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NADH dehydrogenase [ubiquinone] 1 beta subcomplex subunit 10

Accessory subunit that is involved in the functional assembly of the mitochondrial respiratory chain complex I. Complex I has an NADH dehydrogenase activity with ubiquinone as an immediate electron acceptor and mediates the transfer of electrons from NADH to the respiratory chain.

AlphaFold DB , UniProt , Accession A0A096NKY8, Species PAPAN (Papio anubis, Olive baboon), Gene NDUFB10, Length 178 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	44.7	Very low	71.3	Confident	151 Å²	151	109.1 Å²	109.1	74%	0.744	56%	0.561	S	S	*	*				0	127.3	0	-167.7	161.2	160.3	0	0	105.6	D3	M1-D3 PolarHBondContact O-N 3.31Å
2	P	54	Low	72.2	Confident	63 Å²	63	106.8 Å²	106.8	41%	0.409	55%	0.547	S	S	.	.			trans	-57.6	137.2	-176.5	24.2	-31.8	0	0	0	109.5	S4 W5	P2-S4 PolarHBondContact O-N 3.22Å; P2-W5 HydrophobicContact CG-CH2 4.33Å; P2-W5 HydrophobicContact CG-CZ2 3.71Å; P2-W5 PolarHBondContact O-NE1 2.88Å; P2-W5 VanDerWaalsContact O-NE1 3.08Å
3	D	56.1	Low	73.1	Confident	153 Å²	153	105.5 Å²	105.5	82%	0.818	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	19.7	179.7	-67.8	-42.5	0	0	0	112.9	M1	M1-D3 PolarHBondContact O-N 3.31Å
4	S	60.3	Low	74	Confident	87 Å²	87	105.2 Å²	105.2	61%	0.608	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-19.8	-168.1	56.3	0	0	0	0	114.6	P2	P2-S4 PolarHBondContact O-N 3.22Å
5	W	69.1	Low	74.6	Confident	135 Å²	135	111.1 Å²	111.1	51%	0.511	57%	0.569	S	S	.	*	S	Bend	trans	-91	126	178.3	-1.2	83.1	0	0	0	109.5	P2 K7 Y10	P2-W5 HydrophobicContact CG-CH2 4.33Å; P2-W5 HydrophobicContact CG-CZ2 3.71Å; P2-W5 PolarHBondContact O-NE1 2.88Å; P2-W5 VanDerWaalsContact O-NE1 3.08Å; W5-K7 PolarHBondContact O-N 3.44Å; W5-Y10 HydrophobicContact CB-CD2 4.17Å
6	D	80.7	Confident	75.2	Confident	90 Å²	90	118.4 Å²	118.4	48%	0.481	59%	0.587	S	S	.	*			trans	-61.6	118.1	174.4	-169.7	-14.6	0	0	0	109.8	D8 V9 Y10	D6-D8 PolarHBondContact O-N 3.09Å; D6-D8 WeakPolarHBondContact OD1-CB 3.13Å; D6-D8 PolarHBondContact OD1-N 3.26Å; D6-V9 HydrophobicContact CB-CB 4.2Å; D6-V9 HydrophobicContact CB-CG2 4.03Å; D6-V9 PolarHBondContact O-N 3.22Å; D6-V9 VanDerWaalsContact O-N 3.13Å; D6-Y10 PolarHBondContact O-N 3.48Å
7	K	78.6	Confident	75.8	Confident	153 Å²	153	118.8 Å²	118.8	67%	0.665	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-21	-177.6	-67.7	-179.6	-175.1	-72.3	0	112	W5 Y10 P11	W5-K7 PolarHBondContact O-N 3.44Å; K7-Y10 CarbonylContact O-C 3.29Å; K7-Y10 VanDerWaalsContact O-C 3.29Å; K7-P11 VanDerWaalsContact O-CA 3.28Å; K7-P11 WeakPolarHBondContact O-CA 3.48Å
8	D	83.4	Confident	76.2	Confident	140 Å²	140	118.4 Å²	118.4	75%	0.749	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-32.5	174.9	-63.3	-22.2	0	0	0	110.6	D6 R109	D6-D8 PolarHBondContact O-N 3.09Å; D6-D8 WeakPolarHBondContact OD1-CB 3.13Å; D6-D8 PolarHBondContact OD1-N 3.26Å; D8-R109 PolarHBondContact O-NH2 3.4Å
9	V	85.9	Confident	76.6	Confident	48 Å²	48	119.4 Å²	119.4	29%	0.291	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.4	-33.5	175.2	-176.1	0	0	0	0	111.8	D6 P11 I105 R109	D6-V9 HydrophobicContact CB-CB 4.2Å; D6-V9 HydrophobicContact CB-CG2 4.03Å; D6-V9 PolarHBondContact O-N 3.22Å; D6-V9 VanDerWaalsContact O-N 3.13Å; V9-P11 WeakPolarHBondContact O-CD 3.33Å; V9-I105 HydrophobicContact CG1-CG2 3.97Å; V9-R109 VanDerWaalsContact C-NH2 3.32Å; V9-R109 VanDerWaalsContact CA-NH2 3.28Å; V9-R109 PolarHBondContact O-NE 3.38Å; V9-R109 PolarHBondContact O-NH2 3.21Å
10	Y	85.6	Confident	76.7	Confident	105 Å²	105	119.8 Å²	119.8	41%	0.412	62%	0.624	S	S	.	*	S	Bend	trans	-122.5	79.6	176.7	-63.7	-76.6	0	0	0	110	W5 D6 K7 E12 I105	W5-Y10 HydrophobicContact CB-CD2 4.17Å; D6-Y10 PolarHBondContact O-N 3.48Å; K7-Y10 CarbonylContact O-C 3.29Å; K7-Y10 VanDerWaalsContact O-C 3.29Å; Y10-E12 PolarHBondContact O-N 3.12Å; Y10-I105 HydrophobicContact CE1-CG2 4.24Å
11	P	85.6	Confident	76.7	Confident	75 Å²	75	118.5 Å²	118.5	49%	0.487	63%	0.626	S	S	.	*			trans	-67.6	132	-177.2	26.7	-34	0	0	0	110.7	K7 V9	K7-P11 VanDerWaalsContact O-CA 3.28Å; K7-P11 WeakPolarHBondContact O-CA 3.48Å; V9-P11 WeakPolarHBondContact O-CD 3.33Å
12	E	82.6	Confident	78.2	Confident	82 Å²	82	116.1 Å²	116.1	38%	0.383	62%	0.623	S	S	.	*			trans	-125.4	124.7	169.6	-59.3	-160	174.8	0	0	109.5	Y10 R116	Y10-E12 PolarHBondContact O-N 3.12Å; E12-R116 VanDerWaalsContact CD-CZ 3.47Å; E12-R116 VanDerWaalsContact CD-NH1 3.25Å; E12-R116 IonicContact OE1-CZ 3.85Å; E12-R116 IonicContact OE1-NH1 3.46Å; E12-R116 IonicContact OE1-NH2 2.71Å; E12-R116 PolarHBondContact OE1-NH2 3.24Å; E12-R116 IonicContact OE2-CZ 3.66Å; E12-R116 IonicContact OE2-NH1 3.78Å; E12-R116 PolarHBondContact OE2-NH1 2.05Å; E12-R116 IonicContact OE2-NH2 2.74Å; E12-R116 PolarHBondContact OE2-NH2 3.46Å
13	P	83.6	Confident	79.4	Confident	89 Å²	89	122.1 Å²	122.1	58%	0.578	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-64	149.6	172.1	27.2	-33.1	0	0	0	109.9	R15	P13-R15 PolarHBondContact O-N 2.94Å
14	P	85.6	Confident	80.5	Confident	102 Å²	102	119.5 Å²	119.5	66%	0.662	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-59.9	131.2	179	24.6	-33.2	0	0	0	110.2	R16	P14-R16 PolarHBondContact O-N 3.37Å
15	R	84.1	Confident	81.2	Confident	194 Å²	194	127.5 Å²	127.5	73%	0.732	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-66.7	121	179.6	-66.8	-177.6	-172.7	-177.6	2.1	109.7	P13	P13-R15 PolarHBondContact O-N 2.94Å
16	R	84.1	Confident	81.6	Confident	228 Å²	228	127.7 Å²	127.7	86%	0.86	66%	0.663	S	S	*	*			trans	-115.4	95.2	172.7	-65	-178.3	-178.9	179.5	0.2	108.8	P14	P14-R16 PolarHBondContact O-N 3.37Å
17	T	84.2	Confident	81.6	Confident	124 Å²	124	127.5 Å²	127.5	76%	0.761	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-91.2	130.1	171.7	48.8	0	0	0	0	109.1
18	P	83.8	Confident	81.7	Confident	112 Å²	112	124.1 Å²	124.1	73%	0.727	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-62.4	150.1	174.9	28	-34	0	0	0	110	V20	P18-V20 PolarHBondContact O-N 3.04Å
19	V	83.3	Confident	81.9	Confident	138 Å²	138	121.4 Å²	121.4	84%	0.836	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-62.8	128.9	171.4	179.9	0	0	0	0	107.9	S21	V19-S21 PolarHBondContact O-N 2.97Å
20	V	79.2	Confident	82	Confident	126 Å²	126	123.1 Å²	123.1	76%	0.764	66%	0.656	S	S	*	*			trans	-71	100.8	177.3	-179.1	0	0	0	0	108.4	P18	P18-V20 PolarHBondContact O-N 3.04Å
21	S	76.9	Confident	82.1	Confident	94 Å²	94	121.1 Å²	121.1	66%	0.657	66%	0.655	S	S	*	*			trans	-93.3	116.2	172.5	60.2	0	0	0	0	110.1	V19 Q23	V19-S21 PolarHBondContact O-N 2.97Å; S21-Q23 PolarHBondContact O-N 3.05Å
22	S	76.5	Confident	82.3	Confident	100 Å²	100	124.5 Å²	124.5	70%	0.699	66%	0.659	S	S	*	*			trans	-76.2	112.2	174.8	57.2	0	0	0	0	110.3	T24	S22-T24 VanDerWaalsContact C-N 3.32Å
23	Q	77.9	Confident	82.8	Confident	189 Å²	189	126.1 Å²	126.1	88%	0.883	67%	0.669	S	S	*	*	S	Bend	trans	-77.9	-20.9	173.6	-67.9	180	-14.6	0	0	112.4	S21	S21-Q23 PolarHBondContact O-N 3.05Å
24	T	79	Confident	83.1	Confident	98 Å²	98	125 Å²	125	60%	0.601	66%	0.661	S	S	*	*	S	Bend	trans	-110	153.7	179.7	54	0	0	0	0	111.3	S22 L26	S22-T24 VanDerWaalsContact C-N 3.32Å; T24-L26 VanDerWaalsContact C-N 3.29Å
25	W	74.9	Confident	83.4	Confident	256 Å²	256	126.5 Å²	126.5	97%	0.97	66%	0.657	S	S	*	*	S	Bend	trans	-78.4	-15.2	177.2	-148.8	83.9	0	0	0	112.9
26	L	78.6	Confident	83.9	Confident	139 Å²	139	119.3 Å²	119.3	73%	0.728	64%	0.639	S	S	*	*	S	Bend	trans	-74.1	130	176	-68.2	174.6	0	0	0	109.8	T24	T24-L26 VanDerWaalsContact C-N 3.29Å
27	P	80.4	Confident	84.5	Confident	86 Å²	86	114 Å²	114	56%	0.558	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-75.9	138.5	-175.4	35.2	-38.5	0	0	0	110.5	P29 Y32	P27-P29 WeakPolarHBondContact O-CD 3.21Å; P27-Y32 HydrophobicContact CB-CE2 3.97Å; P27-Y32 HydrophobicContact CG-CE2 4.42Å
28	N	81.4	Confident	84.9	Confident	82 Å²	82	111.6 Å²	111.6	44%	0.439	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-71.9	120.1	-176	-174.4	-20	0	0	0	110.8	V30 V31	N28-V30 PolarHBondContact O-N 3.46Å; N28-V30 VanDerWaalsContact OD1-CB 3.3Å; N28-V30 WeakPolarHBondContact OD1-CB 3.07Å; N28-V30 WeakPolarHBondContact OD1-CG2 3.43Å; N28-V30 PolarHBondContact OD1-N 3.1Å; N28-V31 HydrophobicContact CB-CG2 4.33Å; N28-V31 PolarHBondContact O-N 2.94Å
29	P	87.7	Confident	85.5	Confident	83 Å²	83	111.2 Å²	111.2	54%	0.539	60%	0.596	S	S	.	*	H	α-helix	trans	-62.2	-26.7	-178.3	25.6	-35.1	0	0	0	112.9	P27 V31 Y32 I33	P27-P29 WeakPolarHBondContact O-CD 3.21Å; P29-V31 VanDerWaalsContact C-N 3.25Å; P29-V31 PolarHBondContact O-N 3.13Å; P29-Y32 PolarHBondContact O-N 3.38Å; P29-Y32 VanDerWaalsContact O-N 3.16Å; P29-I33 WeakPolarHBondContact O-CG1 3.27Å; P29-I33 PolarHBondContact O-N 3.47Å
30	V	87.8	Confident	86	Confident	84 Å²	84	110.5 Å²	110.5	51%	0.509	59%	0.586	S	S	.	*	H	α-helix	trans	-58.9	-38.9	179.1	178.7	0	0	0	0	111.1	N28 Y32 I33 T34	N28-V30 PolarHBondContact O-N 3.46Å; N28-V30 VanDerWaalsContact OD1-CB 3.3Å; N28-V30 WeakPolarHBondContact OD1-CB 3.07Å; N28-V30 WeakPolarHBondContact OD1-CG2 3.43Å; N28-V30 PolarHBondContact OD1-N 3.1Å; V30-Y32 VanDerWaalsContact C-N 3.32Å; V30-Y32 PolarHBondContact O-N 3.46Å; V30-I33 PolarHBondContact O-N 3.15Å; V30-T34 HydrophobicContact CG1-CG2 4.25Å; V30-T34 WeakPolarHBondContact O-CG2 3.49Å; V30-T34 PolarHBondContact O-N 2.93Å; V30-T34 PolarHBondContact O-OG1 3.36Å
31	V	86.4	Confident	86.8	Confident	62 Å²	62	107.4 Å²	107.4	38%	0.376	57%	0.568	S	S	.	*	H	α-helix	trans	-67	-34.2	-179	179.9	0	0	0	0	111.9	N28 P29 T34 K35	N28-V31 HydrophobicContact CB-CG2 4.33Å; N28-V31 PolarHBondContact O-N 2.94Å; P29-V31 VanDerWaalsContact C-N 3.25Å; P29-V31 PolarHBondContact O-N 3.13Å; V31-T34 PolarHBondContact O-OG1 3.5Å; V31-K35 HydrophobicContact CG1-CD 4.42Å; V31-K35 WeakPolarHBondContact O-CB 3.5Å; V31-K35 VanDerWaalsContact O-CG 3.25Å; V31-K35 WeakPolarHBondContact O-CG 3.49Å; V31-K35 PolarHBondContact O-N 3.36Å
32	Y	89.4	Confident	87.7	Confident	146 Å²	146	106.9 Å²	106.9	57%	0.573	56%	0.557	S	S	*	*	H	α-helix	trans	-75	-40	175.8	-67.1	-84	0	0	0	111.5	P27 P29 V30 K35 A36	P27-Y32 HydrophobicContact CB-CE2 3.97Å; P27-Y32 HydrophobicContact CG-CE2 4.42Å; P29-Y32 PolarHBondContact O-N 3.38Å; P29-Y32 VanDerWaalsContact O-N 3.16Å; V30-Y32 VanDerWaalsContact C-N 3.32Å; V30-Y32 PolarHBondContact O-N 3.46Å; Y32-K35 PolarHBondContact O-N 2.94Å; Y32-A36 WeakPolarHBondContact O-CB 3.37Å; Y32-A36 PolarHBondContact O-N 3.15Å
33	I	93	Very high	88.5	Confident	116 Å²	116	109.8 Å²	109.8	60%	0.595	55%	0.553	S	S	*	*	H	α-helix	trans	-62.9	-44.5	177	-65.7	166.4	0	0	0	110.3	P29 V30 A36 F37	P29-I33 WeakPolarHBondContact O-CG1 3.27Å; P29-I33 PolarHBondContact O-N 3.47Å; V30-I33 PolarHBondContact O-N 3.15Å; I33-A36 PolarHBondContact O-N 3.14Å; I33-F37 WeakPolarHBondContact O-CB 3.32Å; I33-F37 PolarHBondContact O-N 3.25Å
34	T	91.7	Very high	89.4	Confident	67 Å²	67	103.8 Å²	103.8	41%	0.411	53%	0.53	S	S	.	.	H	α-helix	trans	-62.6	-45.6	176.5	56.2	0	0	0	0	111.1	V30 V31 A36 F37 D38	V30-T34 HydrophobicContact CG1-CG2 4.25Å; V30-T34 WeakPolarHBondContact O-CG2 3.49Å; V30-T34 PolarHBondContact O-N 2.93Å; V30-T34 PolarHBondContact O-OG1 3.36Å; V31-T34 PolarHBondContact O-OG1 3.5Å; T34-A36 VanDerWaalsContact C-N 3.33Å; T34-A36 PolarHBondContact O-N 3.39Å; T34-F37 WeakPolarHBondContact O-CB 3.28Å; T34-F37 PolarHBondContact O-N 2.99Å; T34-D38 PolarHBondContact O-N 3.17Å
35	K	91.6	Very high	90.3	Very high	132 Å²	132	103.2 Å²	103.2	57%	0.574	53%	0.526	S	S	*	.	H	α-helix	trans	-61.7	-38.7	176.1	-75.2	178.5	-179.9	-175	0	113.2	V31 Y32 D38 L39	V31-K35 HydrophobicContact CG1-CD 4.42Å; V31-K35 WeakPolarHBondContact O-CB 3.5Å; V31-K35 VanDerWaalsContact O-CG 3.25Å; V31-K35 WeakPolarHBondContact O-CG 3.49Å; V31-K35 PolarHBondContact O-N 3.36Å; Y32-K35 PolarHBondContact O-N 2.94Å; K35-D38 PolarHBondContact O-N 3.44Å; K35-L39 WeakPolarHBondContact O-CB 3.19Å; K35-L39 PolarHBondContact O-N 3.34Å
36	A	94.5	Very high	91.2	Very high	43 Å²	43	93.7 Å²	93.7	36%	0.355	50%	0.497	S	S	.	.	H	α-helix	trans	-66.3	-41.7	176	0	0	0	0	0	111	Y32 I33 T34 L39 I40	Y32-A36 WeakPolarHBondContact O-CB 3.37Å; Y32-A36 PolarHBondContact O-N 3.15Å; I33-A36 PolarHBondContact O-N 3.14Å; T34-A36 VanDerWaalsContact C-N 3.33Å; T34-A36 PolarHBondContact O-N 3.39Å; A36-L39 PolarHBondContact O-N 3.49Å; A36-I40 HydrophobicContact CB-CD1 4.39Å; A36-I40 VanDerWaalsContact O-CB 3.3Å; A36-I40 WeakPolarHBondContact O-CB 3.27Å; A36-I40 VanDerWaalsContact O-CG1 3.24Å; A36-I40 WeakPolarHBondContact O-CG1 3.46Å; A36-I40 PolarHBondContact O-N 2.89Å
37	F	95.3	Very high	92.1	Very high	117 Å²	117	92.3 Å²	92.3	51%	0.513	49%	0.49	S	S	.	.	H	α-helix	trans	-61.6	-45.8	174.2	-179.8	-93.4	0	0	0	111.9	I33 T34 L39 I40 V41 D42	I33-F37 WeakPolarHBondContact O-CB 3.32Å; I33-F37 PolarHBondContact O-N 3.25Å; T34-F37 WeakPolarHBondContact O-CB 3.28Å; T34-F37 PolarHBondContact O-N 2.99Å; F37-L39 PolarHBondContact O-N 3.32Å; F37-I40 PolarHBondContact O-N 2.91Å; F37-V41 HydrophobicContact CD2-CB 4.01Å; F37-V41 HydrophobicContact CD2-CG2 3.88Å; F37-V41 HydrophobicContact CE2-CB 3.81Å; F37-V41 HydrophobicContact CE2-CG1 3.83Å; F37-V41 HydrophobicContact CE2-CG2 3.92Å; F37-V41 HydrophobicContact CG-CB 4.49Å; F37-V41 HydrophobicContact CZ-CB 4.11Å; F37-V41 HydrophobicContact CZ-CG1 3.92Å; F37-V41 WeakPolarHBondContact O-CA 3.44Å; F37-V41 WeakPolarHBondContact O-CB 3.48Å; F37-V41 PolarHBondContact O-N 3.36Å; F37-D42 PolarHBondContact O-N 3.07Å
38	D	94.2	Very high	92.9	Very high	74 Å²	74	92.4 Å²	92.4	40%	0.396	49%	0.488	S	S	.	.	I	π-helix	trans	-59.3	-39.1	177.6	-62.8	-19	0	0	0	111.2	T34 K35 R43	T34-D38 PolarHBondContact O-N 3.17Å; K35-D38 PolarHBondContact O-N 3.44Å; D38-R43 WeakPolarHBondContact O-CB 3.4Å; D38-R43 WeakPolarHBondContact O-CG 3.34Å; D38-R43 PolarHBondContact O-N 3.35Å
39	L	95	Very high	93.5	Very high	103 Å²	103	95 Å²	95	54%	0.539	49%	0.492	S	S	.	.	I	π-helix	trans	-75.9	-45.6	-179.3	-175.4	64	0	0	0	113.2	K35 A36 F37	K35-L39 WeakPolarHBondContact O-CB 3.19Å; K35-L39 PolarHBondContact O-N 3.34Å; A36-L39 PolarHBondContact O-N 3.49Å; F37-L39 PolarHBondContact O-N 3.32Å
40	I	95.4	Very high	93.9	Very high	124 Å²	124	95.5 Å²	95.5	64%	0.636	49%	0.487	S	S	*	.	I	π-helix	trans	-86.2	-32.7	-170	-62.5	167.9	0	0	0	111.3	A36 F37 P44	A36-I40 HydrophobicContact CB-CD1 4.39Å; A36-I40 VanDerWaalsContact O-CB 3.3Å; A36-I40 WeakPolarHBondContact O-CB 3.27Å; A36-I40 VanDerWaalsContact O-CG1 3.24Å; A36-I40 WeakPolarHBondContact O-CG1 3.46Å; A36-I40 PolarHBondContact O-N 2.89Å; F37-I40 PolarHBondContact O-N 2.91Å; I40-P44 WeakPolarHBondContact O-CG 3.36Å
41	V	95.5	Very high	94.3	Very high	61 Å²	61	96.6 Å²	96.6	37%	0.37	49%	0.485	S	S	.	.	I	π-helix	trans	-113.5	-59.6	-172.2	-175.3	0	0	0	0	111.5	F37 R43 P44 V45	F37-V41 HydrophobicContact CD2-CB 4.01Å; F37-V41 HydrophobicContact CD2-CG2 3.88Å; F37-V41 HydrophobicContact CE2-CB 3.81Å; F37-V41 HydrophobicContact CE2-CG1 3.83Å; F37-V41 HydrophobicContact CE2-CG2 3.92Å; F37-V41 HydrophobicContact CG-CB 4.49Å; F37-V41 HydrophobicContact CZ-CB 4.11Å; F37-V41 HydrophobicContact CZ-CG1 3.92Å; F37-V41 WeakPolarHBondContact O-CA 3.44Å; F37-V41 WeakPolarHBondContact O-CB 3.48Å; F37-V41 PolarHBondContact O-N 3.36Å; V41-R43 PolarHBondContact O-N 3.38Å; V41-P44 WeakPolarHBondContact O-CD 3.48Å; V41-V45 HydrophobicContact CG1-CG2 4.43Å; V41-V45 WeakPolarHBondContact O-CB 3.45Å; V41-V45 WeakPolarHBondContact O-CG2 3.49Å; V41-V45 PolarHBondContact O-N 2.97Å; V41-V45 VanDerWaalsContact O-N 3.12Å
42	D	94.8	Very high	94.7	Very high	82 Å²	82	97.6 Å²	97.6	44%	0.439	49%	0.488	S	S	.	.	I	π-helix	trans	-65.4	-42.8	-169.6	-164.6	32.4	0	0	0	112.2	F37 V45 T46	F37-D42 PolarHBondContact O-N 3.07Å; D42-V45 PolarHBondContact O-N 3.31Å; D42-T46 WeakPolarHBondContact O-CB 3.44Å; D42-T46 PolarHBondContact O-N 3.04Å; D42-T46 PolarHBondContact O-OG1 2.88Å
43	R	95.1	Very high	94.9	Very high	162 Å²	162	95 Å²	95	61%	0.611	48%	0.481	S	S	*	.	H	α-helix	trans	-60.5	-55	177.3	-87	179.4	157.5	-164	-6	113.6	D38 V41 V45 T46 L47	D38-R43 WeakPolarHBondContact O-CB 3.4Å; D38-R43 WeakPolarHBondContact O-CG 3.34Å; D38-R43 PolarHBondContact O-N 3.35Å; V41-R43 PolarHBondContact O-N 3.38Å; R43-V45 VanDerWaalsContact C-N 3.31Å; R43-V45 PolarHBondContact O-N 3.47Å; R43-T46 PolarHBondContact O-N 3.26Å; R43-L47 WeakPolarHBondContact O-CG 3.44Å; R43-L47 PolarHBondContact O-N 3.25Å
44	P	96.8	Very high	95	Very high	62 Å²	62	96.5 Å²	96.5	40%	0.403	48%	0.479	S	S	.	.	H	α-helix	trans	-58.3	-40.4	176	-29	37.6	0	0	0	113.4	I40 V41 T46 L47 V48	I40-P44 WeakPolarHBondContact O-CG 3.36Å; V41-P44 WeakPolarHBondContact O-CD 3.48Å; P44-T46 VanDerWaalsContact C-N 3.32Å; P44-T46 PolarHBondContact O-N 2.93Å; P44-L47 PolarHBondContact O-N 2.85Å; P44-V48 WeakPolarHBondContact O-CG2 3.34Å; P44-V48 PolarHBondContact O-N 2.89Å
45	V	96.4	Very high	95.2	Very high	86 Å²	86	96.9 Å²	96.9	52%	0.521	48%	0.476	S	S	.	.	H	α-helix	trans	-62.5	-41.2	176.9	170.8	0	0	0	0	111.1	V41 D42 R43 V48 R49	V41-V45 HydrophobicContact CG1-CG2 4.43Å; V41-V45 WeakPolarHBondContact O-CB 3.45Å; V41-V45 WeakPolarHBondContact O-CG2 3.49Å; V41-V45 PolarHBondContact O-N 2.97Å; V41-V45 VanDerWaalsContact O-N 3.12Å; D42-V45 PolarHBondContact O-N 3.31Å; R43-V45 VanDerWaalsContact C-N 3.31Å; R43-V45 PolarHBondContact O-N 3.47Å; V45-V48 PolarHBondContact O-N 2.93Å; V45-R49 WeakPolarHBondContact O-CB 3.46Å; V45-R49 PolarHBondContact O-N 3.38Å
46	T	95.1	Very high	95.2	Very high	57 Å²	57	95.6 Å²	95.6	35%	0.35	47%	0.472	S	S	.	.	H	α-helix	trans	-62.5	-43.4	176.3	-58.7	0	0	0	0	111.5	D42 R43 P44 V48 R49 E50	D42-T46 WeakPolarHBondContact O-CB 3.44Å; D42-T46 PolarHBondContact O-N 3.04Å; D42-T46 PolarHBondContact O-OG1 2.88Å; R43-T46 PolarHBondContact O-N 3.26Å; P44-T46 VanDerWaalsContact C-N 3.32Å; P44-T46 PolarHBondContact O-N 2.93Å; T46-V48 PolarHBondContact O-N 3.3Å; T46-R49 WeakPolarHBondContact O-CB 3.22Å; T46-R49 PolarHBondContact O-N 2.96Å; T46-E50 WeakPolarHBondContact O-CG 3.48Å; T46-E50 PolarHBondContact O-N 3Å
47	L	96.1	Very high	95.2	Very high	110 Å²	110	97.2 Å²	97.2	58%	0.576	49%	0.486	S	S	*	.	H	α-helix	trans	-63.1	-39.9	176.8	-67.2	175.9	0	0	0	112.9	R43 P44 E50 F51	R43-L47 WeakPolarHBondContact O-CG 3.44Å; R43-L47 PolarHBondContact O-N 3.25Å; P44-L47 PolarHBondContact O-N 2.85Å; L47-E50 PolarHBondContact O-N 3.43Å; L47-F51 PolarHBondContact O-N 3.34Å
48	V	96.9	Very high	95.2	Very high	88 Å²	88	98.4 Å²	98.4	53%	0.533	49%	0.49	S	S	.	.	H	α-helix	trans	-65.1	-43.5	174.8	172.7	0	0	0	0	110.5	P44 V45 T46 E50 F51 I52	P44-V48 WeakPolarHBondContact O-CG2 3.34Å; P44-V48 PolarHBondContact O-N 2.89Å; V45-V48 PolarHBondContact O-N 2.93Å; T46-V48 PolarHBondContact O-N 3.3Å; V48-E50 PolarHBondContact O-N 3.11Å; V48-F51 WeakPolarHBondContact O-CB 3.44Å; V48-F51 PolarHBondContact O-N 3.08Å; V48-I52 HydrophobicContact CG1-CD1 3.91Å; V48-I52 WeakPolarHBondContact O-CG1 3.31Å; V48-I52 PolarHBondContact O-N 3.37Å
49	R	94.6	Very high	95.1	Very high	135 Å²	135	101 Å²	101	51%	0.509	51%	0.505	S	S	.	.	H	α-helix	trans	-59.2	-46.6	175.4	179.5	179.4	170.5	-179.8	-4.4	111.5	V45 T46 F51 I52 E53	V45-R49 WeakPolarHBondContact O-CB 3.46Å; V45-R49 PolarHBondContact O-N 3.38Å; T46-R49 WeakPolarHBondContact O-CB 3.22Å; T46-R49 PolarHBondContact O-N 2.96Å; R49-F51 VanDerWaalsContact C-N 3.31Å; R49-F51 PolarHBondContact O-N 3Å; R49-I52 PolarHBondContact O-N 3.31Å; R49-E53 HydrophobicContact CG-CG 4.38Å; R49-E53 IonicContact CZ-OE1 3.32Å; R49-E53 IonicContact NE-OE1 2.87Å; R49-E53 PolarHBondContact NE-OE1 3.01Å; R49-E53 IonicContact NH2-OE1 3.52Å; R49-E53 PolarHBondContact NH2-OE1 3.44Å; R49-E53 WeakPolarHBondContact O-CB 3.25Å; R49-E53 WeakPolarHBondContact O-CG 3.47Å; R49-E53 PolarHBondContact O-N 3.3Å
50	E	95.8	Very high	94.9	Very high	95 Å²	95	105 Å²	105	44%	0.444	51%	0.512	S	S	.	.	H	α-helix	trans	-62.1	-37.1	176	-73.6	175.5	-173.7	0	0	112.4	T46 L47 V48 R54	T46-E50 WeakPolarHBondContact O-CG 3.48Å; T46-E50 PolarHBondContact O-N 3Å; L47-E50 PolarHBondContact O-N 3.43Å; V48-E50 PolarHBondContact O-N 3.11Å; E50-R54 WeakPolarHBondContact O-CB 3.48Å; E50-R54 VanDerWaalsContact O-CG 3.28Å; E50-R54 WeakPolarHBondContact O-CG 3.44Å; E50-R54 PolarHBondContact O-N 2.87Å; E50-R54 PolarHBondContact O-NE 3.45Å
51	F	96.3	Very high	94.8	Very high	107 Å²	107	107.1 Å²	107.1	47%	0.469	51%	0.514	S	S	.	.	H	α-helix	trans	-62.6	-43.9	173.4	177.8	-97.2	0	0	0	112	L47 V48 R49 R54 Q55	L47-F51 PolarHBondContact O-N 3.34Å; V48-F51 WeakPolarHBondContact O-CB 3.44Å; V48-F51 PolarHBondContact O-N 3.08Å; R49-F51 VanDerWaalsContact C-N 3.31Å; R49-F51 PolarHBondContact O-N 3Å; F51-R54 PolarHBondContact O-N 2.85Å; F51-Q55 PolarHBondContact O-N 2.98Å
52	I	95.4	Very high	94.7	Very high	83 Å²	83	111.9 Å²	111.9	43%	0.426	53%	0.526	S	S	.	.	H	α-helix	trans	-66.3	-46.5	177.4	-67.9	166.2	0	0	0	110.9	V48 R49 R54 Q55 H56	V48-I52 HydrophobicContact CG1-CD1 3.91Å; V48-I52 WeakPolarHBondContact O-CG1 3.31Å; V48-I52 PolarHBondContact O-N 3.37Å; R49-I52 PolarHBondContact O-N 3.31Å; I52-R54 VanDerWaalsContact C-N 3.28Å; I52-R54 PolarHBondContact O-N 2.86Å; I52-Q55 PolarHBondContact O-N 3.39Å; I52-H56 PolarHBondContact O-CD2 3.42Å; I52-H56 PolarHBondContact O-N 2.9Å
53	E	94	Very high	94.7	Very high	91 Å²	91	117.6 Å²	117.6	43%	0.425	54%	0.543	S	S	.	.	H	α-helix	trans	-60.1	-36.9	177.2	-75.2	-178.4	-177.5	0	0	111.7	R49 Q55 H56 A57	R49-E53 HydrophobicContact CG-CG 4.38Å; R49-E53 IonicContact CZ-OE1 3.32Å; R49-E53 IonicContact NE-OE1 2.87Å; R49-E53 PolarHBondContact NE-OE1 3.01Å; R49-E53 IonicContact NH2-OE1 3.52Å; R49-E53 PolarHBondContact NH2-OE1 3.44Å; R49-E53 WeakPolarHBondContact O-CB 3.25Å; R49-E53 WeakPolarHBondContact O-CG 3.47Å; R49-E53 PolarHBondContact O-N 3.3Å; E53-Q55 VanDerWaalsContact C-N 3.3Å; E53-Q55 PolarHBondContact O-N 3.39Å; E53-H56 PolarHBondContact O-N 2.88Å; E53-A57 VanDerWaalsContact O-CB 3.32Å; E53-A57 WeakPolarHBondContact O-CB 3.3Å; E53-A57 PolarHBondContact O-N 3.23Å
54	R	95.3	Very high	94.7	Very high	147 Å²	147	119.7 Å²	119.7	56%	0.555	55%	0.552	S	S	*	*	H	α-helix	trans	-60.4	-35.3	171.8	-79.6	-177.2	-70.2	163.8	-7	113.2	E50 F51 I52 K58	E50-R54 WeakPolarHBondContact O-CB 3.48Å; E50-R54 VanDerWaalsContact O-CG 3.28Å; E50-R54 WeakPolarHBondContact O-CG 3.44Å; E50-R54 PolarHBondContact O-N 2.87Å; E50-R54 PolarHBondContact O-NE 3.45Å; F51-R54 PolarHBondContact O-N 2.85Å; I52-R54 VanDerWaalsContact C-N 3.28Å; I52-R54 PolarHBondContact O-N 2.86Å; R54-K58 WeakPolarHBondContact O-CG 3.34Å; R54-K58 PolarHBondContact O-N 3.35Å
55	Q	94.8	Very high	94.6	Very high	75 Å²	75	125 Å²	125	35%	0.35	57%	0.571	S	S	.	*	H	α-helix	trans	-75.3	-40.8	175.5	-54.9	-51.7	-28.7	0	0	111.6	F51 I52 E53 A57 K58 N59	F51-Q55 PolarHBondContact O-N 2.98Å; I52-Q55 PolarHBondContact O-N 3.39Å; E53-Q55 VanDerWaalsContact C-N 3.3Å; E53-Q55 PolarHBondContact O-N 3.39Å; Q55-A57 VanDerWaalsContact C-N 3.27Å; Q55-A57 PolarHBondContact O-N 3.25Å; Q55-K58 WeakPolarHBondContact O-CB 2.91Å; Q55-K58 PolarHBondContact O-N 3.2Å; Q55-N59 PolarHBondContact O-N 2.84Å
56	H	93.1	Very high	94.6	Very high	105 Å²	105	129.1 Å²	129.1	49%	0.486	58%	0.577	S	S	.	*	H	α-helix	trans	-62.1	-34.9	173.5	-75.8	-65.8	0	0	0	112.6	I52 E53 K58 N59 R60	I52-H56 PolarHBondContact O-CD2 3.42Å; I52-H56 PolarHBondContact O-N 2.9Å; E53-H56 PolarHBondContact O-N 2.88Å; H56-K58 VanDerWaalsContact C-N 3.29Å; H56-K58 PolarHBondContact O-N 2.97Å; H56-N59 CarbonylContact O-C 3.19Å; H56-N59 PolarHBondContact O-N 3.42Å; H56-R60 PolarHBondContact O-N 3.28Å
57	A	93.4	Very high	94.7	Very high	78 Å²	78	134.9 Å²	134.9	65%	0.645	60%	0.6	S	S	*	*	H	α-helix	trans	-65.3	-30.7	176.6	0	0	0	0	0	112.8	E53 Q55	E53-A57 VanDerWaalsContact O-CB 3.32Å; E53-A57 WeakPolarHBondContact O-CB 3.3Å; E53-A57 PolarHBondContact O-N 3.23Å; Q55-A57 VanDerWaalsContact C-N 3.27Å; Q55-A57 PolarHBondContact O-N 3.25Å
58	K	94.8	Very high	94.7	Very high	141 Å²	141	135.3 Å²	135.3	61%	0.613	60%	0.595	S	S	*	*	H	α-helix	trans	-67.5	-38.1	174.8	-68.2	172.3	-174.1	174.8	0	112	R54 Q55 H56	R54-K58 WeakPolarHBondContact O-CG 3.34Å; R54-K58 PolarHBondContact O-N 3.35Å; Q55-K58 WeakPolarHBondContact O-CB 2.91Å; Q55-K58 PolarHBondContact O-N 3.2Å; H56-K58 VanDerWaalsContact C-N 3.29Å; H56-K58 PolarHBondContact O-N 2.97Å
59	N	92.1	Very high	94.7	Very high	130 Å²	130	141.7 Å²	141.7	70%	0.695	61%	0.61	S	S	*	*	S	Bend	trans	-125.1	72.9	-175.5	-65.6	-17	0	0	0	110.6	Q55 H56 Y61	Q55-N59 PolarHBondContact O-N 2.84Å; H56-N59 CarbonylContact O-C 3.19Å; H56-N59 PolarHBondContact O-N 3.42Å; N59-Y61 PolarHBondContact O-N 3Å
60	R	91.9	Very high	94.7	Very high	185 Å²	185	143.2 Å²	143.2	70%	0.698	62%	0.615	S	S	*	*			trans	-78.8	120.6	179.2	-168.3	167.9	-174.7	162.7	1.6	110.8	H56 Y62	H56-R60 PolarHBondContact O-N 3.28Å; R60-Y62 HydrophobicContact CG-CE1 4.42Å; R60-Y62 HydrophobicContact CG-CE2 4.42Å
61	Y	92.6	Very high	94.7	Very high	170 Å²	170	140.2 Å²	140.2	67%	0.667	60%	0.604	S	S	*	*			trans	-102.1	144.8	170.5	58	-86.7	0	0	0	110.2	N59	N59-Y61 PolarHBondContact O-N 3Å
62	Y	94.4	Very high	94.7	Very high	161 Å²	161	137.8 Å²	137.8	63%	0.631	60%	0.598	S	S	*	*			trans	-109.2	140.2	177.1	-61.9	-82.9	0	0	0	109.6	R60	R60-Y62 HydrophobicContact CG-CE1 4.42Å; R60-Y62 HydrophobicContact CG-CE2 4.42Å
63	Y	94.3	Very high	94.6	Very high	202 Å²	202	137.9 Å²	137.9	79%	0.792	60%	0.6	S	S	*	*			trans	-126	150.5	170.3	68.4	-86.3	0	0	0	108.9
64	Y	95.2	Very high	94.6	Very high	206 Å²	206	135 Å²	135	81%	0.808	59%	0.587	S	S	*	*			trans	-119.1	146.1	-177.7	-59.9	-80.5	0	0	0	110.6
65	H	95.1	Very high	94.6	Very high	172 Å²	172	132.8 Å²	132.8	80%	0.796	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-74.4	130.3	171.1	-167.3	80.3	0	0	0	109.7	Q67	H65-Q67 PolarHBondContact O-N 3.22Å
66	R	96	Very high	94.5	Very high	173 Å²	173	136 Å²	136	65%	0.653	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-71.1	125.5	-179.2	-174.9	169.1	-178.3	-167.9	7	110.1	Y68	R66-Y68 WeakPolarHBondContact CD-OH 3.28Å; R66-Y68 HydrophobicContact CG-CE1 4.33Å; R66-Y68 HydrophobicContact CG-CE2 4.07Å; R66-Y68 VanDerWaalsContact NE-CE1 3.35Å; R66-Y68 PolarHBondContact NE-OH 3.09Å; R66-Y68 PolarHBondContact NH1-OH 3.1Å
67	Q	96.8	Very high	94.6	Very high	178 Å²	178	132 Å²	132	83%	0.832	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-103	125.8	176.3	-64.1	179	-2.6	0	0	109.8	H65	H65-Q67 PolarHBondContact O-N 3.22Å
68	Y	96.5	Very high	94.6	Very high	119 Å²	119	136.3 Å²	136.3	47%	0.467	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-102	127.8	175	-63	-82.8	0	0	0	109.3	R66	R66-Y68 WeakPolarHBondContact CD-OH 3.28Å; R66-Y68 HydrophobicContact CG-CE1 4.33Å; R66-Y68 HydrophobicContact CG-CE2 4.07Å; R66-Y68 VanDerWaalsContact NE-CE1 3.35Å; R66-Y68 PolarHBondContact NE-OH 3.09Å; R66-Y68 PolarHBondContact NH1-OH 3.1Å
69	R	96.4	Very high	94.3	Very high	223 Å²	223	138.2 Å²	138.2	84%	0.842	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-70.1	147.1	169.8	-168.5	177.5	66.6	155.3	-0.5	109.4
70	R	95.6	Very high	94.2	Very high	166 Å²	166	138.9 Å²	138.9	63%	0.626	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-66	142.5	171.6	-63.9	-64.5	178.4	-165.2	-1.6	110.7	D95	R70-D95 IonicContact CZ-OD1 3.8Å; R70-D95 IonicContact NH1-OD1 2.85Å; R70-D95 PolarHBondContact NH1-OD1 3.44Å; R70-D95 IonicContact NH1-OD2 3.25Å; R70-D95 PolarHBondContact NH1-OD2 2.56Å; R70-D95 IonicContact NH2-OD1 3.82Å
71	V	95.2	Very high	94.4	Very high	33 Å²	33	133.3 Å²	133.3	20%	0.2	59%	0.591	C	S	.	*			trans	-114.8	152.5	176	171.1	0	0	0	0	106.8	E87 Q91	V71-E87 HydrophobicContact CG1-CB 3.45Å; V71-E87 VanDerWaalsContact CG1-CB 3.45Å; V71-Q91 PolarHBondContact O-NE2 2.71Å; V71-Q91 PolarHBondContact O-OE1 3.33Å
72	P	95.6	Very high	94.5	Very high	55 Å²	55	131.4 Å²	131.4	36%	0.357	59%	0.591	S	S	.	*			trans	-51.5	139.1	170.3	22.5	-35.8	0	0	0	112.2	E76 A88	P72-E76 HydrophobicContact CB-CB 4.34Å; P72-E76 WeakPolarHBondContact CB-OE2 3.38Å; P72-A88 WeakPolarHBondContact O-CB 3.29Å
73	D	93.9	Very high	94.5	Very high	86 Å²	86	130.2 Å²	130.2	46%	0.46	60%	0.595	S	S	.	*			trans	-78.8	167.7	177.8	-69	-33.3	0	0	0	111.2	T75 E76 Q91	D73-T75 PolarHBondContact O-N 3.46Å; D73-E76 PolarHBondContact O-N 2.93Å; D73-Q91 PolarHBondContact OD1-NE2 3.03Å
74	I	94.3	Very high	94.6	Very high	30 Å²	30	121.7 Å²	121.7	15%	0.154	57%	0.565	C	S	.	*	T	Hydrogen-bonded Turn	trans	-60.7	-16.6	-175.9	-162	65	0	0	0	113.7	M85 A88 A152 R153 L156	I74-M85 HydrophobicContact CD1-CB 4.09Å; I74-M85 HydrophobicContact CD1-CG 3.76Å; I74-A88 HydrophobicContact CB-CB 4.32Å; I74-A88 HydrophobicContact CD1-CB 4.29Å; I74-A152 HydrophobicContact CB-CB 4.27Å; I74-A152 HydrophobicContact CG1-CB 4.49Å; I74-A152 HydrophobicContact CG2-CB 4.24Å; I74-R153 HydrophobicContact CD1-CG 4.3Å; I74-R153 HydrophobicContact CG1-CG 4.04Å; I74-L156 HydrophobicContact CG2-CB 4.31Å; I74-L156 HydrophobicContact CG2-CD1 3.58Å
75	T	93.7	Very high	94.6	Very high	100 Å²	100	113.6 Å²	113.6	61%	0.613	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-29.2	176.2	46.1	0	0	0	0	113.5	D73 L156	D73-T75 PolarHBondContact O-N 3.46Å; T75-L156 HydrophobicContact CG2-CD1 3.52Å
76	E	94	Very high	94.6	Very high	144 Å²	144	112 Å²	112	67%	0.673	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-17.5	-175.8	-63	179.1	174.5	0	0	112.1	P72 D73	P72-E76 HydrophobicContact CB-CB 4.34Å; P72-E76 WeakPolarHBondContact CB-OE2 3.38Å; D73-E76 PolarHBondContact O-N 2.93Å
77	C	94.1	Very high	94.6	Very high	20 Å²	20	108.7 Å²	108.7	14%	0.135	52%	0.515	C	S	.	.	S	Bend	trans	-69.8	139.7	178.3	-65.2	0	0	0	0	112.1	C84 M85	C77-C84 WeakPolarHBondContact CA-SG 3.44Å; C77-C84 HydrophobicContact CB-CB 3.81Å; C77-C84 WeakPolarHBondContact CB-SG 3.36Å; C77-C84 WeakPolarHBondContact SG-CB 3.43Å; C77-C84 PolarHBondContact SG-O 3.42Å; C77-C84 CovalentContact SG-SG 2.05Å; C77-C84 PolarHBondContact SG-SG 2.99Å; C77-M85 HydrophobicContact CB-CG 4.37Å
78	K	93.9	Very high	94.6	Very high	168 Å²	168	100.3 Å²	100.3	73%	0.73	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-71.4	149.2	171.4	-65.7	-179.6	-177.3	176.2	0	110.6	N80 D81	K78-N80 PolarHBondContact O-N 3.37Å; K78-D81 HydrophobicContact CB-CB 4.33Å; K78-D81 PolarHBondContact O-N 3.48Å
79	E	89.3	Confident	94.6	Very high	182 Å²	182	96.9 Å²	96.9	85%	0.85	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	132.6	172.4	-63.2	-175.7	172.8	0	0	109.9	D81	E79-D81 VanDerWaalsContact C-N 3.3Å; E79-D81 PolarHBondContact O-N 3.32Å
80	N	89.9	Confident	94.6	Very high	144 Å²	144	88.9 Å²	88.9	77%	0.77	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	4.8	-177	-50.9	-46.6	0	0	0	117.2	K78 I82	K78-N80 PolarHBondContact O-N 3.37Å; N80-I82 PolarHBondContact O-N 2.94Å; N80-I82 VanDerWaalsContact O-N 3.12Å
81	D	95.7	Very high	94.7	Very high	67 Å²	67	81.4 Å²	81.4	36%	0.358	41%	0.409	S	S	.	.			trans	-78.7	93.5	167.6	-173.3	-13.4	0	0	0	110.6	K78 E79 L83 C84 M85	K78-D81 HydrophobicContact CB-CB 4.33Å; K78-D81 PolarHBondContact O-N 3.48Å; E79-D81 VanDerWaalsContact C-N 3.3Å; E79-D81 PolarHBondContact O-N 3.32Å; D81-L83 VanDerWaalsContact C-N 3.29Å; D81-L83 PolarHBondContact O-N 2.97Å; D81-L83 PolarHBondContact OD1-N 2.97Å; D81-C84 HydrophobicContact CB-CB 4.23Å; D81-C84 PolarHBondContact OD1-N 3.41Å; D81-M85 WeakPolarHBondContact O-CB 3.44Å; D81-M85 WeakPolarHBondContact O-CE 3.35Å; D81-M85 VanDerWaalsContact O-CG 3.27Å; D81-M85 WeakPolarHBondContact O-CG 3.43Å; D81-M85 PolarHBondContact O-N 3.25Å
82	I	93.9	Very high	94.8	Very high	130 Å²	130	81.2 Å²	81.2	67%	0.667	41%	0.405	S	S	*	.	H	α-helix	trans	-65.2	-33.2	-174.5	-59.7	169.2	0	0	0	111.8	N80 M85 Y86	N80-I82 PolarHBondContact O-N 2.94Å; N80-I82 VanDerWaalsContact O-N 3.12Å; I82-M85 HydrophobicContact CG1-CE 4.34Å; I82-Y86 WeakPolarHBondContact O-CB 3.23Å; I82-Y86 PolarHBondContact O-N 2.95Å
83	L	95.7	Very high	94.8	Very high	137 Å²	137	83.8 Å²	83.8	72%	0.717	41%	0.407	S	S	*	.	H	α-helix	trans	-69.3	-48.7	-177.9	-67	174.2	0	0	0	110.4	D81 M85 Y86 E87	D81-L83 VanDerWaalsContact C-N 3.29Å; D81-L83 PolarHBondContact O-N 2.97Å; D81-L83 PolarHBondContact OD1-N 2.97Å; L83-M85 PolarHBondContact O-N 3.38Å; L83-Y86 PolarHBondContact O-N 3.02Å; L83-E87 PolarHBondContact O-N 3.38Å
84	C	95.6	Very high	95	Very high	23 Å²	23	83.2 Å²	83.2	16%	0.155	40%	0.399	C	S	.	.	H	α-helix	trans	-60.3	-47.8	175.9	-170.7	0	0	0	0	111.3	C77 D81 Y86 E87 A88	C77-C84 WeakPolarHBondContact CA-SG 3.44Å; C77-C84 HydrophobicContact CB-CB 3.81Å; C77-C84 WeakPolarHBondContact CB-SG 3.36Å; C77-C84 WeakPolarHBondContact SG-CB 3.43Å; C77-C84 PolarHBondContact SG-O 3.42Å; C77-C84 CovalentContact SG-SG 2.05Å; C77-C84 PolarHBondContact SG-SG 2.99Å; D81-C84 HydrophobicContact CB-CB 4.23Å; D81-C84 PolarHBondContact OD1-N 3.41Å; C84-Y86 VanDerWaalsContact C-N 3.31Å; C84-Y86 PolarHBondContact O-N 3.13Å; C84-E87 PolarHBondContact O-N 2.77Å; C84-A88 WeakPolarHBondContact O-CB 3.36Å; C84-A88 PolarHBondContact O-N 3.49Å
85	M	95.1	Very high	95.1	Very high	35 Å²	35	83.9 Å²	83.9	17%	0.172	40%	0.403	C	S	.	.	H	α-helix	trans	-61.4	-38.9	179.6	-71.2	-170.2	-68.7	0	0	112.3	I74 C77 D81 I82 L83 E89	I74-M85 HydrophobicContact CD1-CB 4.09Å; I74-M85 HydrophobicContact CD1-CG 3.76Å; C77-M85 HydrophobicContact CB-CG 4.37Å; D81-M85 WeakPolarHBondContact O-CB 3.44Å; D81-M85 WeakPolarHBondContact O-CE 3.35Å; D81-M85 VanDerWaalsContact O-CG 3.27Å; D81-M85 WeakPolarHBondContact O-CG 3.43Å; D81-M85 PolarHBondContact O-N 3.25Å; I82-M85 HydrophobicContact CG1-CE 4.34Å; L83-M85 PolarHBondContact O-N 3.38Å; M85-E89 WeakPolarHBondContact O-CB 3.4Å; M85-E89 WeakPolarHBondContact O-CG 3.47Å; M85-E89 PolarHBondContact O-N 3.2Å
86	Y	96.1	Very high	95.2	Very high	140 Å²	140	81 Å²	81	55%	0.549	38%	0.381	S	S	.	.	H	α-helix	trans	-63.4	-47.4	178.8	177.3	-94.7	0	0	0	111.9	I82 L83 C84 E89 M90	I82-Y86 WeakPolarHBondContact O-CB 3.23Å; I82-Y86 PolarHBondContact O-N 2.95Å; L83-Y86 PolarHBondContact O-N 3.02Å; C84-Y86 VanDerWaalsContact C-N 3.31Å; C84-Y86 PolarHBondContact O-N 3.13Å; Y86-E89 PolarHBondContact O-N 3.35Å; Y86-M90 HydrophobicContact CD1-CG 4.38Å; Y86-M90 HydrophobicContact CD2-CE 4.18Å; Y86-M90 HydrophobicContact CE1-CG 4.03Å; Y86-M90 HydrophobicContact CE2-CE 3.43Å; Y86-M90 VanDerWaalsContact CE2-CE 3.43Å; Y86-M90 HydrophobicContact CE2-CG 4.4Å; Y86-M90 VanDerWaalsContact O-CG 3.28Å; Y86-M90 WeakPolarHBondContact O-CG 3.47Å; Y86-M90 PolarHBondContact O-N 3.43Å
87	E	96.1	Very high	95.4	Very high	103 Å²	103	80.6 Å²	80.6	48%	0.481	38%	0.377	S	S	.	.	H	α-helix	trans	-66	-41.1	179.9	-60.7	-174.5	163.8	0	0	111.7	V71 L83 C84 M90 Q91	V71-E87 HydrophobicContact CG1-CB 3.45Å; V71-E87 VanDerWaalsContact CG1-CB 3.45Å; L83-E87 PolarHBondContact O-N 3.38Å; C84-E87 PolarHBondContact O-N 2.77Å; E87-M90 PolarHBondContact O-N 3.31Å; E87-Q91 PolarHBondContact O-N 2.9Å
88	A	96.8	Very high	95.5	Very high	2 Å²	2	83.5 Å²	83.5	2%	0.017	39%	0.394	C	S	.	.	H	α-helix	trans	-62.4	-43	175.4	0	0	0	0	0	112.1	P72 I74 C84 M90 Q91 W92	P72-A88 WeakPolarHBondContact O-CB 3.29Å; I74-A88 HydrophobicContact CB-CB 4.32Å; I74-A88 HydrophobicContact CD1-CB 4.29Å; C84-A88 WeakPolarHBondContact O-CB 3.36Å; C84-A88 PolarHBondContact O-N 3.49Å; A88-M90 VanDerWaalsContact C-N 3.33Å; A88-M90 PolarHBondContact O-N 3.3Å; A88-Q91 WeakPolarHBondContact O-CB 3.49Å; A88-Q91 PolarHBondContact O-N 3.39Å; A88-W92 PolarHBondContact O-N 2.84Å
89	E	96.1	Very high	95.7	Very high	47 Å²	47	76.8 Å²	76.8	22%	0.22	37%	0.366	C	S	.	.	H	α-helix	trans	-64	-38.8	175	-79.9	-168.6	176	0	0	112.1	M85 Y86 Q91 W92 R93 A152	M85-E89 WeakPolarHBondContact O-CB 3.4Å; M85-E89 WeakPolarHBondContact O-CG 3.47Å; M85-E89 PolarHBondContact O-N 3.2Å; Y86-E89 PolarHBondContact O-N 3.35Å; E89-Q91 VanDerWaalsContact C-N 3.35Å; E89-W92 PolarHBondContact O-N 3.14Å; E89-R93 WeakPolarHBondContact O-CB 3.4Å; E89-R93 VanDerWaalsContact O-CG 3.29Å; E89-R93 WeakPolarHBondContact O-CG 3.32Å; E89-R93 PolarHBondContact O-N 3.42Å; E89-A152 HydrophobicContact CG-CB 4.3Å
90	M	96.5	Very high	96	Very high	55 Å²	55	71.2 Å²	71.2	27%	0.271	34%	0.34	S	S	.	.	H	α-helix	trans	-68.7	-34.6	177	-70.3	-61.3	165	0	0	112.2	Y86 E87 A88 R94	Y86-M90 HydrophobicContact CD1-CG 4.38Å; Y86-M90 HydrophobicContact CD2-CE 4.18Å; Y86-M90 HydrophobicContact CE1-CG 4.03Å; Y86-M90 HydrophobicContact CE2-CE 3.43Å; Y86-M90 VanDerWaalsContact CE2-CE 3.43Å; Y86-M90 HydrophobicContact CE2-CG 4.4Å; Y86-M90 VanDerWaalsContact O-CG 3.28Å; Y86-M90 WeakPolarHBondContact O-CG 3.47Å; Y86-M90 PolarHBondContact O-N 3.43Å; E87-M90 PolarHBondContact O-N 3.31Å; A88-M90 VanDerWaalsContact C-N 3.33Å; A88-M90 PolarHBondContact O-N 3.3Å; M90-R94 WeakPolarHBondContact O-CG 3.47Å; M90-R94 PolarHBondContact O-N 3.02Å; M90-R94 PolarHBondContact O-NH1 3.02Å
91	Q	97.1	Very high	96.4	Very high	8 Å²	8	69.7 Å²	69.7	4%	0.037	33%	0.328	C	S	.	.	H	α-helix	trans	-61	-54.5	170.2	174.5	154.2	-56.3	0	0	110.9	V71 D73 E87 A88 E89 R93 R94 D95	V71-Q91 PolarHBondContact O-NE2 2.71Å; V71-Q91 PolarHBondContact O-OE1 3.33Å; D73-Q91 PolarHBondContact OD1-NE2 3.03Å; E87-Q91 PolarHBondContact O-N 2.9Å; A88-Q91 WeakPolarHBondContact O-CB 3.49Å; A88-Q91 PolarHBondContact O-N 3.39Å; E89-Q91 VanDerWaalsContact C-N 3.35Å; Q91-R93 VanDerWaalsContact C-N 3.3Å; Q91-R93 PolarHBondContact O-N 3.37Å; Q91-R94 WeakPolarHBondContact O-CB 3.39Å; Q91-R94 PolarHBondContact O-N 3.13Å; Q91-D95 WeakPolarHBondContact CG-OD2 3.35Å; Q91-D95 PolarHBondContact O-N 2.89Å
92	W	97	Very high	96.4	Very high	30 Å²	30	70 Å²	70	11%	0.114	33%	0.329	C	S	.	.	H	α-helix	trans	-59	-38.9	179.8	179.8	88.4	0	0	0	112.7	A88 E89 R94 D95 Y96 Y143 L146 Y150 A152 C155	A88-W92 PolarHBondContact O-N 2.84Å; E89-W92 PolarHBondContact O-N 3.14Å; W92-R94 VanDerWaalsContact C-N 3.32Å; W92-R94 PolarHBondContact O-N 3.21Å; W92-D95 PolarHBondContact O-N 3.34Å; W92-Y96 WeakPolarHBondContact O-CB 3.48Å; W92-Y96 PolarHBondContact O-N 2.86Å; W92-Y143 AromaticContact CE2-CE1 3.98Å; W92-Y143 AromaticContact CZ2-CD1 3.89Å; W92-Y143 HydrophobicContact CZ2-CD1 3.89Å; W92-Y143 AromaticContact CZ2-CE1 3.77Å; W92-Y143 HydrophobicContact CZ2-CE1 3.77Å; W92-Y143 AromaticContact NE1-CE1 3.9Å; W92-L146 HydrophobicContact CH2-CD1 4.18Å; W92-L146 HydrophobicContact CZ2-CD1 3.82Å; W92-Y150 AromaticContact CH2-CD2 3.45Å; W92-Y150 HydrophobicContact CH2-CD2 3.45Å; W92-Y150 VanDerWaalsContact CH2-CD2 3.45Å; W92-Y150 HydrophobicContact CH2-CE2 4.23Å; W92-Y150 HydrophobicContact CH2-CG 4.07Å; W92-Y150 AromaticContact CZ3-CD2 3.39Å; W92-Y150 HydrophobicContact CZ3-CD2 3.39Å; W92-Y150 AromaticContact CZ3-CE2 3.89Å; W92-Y150 HydrophobicContact CZ3-CE2 3.89Å; W92-Y150 HydrophobicContact CZ3-CG 4.41Å; W92-A152 HydrophobicContact CB-CB 3.83Å; W92-A152 HydrophobicContact CD2-CB 4.12Å; W92-A152 HydrophobicContact CG-CB 3.74Å; W92-C155 HydrophobicContact CZ2-CB 4.08Å
93	R	96.5	Very high	96.6	Very high	109 Å²	109	65 Å²	65	41%	0.411	30%	0.304	S	S	.	.	H	α-helix	trans	-64.4	-34.2	175.2	-76.6	176.7	-175.2	-127.2	3.8	113.1	E89 Q91 K97	E89-R93 WeakPolarHBondContact O-CB 3.4Å; E89-R93 VanDerWaalsContact O-CG 3.29Å; E89-R93 WeakPolarHBondContact O-CG 3.32Å; E89-R93 PolarHBondContact O-N 3.42Å; Q91-R93 VanDerWaalsContact C-N 3.3Å; Q91-R93 PolarHBondContact O-N 3.37Å; R93-K97 PolarHBondContact O-N 3.19Å
94	R	97.1	Very high	96.6	Very high	73 Å²	73	61.9 Å²	61.9	28%	0.275	29%	0.289	S	S	.	.	H	α-helix	trans	-70.1	-48.2	174.7	-73.4	-175.8	-63.3	-92.4	5.7	110.2	M90 Q91 W92 Y96 K97 V98	M90-R94 WeakPolarHBondContact O-CG 3.47Å; M90-R94 PolarHBondContact O-N 3.02Å; M90-R94 PolarHBondContact O-NH1 3.02Å; Q91-R94 WeakPolarHBondContact O-CB 3.39Å; Q91-R94 PolarHBondContact O-N 3.13Å; W92-R94 VanDerWaalsContact C-N 3.32Å; W92-R94 PolarHBondContact O-N 3.21Å; R94-Y96 VanDerWaalsContact C-N 3.28Å; R94-Y96 PolarHBondContact O-N 3.32Å; R94-K97 PolarHBondContact O-N 3.12Å; R94-K97 VanDerWaalsContact O-N 3.13Å; R94-V98 WeakPolarHBondContact O-CG2 3.49Å; R94-V98 PolarHBondContact O-N 2.86Å
95	D	97.3	Very high	96.6	Very high	45 Å²	45	62.9 Å²	62.9	24%	0.241	29%	0.292	C	S	.	.	H	α-helix	trans	-62.1	-37.3	179.6	-65.6	-37.3	0	0	0	111.2	R70 Q91 W92 K97 V98 D99	R70-D95 IonicContact CZ-OD1 3.8Å; R70-D95 IonicContact NH1-OD1 2.85Å; R70-D95 PolarHBondContact NH1-OD1 3.44Å; R70-D95 IonicContact NH1-OD2 3.25Å; R70-D95 PolarHBondContact NH1-OD2 2.56Å; R70-D95 IonicContact NH2-OD1 3.82Å; Q91-D95 WeakPolarHBondContact CG-OD2 3.35Å; Q91-D95 PolarHBondContact O-N 2.89Å; W92-D95 PolarHBondContact O-N 3.34Å; D95-K97 PolarHBondContact O-N 2.82Å; D95-V98 PolarHBondContact O-N 3.16Å; D95-D99 WeakPolarHBondContact O-CB 3.19Å; D95-D99 PolarHBondContact O-N 3.41Å
96	Y	96.3	Very high	96.6	Very high	38 Å²	38	62.1 Å²	62.1	15%	0.149	29%	0.288	C	S	.	.	H	α-helix	trans	-57.6	-45.8	172.4	177.1	-115.4	0	0	0	112.9	W92 R94 D99 Q100 Y139 Y143 Y150	W92-Y96 WeakPolarHBondContact O-CB 3.48Å; W92-Y96 PolarHBondContact O-N 2.86Å; R94-Y96 VanDerWaalsContact C-N 3.28Å; R94-Y96 PolarHBondContact O-N 3.32Å; Y96-D99 PolarHBondContact O-N 3Å; Y96-Q100 HydrophobicContact CE2-CG 4.49Å; Y96-Q100 WeakPolarHBondContact O-CG 3.49Å; Y96-Q100 PolarHBondContact O-N 3.4Å; Y96-Q100 PolarHBondContact OH-NE2 2.79Å; Y96-Y139 HydrophobicContact CE2-CE2 4.36Å; Y96-Y139 VanDerWaalsContact CE2-OH 3.32Å; Y96-Y139 WeakPolarHBondContact CE2-OH 3.39Å; Y96-Y139 PolarHBondContact OH-OH 2.87Å; Y96-Y143 AromaticContact CD2-CD1 3.52Å; Y96-Y143 HydrophobicContact CD2-CD1 3.52Å; Y96-Y143 AromaticContact CD2-CD2 3.87Å; Y96-Y143 HydrophobicContact CD2-CD2 3.87Å; Y96-Y143 AromaticContact CD2-CE1 3.55Å; Y96-Y143 HydrophobicContact CD2-CE1 3.55Å; Y96-Y143 AromaticContact CD2-CE2 3.87Å; Y96-Y143 HydrophobicContact CD2-CE2 3.87Å; Y96-Y143 AromaticContact CD2-CG 3.68Å; Y96-Y143 HydrophobicContact CD2-CG 3.68Å; Y96-Y143 AromaticContact CD2-CZ 3.72Å; Y96-Y143 AromaticContact CE2-CD1 3.89Å; Y96-Y143 HydrophobicContact CE2-CD1 3.89Å; Y96-Y143 HydrophobicContact CE2-CD2 4.03Å; Y96-Y143 HydrophobicContact CE2-CE1 4.37Å; Y96-Y143 HydrophobicContact CE2-CE2 4.46Å; Y96-Y143 AromaticContact CE2-CG 3.69Å; Y96-Y143 HydrophobicContact CE2-CG 3.69Å; Y96-Y143 HydrophobicContact CG-CE1 4.35Å; Y96-Y150 HydrophobicContact CD1-CE2 4.45Å; Y96-Y150 HydrophobicContact CE1-CE2 4.47Å
97	K	96.9	Very high	96.6	Very high	137 Å²	137	58.8 Å²	58.8	60%	0.596	28%	0.278	S	S	*	.	H	α-helix	trans	-67.3	-37.6	176.6	-72.3	-179.2	177.3	-174.1	0	112.1	R93 R94 D95 D99 Q100 E101	R93-K97 PolarHBondContact O-N 3.19Å; R94-K97 PolarHBondContact O-N 3.12Å; R94-K97 VanDerWaalsContact O-N 3.13Å; D95-K97 PolarHBondContact O-N 2.82Å; K97-D99 VanDerWaalsContact C-N 3.35Å; K97-Q100 WeakPolarHBondContact O-CB 3.42Å; K97-Q100 PolarHBondContact O-N 2.96Å; K97-E101 PolarHBondContact O-N 3.2Å; K97-E101 VanDerWaalsContact O-N 3.14Å
98	V	97.3	Very high	96.5	Very high	81 Å²	81	56 Å²	56	49%	0.491	27%	0.272	S	S	.	.	H	α-helix	trans	-63.3	-44.3	175.3	172.1	0	0	0	0	110.3	R94 D95 Q100 E101 I102	R94-V98 WeakPolarHBondContact O-CG2 3.49Å; R94-V98 PolarHBondContact O-N 2.86Å; D95-V98 PolarHBondContact O-N 3.16Å; V98-Q100 VanDerWaalsContact C-N 3.32Å; V98-Q100 PolarHBondContact O-N 2.86Å; V98-E101 PolarHBondContact O-N 3.46Å; V98-E101 VanDerWaalsContact O-N 3.14Å; V98-I102 HydrophobicContact CG1-CD1 3.99Å; V98-I102 HydrophobicContact CG1-CG1 4.47Å; V98-I102 WeakPolarHBondContact O-CG1 3.28Å; V98-I102 PolarHBondContact O-N 3.49Å
99	D	97.6	Very high	96.4	Very high	27 Å²	27	58.4 Å²	58.4	14%	0.144	28%	0.281	C	S	.	.	H	α-helix	trans	-63.7	-35.8	177.2	-73.6	-29.2	0	0	0	112.4	D95 Y96 K97 I102 V103 Y139 R142 Y143	D95-D99 WeakPolarHBondContact O-CB 3.19Å; D95-D99 PolarHBondContact O-N 3.41Å; Y96-D99 PolarHBondContact O-N 3Å; K97-D99 VanDerWaalsContact C-N 3.35Å; D99-I102 PolarHBondContact O-N 3.35Å; D99-V103 WeakPolarHBondContact O-CG2 3.28Å; D99-V103 PolarHBondContact O-N 2.88Å; D99-Y139 HydrophobicContact CB-CD2 4.09Å; D99-Y139 HydrophobicContact CB-CE2 4.13Å; D99-R142 IonicContact OD1-NH1 2.78Å; D99-R142 PolarHBondContact OD1-NH1 3.41Å; D99-R142 IonicContact OD2-CZ 2.98Å; D99-R142 IonicContact OD2-NH1 3.33Å; D99-R142 PolarHBondContact OD2-NH1 3.33Å; D99-Y143 HydrophobicContact CB-CE2 3.81Å; D99-Y143 VanDerWaalsContact OD2-CE2 3.23Å; D99-Y143 WeakPolarHBondContact OD2-CE2 3.36Å; D99-Y143 VanDerWaalsContact OD2-CZ 3.3Å; D99-Y143 PolarHBondContact OD2-OH 3.37Å
100	Q	96.2	Very high	96.2	Very high	65 Å²	65	57.8 Å²	57.8	30%	0.304	28%	0.279	S	S	.	.	H	α-helix	trans	-59.2	-46.2	171.2	-75	178.3	-25.8	0	0	111.6	Y96 K97 V98 I102 V103 N104 Y139	Y96-Q100 HydrophobicContact CE2-CG 4.49Å; Y96-Q100 WeakPolarHBondContact O-CG 3.49Å; Y96-Q100 PolarHBondContact O-N 3.4Å; Y96-Q100 PolarHBondContact OH-NE2 2.79Å; K97-Q100 WeakPolarHBondContact O-CB 3.42Å; K97-Q100 PolarHBondContact O-N 2.96Å; V98-Q100 VanDerWaalsContact C-N 3.32Å; V98-Q100 PolarHBondContact O-N 2.86Å; Q100-I102 VanDerWaalsContact C-N 3.33Å; Q100-I102 PolarHBondContact O-N 3.48Å; Q100-V103 PolarHBondContact O-N 3.45Å; Q100-N104 VanDerWaalsContact O-CG 3.25Å; Q100-N104 PolarHBondContact O-N 2.97Å; Q100-N104 PolarHBondContact O-ND2 2.8Å; Q100-Y139 HydrophobicContact CG-CE2 4.15Å; Q100-Y139 WeakPolarHBondContact CG-OH 2.96Å
101	E	97	Very high	96.1	Very high	111 Å²	111	60.8 Å²	60.8	52%	0.519	29%	0.29	S	S	.	.	H	α-helix	trans	-68.2	-32.7	177.3	-63.9	-54.2	158.1	0	0	112.6	K97 V98 V103 N104 I105	K97-E101 PolarHBondContact O-N 3.2Å; K97-E101 VanDerWaalsContact O-N 3.14Å; V98-E101 PolarHBondContact O-N 3.46Å; V98-E101 VanDerWaalsContact O-N 3.14Å; E101-V103 PolarHBondContact O-N 2.91Å; E101-N104 WeakPolarHBondContact O-CB 3.4Å; E101-N104 PolarHBondContact O-N 3.38Å; E101-N104 PolarHBondContact OE2-ND2 2.87Å; E101-I105 WeakPolarHBondContact O-CG1 3.28Å; E101-I105 PolarHBondContact O-N 3.37Å
102	I	96.8	Very high	95.8	Very high	73 Å²	73	62.1 Å²	62.1	37%	0.374	30%	0.303	S	S	.	.	H	α-helix	trans	-60.1	-47.2	172.4	-70.2	167.5	0	0	0	110.3	V98 D99 Q100 N104 I105 I106 V135	V98-I102 HydrophobicContact CG1-CD1 3.99Å; V98-I102 HydrophobicContact CG1-CG1 4.47Å; V98-I102 WeakPolarHBondContact O-CG1 3.28Å; V98-I102 PolarHBondContact O-N 3.49Å; D99-I102 PolarHBondContact O-N 3.35Å; Q100-I102 VanDerWaalsContact C-N 3.33Å; Q100-I102 PolarHBondContact O-N 3.48Å; I102-N104 VanDerWaalsContact C-N 3.32Å; I102-N104 PolarHBondContact O-N 2.74Å; I102-I105 PolarHBondContact O-N 3.46Å; I102-I106 WeakPolarHBondContact O-CG1 3.31Å; I102-I106 PolarHBondContact O-N 3.19Å; I102-I106 VanDerWaalsContact O-N 3.09Å; I102-V135 HydrophobicContact CG2-CG1 4.26Å
103	V	96.9	Very high	95.6	Very high	25 Å²	25	61.2 Å²	61.2	15%	0.152	30%	0.301	C	S	.	.	H	α-helix	trans	-60.4	-43.6	175.7	175.1	0	0	0	0	110.8	D99 Q100 E101 I105 I106 Q107 V135 Y139	D99-V103 WeakPolarHBondContact O-CG2 3.28Å; D99-V103 PolarHBondContact O-N 2.88Å; Q100-V103 PolarHBondContact O-N 3.45Å; E101-V103 PolarHBondContact O-N 2.91Å; V103-I105 VanDerWaalsContact C-N 3.33Å; V103-I105 PolarHBondContact O-N 3.47Å; V103-I106 PolarHBondContact O-N 3.46Å; V103-Q107 WeakPolarHBondContact O-CB 3.47Å; V103-Q107 PolarHBondContact O-N 3.16Å; V103-V135 HydrophobicContact CG2-CG1 3.98Å; V103-Y139 HydrophobicContact CG2-CD1 4.4Å; V103-Y139 HydrophobicContact CG2-CD2 3.78Å; V103-Y139 HydrophobicContact CG2-CE2 4.44Å; V103-Y139 HydrophobicContact CG2-CG 3.76Å
104	N	96.4	Very high	95.4	Very high	73 Å²	73	60.4 Å²	60.4	39%	0.39	30%	0.302	S	S	.	.	H	α-helix	trans	-59.8	-42	177.6	-68.6	-23.5	0	0	0	112.1	Q100 E101 I102 Q107 A108	Q100-N104 VanDerWaalsContact O-CG 3.25Å; Q100-N104 PolarHBondContact O-N 2.97Å; Q100-N104 PolarHBondContact O-ND2 2.8Å; E101-N104 WeakPolarHBondContact O-CB 3.4Å; E101-N104 PolarHBondContact O-N 3.38Å; E101-N104 PolarHBondContact OE2-ND2 2.87Å; I102-N104 VanDerWaalsContact C-N 3.32Å; I102-N104 PolarHBondContact O-N 2.74Å; N104-Q107 PolarHBondContact O-N 2.96Å; N104-A108 WeakPolarHBondContact O-CB 3.32Å; N104-A108 PolarHBondContact O-N 3.43Å
105	I	95.8	Very high	95.2	Very high	44 Å²	44	64.8 Å²	64.8	23%	0.226	33%	0.326	C	S	.	.	H	α-helix	trans	-62.4	-49.1	178	-70.2	164.5	0	0	0	110.4	V9 Y10 E101 I102 V103 Q107 A108 R109	V9-I105 HydrophobicContact CG1-CG2 3.97Å; Y10-I105 HydrophobicContact CE1-CG2 4.24Å; E101-I105 WeakPolarHBondContact O-CG1 3.28Å; E101-I105 PolarHBondContact O-N 3.37Å; I102-I105 PolarHBondContact O-N 3.46Å; V103-I105 VanDerWaalsContact C-N 3.33Å; V103-I105 PolarHBondContact O-N 3.47Å; I105-Q107 VanDerWaalsContact C-N 3.31Å; I105-Q107 PolarHBondContact O-N 3.26Å; I105-A108 WeakPolarHBondContact O-CB 3.35Å; I105-A108 PolarHBondContact O-N 3.46Å; I105-A108 VanDerWaalsContact O-N 3.15Å; I105-R109 WeakPolarHBondContact O-CG 3.16Å; I105-R109 PolarHBondContact O-N 3.42Å
106	I	95.6	Very high	94.8	Very high	19 Å²	19	67.9 Å²	67.9	10%	0.097	33%	0.334	C	S	.	.	H	α-helix	trans	-65.8	-37.4	180	-58.2	-58.4	0	0	0	110.9	I102 V103 A108 R109 L110 F132 V135	I102-I106 WeakPolarHBondContact O-CG1 3.31Å; I102-I106 PolarHBondContact O-N 3.19Å; I102-I106 VanDerWaalsContact O-N 3.09Å; V103-I106 PolarHBondContact O-N 3.46Å; I106-A108 VanDerWaalsContact C-N 3.34Å; I106-A108 PolarHBondContact O-N 3.45Å; I106-R109 WeakPolarHBondContact O-CB 3.45Å; I106-R109 PolarHBondContact O-N 2.94Å; I106-L110 PolarHBondContact O-N 3.4Å; I106-F132 HydrophobicContact CG2-CB 3.94Å; I106-F132 HydrophobicContact CG2-CD2 4.15Å; I106-V135 HydrophobicContact CG1-CG2 4.34Å
107	Q	95.3	Very high	94.5	Very high	70 Å²	70	68.6 Å²	68.6	33%	0.327	34%	0.339	S	S	.	.	H	α-helix	trans	-63.3	-39.6	172.8	-167.7	-174.4	12.8	0	0	112	V103 N104 I105 L110 K111 F132	V103-Q107 WeakPolarHBondContact O-CB 3.47Å; V103-Q107 PolarHBondContact O-N 3.16Å; N104-Q107 PolarHBondContact O-N 2.96Å; I105-Q107 VanDerWaalsContact C-N 3.31Å; I105-Q107 PolarHBondContact O-N 3.26Å; Q107-L110 PolarHBondContact O-N 2.99Å; Q107-K111 WeakPolarHBondContact O-CG 3.37Å; Q107-K111 PolarHBondContact O-N 3.46Å; Q107-F132 HydrophobicContact CB-CE2 4.13Å; Q107-F132 HydrophobicContact CG-CE2 4.34Å
108	A	94.3	Very high	94.1	Very high	44 Å²	44	64 Å²	64	36%	0.364	33%	0.33	S	S	.	.	H	α-helix	trans	-64.6	-39.3	175.8	0	0	0	0	0	111.6	N104 I105 I106 K111 A112	N104-A108 WeakPolarHBondContact O-CB 3.32Å; N104-A108 PolarHBondContact O-N 3.43Å; I105-A108 WeakPolarHBondContact O-CB 3.35Å; I105-A108 PolarHBondContact O-N 3.46Å; I105-A108 VanDerWaalsContact O-N 3.15Å; I106-A108 VanDerWaalsContact C-N 3.34Å; I106-A108 PolarHBondContact O-N 3.45Å; A108-K111 PolarHBondContact O-N 3.06Å; A108-A112 VanDerWaalsContact O-CB 3.27Å; A108-A112 WeakPolarHBondContact O-CB 3.32Å; A108-A112 PolarHBondContact O-N 2.75Å
109	R	93.6	Very high	93.7	Very high	53 Å²	53	69.1 Å²	69.1	20%	0.2	35%	0.348	C	S	.	.	H	α-helix	trans	-59.9	-47.1	172.9	-68.6	178.1	-177.8	-174.8	-0.9	111.7	D8 V9 I105 I106 K111 A112 C113	D8-R109 PolarHBondContact O-NH2 3.4Å; V9-R109 VanDerWaalsContact C-NH2 3.32Å; V9-R109 VanDerWaalsContact CA-NH2 3.28Å; V9-R109 PolarHBondContact O-NE 3.38Å; V9-R109 PolarHBondContact O-NH2 3.21Å; I105-R109 WeakPolarHBondContact O-CG 3.16Å; I105-R109 PolarHBondContact O-N 3.42Å; I106-R109 WeakPolarHBondContact O-CB 3.45Å; I106-R109 PolarHBondContact O-N 2.94Å; R109-K111 PolarHBondContact O-N 2.99Å; R109-A112 PolarHBondContact O-N 2.7Å; R109-C113 VanDerWaalsContact O-CB 3.31Å; R109-C113 WeakPolarHBondContact O-CB 3.48Å; R109-C113 PolarHBondContact O-N 3.14Å
110	L	92.9	Very high	93.3	Very high	34 Å²	34	73 Å²	73	18%	0.178	37%	0.369	C	S	.	.	H	α-helix	trans	-61.4	-44.8	178.6	-176.7	139	0	0	0	111.9	I106 Q107 A112 C113 Q114 V129 F132	I106-L110 PolarHBondContact O-N 3.4Å; Q107-L110 PolarHBondContact O-N 2.99Å; L110-A112 PolarHBondContact O-N 3.33Å; L110-C113 PolarHBondContact O-N 3.09Å; L110-Q114 WeakPolarHBondContact O-CB 3.45Å; L110-Q114 PolarHBondContact O-N 3.3Å; L110-V129 HydrophobicContact CD1-CB 4.33Å; L110-V129 HydrophobicContact CD1-CG2 3.79Å; L110-F132 HydrophobicContact CD1-CB 3.92Å; L110-F132 HydrophobicContact CD1-CD1 4.4Å; L110-F132 HydrophobicContact CD1-CG 4.21Å
111	K	93.3	Very high	93	Very high	117 Å²	117	74 Å²	74	51%	0.509	37%	0.371	S	S	.	.	H	α-helix	trans	-62.7	-41.9	174.9	-71.8	174.8	-178.9	171.9	0	112.1	Q107 A108 R109 Q114 Q115	Q107-K111 WeakPolarHBondContact O-CG 3.37Å; Q107-K111 PolarHBondContact O-N 3.46Å; A108-K111 PolarHBondContact O-N 3.06Å; R109-K111 PolarHBondContact O-N 2.99Å; K111-Q114 PolarHBondContact O-N 3.21Å; K111-Q115 WeakPolarHBondContact O-CB 3.33Å; K111-Q115 PolarHBondContact O-N 3.31Å
112	A	92.4	Very high	92.5	Very high	37 Å²	37	76.6 Å²	76.6	31%	0.306	38%	0.38	S	S	.	.	H	α-helix	trans	-64.3	-41.5	178	0	0	0	0	0	111.7	A108 R109 L110 Q115 R116	A108-A112 VanDerWaalsContact O-CB 3.27Å; A108-A112 WeakPolarHBondContact O-CB 3.32Å; A108-A112 PolarHBondContact O-N 2.75Å; R109-A112 PolarHBondContact O-N 2.7Å; L110-A112 PolarHBondContact O-N 3.33Å; A112-Q115 PolarHBondContact O-N 3.42Å; A112-R116 WeakPolarHBondContact O-CB 3.34Å; A112-R116 WeakPolarHBondContact O-CG 3.41Å; A112-R116 PolarHBondContact O-N 2.87Å
113	C	92.8	Very high	92.1	Very high	11 Å²	11	80.6 Å²	80.6	7%	0.074	40%	0.397	C	S	.	.	H	α-helix	trans	-62.8	-49.1	175.6	174.1	0	0	0	0	111.5	R109 L110 Q115 R116 E117 C125 E128	R109-C113 VanDerWaalsContact O-CB 3.31Å; R109-C113 WeakPolarHBondContact O-CB 3.48Å; R109-C113 PolarHBondContact O-N 3.14Å; L110-C113 PolarHBondContact O-N 3.09Å; C113-Q115 VanDerWaalsContact C-N 3.31Å; C113-Q115 PolarHBondContact O-N 3.27Å; C113-R116 PolarHBondContact O-N 3.44Å; C113-R116 VanDerWaalsContact O-N 3.12Å; C113-E117 WeakPolarHBondContact O-CG 3.22Å; C113-E117 PolarHBondContact O-N 2.95Å; C113-C125 HydrophobicContact CB-CB 4.39Å; C113-C125 WeakPolarHBondContact CB-SG 3.41Å; C113-C125 WeakPolarHBondContact SG-CA 3.44Å; C113-C125 WeakPolarHBondContact SG-CB 3.45Å; C113-C125 CovalentContact SG-SG 2.04Å; C113-C125 PolarHBondContact SG-SG 3.15Å; C113-E128 HydrophobicContact CB-CG 4.09Å
114	Q	92.4	Very high	91.8	Very high	92 Å²	92	84 Å²	84	43%	0.43	41%	0.414	S	S	.	.	H	α-helix	trans	-56.4	-43.8	175.8	-174.5	-179.9	-1.7	0	0	112.3	L110 K111 G118 Y121	L110-Q114 WeakPolarHBondContact O-CB 3.45Å; L110-Q114 PolarHBondContact O-N 3.3Å; K111-Q114 PolarHBondContact O-N 3.21Å; Q114-G118 PolarHBondContact O-N 3.44Å; Q114-Y121 HydrophobicContact CG-CD2 4.15Å; Q114-Y121 HydrophobicContact CG-CG 4.31Å
115	Q	92.4	Very high	91.7	Very high	164 Å²	164	80.7 Å²	80.7	77%	0.766	40%	0.397	S	S	*	.	H	α-helix	trans	-68.7	-34.6	179.1	-174.1	62.3	25.1	0	0	112.7	K111 A112 C113	K111-Q115 WeakPolarHBondContact O-CB 3.33Å; K111-Q115 PolarHBondContact O-N 3.31Å; A112-Q115 PolarHBondContact O-N 3.42Å; C113-Q115 VanDerWaalsContact C-N 3.31Å; C113-Q115 PolarHBondContact O-N 3.27Å
116	R	88.8	Confident	91.5	Very high	111 Å²	111	81.2 Å²	81.2	42%	0.419	40%	0.404	S	S	.	.	H	α-helix	trans	-74.5	-38.9	-179.3	-75	173.9	-161.3	-98.1	-5.9	112.6	E12 A112 C113	E12-R116 VanDerWaalsContact CD-CZ 3.47Å; E12-R116 VanDerWaalsContact CD-NH1 3.25Å; E12-R116 IonicContact OE1-CZ 3.85Å; E12-R116 IonicContact OE1-NH1 3.46Å; E12-R116 IonicContact OE1-NH2 2.71Å; E12-R116 PolarHBondContact OE1-NH2 3.24Å; E12-R116 IonicContact OE2-CZ 3.66Å; E12-R116 IonicContact OE2-NH1 3.78Å; E12-R116 PolarHBondContact OE2-NH1 2.05Å; E12-R116 IonicContact OE2-NH2 2.74Å; E12-R116 PolarHBondContact OE2-NH2 3.46Å; A112-R116 WeakPolarHBondContact O-CB 3.34Å; A112-R116 WeakPolarHBondContact O-CG 3.41Å; A112-R116 PolarHBondContact O-N 2.87Å; C113-R116 PolarHBondContact O-N 3.44Å; C113-R116 VanDerWaalsContact O-N 3.12Å
117	E	89.1	Confident	91.4	Very high	53 Å²	53	87.3 Å²	87.3	25%	0.248	43%	0.43	C	S	.	.	H	α-helix	trans	-85.3	-18.1	-173.4	-65.3	178.9	168.5	0	0	113.4	C113 H119 N120 Y121 N124 C125	C113-E117 WeakPolarHBondContact O-CG 3.22Å; C113-E117 PolarHBondContact O-N 2.95Å; E117-H119 PolarHBondContact O-N 2.88Å; E117-N120 PolarHBondContact O-N 3.5Å; E117-Y121 VanDerWaalsContact OE2-CA 3.24Å; E117-Y121 WeakPolarHBondContact OE2-CA 2.92Å; E117-N124 HydrophobicContact CG-CB 4.12Å; E117-N124 VanDerWaalsContact OE1-C 3.27Å; E117-N124 WeakPolarHBondContact OE1-CB 3.47Å; E117-N124 WeakPolarHBondContact OE2-CB 3.49Å; E117-C125 VanDerWaalsContact OE2-CB 3.3Å; E117-C125 WeakPolarHBondContact OE2-CB 3.46Å; E117-C125 PolarHBondContact OE2-N 2.9Å
118	G	89.6	Confident	91.3	Very high	40 Å²	40	86.4 Å²	86.4	41%	0.412	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	60.9	-120.8	174.7	0	0	0	0	0	111.5	Q114 N120 Y121	Q114-G118 PolarHBondContact O-N 3.44Å; G118-N120 VanDerWaalsContact C-N 3.34Å; G118-N120 PolarHBondContact O-N 3.42Å; G118-Y121 WeakPolarHBondContact O-CD1 3.17Å
119	H	88.7	Confident	91.3	Very high	188 Å²	188	87.5 Å²	87.5	87%	0.87	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-69.3	-27.7	-176.3	-62.7	-63	0	0	0	114.3	E117 Y121	E117-H119 PolarHBondContact O-N 2.88Å; H119-Y121 VanDerWaalsContact C-N 3.3Å; H119-Y121 PolarHBondContact O-N 3.29Å
120	N	89.5	Confident	91.4	Very high	108 Å²	108	90.3 Å²	90.3	58%	0.578	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-93.5	16.4	-175.4	-67.7	-24.2	0	0	0	113.3	E117 G118 K122 Q123	E117-N120 PolarHBondContact O-N 3.5Å; G118-N120 VanDerWaalsContact C-N 3.34Å; G118-N120 PolarHBondContact O-N 3.42Å; N120-K122 PolarHBondContact O-N 3.03Å; N120-K122 VanDerWaalsContact O-N 3.12Å; N120-Q123 PolarHBondContact O-N 3.35Å
121	Y	88.6	Confident	91.5	Very high	88 Å²	88	92.6 Å²	92.6	35%	0.345	45%	0.453	S	S	.	.	H	α-helix	trans	-60.7	-25.8	-173.1	76.9	-82.3	0	0	0	114.8	Q114 E117 G118 H119 Q123 C125	Q114-Y121 HydrophobicContact CG-CD2 4.15Å; Q114-Y121 HydrophobicContact CG-CG 4.31Å; E117-Y121 VanDerWaalsContact OE2-CA 3.24Å; E117-Y121 WeakPolarHBondContact OE2-CA 2.92Å; G118-Y121 WeakPolarHBondContact O-CD1 3.17Å; H119-Y121 VanDerWaalsContact C-N 3.3Å; H119-Y121 PolarHBondContact O-N 3.29Å; Y121-Q123 VanDerWaalsContact C-N 3.3Å; Y121-Q123 PolarHBondContact O-N 3.48Å; Y121-C125 WeakPolarHBondContact O-CB 3.11Å; Y121-C125 PolarHBondContact O-N 3.48Å
122	K	86.4	Confident	91.6	Very high	165 Å²	165	90 Å²	90	72%	0.717	44%	0.442	S	S	*	.	H	α-helix	trans	-68.1	-29.3	-176.8	-67.3	-177.2	179.5	179.2	0	113.4	N120	N120-K122 PolarHBondContact O-N 3.03Å; N120-K122 VanDerWaalsContact O-N 3.12Å
123	Q	89.1	Confident	91.8	Very high	157 Å²	157	91 Å²	91	73%	0.734	44%	0.444	S	S	*	.	H	α-helix	trans	-94.3	-42.1	-176.6	-69.3	-178.8	-4.5	0	0	111.8	N120 Y121	N120-Q123 PolarHBondContact O-N 3.35Å; Y121-Q123 VanDerWaalsContact C-N 3.3Å; Y121-Q123 PolarHBondContact O-N 3.48Å
124	N	90.4	Very high	92	Very high	96 Å²	96	96.6 Å²	96.6	51%	0.513	47%	0.469	S	S	.	.	H	α-helix	trans	-83.3	-31.1	-171.2	-64.7	-21.3	0	0	0	112	E117 S126	E117-N124 HydrophobicContact CG-CB 4.12Å; E117-N124 VanDerWaalsContact OE1-C 3.27Å; E117-N124 WeakPolarHBondContact OE1-CB 3.47Å; E117-N124 WeakPolarHBondContact OE2-CB 3.49Å; N124-S126 VanDerWaalsContact C-N 3.33Å; N124-S126 PolarHBondContact O-N 3.2Å
125	C	93.6	Very high	92.3	Very high	4 Å²	4	94.2 Å²	94.2	3%	0.027	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	16.2	-178.5	-147.8	0	0	0	0	116	C113 E117 Y121 K127 E128 V129	C113-C125 HydrophobicContact CB-CB 4.39Å; C113-C125 WeakPolarHBondContact CB-SG 3.41Å; C113-C125 WeakPolarHBondContact SG-CA 3.44Å; C113-C125 WeakPolarHBondContact SG-CB 3.45Å; C113-C125 CovalentContact SG-SG 2.04Å; C113-C125 PolarHBondContact SG-SG 3.15Å; E117-C125 VanDerWaalsContact OE2-CB 3.3Å; E117-C125 WeakPolarHBondContact OE2-CB 3.46Å; E117-C125 PolarHBondContact OE2-N 2.9Å; Y121-C125 WeakPolarHBondContact O-CB 3.11Å; Y121-C125 PolarHBondContact O-N 3.48Å; C125-K127 VanDerWaalsContact C-N 3.32Å; C125-K127 PolarHBondContact O-N 2.86Å; C125-E128 WeakPolarHBondContact CA-OE2 3.37Å; C125-E128 PolarHBondContact O-N 3.48Å; C125-V129 WeakPolarHBondContact O-CG2 3.33Å; C125-V129 PolarHBondContact O-N 3.39Å
126	S	92.8	Very high	92.5	Very high	54 Å²	54	87.7 Å²	87.7	38%	0.378	44%	0.435	S	S	.	.	H	α-helix	trans	-63.4	-37.9	-173.3	54.8	0	0	0	0	112.6	N124 V129 E130	N124-S126 VanDerWaalsContact C-N 3.33Å; N124-S126 PolarHBondContact O-N 3.2Å; S126-V129 PolarHBondContact O-N 2.91Å; S126-E130 WeakPolarHBondContact O-CG 3.45Å; S126-E130 PolarHBondContact O-N 3.37Å
127	K	92.9	Very high	92.9	Very high	147 Å²	147	88.9 Å²	88.9	64%	0.639	44%	0.443	S	S	*	.	H	α-helix	trans	-66.4	-42.9	-178.7	-65.9	-178.6	-179.2	178.7	0	112.1	C125 V129 E130 Q131	C125-K127 VanDerWaalsContact C-N 3.32Å; C125-K127 PolarHBondContact O-N 2.86Å; K127-V129 VanDerWaalsContact C-N 3.31Å; K127-E130 PolarHBondContact O-N 3.23Å; K127-Q131 WeakPolarHBondContact O-CB 3.46Å; K127-Q131 VanDerWaalsContact O-CG 3.31Å; K127-Q131 WeakPolarHBondContact O-CG 3.28Å; K127-Q131 PolarHBondContact O-N 3.44Å
128	E	93.5	Very high	93.2	Very high	51 Å²	51	88.8 Å²	88.8	24%	0.238	45%	0.452	C	S	.	.	H	α-helix	trans	-66.3	-37.6	178	-66.9	77.3	-174.9	0	0	110.9	C113 C125 F132	C113-E128 HydrophobicContact CB-CG 4.09Å; C125-E128 WeakPolarHBondContact CA-OE2 3.37Å; C125-E128 PolarHBondContact O-N 3.48Å; E128-F132 WeakPolarHBondContact O-CB 3.31Å; E128-F132 PolarHBondContact O-N 3.33Å
129	V	94.1	Very high	93.6	Very high	68 Å²	68	89.6 Å²	89.6	41%	0.412	44%	0.443	S	S	.	.	H	α-helix	trans	-64.7	-47.6	174	175.5	0	0	0	0	110.4	L110 C125 S126 K127 Q131 F132 T133	L110-V129 HydrophobicContact CD1-CB 4.33Å; L110-V129 HydrophobicContact CD1-CG2 3.79Å; C125-V129 WeakPolarHBondContact O-CG2 3.33Å; C125-V129 PolarHBondContact O-N 3.39Å; S126-V129 PolarHBondContact O-N 2.91Å; K127-V129 VanDerWaalsContact C-N 3.31Å; V129-Q131 PolarHBondContact O-N 2.97Å; V129-F132 PolarHBondContact O-N 3.28Å; V129-T133 HydrophobicContact CG1-CG2 4.43Å; V129-T133 VanDerWaalsContact O-CG2 3.31Å; V129-T133 WeakPolarHBondContact O-CG2 3.22Å; V129-T133 PolarHBondContact O-N 3.34Å; V129-T133 PolarHBondContact O-OG1 3.39Å
130	E	95.4	Very high	93.9	Very high	111 Å²	111	85.1 Å²	85.1	52%	0.519	42%	0.422	S	S	.	.	H	α-helix	trans	-58	-49.2	176	-75.5	173.9	-169.5	0	0	111.5	S126 K127 F132 T133 Q134	S126-E130 WeakPolarHBondContact O-CG 3.45Å; S126-E130 PolarHBondContact O-N 3.37Å; K127-E130 PolarHBondContact O-N 3.23Å; E130-F132 VanDerWaalsContact C-N 3.32Å; E130-F132 PolarHBondContact O-N 3.19Å; E130-T133 PolarHBondContact O-N 3.38Å; E130-T133 VanDerWaalsContact O-N 3.16Å; E130-T133 PolarHBondContact O-OG1 3.35Å; E130-Q134 WeakPolarHBondContact O-CG 3.44Å; E130-Q134 PolarHBondContact O-N 2.99Å
131	Q	95.3	Very high	94.2	Very high	83 Å²	83	83.9 Å²	83.9	39%	0.388	42%	0.416	S	S	.	.	H	α-helix	trans	-56.9	-45.4	175.6	-75.2	179.2	4.1	0	0	111.9	K127 V129 T133 Q134 V135	K127-Q131 WeakPolarHBondContact O-CB 3.46Å; K127-Q131 VanDerWaalsContact O-CG 3.31Å; K127-Q131 WeakPolarHBondContact O-CG 3.28Å; K127-Q131 PolarHBondContact O-N 3.44Å; V129-Q131 PolarHBondContact O-N 2.97Å; Q131-T133 PolarHBondContact O-N 3.34Å; Q131-Q134 PolarHBondContact O-N 2.82Å; Q131-V135 WeakPolarHBondContact O-CG2 3.37Å; Q131-V135 PolarHBondContact O-N 2.98Å
132	F	96.3	Very high	94.6	Very high	63 Å²	63	85.1 Å²	85.1	28%	0.276	42%	0.42	S	S	.	.	H	α-helix	trans	-61.7	-44.2	176.8	178.8	-102.8	0	0	0	111.6	I106 Q107 L110 E128 V129 E130 Q134 V135 A136	I106-F132 HydrophobicContact CG2-CB 3.94Å; I106-F132 HydrophobicContact CG2-CD2 4.15Å; Q107-F132 HydrophobicContact CB-CE2 4.13Å; Q107-F132 HydrophobicContact CG-CE2 4.34Å; L110-F132 HydrophobicContact CD1-CB 3.92Å; L110-F132 HydrophobicContact CD1-CD1 4.4Å; L110-F132 HydrophobicContact CD1-CG 4.21Å; E128-F132 WeakPolarHBondContact O-CB 3.31Å; E128-F132 PolarHBondContact O-N 3.33Å; V129-F132 PolarHBondContact O-N 3.28Å; E130-F132 VanDerWaalsContact C-N 3.32Å; E130-F132 PolarHBondContact O-N 3.19Å; F132-Q134 VanDerWaalsContact C-N 3.33Å; F132-Q134 PolarHBondContact O-N 2.99Å; F132-V135 PolarHBondContact O-N 2.78Å; F132-A136 HydrophobicContact CE1-CB 4.37Å; F132-A136 HydrophobicContact CZ-CB 4.36Å; F132-A136 WeakPolarHBondContact O-CB 3.27Å; F132-A136 PolarHBondContact O-N 3.08Å
133	T	96.6	Very high	95	Very high	57 Å²	57	78.3 Å²	78.3	35%	0.35	39%	0.39	S	S	.	.	H	α-helix	trans	-64.5	-37.4	178.9	62.8	0	0	0	0	112.5	V129 E130 Q131 K137	V129-T133 HydrophobicContact CG1-CG2 4.43Å; V129-T133 VanDerWaalsContact O-CG2 3.31Å; V129-T133 WeakPolarHBondContact O-CG2 3.22Å; V129-T133 PolarHBondContact O-N 3.34Å; V129-T133 PolarHBondContact O-OG1 3.39Å; E130-T133 PolarHBondContact O-N 3.38Å; E130-T133 VanDerWaalsContact O-N 3.16Å; E130-T133 PolarHBondContact O-OG1 3.35Å; Q131-T133 PolarHBondContact O-N 3.34Å; T133-K137 VanDerWaalsContact O-CB 3.28Å; T133-K137 WeakPolarHBondContact O-CB 3.44Å; T133-K137 WeakPolarHBondContact O-CG 3.48Å; T133-K137 PolarHBondContact O-N 2.85Å
134	Q	97.1	Very high	95.3	Very high	128 Å²	128	74.5 Å²	74.5	60%	0.598	37%	0.372	S	S	*	.	H	α-helix	trans	-66.2	-48.6	176.8	-70.1	173.8	13.8	0	0	111.2	E130 Q131 F132 K137 A138	E130-Q134 WeakPolarHBondContact O-CG 3.44Å; E130-Q134 PolarHBondContact O-N 2.99Å; Q131-Q134 PolarHBondContact O-N 2.82Å; F132-Q134 VanDerWaalsContact C-N 3.33Å; F132-Q134 PolarHBondContact O-N 2.99Å; Q134-K137 PolarHBondContact O-N 3.4Å; Q134-A138 WeakPolarHBondContact O-CB 3.4Å; Q134-A138 PolarHBondContact O-N 3.32Å
135	V	97.4	Very high	95.5	Very high	43 Å²	43	76.6 Å²	76.6	26%	0.261	38%	0.383	S	S	.	.	H	α-helix	trans	-67.3	-41.1	-180	173.8	0	0	0	0	111.2	I102 V103 I106 Q131 F132 A138 Y139	I102-V135 HydrophobicContact CG2-CG1 4.26Å; V103-V135 HydrophobicContact CG2-CG1 3.98Å; I106-V135 HydrophobicContact CG1-CG2 4.34Å; Q131-V135 WeakPolarHBondContact O-CG2 3.37Å; Q131-V135 PolarHBondContact O-N 2.98Å; F132-V135 PolarHBondContact O-N 2.78Å; V135-A138 PolarHBondContact O-N 2.87Å; V135-Y139 VanDerWaalsContact O-CB 3.28Å; V135-Y139 WeakPolarHBondContact O-CB 2.92Å; V135-Y139 PolarHBondContact O-N 2.74Å
136	A	96.9	Very high	95.4	Very high	27 Å²	27	77.1 Å²	77.1	22%	0.223	39%	0.386	C	S	.	.	H	α-helix	trans	-63.6	-44.6	176.8	0	0	0	0	0	111.7	F132 Y139 Q140	F132-A136 HydrophobicContact CE1-CB 4.37Å; F132-A136 HydrophobicContact CZ-CB 4.36Å; F132-A136 WeakPolarHBondContact O-CB 3.27Å; F132-A136 PolarHBondContact O-N 3.08Å; A136-Y139 PolarHBondContact O-N 3.23Å; A136-Q140 WeakPolarHBondContact O-CB 3.31Å; A136-Q140 PolarHBondContact O-N 2.86Å
137	K	97.1	Very high	95.5	Very high	135 Å²	135	77 Å²	77	59%	0.587	39%	0.393	S	S	*	.	H	α-helix	trans	-59.9	-50.5	174	-76	173.6	-177.8	-179	0	111	T133 Q134 Y139 Q140 D141	T133-K137 VanDerWaalsContact O-CB 3.28Å; T133-K137 WeakPolarHBondContact O-CB 3.44Å; T133-K137 WeakPolarHBondContact O-CG 3.48Å; T133-K137 PolarHBondContact O-N 2.85Å; Q134-K137 PolarHBondContact O-N 3.4Å; K137-Y139 VanDerWaalsContact C-N 3.32Å; K137-Y139 PolarHBondContact O-N 3.5Å; K137-Q140 PolarHBondContact O-N 3.48Å; K137-D141 WeakPolarHBondContact O-CB 3.46Å; K137-D141 PolarHBondContact O-N 3.43Å
138	A	96.7	Very high	95.4	Very high	51 Å²	51	74.4 Å²	74.4	42%	0.421	40%	0.399	S	S	.	.	H	α-helix	trans	-60.2	-40.1	179.2	0	0	0	0	0	113	Q134 V135 R142	Q134-A138 WeakPolarHBondContact O-CB 3.4Å; Q134-A138 PolarHBondContact O-N 3.32Å; V135-A138 PolarHBondContact O-N 2.87Å; A138-R142 WeakPolarHBondContact O-CB 3.24Å; A138-R142 PolarHBondContact O-N 3Å; A138-R142 VanDerWaalsContact O-N 3.12Å
139	Y	97	Very high	95.4	Very high	57 Å²	57	79.7 Å²	79.7	22%	0.224	42%	0.423	C	S	.	.	H	α-helix	trans	-67.3	-44.2	176.5	-179.5	-92.8	0	0	0	111.7	Y96 D99 Q100 V103 V135 A136 K137 R142 Y143	Y96-Y139 HydrophobicContact CE2-CE2 4.36Å; Y96-Y139 VanDerWaalsContact CE2-OH 3.32Å; Y96-Y139 WeakPolarHBondContact CE2-OH 3.39Å; Y96-Y139 PolarHBondContact OH-OH 2.87Å; D99-Y139 HydrophobicContact CB-CD2 4.09Å; D99-Y139 HydrophobicContact CB-CE2 4.13Å; Q100-Y139 HydrophobicContact CG-CE2 4.15Å; Q100-Y139 WeakPolarHBondContact CG-OH 2.96Å; V103-Y139 HydrophobicContact CG2-CD1 4.4Å; V103-Y139 HydrophobicContact CG2-CD2 3.78Å; V103-Y139 HydrophobicContact CG2-CE2 4.44Å; V103-Y139 HydrophobicContact CG2-CG 3.76Å; V135-Y139 VanDerWaalsContact O-CB 3.28Å; V135-Y139 WeakPolarHBondContact O-CB 2.92Å; V135-Y139 PolarHBondContact O-N 2.74Å; A136-Y139 PolarHBondContact O-N 3.23Å; K137-Y139 VanDerWaalsContact C-N 3.32Å; K137-Y139 PolarHBondContact O-N 3.5Å; Y139-R142 PolarHBondContact O-N 3.36Å; Y139-Y143 AromaticContact CD2-CD2 3.51Å; Y139-Y143 HydrophobicContact CD2-CD2 3.51Å; Y139-Y143 AromaticContact CD2-CE2 3.87Å; Y139-Y143 HydrophobicContact CD2-CE2 3.87Å; Y139-Y143 AromaticContact CE2-CD2 3.39Å; Y139-Y143 HydrophobicContact CE2-CD2 3.39Å; Y139-Y143 AromaticContact CE2-CE2 3.81Å; Y139-Y143 HydrophobicContact CE2-CE2 3.81Å; Y139-Y143 HydrophobicContact CE2-CG 4.38Å; Y139-Y143 HydrophobicContact CG-CD2 4.14Å; Y139-Y143 AromaticContact CZ-CD2 3.94Å; Y139-Y143 PolarHBondContact O-N 3.26Å
140	Q	96.2	Very high	95.5	Very high	95 Å²	95	80.2 Å²	80.2	44%	0.444	42%	0.418	S	S	.	.	H	α-helix	trans	-62.6	-48.8	176.6	-178.5	172.3	-9.5	0	0	110.8	A136 K137 R142 Y143 Q144 K158	A136-Q140 WeakPolarHBondContact O-CB 3.31Å; A136-Q140 PolarHBondContact O-N 2.86Å; K137-Q140 PolarHBondContact O-N 3.48Å; Q140-R142 PolarHBondContact O-N 3.31Å; Q140-Y143 PolarHBondContact O-N 2.04Å; Q140-Q144 HydrophobicContact CG-CB 3.87Å; Q140-Q144 HydrophobicContact CG-CG 4.11Å; Q140-Q144 WeakPolarHBondContact O-CA 3.2Å; Q140-Q144 WeakPolarHBondContact O-CB 3.3Å; Q140-Q144 PolarHBondContact O-N 2.95Å; Q140-K158 PolarHBondContact O-NZ 3.23Å; Q140-K158 VanDerWaalsContact O-NZ 3.16Å
141	D	95.6	Very high	95.4	Very high	81 Å²	81	76 Å²	76	43%	0.433	40%	0.401	S	S	.	.	H	α-helix	trans	-56.5	-38.9	176.7	-65.9	-23	0	0	0	111.6	K137 K158	K137-D141 WeakPolarHBondContact O-CB 3.46Å; K137-D141 PolarHBondContact O-N 3.43Å; D141-K158 WeakPolarHBondContact O-CE 3.2Å; D141-K158 PolarHBondContact O-NZ 3.31Å
142	R	95.3	Very high	95.4	Very high	115 Å²	115	72.2 Å²	72.2	43%	0.434	38%	0.384	S	S	.	.	H	α-helix	trans	-75.5	-45.5	-179.9	-166.9	179.7	-66.1	169.9	1	113.5	D99 A138 Y139 Q140	D99-R142 IonicContact OD1-NH1 2.78Å; D99-R142 PolarHBondContact OD1-NH1 3.41Å; D99-R142 IonicContact OD2-CZ 2.98Å; D99-R142 IonicContact OD2-NH1 3.33Å; D99-R142 PolarHBondContact OD2-NH1 3.33Å; A138-R142 WeakPolarHBondContact O-CB 3.24Å; A138-R142 PolarHBondContact O-N 3Å; A138-R142 VanDerWaalsContact O-N 3.12Å; Y139-R142 PolarHBondContact O-N 3.36Å; Q140-R142 PolarHBondContact O-N 3.31Å
143	Y	96.1	Very high	95.3	Very high	21 Å²	21	76.8 Å²	76.8	8%	0.082	40%	0.399	C	S	.	.	H	α-helix	trans	-118.3	-6.9	-165.1	-59.1	-62.3	0	0	0	116.1	W92 Y96 D99 Y139 Q140 L146	W92-Y143 AromaticContact CE2-CE1 3.98Å; W92-Y143 AromaticContact CZ2-CD1 3.89Å; W92-Y143 HydrophobicContact CZ2-CD1 3.89Å; W92-Y143 AromaticContact CZ2-CE1 3.77Å; W92-Y143 HydrophobicContact CZ2-CE1 3.77Å; W92-Y143 AromaticContact NE1-CE1 3.9Å; Y96-Y143 AromaticContact CD2-CD1 3.52Å; Y96-Y143 HydrophobicContact CD2-CD1 3.52Å; Y96-Y143 AromaticContact CD2-CD2 3.87Å; Y96-Y143 HydrophobicContact CD2-CD2 3.87Å; Y96-Y143 AromaticContact CD2-CE1 3.55Å; Y96-Y143 HydrophobicContact CD2-CE1 3.55Å; Y96-Y143 AromaticContact CD2-CE2 3.87Å; Y96-Y143 HydrophobicContact CD2-CE2 3.87Å; Y96-Y143 AromaticContact CD2-CG 3.68Å; Y96-Y143 HydrophobicContact CD2-CG 3.68Å; Y96-Y143 AromaticContact CD2-CZ 3.72Å; Y96-Y143 AromaticContact CE2-CD1 3.89Å; Y96-Y143 HydrophobicContact CE2-CD1 3.89Å; Y96-Y143 HydrophobicContact CE2-CD2 4.03Å; Y96-Y143 HydrophobicContact CE2-CE1 4.37Å; Y96-Y143 HydrophobicContact CE2-CE2 4.46Å; Y96-Y143 AromaticContact CE2-CG 3.69Å; Y96-Y143 HydrophobicContact CE2-CG 3.69Å; Y96-Y143 HydrophobicContact CG-CE1 4.35Å; D99-Y143 HydrophobicContact CB-CE2 3.81Å; D99-Y143 VanDerWaalsContact OD2-CE2 3.23Å; D99-Y143 WeakPolarHBondContact OD2-CE2 3.36Å; D99-Y143 VanDerWaalsContact OD2-CZ 3.3Å; D99-Y143 PolarHBondContact OD2-OH 3.37Å; Y139-Y143 AromaticContact CD2-CD2 3.51Å; Y139-Y143 HydrophobicContact CD2-CD2 3.51Å; Y139-Y143 AromaticContact CD2-CE2 3.87Å; Y139-Y143 HydrophobicContact CD2-CE2 3.87Å; Y139-Y143 AromaticContact CE2-CD2 3.39Å; Y139-Y143 HydrophobicContact CE2-CD2 3.39Å; Y139-Y143 AromaticContact CE2-CE2 3.81Å; Y139-Y143 HydrophobicContact CE2-CE2 3.81Å; Y139-Y143 HydrophobicContact CE2-CG 4.38Å; Y139-Y143 HydrophobicContact CG-CD2 4.14Å; Y139-Y143 AromaticContact CZ-CD2 3.94Å; Y139-Y143 PolarHBondContact O-N 3.26Å; Q140-Y143 PolarHBondContact O-N 2.04Å; Y143-L146 HydrophobicContact CD1-CD1 3.91Å; Y143-L146 WeakPolarHBondContact O-CG 2.99Å
144	Q	94.8	Very high	95.2	Very high	77 Å²	77	78.4 Å²	78.4	36%	0.36	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	143.7	177.5	-169.5	-169.8	-8.9	0	0	111.2	Q140 L146 K158	Q140-Q144 HydrophobicContact CG-CB 3.87Å; Q140-Q144 HydrophobicContact CG-CG 4.11Å; Q140-Q144 WeakPolarHBondContact O-CA 3.2Å; Q140-Q144 WeakPolarHBondContact O-CB 3.3Å; Q140-Q144 PolarHBondContact O-N 2.95Å; Q144-L146 VanDerWaalsContact C-N 3.26Å; Q144-L146 PolarHBondContact O-N 2.95Å; Q144-K158 WeakPolarHBondContact O-CE 3.45Å; Q144-K158 PolarHBondContact O-NZ 3.44Å
145	D	94	Very high	95.2	Very high	141 Å²	141	73.1 Å²	73.1	75%	0.754	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	18.3	172.9	-54.5	-33.7	0	0	0	116.8	G147	D145-G147 PolarHBondContact O-N 3.23Å
146	L	93.4	Very high	95.1	Very high	15 Å²	15	72.5 Å²	72.5	8%	0.079	37%	0.374	C	S	.	.			trans	-69.7	-18.1	172.6	-65.3	173	0	0	0	113.5	W92 Y143 Q144 K154 C155	W92-L146 HydrophobicContact CH2-CD1 4.18Å; W92-L146 HydrophobicContact CZ2-CD1 3.82Å; Y143-L146 HydrophobicContact CD1-CD1 3.91Å; Y143-L146 WeakPolarHBondContact O-CG 2.99Å; Q144-L146 VanDerWaalsContact C-N 3.26Å; Q144-L146 PolarHBondContact O-N 2.95Å; L146-K154 HydrophobicContact CD2-CB 3.71Å; L146-K154 WeakPolarHBondContact O-CD 3.39Å; L146-K154 PolarHBondContact O-NZ 3.49Å; L146-C155 HydrophobicContact CD2-CB 4.37Å
147	G	93.4	Very high	95.1	Very high	51 Å²	51	73.4 Å²	73.4	53%	0.526	38%	0.381	S	S	.	.			trans	72.9	-178.5	-176.1	0	0	0	0	0	113.6	D145 H149 Y150	D145-G147 PolarHBondContact O-N 3.23Å; G147-H149 VanDerWaalsContact C-N 3.34Å; G147-H149 PolarHBondContact O-N 3.4Å; G147-Y150 WeakPolarHBondContact O-CD1 3.09Å; G147-Y150 PolarHBondContact O-N 3.29Å
148	A	92.1	Very high	95	Very high	92 Å²	92	69.3 Å²	69.3	76%	0.76	36%	0.363	S	S	*	.	S	Bend	trans	-64.7	-37.3	-178.6	0	0	0	0	0	112.9	Y150	A148-Y150 VanDerWaalsContact C-N 3.26Å; A148-Y150 WeakPolarHBondContact O-CD1 3.37Å; A148-Y150 PolarHBondContact O-N 3.39Å
149	H	93.6	Very high	95	Very high	163 Å²	163	71.6 Å²	71.6	76%	0.755	37%	0.365	S	S	*	.	S	Bend	trans	-89.9	60.5	173.9	-61	-66.9	0	0	0	110.6	G147 K154	G147-H149 VanDerWaalsContact C-N 3.34Å; G147-H149 PolarHBondContact O-N 3.4Å; H149-K154 WeakPolarHBondContact O-CD 3.45Å; H149-K154 VanDerWaalsContact O-CE 3.32Å; H149-K154 WeakPolarHBondContact O-CE 3.43Å; H149-K154 PolarHBondContact O-NZ 3.46Å
150	Y	94.8	Very high	95	Very high	79 Å²	79	75.1 Å²	75.1	31%	0.31	38%	0.381	S	S	.	.			trans	-71.7	147.1	177	54.4	-106.5	0	0	0	111	W92 Y96 G147 A148	W92-Y150 AromaticContact CH2-CD2 3.45Å; W92-Y150 HydrophobicContact CH2-CD2 3.45Å; W92-Y150 VanDerWaalsContact CH2-CD2 3.45Å; W92-Y150 HydrophobicContact CH2-CE2 4.23Å; W92-Y150 HydrophobicContact CH2-CG 4.07Å; W92-Y150 AromaticContact CZ3-CD2 3.39Å; W92-Y150 HydrophobicContact CZ3-CD2 3.39Å; W92-Y150 AromaticContact CZ3-CE2 3.89Å; W92-Y150 HydrophobicContact CZ3-CE2 3.89Å; W92-Y150 HydrophobicContact CZ3-CG 4.41Å; Y96-Y150 HydrophobicContact CD1-CE2 4.45Å; Y96-Y150 HydrophobicContact CE1-CE2 4.47Å; G147-Y150 WeakPolarHBondContact O-CD1 3.09Å; G147-Y150 PolarHBondContact O-N 3.29Å; A148-Y150 VanDerWaalsContact C-N 3.26Å; A148-Y150 WeakPolarHBondContact O-CD1 3.37Å; A148-Y150 PolarHBondContact O-N 3.39Å
151	S	94.3	Very high	95	Very high	22 Å²	22	76.2 Å²	76.2	15%	0.154	39%	0.386	C	S	.	.			trans	-152.5	161.4	176.7	67.6	0	0	0	0	111.1	R153 K154 C155	S151-R153 PolarHBondContact O-N 3.42Å; S151-K154 PolarHBondContact O-N 2.99Å; S151-K154 VanDerWaalsContact O-N 3.1Å; S151-K154 PolarHBondContact OG-N 3.21Å; S151-C155 PolarHBondContact O-N 3.19Å; S151-C155 VanDerWaalsContact O-N 3.09Å
152	A	94.8	Very high	95	Very high	4 Å²	4	76.4 Å²	76.4	3%	0.033	38%	0.381	C	S	.	.	H	α-helix	trans	-56.8	-34.4	175.4	0	0	0	0	0	111.8	I74 E89 W92 C155 L156	I74-A152 HydrophobicContact CB-CB 4.27Å; I74-A152 HydrophobicContact CG1-CB 4.49Å; I74-A152 HydrophobicContact CG2-CB 4.24Å; E89-A152 HydrophobicContact CG-CB 4.3Å; W92-A152 HydrophobicContact CB-CB 3.83Å; W92-A152 HydrophobicContact CD2-CB 4.12Å; W92-A152 HydrophobicContact CG-CB 3.74Å; A152-C155 WeakPolarHBondContact O-CB 3.46Å; A152-C155 PolarHBondContact O-N 2.87Å; A152-L156 WeakPolarHBondContact O-CB 3.43Å; A152-L156 PolarHBondContact O-N 3.46Å
153	R	93.8	Very high	95	Very high	159 Å²	159	75.8 Å²	75.8	60%	0.6	39%	0.385	S	S	*	.	H	α-helix	trans	-62.4	-43.6	176.7	-63.5	177	65	-178.5	2.3	112.4	I74 S151 L156 A157	I74-R153 HydrophobicContact CD1-CG 4.3Å; I74-R153 HydrophobicContact CG1-CG 4.04Å; S151-R153 PolarHBondContact O-N 3.42Å; R153-L156 PolarHBondContact O-N 3.12Å; R153-A157 PolarHBondContact O-N 3.29Å
154	K	95.9	Very high	95.1	Very high	91 Å²	91	79.4 Å²	79.4	40%	0.396	41%	0.405	S	S	.	.	H	α-helix	trans	-67.1	-40.5	176.2	-71.1	-177.1	172.7	-178	0	111.6	L146 H149 S151 L156 A157 K158	L146-K154 HydrophobicContact CD2-CB 3.71Å; L146-K154 WeakPolarHBondContact O-CD 3.39Å; L146-K154 PolarHBondContact O-NZ 3.49Å; H149-K154 WeakPolarHBondContact O-CD 3.45Å; H149-K154 VanDerWaalsContact O-CE 3.32Å; H149-K154 WeakPolarHBondContact O-CE 3.43Å; H149-K154 PolarHBondContact O-NZ 3.46Å; S151-K154 PolarHBondContact O-N 2.99Å; S151-K154 VanDerWaalsContact O-N 3.1Å; S151-K154 PolarHBondContact OG-N 3.21Å; K154-L156 VanDerWaalsContact C-N 3.29Å; K154-L156 PolarHBondContact O-N 3.02Å; K154-A157 PolarHBondContact O-N 2.99Å; K154-K158 PolarHBondContact O-N 2.97Å
155	C	96.1	Very high	95.2	Very high	16 Å²	16	82.1 Å²	82.1	11%	0.108	42%	0.417	C	S	.	.	H	α-helix	trans	-58.7	-43.2	174.4	-170.9	0	0	0	0	111.3	W92 L146 S151 A152 K158 Q159	W92-C155 HydrophobicContact CZ2-CB 4.08Å; L146-C155 HydrophobicContact CD2-CB 4.37Å; S151-C155 PolarHBondContact O-N 3.19Å; S151-C155 VanDerWaalsContact O-N 3.09Å; A152-C155 WeakPolarHBondContact O-CB 3.46Å; A152-C155 PolarHBondContact O-N 2.87Å; C155-K158 PolarHBondContact O-N 2.83Å; C155-Q159 WeakPolarHBondContact O-CB 3.19Å; C155-Q159 PolarHBondContact O-N 3.01Å
156	L	95.9	Very high	95.3	Very high	31 Å²	31	80 Å²	80	16%	0.162	40%	0.403	C	S	.	.	H	α-helix	trans	-66.6	-40.8	176.8	-179.1	156.9	0	0	0	112.2	I74 T75 A152 R153 K154 Q159 K160	I74-L156 HydrophobicContact CG2-CB 4.31Å; I74-L156 HydrophobicContact CG2-CD1 3.58Å; T75-L156 HydrophobicContact CG2-CD1 3.52Å; A152-L156 WeakPolarHBondContact O-CB 3.43Å; A152-L156 PolarHBondContact O-N 3.46Å; R153-L156 PolarHBondContact O-N 3.12Å; K154-L156 VanDerWaalsContact C-N 3.29Å; K154-L156 PolarHBondContact O-N 3.02Å; L156-Q159 PolarHBondContact O-N 3.3Å; L156-K160 HydrophobicContact CD2-CD 3.7Å; L156-K160 HydrophobicContact CD2-CG 4.2Å; L156-K160 WeakPolarHBondContact O-CG 3.41Å; L156-K160 PolarHBondContact O-N 3.45Å
157	A	95.3	Very high	95.4	Very high	45 Å²	45	85.7 Å²	85.7	37%	0.372	42%	0.423	S	S	.	.	H	α-helix	trans	-59.8	-48.8	175.4	0	0	0	0	0	111.3	R153 K154 Q159 K160 E161	R153-A157 PolarHBondContact O-N 3.29Å; K154-A157 PolarHBondContact O-N 2.99Å; A157-Q159 VanDerWaalsContact C-N 3.32Å; A157-Q159 PolarHBondContact O-N 3.12Å; A157-K160 WeakPolarHBondContact O-CB 3.48Å; A157-K160 PolarHBondContact O-N 3.35Å; A157-K160 VanDerWaalsContact O-N 3.11Å; A157-E161 PolarHBondContact O-N 3.44Å
158	K	96.3	Very high	95.6	Very high	49 Å²	49	89.4 Å²	89.4	21%	0.213	43%	0.425	C	S	.	.	H	α-helix	trans	-58	-43.5	174.8	-174.1	-176.8	-176.4	-171	0	112.1	Q140 D141 Q144 K154 C155 K160 E161 R162	Q140-K158 PolarHBondContact O-NZ 3.23Å; Q140-K158 VanDerWaalsContact O-NZ 3.16Å; D141-K158 WeakPolarHBondContact O-CE 3.2Å; D141-K158 PolarHBondContact O-NZ 3.31Å; Q144-K158 WeakPolarHBondContact O-CE 3.45Å; Q144-K158 PolarHBondContact O-NZ 3.44Å; K154-K158 PolarHBondContact O-N 2.97Å; C155-K158 PolarHBondContact O-N 2.83Å; K158-K160 VanDerWaalsContact C-N 3.32Å; K158-K160 PolarHBondContact O-N 3.06Å; K158-E161 PolarHBondContact O-N 3.28Å; K158-R162 PolarHBondContact O-N 3.43Å
159	Q	96.4	Very high	95.8	Very high	99 Å²	99	87.7 Å²	87.7	46%	0.463	41%	0.411	S	S	.	.	H	α-helix	trans	-61.4	-41.6	177	-175.1	179.3	4.7	0	0	111.4	C155 L156 A157 R162 M163	C155-Q159 WeakPolarHBondContact O-CB 3.19Å; C155-Q159 PolarHBondContact O-N 3.01Å; L156-Q159 PolarHBondContact O-N 3.3Å; A157-Q159 VanDerWaalsContact C-N 3.32Å; A157-Q159 PolarHBondContact O-N 3.12Å; Q159-R162 PolarHBondContact O-N 2.91Å; Q159-M163 VanDerWaalsContact O-CG 3.22Å; Q159-M163 WeakPolarHBondContact O-CG 3.43Å; Q159-M163 PolarHBondContact O-N 3.22Å
160	K	96.8	Very high	95.9	Very high	131 Å²	131	82.8 Å²	82.8	57%	0.57	40%	0.399	S	S	*	.	H	α-helix	trans	-62.9	-43	176.1	-75.5	179.1	174.6	173.7	0	112.1	L156 A157 K158 M163 L164	L156-K160 HydrophobicContact CD2-CD 3.7Å; L156-K160 HydrophobicContact CD2-CG 4.2Å; L156-K160 WeakPolarHBondContact O-CG 3.41Å; L156-K160 PolarHBondContact O-N 3.45Å; A157-K160 WeakPolarHBondContact O-CB 3.48Å; A157-K160 PolarHBondContact O-N 3.35Å; A157-K160 VanDerWaalsContact O-N 3.11Å; K158-K160 VanDerWaalsContact C-N 3.32Å; K158-K160 PolarHBondContact O-N 3.06Å; K160-M163 PolarHBondContact O-N 2.87Å; K160-L164 VanDerWaalsContact O-CG 3.31Å; K160-L164 WeakPolarHBondContact O-CG 3.37Å; K160-L164 PolarHBondContact O-N 3.02Å
161	E	96.5	Very high	95.9	Very high	118 Å²	118	86.6 Å²	86.6	55%	0.551	41%	0.412	S	S	*	.	H	α-helix	trans	-57.1	-50.1	175	-71	170.6	174.8	0	0	110.8	A157 K158 M163 L164 E165	A157-E161 PolarHBondContact O-N 3.44Å; K158-E161 PolarHBondContact O-N 3.28Å; E161-M163 PolarHBondContact O-N 3.39Å; E161-L164 WeakPolarHBondContact O-CB 3.43Å; E161-L164 PolarHBondContact O-N 3.12Å; E161-L164 VanDerWaalsContact O-N 3.08Å; E161-E165 WeakPolarHBondContact O-CG 3.41Å; E161-E165 PolarHBondContact O-N 3.04Å
162	R	95.3	Very high	96	Very high	85 Å²	85	91 Å²	91	32%	0.321	43%	0.43	S	S	.	.	H	α-helix	trans	-57.8	-45.4	176.6	-168.8	-178.2	68.8	-148	-2.9	112.6	K158 Q159 L164 E165 E166	K158-R162 PolarHBondContact O-N 3.43Å; Q159-R162 PolarHBondContact O-N 2.91Å; R162-L164 VanDerWaalsContact C-N 3.27Å; R162-L164 PolarHBondContact O-N 3.41Å; R162-E165 PolarHBondContact O-N 2.78Å; R162-E166 WeakPolarHBondContact CD-OE1 3.45Å; R162-E166 HydrophobicContact CG-CG 4.38Å; R162-E166 WeakPolarHBondContact CG-OE1 3.21Å; R162-E166 IonicContact NE-OE1 3.95Å; R162-E166 PolarHBondContact NE-OE1 3.2Å; R162-E166 WeakPolarHBondContact O-CB 3.39Å; R162-E166 WeakPolarHBondContact O-CG 3.38Å; R162-E166 PolarHBondContact O-N 3.46Å
163	M	96.4	Very high	96	Very high	103 Å²	103	93.3 Å²	93.3	51%	0.507	45%	0.45	S	S	.	.	H	α-helix	trans	-63.2	-32.9	178.2	-67.8	-63.4	-59.2	0	0	112.4	Q159 K160 E161 R167	Q159-M163 VanDerWaalsContact O-CG 3.22Å; Q159-M163 WeakPolarHBondContact O-CG 3.43Å; Q159-M163 PolarHBondContact O-N 3.22Å; K160-M163 PolarHBondContact O-N 2.87Å; E161-M163 PolarHBondContact O-N 3.39Å; M163-R167 WeakPolarHBondContact O-CB 3.43Å; M163-R167 PolarHBondContact O-N 3.32Å
164	L	97.4	Very high	96	Very high	96 Å²	96	88.5 Å²	88.5	50%	0.503	44%	0.444	S	S	.	.	H	α-helix	trans	-70.8	-41	175.7	-71	171.3	0	0	0	111.6	K160 E161 R162 R167 K168	K160-L164 VanDerWaalsContact O-CG 3.31Å; K160-L164 WeakPolarHBondContact O-CG 3.37Å; K160-L164 PolarHBondContact O-N 3.02Å; E161-L164 WeakPolarHBondContact O-CB 3.43Å; E161-L164 PolarHBondContact O-N 3.12Å; E161-L164 VanDerWaalsContact O-N 3.08Å; R162-L164 VanDerWaalsContact C-N 3.27Å; R162-L164 PolarHBondContact O-N 3.41Å; L164-R167 PolarHBondContact O-N 3.31Å; L164-K168 WeakPolarHBondContact O-CB 3.46Å; L164-K168 PolarHBondContact O-N 2.86Å
165	E	96.4	Very high	95.9	Very high	134 Å²	134	87.2 Å²	87.2	63%	0.626	45%	0.45	S	S	*	.	H	α-helix	trans	-64.7	-48.5	175.8	-69.8	176.6	170.9	0	0	111.6	E161 R162 R167 K168 A169	E161-E165 WeakPolarHBondContact O-CG 3.41Å; E161-E165 PolarHBondContact O-N 3.04Å; R162-E165 PolarHBondContact O-N 2.78Å; E165-R167 VanDerWaalsContact C-N 3.3Å; E165-R167 PolarHBondContact O-N 3.01Å; E165-K168 WeakPolarHBondContact O-CB 3.39Å; E165-K168 PolarHBondContact O-N 3.45Å; E165-K168 VanDerWaalsContact O-N 3.1Å; E165-A169 WeakPolarHBondContact O-CB 3.44Å; E165-A169 PolarHBondContact O-N 3.43Å
166	E	96.1	Very high	95.6	Very high	97 Å²	97	90.5 Å²	90.5	45%	0.453	48%	0.479	S	S	.	.	H	α-helix	trans	-58.2	-43.5	175.4	-73.1	172.4	-169.7	0	0	111.1	R162 K168 A169 A170	R162-E166 WeakPolarHBondContact CD-OE1 3.45Å; R162-E166 HydrophobicContact CG-CG 4.38Å; R162-E166 WeakPolarHBondContact CG-OE1 3.21Å; R162-E166 IonicContact NE-OE1 3.95Å; R162-E166 PolarHBondContact NE-OE1 3.2Å; R162-E166 WeakPolarHBondContact O-CB 3.39Å; R162-E166 WeakPolarHBondContact O-CG 3.38Å; R162-E166 PolarHBondContact O-N 3.46Å; E166-K168 VanDerWaalsContact C-N 3.34Å; E166-K168 PolarHBondContact O-N 3.49Å; E166-A169 PolarHBondContact O-N 3.07Å; E166-A170 VanDerWaalsContact O-CB 3.25Å; E166-A170 WeakPolarHBondContact O-CB 3.25Å; E166-A170 PolarHBondContact O-N 3.31Å
167	R	96.8	Very high	95.1	Very high	134 Å²	134	95 Å²	95	51%	0.506	51%	0.508	S	S	.	.	H	α-helix	trans	-64.1	-38.2	176.2	-172.8	-177.7	71.8	172.9	1.5	112.1	M163 L164 E165 R171	M163-R167 WeakPolarHBondContact O-CB 3.43Å; M163-R167 PolarHBondContact O-N 3.32Å; L164-R167 PolarHBondContact O-N 3.31Å; E165-R167 VanDerWaalsContact C-N 3.3Å; E165-R167 PolarHBondContact O-N 3.01Å; R167-R171 VanDerWaalsContact O-CG 3.27Å; R167-R171 WeakPolarHBondContact O-CG 3.45Å; R167-R171 PolarHBondContact O-N 3.19Å; R167-R171 VanDerWaalsContact O-N 3.13Å
168	K	96.9	Very high	93.4	Very high	130 Å²	130	99.7 Å²	99.7	57%	0.565	54%	0.538	S	S	*	.	H	α-helix	trans	-66.8	-50	176.9	-178.4	-177.5	169.6	-173.6	0	110.5	L164 E165 E166 A170 R171 E172	L164-K168 WeakPolarHBondContact O-CB 3.46Å; L164-K168 PolarHBondContact O-N 2.86Å; E165-K168 WeakPolarHBondContact O-CB 3.39Å; E165-K168 PolarHBondContact O-N 3.45Å; E165-K168 VanDerWaalsContact O-N 3.1Å; E166-K168 VanDerWaalsContact C-N 3.34Å; E166-K168 PolarHBondContact O-N 3.49Å; K168-A170 VanDerWaalsContact C-N 3.32Å; K168-A170 PolarHBondContact O-N 3.18Å; K168-R171 WeakPolarHBondContact O-CB 3.4Å; K168-R171 PolarHBondContact O-N 3.36Å; K168-R171 VanDerWaalsContact O-N 3.15Å; K168-E172 WeakPolarHBondContact CE-OE1 3.33Å; K168-E172 IonicContact NZ-OE1 3.41Å; K168-E172 WeakPolarHBondContact O-CG 3.35Å; K168-E172 PolarHBondContact O-N 3.03Å
169	A	96.1	Very high	93.2	Very high	55 Å²	55	102.3 Å²	102.3	46%	0.455	55%	0.554	S	S	.	*	H	α-helix	trans	-59.6	-42	178.1	0	0	0	0	0	112	E165 E166 R171 E172 A173	E165-A169 WeakPolarHBondContact O-CB 3.44Å; E165-A169 PolarHBondContact O-N 3.43Å; E166-A169 PolarHBondContact O-N 3.07Å; A169-R171 PolarHBondContact O-N 3.17Å; A169-E172 PolarHBondContact O-N 3.2Å; A169-A173 VanDerWaalsContact O-CB 3.3Å; A169-A173 WeakPolarHBondContact O-CB 3.24Å; A169-A173 PolarHBondContact O-N 2.85Å
170	A	95.4	Very high	93.1	Very high	61 Å²	61	102.4 Å²	102.4	50%	0.504	56%	0.559	S	S	.	*	H	α-helix	trans	-64.2	-38	176.5	0	0	0	0	0	112.6	E166 K168 A174	E166-A170 VanDerWaalsContact O-CB 3.25Å; E166-A170 WeakPolarHBondContact O-CB 3.25Å; E166-A170 PolarHBondContact O-N 3.31Å; K168-A170 VanDerWaalsContact C-N 3.32Å; K168-A170 PolarHBondContact O-N 3.18Å; A170-A174 VanDerWaalsContact O-CB 3.28Å; A170-A174 WeakPolarHBondContact O-CB 3.3Å; A170-A174 PolarHBondContact O-N 3.38Å
171	R	95.4	Very high	92.8	Very high	159 Å²	159	100.8 Å²	100.8	60%	0.6	56%	0.558	S	S	*	*	H	α-helix	trans	-66.6	-43.4	175.2	-76.2	173.4	178.7	-169.1	-2.4	112	R167 K168 A169 A174 A175	R167-R171 VanDerWaalsContact O-CG 3.27Å; R167-R171 WeakPolarHBondContact O-CG 3.45Å; R167-R171 PolarHBondContact O-N 3.19Å; R167-R171 VanDerWaalsContact O-N 3.13Å; K168-R171 WeakPolarHBondContact O-CB 3.4Å; K168-R171 PolarHBondContact O-N 3.36Å; K168-R171 VanDerWaalsContact O-N 3.15Å; A169-R171 PolarHBondContact O-N 3.17Å; R171-A174 PolarHBondContact O-N 2.84Å; R171-A175 WeakPolarHBondContact O-CB 3.47Å; R171-A175 PolarHBondContact O-N 3.29Å
172	E	95.4	Very high	92.6	Very high	113 Å²	113	99.8 Å²	99.8	53%	0.528	56%	0.559	S	S	.	*	H	α-helix	trans	-66.2	-41.7	177.4	-70.8	172.6	-177.9	0	0	111.4	K168 A169 A175 A176	K168-E172 WeakPolarHBondContact CE-OE1 3.33Å; K168-E172 IonicContact NZ-OE1 3.41Å; K168-E172 WeakPolarHBondContact O-CG 3.35Å; K168-E172 PolarHBondContact O-N 3.03Å; A169-E172 PolarHBondContact O-N 3.2Å; E172-A175 PolarHBondContact O-N 3.21Å; E172-A176 WeakPolarHBondContact O-CB 3.32Å; E172-A176 PolarHBondContact O-N 3.34Å
173	A	94.9	Very high	92.5	Very high	54 Å²	54	100.8 Å²	100.8	45%	0.446	57%	0.574	S	S	.	*	H	α-helix	trans	-62.8	-44.2	174.4	0	0	0	0	0	111.8	A169 A175 A176 T177	A169-A173 VanDerWaalsContact O-CB 3.3Å; A169-A173 WeakPolarHBondContact O-CB 3.24Å; A169-A173 PolarHBondContact O-N 2.85Å; A173-A175 PolarHBondContact O-N 2.97Å; A173-A176 PolarHBondContact O-N 2.87Å; A173-T177 PolarHBondContact O-N 2.88Å; A173-T177 VanDerWaalsContact O-N 3.15Å; A173-T177 PolarHBondContact O-OG1 3.3Å; A173-T177 VanDerWaalsContact O-OG1 3.14Å
174	A	94.8	Very high	92.2	Very high	57 Å²	57	100.6 Å²	100.6	47%	0.471	58%	0.578	S	S	.	*	H	α-helix	trans	-62.5	-42.3	176.2	0	0	0	0	0	112	A170 R171 A176 T177 S178	A170-A174 VanDerWaalsContact O-CB 3.28Å; A170-A174 WeakPolarHBondContact O-CB 3.3Å; A170-A174 PolarHBondContact O-N 3.38Å; R171-A174 PolarHBondContact O-N 2.84Å; A174-A176 VanDerWaalsContact C-N 3.31Å; A174-A176 PolarHBondContact O-N 2.88Å; A174-T177 WeakPolarHBondContact CA-OG1 3.3Å; A174-T177 PolarHBondContact O-N 3.3Å; A174-T177 PolarHBondContact O-OG1 3.02Å; A174-S178 PolarHBondContact O-N 3.41Å; A174-S178 PolarHBondContact O-OG 3.16Å
175	A	93.1	Very high	91.8	Very high	64 Å²	64	100.9 Å²	100.9	53%	0.529	58%	0.583	S	S	.	*	H	α-helix	trans	-69.1	-25.8	176.7	0	0	0	0	0	113.5	R171 E172 A173 S178	R171-A175 WeakPolarHBondContact O-CB 3.47Å; R171-A175 PolarHBondContact O-N 3.29Å; E172-A175 PolarHBondContact O-N 3.21Å; A173-A175 PolarHBondContact O-N 2.97Å; A175-S178 WeakPolarHBondContact CA-OG 3.34Å; A175-S178 PolarHBondContact O-OG 3.19Å; A175-S178 VanDerWaalsContact O-OG 3.09Å
176	A	89.9	Confident	91.5	Very high	86 Å²	86	98.4 Å²	98.4	71%	0.711	58%	0.58	S	S	*	*	H	α-helix	trans	-80.3	-21.5	175	0	0	0	0	0	113.1	E172 A173 A174	E172-A176 WeakPolarHBondContact O-CB 3.32Å; E172-A176 PolarHBondContact O-N 3.34Å; A173-A176 PolarHBondContact O-N 2.87Å; A174-A176 VanDerWaalsContact C-N 3.31Å; A174-A176 PolarHBondContact O-N 2.88Å
177	T	85.1	Confident	91.1	Very high	125 Å²	125	98.5 Å²	98.5	77%	0.767	59%	0.591	S	S	*	*	H	α-helix	trans	-92.9	-10.7	176.3	52	0	0	0	0	114.2	A173 A174	A173-T177 PolarHBondContact O-N 2.88Å; A173-T177 VanDerWaalsContact O-N 3.15Å; A173-T177 PolarHBondContact O-OG1 3.3Å; A173-T177 VanDerWaalsContact O-OG1 3.14Å; A174-T177 WeakPolarHBondContact CA-OG1 3.3Å; A174-T177 PolarHBondContact O-N 3.3Å; A174-T177 PolarHBondContact O-OG1 3.02Å
178	S	59.7	Low	90.6	Very high	144 Å²	144	95.3 Å²	95.3	100%	1.007	60%	0.598	S	S	*	*			trans	-95.7	0	174.6	63.9	0	0	0	0	111.6	A174 A175	A174-S178 PolarHBondContact O-N 3.41Å; A174-S178 PolarHBondContact O-OG 3.16Å; A175-S178 WeakPolarHBondContact CA-OG 3.34Å; A175-S178 PolarHBondContact O-OG 3.19Å; A175-S178 VanDerWaalsContact O-OG 3.09Å

Retrieved 178 of 178 residues in 163.4 ms (Link to these results)

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