144.3	156.9	-136.6	-29.5	0	0	0	113.9
77	S	50.3	Low	47.9	Very low	88 Å²	88	147.6 Å²	147.6	62%	0.615	79%	0.789	S	S	*	*			trans	74.5	88.5	151.4	-58.3	0	0	0	0	118
78	T	46.4	Very low	48.4	Very low	131 Å²	131	144.2 Å²	144.2	80%	0.804	77%	0.769	S	S	*	*				27.4	131.9	120.7	56.3	0	0	0	0	118.9
79	S	45.2	Very low	49	Very low	107 Å²	107	138 Å²	138	75%	0.748	74%	0.741	S	S	*	*			trans	91.4	88.6	168.5	85.8	0	0	0	0	115.8
80	D	43.6	Very low	49.5	Very low	133 Å²	133	139 Å²	139	71%	0.711	73%	0.726	S	S	*	*			trans	-179.8	47.8	138.2	-94.3	-34.4	0	0	0	113.5	R82	D80-R82 PolarHBondContact O-N 3.18Å; D80-R82 VanDerWaalsContact O-N 3.09Å
81	L	53.9	Low	50.1	Low	183 Å²	183	132.2 Å²	132.2	96%	0.958	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	14.6	178.5	-130.2	79.7	0	0	0	114.5
82	R	48.3	Very low	50.5	Low	246 Å²	246	126.4 Å²	126.4	93%	0.928	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.9	9.5	-174.9	-67.9	-176	79	174.5	3.6	115.7	D80	D80-R82 PolarHBondContact O-N 3.18Å; D80-R82 VanDerWaalsContact O-N 3.09Å
83	N	49.3	Very low	50.6	Low	123 Å²	123	127.4 Å²	127.4	66%	0.658	67%	0.673	S	S	*	*	S	Bend	trans	-135.3	45.5	-170.3	-154.1	-14.5	0	0	0	114.7
84	R	48	Very low	51.6	Low	218 Å²	218	122.3 Å²	122.3	82%	0.823	65%	0.648	S	S	*	*	S	Bend	trans	-132.2	2.7	-174.1	-146.2	176.5	172	-170.7	-2.9	116.5
85	D	50.8	Low	52.1	Low	126 Å²	126	127.1 Å²	127.1	67%	0.674	65%	0.646	S	S	*	*			trans	-120.1	22.2	-171.2	-116.2	-27.8	0	0	0	115.6	R87	D85-R87 PolarHBondContact O-N 3.22Å; D85-R87 IonicContact OD1-NE 2.65Å; D85-R87 PolarHBondContact OD1-NE 3.43Å; D85-R87 IonicContact OD1-NH2 3.54Å
86	Q	54.7	Low	52.7	Low	145 Å²	145	124.9 Å²	124.9	68%	0.678	62%	0.623	S	S	*	*			trans	-78.5	73.4	167.4	-69.3	-173.8	15	0	0	110.4	A88 T99	Q86-A88 PolarHBondContact O-N 2.97Å; Q86-T99 HydrophobicContact CB-CG2 4Å; Q86-T99 HydrophobicContact CG-CG2 4.43Å
87	R	57.7	Low	53.5	Low	178 Å²	178	120.8 Å²	120.8	67%	0.672	61%	0.61	S	S	*	*			trans	-66.6	97.5	169	-63.1	-176.7	-159.3	-170	3.8	108.5	D85 L89	D85-R87 PolarHBondContact O-N 3.22Å; D85-R87 IonicContact OD1-NE 2.65Å; D85-R87 PolarHBondContact OD1-NE 3.43Å; D85-R87 IonicContact OD1-NH2 3.54Å; R87-L89 PolarHBondContact O-N 3.21Å
88	A	58.5	Low	54.3	Low	65 Å²	65	117.2 Å²	117.2	54%	0.537	59%	0.585	S	S	.	*			trans	-63	124.1	173	0	0	0	0	0	109.7	Q86 T98	Q86-A88 PolarHBondContact O-N 2.97Å; A88-T98 CarbonylContact C-O 3.54Å
89	L	60	Low	55.2	Low	54 Å²	54	114.8 Å²	114.8	28%	0.283	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.4	128.8	171.4	-57	167.4	0	0	0	108.9	R87 A97 T98 R101 M104	R87-L89 PolarHBondContact O-N 3.21Å; L89-A97 CarbonylContact O-C 3.59Å; L89-A97 WeakPolarHBondContact O-CA 3.36Å; L89-T98 HydrophobicContact CB-CG2 4.31Å; L89-T98 WeakPolarHBondContact CB-O 3.08Å; L89-T98 PolarHBondContact N-O 3.5Å; L89-T98 PolarHBondContact O-N 3.46Å; L89-R101 VanDerWaalsContact CD1-CA 3.5Å; L89-R101 HydrophobicContact CD1-CB 3.94Å; L89-R101 HydrophobicContact CD1-CG 4.19Å; L89-M104 HydrophobicContact CB-CE 3.81Å; L89-M104 HydrophobicContact CB-CG 3.88Å; L89-M104 HydrophobicContact CB-SD 3.36Å; L89-M104 WeakPolarHBondContact CB-SD 3.31Å; L89-M104 HydrophobicContact CD1-CG 4.06Å; L89-M104 HydrophobicContact CD1-SD 3.9Å; L89-M104 HydrophobicContact CG-SD 4.14Å
90	Y	54.9	Low	56	Low	112 Å²	112	113.9 Å²	113.9	44%	0.439	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.7	124.2	-176.2	177.2	-99.4	0	0	0	111.6	V92 R95 A97 M104	Y90-V92 HydrophobicContact CD1-CG2 3.9Å; Y90-V92 HydrophobicContact CE1-CB 4.4Å; Y90-V92 HydrophobicContact CE1-CG2 4.03Å; Y90-V92 PolarHBondContact O-N 2.85Å; Y90-R95 HydrophobicContact CE2-CB 4.18Å; Y90-R95 WeakPolarHBondContact OH-CG 3.37Å; Y90-A97 HydrophobicContact CD2-CB 4.36Å; Y90-M104 WeakPolarHBondContact O-CE 3.49Å
91	C	55.8	Low	56.7	Low	21 Å²	21	116.3 Å²	116.3	14%	0.142	55%	0.553	C	S	.	*			trans	-79.7	103.8	173.1	173.4	0	0	0	0	109.3	L93 C94 R95 F96 M104	C91-L93 PolarHBondContact O-N 3.22Å; C91-C94 HydrophobicContact CB-CB 4.41Å; C91-C94 WeakPolarHBondContact CB-SG 3.5Å; C91-C94 PolarHBondContact O-N 2.78Å; C91-C94 WeakPolarHBondContact SG-CB 3.35Å; C91-C94 PolarHBondContact SG-N 3.36Å; C91-C94 CovalentContact SG-SG 2.06Å; C91-C94 PolarHBondContact SG-SG 3.43Å; C91-R95 VanDerWaalsContact O-CA 3.28Å; C91-R95 WeakPolarHBondContact O-CA 3.21Å; C91-R95 PolarHBondContact O-N 2.84Å; C91-F96 HydrophobicContact CB-CB 3.96Å; C91-F96 WeakPolarHBondContact CB-O 3.37Å; C91-F96 PolarHBondContact N-O 3.29Å; C91-M104 HydrophobicContact CB-CE 4.08Å; C91-M104 VanDerWaalsContact N-CE 3.32Å
92	V	57	Low	57.2	Low	82 Å²	82	116.5 Å²	116.5	50%	0.497	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-23.1	177.8	179.7	0	0	0	0	112.5	Y90	Y90-V92 HydrophobicContact CD1-CG2 3.9Å; Y90-V92 HydrophobicContact CE1-CB 4.4Å; Y90-V92 HydrophobicContact CE1-CG2 4.03Å; Y90-V92 PolarHBondContact O-N 2.85Å
93	L	49.2	Very low	57.7	Low	137 Å²	137	111.7 Å²	111.7	72%	0.717	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-33	-178.8	-60.3	176.8	0	0	0	113.4	C91 Y114	C91-L93 PolarHBondContact O-N 3.22Å; L93-Y114 HydrophobicContact CD1-CD2 4.19Å; L93-Y114 HydrophobicContact CD1-CE2 4.4Å
94	C	61.5	Low	58	Low	45 Å²	45	108.6 Å²	108.6	30%	0.304	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.6	0.8	-168.2	64.3	0	0	0	0	113.7	C91 F96 L110	C91-C94 HydrophobicContact CB-CB 4.41Å; C91-C94 WeakPolarHBondContact CB-SG 3.5Å; C91-C94 PolarHBondContact O-N 2.78Å; C91-C94 WeakPolarHBondContact SG-CB 3.35Å; C91-C94 PolarHBondContact SG-N 3.36Å; C91-C94 CovalentContact SG-SG 2.06Å; C91-C94 PolarHBondContact SG-SG 3.43Å; C94-F96 PolarHBondContact O-N 3.06Å; C94-F96 WeakPolarHBondContact SG-CB 3.33Å; C94-L110 HydrophobicContact CB-CD1 3.99Å; C94-L110 HydrophobicContact CB-CD2 3.96Å; C94-L110 WeakPolarHBondContact SG-CD1 3.47Å
95	R	60.8	Low	58.4	Low	198 Å²	198	105.5 Å²	105.5	75%	0.747	50%	0.503	S	S	*	.			trans	56.4	14.7	-174.1	-53.3	-169.3	166.8	167.8	-3.7	115	Y90 C91 A97	Y90-R95 HydrophobicContact CE2-CB 4.18Å; Y90-R95 WeakPolarHBondContact OH-CG 3.37Å; C91-R95 VanDerWaalsContact O-CA 3.28Å; C91-R95 WeakPolarHBondContact O-CA 3.21Å; C91-R95 PolarHBondContact O-N 2.84Å; R95-A97 PolarHBondContact O-N 3.5Å
96	F	56.9	Low	58.7	Low	80 Å²	80	102 Å²	102	35%	0.351	50%	0.497	S	S	.	.			trans	-74.4	122.7	177.6	-174.1	-107.4	0	0	0	110.1	C91 C94 T98	C91-F96 HydrophobicContact CB-CB 3.96Å; C91-F96 WeakPolarHBondContact CB-O 3.37Å; C91-F96 PolarHBondContact N-O 3.29Å; C94-F96 PolarHBondContact O-N 3.06Å; C94-F96 WeakPolarHBondContact SG-CB 3.33Å; F96-T98 HydrophobicContact CD1-CG2 4.31Å; F96-T98 HydrophobicContact CE1-CG2 3.9Å
97	A	61.4	Low	58.7	Low	64 Å²	64	98 Å²	98	53%	0.529	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	134.4	172.6	0	0	0	0	0	109.4	L89 Y90 R95	L89-A97 CarbonylContact O-C 3.59Å; L89-A97 WeakPolarHBondContact O-CA 3.36Å; Y90-A97 HydrophobicContact CD2-CB 4.36Å; R95-A97 PolarHBondContact O-N 3.5Å
98	T	66.5	Low	58.5	Low	14 Å²	14	97.6 Å²	97.6	9%	0.086	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	143.7	175.7	-174.3	0	0	0	0	111.2	A88 L89 F96 E100 R103 M104	A88-T98 CarbonylContact C-O 3.54Å; L89-T98 HydrophobicContact CB-CG2 4.31Å; L89-T98 WeakPolarHBondContact CB-O 3.08Å; L89-T98 PolarHBondContact N-O 3.5Å; L89-T98 PolarHBondContact O-N 3.46Å; F96-T98 HydrophobicContact CD1-CG2 4.31Å; F96-T98 HydrophobicContact CE1-CG2 3.9Å; T98-E100 VanDerWaalsContact C-N 3.29Å; T98-E100 WeakPolarHBondContact CG2-O 3.06Å; T98-E100 PolarHBondContact OG1-N 3.29Å; T98-R103 HydrophobicContact CG2-CB 4.35Å; T98-M104 HydrophobicContact CG2-CB 4.22Å; T98-M104 HydrophobicContact CG2-CG 3.42Å; T98-M104 VanDerWaalsContact CG2-CG 3.42Å
99	T	64.8	Low	58.3	Low	79 Å²	79	102.8 Å²	102.8	49%	0.485	50%	0.499	S	S	.	.	S	Bend	trans	-84.3	-8.2	171.8	50.8	0	0	0	0	112	Q86	Q86-T99 HydrophobicContact CB-CG2 4Å; Q86-T99 HydrophobicContact CG-CG2 4.43Å
100	E	62.3	Low	58	Low	89 Å²	89	103.2 Å²	103.2	42%	0.416	50%	0.501	S	S	.	.			trans	-108.4	117.3	-177.2	-71.5	177.5	-153	0	0	111.8	T98 K102 R103 M104	T98-E100 VanDerWaalsContact C-N 3.29Å; T98-E100 WeakPolarHBondContact CG2-O 3.06Å; T98-E100 PolarHBondContact OG1-N 3.29Å; E100-K102 PolarHBondContact O-N 2.65Å; E100-R103 HydrophobicContact CB-CB 4.23Å; E100-R103 HydrophobicContact CB-CG 3.96Å; E100-R103 VanDerWaalsContact CD-NE 3.32Å; E100-R103 PolarHBondContact O-N 3.06Å; E100-R103 VanDerWaalsContact O-N 3.11Å; E100-R103 IonicContact OE1-CZ 3.8Å; E100-R103 IonicContact OE1-NE 2.73Å; E100-R103 IonicContact OE1-NH2 3.4Å; E100-R103 PolarHBondContact OE1-NH2 3.33Å; E100-R103 WeakPolarHBondContact OE2-CD 3.36Å; E100-R103 WeakPolarHBondContact OE2-CG 3.47Å; E100-R103 IonicContact OE2-CZ 3.68Å; E100-R103 IonicContact OE2-NE 3.52Å; E100-R103 PolarHBondContact OE2-NE 2.73Å; E100-R103 IonicContact OE2-NH2 3.74Å; E100-M104 PolarHBondContact O-N 3.01Å
101	R	58.8	Low	57.5	Low	183 Å²	183	105.3 Å²	105.3	69%	0.691	51%	0.513	S	S	*	.	H	α-helix	trans	-56.9	-36.3	176.4	-167.5	-177.5	-65.2	126.7	-0.4	113	L89 R103 M104 F105	L89-R101 VanDerWaalsContact CD1-CA 3.5Å; L89-R101 HydrophobicContact CD1-CB 3.94Å; L89-R101 HydrophobicContact CD1-CG 4.19Å; R101-R103 VanDerWaalsContact C-N 3.33Å; R101-R103 PolarHBondContact O-N 2.75Å; R101-M104 PolarHBondContact O-N 2.77Å; R101-F105 HydrophobicContact CG-CD2 4.13Å; R101-F105 HydrophobicContact CG-CE2 3.75Å; R101-F105 VanDerWaalsContact O-CD2 3.25Å; R101-F105 WeakPolarHBondContact O-CD2 3.48Å
102	K	63.6	Low	57.1	Low	187 Å²	187	111.1 Å²	111.1	81%	0.813	54%	0.538	S	S	*	.	H	α-helix	trans	-64.9	-34.8	178.9	-69.1	-174.9	178.9	-178	0	112.5	E100 F105 G106	E100-K102 PolarHBondContact O-N 2.65Å; K102-F105 PolarHBondContact O-N 3.44Å; K102-G106 PolarHBondContact O-N 3.09Å
103	R	59.9	Low	56.5	Low	145 Å²	145	110 Å²	110	55%	0.547	53%	0.533	S	S	.	.	H	α-helix	trans	-72.6	-26.8	178.6	-67.7	-169.5	-169.8	-151.9	6.3	113.3	T98 E100 R101	T98-R103 HydrophobicContact CG2-CB 4.35Å; E100-R103 HydrophobicContact CB-CB 4.23Å; E100-R103 HydrophobicContact CB-CG 3.96Å; E100-R103 VanDerWaalsContact CD-NE 3.32Å; E100-R103 PolarHBondContact O-N 3.06Å; E100-R103 VanDerWaalsContact O-N 3.11Å; E100-R103 IonicContact OE1-CZ 3.8Å; E100-R103 IonicContact OE1-NE 2.73Å; E100-R103 IonicContact OE1-NH2 3.4Å; E100-R103 PolarHBondContact OE1-NH2 3.33Å; E100-R103 WeakPolarHBondContact OE2-CD 3.36Å; E100-R103 WeakPolarHBondContact OE2-CG 3.47Å; E100-R103 IonicContact OE2-CZ 3.68Å; E100-R103 IonicContact OE2-NE 3.52Å; E100-R103 PolarHBondContact OE2-NE 2.73Å; E100-R103 IonicContact OE2-NH2 3.74Å; R101-R103 VanDerWaalsContact C-N 3.33Å; R101-R103 PolarHBondContact O-N 2.75Å
104	M	55.5	Low	56.1	Low	58 Å²	58	108.8 Å²	108.8	29%	0.286	52%	0.52	S	S	.	.	H	α-helix	trans	-65.7	-44.3	173.4	-96.4	-150.3	138.9	0	0	112.7	L89 Y90 C91 T98 E100 R101	L89-M104 HydrophobicContact CB-CE 3.81Å; L89-M104 HydrophobicContact CB-CG 3.88Å; L89-M104 HydrophobicContact CB-SD 3.36Å; L89-M104 WeakPolarHBondContact CB-SD 3.31Å; L89-M104 HydrophobicContact CD1-CG 4.06Å; L89-M104 HydrophobicContact CD1-SD 3.9Å; L89-M104 HydrophobicContact CG-SD 4.14Å; Y90-M104 WeakPolarHBondContact O-CE 3.49Å; C91-M104 HydrophobicContact CB-CE 4.08Å; C91-M104 VanDerWaalsContact N-CE 3.32Å; T98-M104 HydrophobicContact CG2-CB 4.22Å; T98-M104 HydrophobicContact CG2-CG 3.42Å; T98-M104 VanDerWaalsContact CG2-CG 3.42Å; E100-M104 PolarHBondContact O-N 3.01Å; R101-M104 PolarHBondContact O-N 2.77Å
105	F	56.4	Low	55.3	Low	154 Å²	154	110.6 Å²	110.6	68%	0.675	53%	0.529	S	S	*	.	H	α-helix	trans	-86.3	-16.3	-178.1	-63.6	-72.4	0	0	0	113.2	R101 K102	R101-F105 HydrophobicContact CG-CD2 4.13Å; R101-F105 HydrophobicContact CG-CE2 3.75Å; R101-F105 VanDerWaalsContact O-CD2 3.25Å; R101-F105 WeakPolarHBondContact O-CD2 3.48Å; K102-F105 PolarHBondContact O-N 3.44Å
106	G	56.5	Low	54.3	Low	52 Å²	52	107.4 Å²	107.4	54%	0.536	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-2	179.2	0	0	0	0	0	115.9	K102 E108	K102-G106 PolarHBondContact O-N 3.09Å; G106-E108 VanDerWaalsContact C-N 3.27Å; G106-E108 PolarHBondContact O-N 3.38Å
107	N	55.2	Low	53.6	Low	62 Å²	62	112.7 Å²	112.7	33%	0.332	54%	0.539	S	S	.	.			trans	-81.3	73.8	171.7	-97.1	-12.9	0	0	0	110.3	Q109 L110	N107-Q109 PolarHBondContact O-N 3.35Å; N107-Q109 VanDerWaalsContact O-N 3.14Å; N107-L110 HydrophobicContact CB-CB 4.4Å; N107-L110 HydrophobicContact CB-CD1 3.78Å; N107-L110 HydrophobicContact CB-CG 4.17Å; N107-L110 PolarHBondContact O-N 3.15Å
108	E	52.9	Low	52.7	Low	168 Å²	168	117.8 Å²	117.8	79%	0.785	54%	0.544	S	S	*	.	H	α-helix	trans	-54	-30.1	174.4	-77	-175.8	145	0	0	112.5	G106 L110 F111	G106-E108 VanDerWaalsContact C-N 3.27Å; G106-E108 PolarHBondContact O-N 3.38Å; E108-L110 PolarHBondContact O-N 3.11Å; E108-F111 PolarHBondContact O-N 3.22Å
109	Q	54.8	Low	51.6	Low	174 Å²	174	122.2 Å²	122.2	81%	0.813	57%	0.567	S	S	*	*	H	α-helix	trans	-64	-25.9	177.7	-64.6	-171.9	-2.1	0	0	113.6	N107	N107-Q109 PolarHBondContact O-N 3.35Å; N107-Q109 VanDerWaalsContact O-N 3.14Å
110	L	52.9	Low	50.8	Low	64 Å²	64	124.1 Å²	124.1	34%	0.335	57%	0.571	S	S	.	*	H	α-helix	trans	-82.2	-30.8	179.3	-72	171.2	0	0	0	112.4	C94 N107 E108 H112 S113 Y114	C94-L110 HydrophobicContact CB-CD1 3.99Å; C94-L110 HydrophobicContact CB-CD2 3.96Å; C94-L110 WeakPolarHBondContact SG-CD1 3.47Å; N107-L110 HydrophobicContact CB-CB 4.4Å; N107-L110 HydrophobicContact CB-CD1 3.78Å; N107-L110 HydrophobicContact CB-CG 4.17Å; N107-L110 PolarHBondContact O-N 3.15Å; E108-L110 PolarHBondContact O-N 3.11Å; L110-H112 VanDerWaalsContact C-N 3.33Å; L110-H112 PolarHBondContact O-N 3.08Å; L110-S113 PolarHBondContact O-N 2.98Å; L110-S113 PolarHBondContact O-OG 3Å; L110-Y114 PolarHBondContact O-N 2.93Å
111	F	45.6	Very low	50	Low	156 Å²	156	128.5 Å²	128.5	68%	0.684	59%	0.589	S	S	*	*	H	α-helix	trans	-62.9	-40.4	178.5	-118.5	-90.8	0	0	0	111.7	E108 S113 V115	E108-F111 PolarHBondContact O-N 3.22Å; F111-S113 PolarHBondContact O-N 3.31Å; F111-V115 PolarHBondContact O-N 3.43Å
112	H	46.5	Very low	49.4	Very low	143 Å²	143	123.9 Å²	123.9	66%	0.662	59%	0.589	S	S	*	*	H	α-helix	trans	-66.3	-38.3	177.7	-119.6	-131	0	0	0	112.3	L110 Y114 V115 F116	L110-H112 VanDerWaalsContact C-N 3.33Å; L110-H112 PolarHBondContact O-N 3.08Å; H112-Y114 PolarHBondContact O-N 3.17Å; H112-V115 PolarHBondContact O-N 2.88Å; H112-F116 WeakPolarHBondContact O-CB 3.47Å; H112-F116 PolarHBondContact O-N 3.41Å
113	S	45.3	Very low	48.5	Very low	57 Å²	57	119.4 Å²	119.4	40%	0.399	58%	0.582	S	S	.	*	H	α-helix	trans	-67.9	-32.8	-178.3	74.7	0	0	0	0	114	L110 F111 R117	L110-S113 PolarHBondContact O-N 2.98Å; L110-S113 PolarHBondContact O-OG 3Å; F111-S113 PolarHBondContact O-N 3.31Å; S113-R117 WeakPolarHBondContact O-CB 3.36Å; S113-R117 PolarHBondContact O-N 3.46Å
114	Y	40.8	Very low	47.6	Very low	113 Å²	113	120.6 Å²	120.6	44%	0.443	59%	0.594	S	S	.	*	H	α-helix	trans	-75.1	-34.1	-179.7	-169.5	-103.6	0	0	0	112.2	L93 L110 H112 R118	L93-Y114 HydrophobicContact CD1-CD2 4.19Å; L93-Y114 HydrophobicContact CD1-CE2 4.4Å; L110-Y114 PolarHBondContact O-N 2.93Å; H112-Y114 PolarHBondContact O-N 3.17Å; Y114-R118 PolarHBondContact OH-NH1 3.17Å
115	V	44.7	Very low	46.9	Very low	82 Å²	82	126.4 Å²	126.4	50%	0.497	63%	0.625	S	S	.	*	H	α-helix	trans	-76.9	-38	175.1	-179.1	0	0	0	0	110.8	F111 H112 N119	F111-V115 PolarHBondContact O-N 3.43Å; H112-V115 PolarHBondContact O-N 2.88Å; V115-N119 PolarHBondContact O-N 3.47Å
116	F	39.8	Very low	46.2	Very low	132 Å²	132	131.7 Å²	131.7	58%	0.579	65%	0.652	S	S	*	*	H	α-helix	trans	-68.8	-43.4	179.1	-130.2	-95.7	0	0	0	112.7	H112 R118 N119 Q120	H112-F116 WeakPolarHBondContact O-CB 3.47Å; H112-F116 PolarHBondContact O-N 3.41Å; F116-R118 VanDerWaalsContact C-N 3.34Å; F116-R118 PolarHBondContact O-N 3.08Å; F116-N119 PolarHBondContact O-N 3.42Å; F116-Q120 PolarHBondContact O-N 3.07Å; F116-Q120 VanDerWaalsContact O-N 3.08Å
117	R	41.7	Very low	45.7	Very low	191 Å²	191	135.7 Å²	135.7	72%	0.721	66%	0.657	S	S	*	*	H	α-helix	trans	-74.3	-23.1	-176.6	-154.3	-176.5	-75.4	-164.2	-2.9	113.3	S113	S113-R117 WeakPolarHBondContact O-CB 3.36Å; S113-R117 PolarHBondContact O-N 3.46Å
118	R	42.8	Very low	45.2	Very low	170 Å²	170	139.5 Å²	139.5	64%	0.642	68%	0.675	S	S	*	*	H	α-helix	trans	-76.7	-26.7	170.6	-101.3	-178.9	161.1	166.9	-3.4	113.2	Y114 F116	Y114-R118 PolarHBondContact OH-NH1 3.17Å; F116-R118 VanDerWaalsContact C-N 3.34Å; F116-R118 PolarHBondContact O-N 3.08Å
119	N	42.6	Very low	44.8	Very low	107 Å²	107	137.9 Å²	137.9	57%	0.572	67%	0.668	S	S	*	*	H	α-helix	trans	-93.1	-11.7	179.2	-75	-12.9	0	0	0	114.1	V115 F116 A122	V115-N119 PolarHBondContact O-N 3.47Å; F116-N119 PolarHBondContact O-N 3.42Å; N119-A122 PolarHBondContact O-N 2.79Å
120	Q	47.6	Very low	44.2	Very low	119 Å²	119	135.8 Å²	135.8	56%	0.556	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-16	-179.5	-137.6	168.2	8.4	0	0	114.4	F116	F116-Q120 PolarHBondContact O-N 3.07Å; F116-Q120 VanDerWaalsContact O-N 3.08Å
121	F	47.1	Very low	43.6	Very low	182 Å²	182	140.3 Å²	140.3	80%	0.798	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	3	173.1	-83	-81.8	0	0	0	113.7
122	A	45.6	Very low	43.5	Very low	85 Å²	85	139.3 Å²	139.3	70%	0.702	68%	0.68	S	S	*	*	S	Bend	trans	-106.5	8.9	-177.1	0	0	0	0	0	113.6	N119	N119-A122 PolarHBondContact O-N 2.79Å
123	S	45	Very low	43.3	Very low	94 Å²	94	139 Å²	139	66%	0.657	68%	0.681	S	S	*	*	S	Bend	trans	-127	18.4	-172.5	57.9	0	0	0	0	115.4
124	E	40.7	Very low	43.1	Very low	170 Å²	170	145.3 Å²	145.3	79%	0.794	70%	0.703	S	S	*	*			trans	-113.1	25.4	178	-79.2	-175.2	161.2	0	0	114
125	L	40.8	Very low	43.3	Very low	180 Å²	180	148 Å²	148	94%	0.942	73%	0.725	S	S	*	*			trans	-122.7	83.6	169.7	-82.7	160.1	0	0	0	109.3
126	Q	41.4	Very low	43.2	Very low	264 Å²	264	154 Å²	154	100%	1.234	75%	0.745	S	S	*	*			trans	-114.5	0	157.4	-166.2	175.2	-14.5	0	0	106.8

Retrieved 126 of 126 residues in 371.6 ms (Link to these results)

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