A0A087X4Z1_POEFO Loading...

Muscle-restricted coiled-coil protein

AlphaFold DB , UniProt , Accession A0A087X4Z1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 314 aa.

Structure Viewer

Loading PAE data...

(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	39.9	Very low	44.3	Very low	225 Å²	225	158.8 Å²	158.8	100%	1.108	84%	0.844	S	S	*	*				0	57.3	0	-61.1	-165.6	-142.4	0	0	108.4
2	D	44.4	Very low	44.5	Very low	144 Å²	144	161.4 Å²	161.4	77%	0.77	85%	0.848	S	S	*	*				81.5	78.5	77.8	-64.9	-56.2	0	0	0	112
3	Q	42.8	Very low	44.6	Very low	204 Å²	204	161.2 Å²	161.2	95%	0.953	84%	0.84	S	S	*	*			trans	-122.3	24.9	153.1	-72.4	-147.6	80.6	0	0	111.3	K5	Q3-K5 VanDerWaalsContact C-N 3.32Å; Q3-K5 PolarHBondContact O-N 2.82Å
4	H	46.4	Very low	44.8	Very low	189 Å²	189	160.7 Å²	160.7	88%	0.875	83%	0.827	S	S	*	*	S	Bend	trans	-92.1	21	179.7	-119.8	-68.2	0	0	0	113.8
5	K	52.7	Low	44.9	Very low	189 Å²	189	159.7 Å²	159.7	82%	0.822	82%	0.823	S	S	*	*			trans	-156.6	77.8	-171.5	-145	165.5	-168.4	-180	0	111.8	Q3	Q3-K5 VanDerWaalsContact C-N 3.32Å; Q3-K5 PolarHBondContact O-N 2.82Å
6	L	43.8	Very low	44.9	Very low	167 Å²	167	158.2 Å²	158.2	87%	0.874	81%	0.811	S	S	*	*	S	Bend	trans	-165.2	128.4	143.8	-119.1	91.5	0	0	0	109.2
7	R	40.2	Very low	45.4	Very low	229 Å²	229	157.5 Å²	157.5	86%	0.864	81%	0.808	S	S	*	*			trans	81.4	51.9	173.1	-63.8	-174	172.6	-179.3	-2.4	118	A9	R7-A9 PolarHBondContact O-N 2.75Å
8	S	44.9	Very low	45.8	Very low	131 Å²	131	156 Å²	156	92%	0.916	81%	0.807	S	S	*	*			trans	-78.3	49.5	138.5	-35	0	0	0	0	110.2	G10	S8-G10 PolarHBondContact O-N 3.41Å
9	A	45.5	Very low	46.4	Very low	75 Å²	75	149.9 Å²	149.9	62%	0.62	79%	0.787	S	S	*	*			trans	-88.5	88.7	167.7	0	0	0	0	0	105.5	R7 V11	R7-A9 PolarHBondContact O-N 2.75Å; A9-V11 VanDerWaalsContact C-N 3.33Å; A9-V11 PolarHBondContact O-N 2.72Å
10	G	44.5	Very low	47.2	Very low	72 Å²	72	146.6 Å²	146.6	74%	0.742	77%	0.772	S	S	*	*			trans	-55.8	101.4	169.6	0	0	0	0	0	108.2	S8 Q12	S8-G10 PolarHBondContact O-N 3.41Å; G10-Q12 PolarHBondContact O-N 3.34Å
11	V	41.8	Very low	48.2	Very low	122 Å²	122	145.8 Å²	145.8	74%	0.739	77%	0.765	S	S	*	*			trans	-70.3	87	154.9	-176.9	0	0	0	0	103.6	A9 E13	A9-V11 VanDerWaalsContact C-N 3.33Å; A9-V11 PolarHBondContact O-N 2.72Å; V11-E13 HydrophobicContact CG1-CB 4Å; V11-E13 HydrophobicContact CG1-CG 4.48Å; V11-E13 PolarHBondContact O-N 2.86Å
12	Q	47.3	Very low	49.5	Very low	190 Å²	190	138.3 Å²	138.3	89%	0.888	73%	0.729	S	S	*	*			trans	-62.2	80.9	149.3	-99.6	176.2	-11.3	0	0	104.8	G10 K14	G10-Q12 PolarHBondContact O-N 3.34Å; Q12-K14 PolarHBondContact O-N 3.17Å
13	E	45.8	Very low	50.6	Low	159 Å²	159	141.8 Å²	141.8	74%	0.743	74%	0.74	S	S	*	*			trans	-65.1	91.7	159.6	-147.9	174.3	-172.5	0	0	103.3	V11 L15	V11-E13 HydrophobicContact CG1-CB 4Å; V11-E13 HydrophobicContact CG1-CG 4.48Å; V11-E13 PolarHBondContact O-N 2.86Å; E13-L15 PolarHBondContact O-N 3.13Å
14	K	46.9	Very low	52.1	Low	154 Å²	154	135.8 Å²	135.8	67%	0.67	73%	0.726	S	S	*	*			trans	-57	100.8	166.9	-172.9	-174.8	177.1	-152.8	0	103.4	Q12 E16	Q12-K14 PolarHBondContact O-N 3.17Å; K14-E16 HydrophobicContact CD-CG 3.87Å; K14-E16 WeakPolarHBondContact CE-OE1 3.3Å; K14-E16 HydrophobicContact CG-CG 3.93Å; K14-E16 IonicContact NZ-OE1 2.7Å; K14-E16 PolarHBondContact NZ-OE1 3.17Å; K14-E16 PolarHBondContact O-N 3.32Å
15	L	46.3	Very low	53	Low	146 Å²	146	128.7 Å²	128.7	76%	0.764	70%	0.704	S	S	*	*			trans	-61	80.4	166	-124.2	79.9	0	0	0	105	E13 I17	E13-L15 PolarHBondContact O-N 3.13Å; L15-I17 PolarHBondContact O-N 3.34Å
16	E	45.4	Very low	54.2	Low	135 Å²	135	123.9 Å²	123.9	63%	0.631	69%	0.687	S	S	*	*			trans	-66.1	100.6	163.5	-71.4	-166.6	161	0	0	103.9	K14 V18	K14-E16 HydrophobicContact CD-CG 3.87Å; K14-E16 WeakPolarHBondContact CE-OE1 3.3Å; K14-E16 HydrophobicContact CG-CG 3.93Å; K14-E16 IonicContact NZ-OE1 2.7Å; K14-E16 PolarHBondContact NZ-OE1 3.17Å; K14-E16 PolarHBondContact O-N 3.32Å; E16-V18 PolarHBondContact O-N 3.01Å
17	I	52.6	Low	55.5	Low	146 Å²	146	120.8 Å²	120.8	75%	0.749	68%	0.677	S	S	*	*			trans	-56.6	94.2	165.7	-61.7	167.7	0	0	0	104.1	L15 G19	L15-I17 PolarHBondContact O-N 3.34Å; I17-G19 PolarHBondContact O-N 3.43Å
18	V	52.7	Low	57.3	Low	131 Å²	131	112.7 Å²	112.7	79%	0.794	65%	0.65	S	S	*	*			trans	-51.3	112.9	168.2	173.8	0	0	0	0	104.4	E16 V20	E16-V18 PolarHBondContact O-N 3.01Å; V18-V20 PolarHBondContact O-N 2.92Å; V18-V20 VanDerWaalsContact O-N 3.1Å
19	G	57.3	Low	59.3	Low	41 Å²	41	109.3 Å²	109.3	42%	0.423	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-52.8	121.7	-176	0	0	0	0	0	108.1	I17 E21	I17-G19 PolarHBondContact O-N 3.43Å; G19-E21 PolarHBondContact O-N 3.44Å
20	V	63.1	Low	61.2	Low	82 Å²	82	108.9 Å²	108.9	50%	0.497	62%	0.623	S	S	.	*	P	Polyproline II helix	trans	-67.4	116.6	169.3	-172.2	0	0	0	0	104.5	V18 I28 I33	V18-V20 PolarHBondContact O-N 2.92Å; V18-V20 VanDerWaalsContact O-N 3.1Å; V20-I28 HydrophobicContact CB-CB 4.42Å; V20-I28 HydrophobicContact CB-CD1 4.07Å; V20-I28 HydrophobicContact CG1-CD1 3.61Å; V20-I28 WeakPolarHBondContact O-CA 3.44Å; V20-I28 WeakPolarHBondContact O-CB 3.35Å; V20-I28 WeakPolarHBondContact O-CG1 3.34Å; V20-I28 PolarHBondContact O-N 3.08Å; V20-I33 HydrophobicContact CB-CD1 4.43Å; V20-I33 HydrophobicContact CG2-CD1 4.28Å
21	E	67.1	Low	63.2	Low	131 Å²	131	111.8 Å²	111.8	61%	0.612	62%	0.621	S	S	*	*	B	Isolated β-bridge	trans	-91.2	146.4	177.9	-67.1	174.7	167.8	0	0	109.4	G19 N26	G19-E21 PolarHBondContact O-N 3.44Å; E21-N26 CarbonylContact C-O 3.5Å; E21-N26 VanDerWaalsContact CA-O 3.22Å; E21-N26 WeakPolarHBondContact CA-O 3.38Å
22	D	68.4	Low	65.5	Low	68 Å²	68	109.6 Å²	109.6	36%	0.364	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-71.4	173.8	171.5	69.3	7.9	0	0	0	111	A24 G25 N26 I28	D22-A24 PolarHBondContact O-N 2.84Å; D22-A24 VanDerWaalsContact OD1-C 3.24Å; D22-A24 VanDerWaalsContact OD1-CA 3.3Å; D22-A24 WeakPolarHBondContact OD1-CA 3.41Å; D22-A24 WeakPolarHBondContact OD1-CB 3.4Å; D22-A24 PolarHBondContact OD1-N 3.36Å; D22-G25 PolarHBondContact O-N 2.91Å; D22-G25 PolarHBondContact OD1-N 3.44Å; D22-N26 PolarHBondContact N-O 3.18Å; D22-N26 WeakPolarHBondContact OD1-CB 3.37Å; D22-N26 PolarHBondContact OD1-N 3.14Å; D22-N26 PolarHBondContact OD1-ND2 3.2Å; D22-N26 PolarHBondContact OD2-ND2 3.19Å; D22-I28 HydrophobicContact CB-CG1 4.21Å
23	E	67.3	Low	67.6	Low	216 Å²	216	103.3 Å²	103.3	100%	1.009	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	-9	177.5	-71.2	-136.1	145.7	0	0	113.9
24	A	73.6	Confident	69.8	Low	78 Å²	78	100.7 Å²	100.7	65%	0.645	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	5.5	175.7	0	0	0	0	0	113.5	D22	D22-A24 PolarHBondContact O-N 2.84Å; D22-A24 VanDerWaalsContact OD1-C 3.24Å; D22-A24 VanDerWaalsContact OD1-CA 3.3Å; D22-A24 WeakPolarHBondContact OD1-CA 3.41Å; D22-A24 WeakPolarHBondContact OD1-CB 3.4Å; D22-A24 PolarHBondContact OD1-N 3.36Å
25	G	66.8	Low	72	Confident	41 Å²	41	96.9 Å²	96.9	42%	0.423	56%	0.563	S	S	.	*	S	Bend	trans	79.2	13.4	178.5	0	0	0	0	0	114.7	D22	D22-G25 PolarHBondContact O-N 2.91Å; D22-G25 PolarHBondContact OD1-N 3.44Å
26	N	76.8	Confident	74.4	Confident	88 Å²	88	94.9 Å²	94.9	47%	0.471	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-87.2	138.4	177	-53.6	-64	0	0	0	110.6	E21 D22 I28	E21-N26 CarbonylContact C-O 3.5Å; E21-N26 VanDerWaalsContact CA-O 3.22Å; E21-N26 WeakPolarHBondContact CA-O 3.38Å; D22-N26 PolarHBondContact N-O 3.18Å; D22-N26 WeakPolarHBondContact OD1-CB 3.37Å; D22-N26 PolarHBondContact OD1-N 3.14Å; D22-N26 PolarHBondContact OD1-ND2 3.2Å; D22-N26 PolarHBondContact OD2-ND2 3.19Å; N26-I28 PolarHBondContact O-N 3.11Å; N26-I28 VanDerWaalsContact O-N 3.14Å
27	P	72.4	Confident	76.8	Confident	101 Å²	101	93.2 Å²	93.2	66%	0.656	55%	0.548	S	S	*	.	B	Isolated β-bridge	trans	-63.9	118.3	178	26.3	-33.7	0	0	0	110.4	S29	P27-S29 PolarHBondContact O-N 3.16Å
28	I	78	Confident	78.9	Confident	59 Å²	59	93.5 Å²	93.5	30%	0.303	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-65.2	121.2	173.8	-60.4	175.9	0	0	0	107.7	V20 D22 N26 A30 I33	V20-I28 HydrophobicContact CB-CB 4.42Å; V20-I28 HydrophobicContact CB-CD1 4.07Å; V20-I28 HydrophobicContact CG1-CD1 3.61Å; V20-I28 WeakPolarHBondContact O-CA 3.44Å; V20-I28 WeakPolarHBondContact O-CB 3.35Å; V20-I28 WeakPolarHBondContact O-CG1 3.34Å; V20-I28 PolarHBondContact O-N 3.08Å; D22-I28 HydrophobicContact CB-CG1 4.21Å; N26-I28 PolarHBondContact O-N 3.11Å; N26-I28 VanDerWaalsContact O-N 3.14Å; I28-A30 PolarHBondContact O-N 2.84Å; I28-I33 HydrophobicContact CB-CD1 4.42Å; I28-I33 HydrophobicContact CG2-CD1 3.93Å; I28-I33 HydrophobicContact CG2-CG1 3.71Å
29	S	86.2	Confident	81	Confident	61 Å²	61	96.1 Å²	96.1	43%	0.427	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-58.7	129.5	178.5	178.7	0	0	0	0	110.8	P27 L31 T32 I33	P27-S29 PolarHBondContact O-N 3.16Å; S29-L31 PolarHBondContact O-N 2.84Å; S29-L31 VanDerWaalsContact O-N 3.11Å; S29-L31 PolarHBondContact OG-N 3.49Å; S29-T32 WeakPolarHBondContact O-CB 3.4Å; S29-T32 PolarHBondContact O-N 3.1Å; S29-I33 PolarHBondContact O-N 3.47Å
30	A	85.1	Confident	82.9	Confident	66 Å²	66	97.7 Å²	97.7	55%	0.545	54%	0.543	S	S	.	.	H	α-helix	trans	-54.6	-30.6	175.2	0	0	0	0	0	112.3	I28 T32 I33 L34	I28-A30 PolarHBondContact O-N 2.84Å; A30-T32 PolarHBondContact O-N 3.35Å; A30-I33 PolarHBondContact O-N 2.85Å; A30-L34 WeakPolarHBondContact O-CB 3.25Å; A30-L34 VanDerWaalsContact O-CG 3.26Å; A30-L34 WeakPolarHBondContact O-CG 3.36Å; A30-L34 PolarHBondContact O-N 3.37Å
31	L	87.2	Confident	84.6	Confident	133 Å²	133	96 Å²	96	70%	0.696	54%	0.537	S	S	*	.	H	α-helix	trans	-65.1	-36.8	175.5	-67.5	175.1	0	0	0	112.6	S29 L34 S35	S29-L31 PolarHBondContact O-N 2.84Å; S29-L31 VanDerWaalsContact O-N 3.11Å; S29-L31 PolarHBondContact OG-N 3.49Å; L31-L34 PolarHBondContact O-N 3.17Å; L31-S35 WeakPolarHBondContact O-CB 3.34Å; L31-S35 PolarHBondContact O-N 3.49Å
32	T	89.6	Confident	86	Confident	75 Å²	75	91 Å²	91	46%	0.46	52%	0.522	S	S	.	.	H	α-helix	trans	-69.1	-40.9	177.5	-53.4	0	0	0	0	111	S29 A30 S35 L36	S29-T32 WeakPolarHBondContact O-CB 3.4Å; S29-T32 PolarHBondContact O-N 3.1Å; A30-T32 PolarHBondContact O-N 3.35Å; T32-S35 PolarHBondContact O-N 3.34Å; T32-L36 WeakPolarHBondContact O-CG 3.44Å; T32-L36 PolarHBondContact O-N 2.89Å
33	I	90.3	Very high	87.5	Confident	59 Å²	59	92.2 Å²	92.2	30%	0.303	53%	0.527	S	S	.	.	H	α-helix	trans	-63.4	-45.5	175.1	-62	170.3	0	0	0	110.3	V20 I28 S29 A30 S35 L36 L37	V20-I33 HydrophobicContact CB-CD1 4.43Å; V20-I33 HydrophobicContact CG2-CD1 4.28Å; I28-I33 HydrophobicContact CB-CD1 4.42Å; I28-I33 HydrophobicContact CG2-CD1 3.93Å; I28-I33 HydrophobicContact CG2-CG1 3.71Å; S29-I33 PolarHBondContact O-N 3.47Å; A30-I33 PolarHBondContact O-N 2.85Å; I33-S35 PolarHBondContact O-N 3.16Å; I33-L36 PolarHBondContact O-N 3.45Å; I33-L37 HydrophobicContact CG2-CD1 4.14Å; I33-L37 HydrophobicContact CG2-CG 4.45Å; I33-L37 WeakPolarHBondContact O-CG 3.47Å; I33-L37 PolarHBondContact O-N 2.74Å
34	L	92	Very high	88.9	Confident	104 Å²	104	85.7 Å²	85.7	55%	0.545	50%	0.498	S	S	.	.	H	α-helix	trans	-60.8	-42.8	177	-73	170.9	0	0	0	112.2	A30 L31 L36 L37 E38	A30-L34 WeakPolarHBondContact O-CB 3.25Å; A30-L34 VanDerWaalsContact O-CG 3.26Å; A30-L34 WeakPolarHBondContact O-CG 3.36Å; A30-L34 PolarHBondContact O-N 3.37Å; L31-L34 PolarHBondContact O-N 3.17Å; L34-L36 VanDerWaalsContact C-N 3.34Å; L34-L36 PolarHBondContact O-N 2.83Å; L34-L37 PolarHBondContact O-N 3.14Å; L34-E38 PolarHBondContact O-N 3.03Å
35	S	94.7	Very high	90.1	Very high	74 Å²	74	86.7 Å²	86.7	52%	0.517	49%	0.492	S	S	.	.	H	α-helix	trans	-63.6	-38.2	176.6	-177	0	0	0	0	112.6	L31 T32 I33 R39	L31-S35 WeakPolarHBondContact O-CB 3.34Å; L31-S35 PolarHBondContact O-N 3.49Å; T32-S35 PolarHBondContact O-N 3.34Å; I33-S35 PolarHBondContact O-N 3.16Å; S35-R39 PolarHBondContact O-N 3.24Å
36	L	96.1	Very high	91.6	Very high	103 Å²	103	90.2 Å²	90.2	54%	0.539	50%	0.502	S	S	.	.	H	α-helix	trans	-65.7	-43.3	173.2	-73.9	167.2	0	0	0	111.7	T32 I33 L34 E38 R39 V40	T32-L36 WeakPolarHBondContact O-CG 3.44Å; T32-L36 PolarHBondContact O-N 2.89Å; I33-L36 PolarHBondContact O-N 3.45Å; L34-L36 VanDerWaalsContact C-N 3.34Å; L34-L36 PolarHBondContact O-N 2.83Å; L36-E38 VanDerWaalsContact C-N 3.35Å; L36-E38 PolarHBondContact O-N 3.01Å; L36-R39 PolarHBondContact O-N 3.2Å; L36-V40 VanDerWaalsContact O-CG2 3.28Å; L36-V40 WeakPolarHBondContact O-CG2 3.49Å; L36-V40 PolarHBondContact O-N 2.86Å
37	L	96	Very high	92.6	Very high	101 Å²	101	90 Å²	90	53%	0.529	50%	0.503	S	S	.	.	H	α-helix	trans	-63.2	-39.7	176.8	-72	174.7	0	0	0	112.1	I33 L34 V40 A41	I33-L37 HydrophobicContact CG2-CD1 4.14Å; I33-L37 HydrophobicContact CG2-CG 4.45Å; I33-L37 WeakPolarHBondContact O-CG 3.47Å; I33-L37 PolarHBondContact O-N 2.74Å; L34-L37 PolarHBondContact O-N 3.14Å; L37-V40 PolarHBondContact O-N 3.26Å; L37-A41 WeakPolarHBondContact O-CB 3.45Å; L37-A41 PolarHBondContact O-N 3.14Å
38	E	96.3	Very high	93.9	Very high	151 Å²	151	90.7 Å²	90.7	71%	0.706	50%	0.498	S	S	*	.	H	α-helix	trans	-63.1	-42.4	174.1	-174.9	174.3	-171.2	0	0	111.4	L34 L36 V40 A41 G42	L34-E38 PolarHBondContact O-N 3.03Å; L36-E38 VanDerWaalsContact C-N 3.35Å; L36-E38 PolarHBondContact O-N 3.01Å; E38-V40 PolarHBondContact O-N 2.87Å; E38-A41 PolarHBondContact O-N 3.38Å; E38-G42 PolarHBondContact O-N 3.02Å
39	R	97.2	Very high	94.8	Very high	186 Å²	186	90.7 Å²	90.7	70%	0.702	50%	0.503	S	S	*	.	H	α-helix	trans	-62.9	-42.3	173.9	-176.8	174.8	179.7	159.3	0.3	112.2	S35 L36 G42 I43	S35-R39 PolarHBondContact O-N 3.24Å; L36-R39 PolarHBondContact O-N 3.2Å; R39-G42 PolarHBondContact O-N 3.36Å; R39-I43 HydrophobicContact CG-CD1 4.29Å; R39-I43 WeakPolarHBondContact O-CG1 3.44Å; R39-I43 PolarHBondContact O-N 3.43Å
40	V	97.9	Very high	95.4	Very high	75 Å²	75	91.3 Å²	91.3	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-65.7	-42.7	177.4	169.7	0	0	0	0	110.7	L36 L37 E38 G42 I43 I44	L36-V40 VanDerWaalsContact O-CG2 3.28Å; L36-V40 WeakPolarHBondContact O-CG2 3.49Å; L36-V40 PolarHBondContact O-N 2.86Å; L37-V40 PolarHBondContact O-N 3.26Å; E38-V40 PolarHBondContact O-N 2.87Å; V40-G42 VanDerWaalsContact C-N 3.34Å; V40-G42 PolarHBondContact O-N 3.38Å; V40-I43 PolarHBondContact O-N 3.04Å; V40-I43 VanDerWaalsContact O-N 3.14Å; V40-I44 HydrophobicContact CG1-CD1 3.86Å; V40-I44 HydrophobicContact CG1-CG1 4.41Å; V40-I44 WeakPolarHBondContact O-CG1 3.4Å; V40-I44 PolarHBondContact O-N 3.08Å
41	A	97.1	Very high	96	Very high	45 Å²	45	93.2 Å²	93.2	37%	0.372	50%	0.504	S	S	.	.	H	α-helix	trans	-58.3	-46.5	174.4	0	0	0	0	0	111	L37 E38 I43 I44 D45	L37-A41 WeakPolarHBondContact O-CB 3.45Å; L37-A41 PolarHBondContact O-N 3.14Å; E38-A41 PolarHBondContact O-N 3.38Å; A41-I43 VanDerWaalsContact C-N 3.31Å; A41-I43 PolarHBondContact O-N 3.42Å; A41-I44 WeakPolarHBondContact O-CB 3.4Å; A41-I44 PolarHBondContact O-N 3.32Å; A41-I44 VanDerWaalsContact O-N 3.1Å; A41-D45 PolarHBondContact O-N 2.94Å
42	G	98.1	Very high	96.5	Very high	28 Å²	28	92.2 Å²	92.2	29%	0.289	50%	0.496	S	S	.	.	H	α-helix	trans	-62.1	-34.8	175	0	0	0	0	0	113.8	E38 R39 V40 N46	E38-G42 PolarHBondContact O-N 3.02Å; R39-G42 PolarHBondContact O-N 3.36Å; V40-G42 VanDerWaalsContact C-N 3.34Å; V40-G42 PolarHBondContact O-N 3.38Å; G42-N46 WeakPolarHBondContact O-CB 3.49Å; G42-N46 VanDerWaalsContact O-CG 3.29Å; G42-N46 PolarHBondContact O-N 3.18Å; G42-N46 VanDerWaalsContact O-N 3.13Å; G42-N46 PolarHBondContact O-ND2 2.87Å
43	I	98.2	Very high	96.9	Very high	92 Å²	92	96.8 Å²	96.8	47%	0.472	51%	0.505	S	S	.	.	H	α-helix	trans	-67.5	-42.8	173	-68	165.4	0	0	0	110.5	R39 V40 A41 N46 V47	R39-I43 HydrophobicContact CG-CD1 4.29Å; R39-I43 WeakPolarHBondContact O-CG1 3.44Å; R39-I43 PolarHBondContact O-N 3.43Å; V40-I43 PolarHBondContact O-N 3.04Å; V40-I43 VanDerWaalsContact O-N 3.14Å; A41-I43 VanDerWaalsContact C-N 3.31Å; A41-I43 PolarHBondContact O-N 3.42Å; I43-N46 PolarHBondContact O-N 3.28Å; I43-V47 HydrophobicContact CG2-CG2 4.35Å; I43-V47 WeakPolarHBondContact O-CG2 3.5Å; I43-V47 PolarHBondContact O-N 3.24Å
44	I	98.1	Very high	97.3	Very high	80 Å²	80	99.4 Å²	99.4	41%	0.41	52%	0.517	S	S	.	.	H	α-helix	trans	-61.1	-46	177.3	-69.4	167.7	0	0	0	110.4	V40 A41 N46 V47 Q48	V40-I44 HydrophobicContact CG1-CD1 3.86Å; V40-I44 HydrophobicContact CG1-CG1 4.41Å; V40-I44 WeakPolarHBondContact O-CG1 3.4Å; V40-I44 PolarHBondContact O-N 3.08Å; A41-I44 WeakPolarHBondContact O-CB 3.4Å; A41-I44 PolarHBondContact O-N 3.32Å; A41-I44 VanDerWaalsContact O-N 3.1Å; I44-N46 VanDerWaalsContact C-N 3.3Å; I44-N46 PolarHBondContact O-N 2.74Å; I44-V47 PolarHBondContact O-N 3.13Å; I44-Q48 HydrophobicContact CG2-CG 4.23Å; I44-Q48 WeakPolarHBondContact O-CB 3.45Å; I44-Q48 VanDerWaalsContact O-CG 3.31Å; I44-Q48 WeakPolarHBondContact O-CG 3.49Å; I44-Q48 PolarHBondContact O-N 3.37Å
45	D	98.3	Very high	97.6	Very high	98 Å²	98	99.5 Å²	99.5	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-60.5	-41.2	178	-68	-19.2	0	0	0	111.6	A41 Q48 S49	A41-D45 PolarHBondContact O-N 2.94Å; D45-Q48 PolarHBondContact O-N 3.41Å; D45-S49 WeakPolarHBondContact O-CB 3.49Å; D45-S49 PolarHBondContact O-N 3.4Å
46	N	98.2	Very high	97.7	Very high	116 Å²	116	101.3 Å²	101.3	62%	0.62	52%	0.515	S	S	*	.	H	α-helix	trans	-65.2	-42.7	175.5	-76.4	-44.2	0	0	0	112.4	G42 I43 I44 S49 C50	G42-N46 WeakPolarHBondContact O-CB 3.49Å; G42-N46 VanDerWaalsContact O-CG 3.29Å; G42-N46 PolarHBondContact O-N 3.18Å; G42-N46 VanDerWaalsContact O-N 3.13Å; G42-N46 PolarHBondContact O-ND2 2.87Å; I43-N46 PolarHBondContact O-N 3.28Å; I44-N46 VanDerWaalsContact C-N 3.3Å; I44-N46 PolarHBondContact O-N 2.74Å; N46-S49 PolarHBondContact O-N 2.9Å; N46-C50 VanDerWaalsContact O-CB 3.31Å; N46-C50 WeakPolarHBondContact O-CB 3.45Å; N46-C50 PolarHBondContact O-N 3.08Å
47	V	98.4	Very high	97.8	Very high	83 Å²	83	104.4 Å²	104.4	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-64.1	-44.4	176.4	170.5	0	0	0	0	110.4	I43 I44 C50 Q51	I43-V47 HydrophobicContact CG2-CG2 4.35Å; I43-V47 WeakPolarHBondContact O-CG2 3.5Å; I43-V47 PolarHBondContact O-N 3.24Å; I44-V47 PolarHBondContact O-N 3.13Å; V47-C50 PolarHBondContact O-N 2.82Å; V47-Q51 VanDerWaalsContact O-CB 3.3Å; V47-Q51 WeakPolarHBondContact O-CB 3.45Å; V47-Q51 PolarHBondContact O-N 3.17Å
48	Q	98.2	Very high	97.9	Very high	115 Å²	115	104.5 Å²	104.5	54%	0.537	52%	0.517	S	S	.	.	H	α-helix	trans	-61.4	-45.9	177	-74.2	179.6	-0.5	0	0	111.7	I44 D45 C50 Q51 Q52	I44-Q48 HydrophobicContact CG2-CG 4.23Å; I44-Q48 WeakPolarHBondContact O-CB 3.45Å; I44-Q48 VanDerWaalsContact O-CG 3.31Å; I44-Q48 WeakPolarHBondContact O-CG 3.49Å; I44-Q48 PolarHBondContact O-N 3.37Å; D45-Q48 PolarHBondContact O-N 3.41Å; Q48-C50 VanDerWaalsContact C-N 3.34Å; Q48-C50 PolarHBondContact O-N 3.07Å; Q48-Q51 PolarHBondContact O-N 3.03Å; Q48-Q52 PolarHBondContact O-N 2.98Å
49	S	97.9	Very high	98	Very high	59 Å²	59	102.1 Å²	102.1	41%	0.413	51%	0.509	S	S	.	.	H	α-helix	trans	-63	-40.2	176.2	-175.7	0	0	0	0	112.4	D45 N46 R53	D45-S49 WeakPolarHBondContact O-CB 3.49Å; D45-S49 PolarHBondContact O-N 3.4Å; N46-S49 PolarHBondContact O-N 2.9Å; S49-R53 PolarHBondContact O-N 3.42Å; S49-R53 VanDerWaalsContact O-N 3.16Å
50	C	97.9	Very high	98.1	Very high	74 Å²	74	98.9 Å²	98.9	50%	0.5	50%	0.502	S	S	.	.	H	α-helix	trans	-65.7	-42.3	176.1	-173.7	0	0	0	0	111.6	N46 V47 Q48 R53 M54	N46-C50 VanDerWaalsContact O-CB 3.31Å; N46-C50 WeakPolarHBondContact O-CB 3.45Å; N46-C50 PolarHBondContact O-N 3.08Å; V47-C50 PolarHBondContact O-N 2.82Å; Q48-C50 VanDerWaalsContact C-N 3.34Å; Q48-C50 PolarHBondContact O-N 3.07Å; C50-R53 PolarHBondContact O-N 2.83Å; C50-M54 WeakPolarHBondContact O-CB 3.46Å; C50-M54 PolarHBondContact O-N 3.08Å
51	Q	98.1	Very high	98.1	Very high	106 Å²	106	99.6 Å²	99.6	50%	0.495	50%	0.503	S	S	.	.	H	α-helix	trans	-63.6	-46.4	178.3	-178.8	170	-2.4	0	0	111.3	V47 Q48 R53 M54 E55	V47-Q51 VanDerWaalsContact O-CB 3.3Å; V47-Q51 WeakPolarHBondContact O-CB 3.45Å; V47-Q51 PolarHBondContact O-N 3.17Å; Q48-Q51 PolarHBondContact O-N 3.03Å; Q51-R53 VanDerWaalsContact C-N 3.33Å; Q51-R53 PolarHBondContact O-N 3.34Å; Q51-M54 WeakPolarHBondContact O-CB 3.46Å; Q51-M54 PolarHBondContact O-N 3.37Å; Q51-M54 VanDerWaalsContact O-N 3.09Å; Q51-E55 HydrophobicContact CG-CG 4.43Å; Q51-E55 WeakPolarHBondContact CG-OE1 3.44Å; Q51-E55 PolarHBondContact NE2-OE1 3.46Å; Q51-E55 WeakPolarHBondContact O-CG 3.39Å; Q51-E55 PolarHBondContact O-N 3.3Å
52	Q	98.1	Very high	98.2	Very high	113 Å²	113	101.2 Å²	101.2	53%	0.528	50%	0.503	S	S	.	.	H	α-helix	trans	-57.9	-46.3	176.1	-177.4	178.4	-2.3	0	0	111.6	Q48 M54 E55 E56	Q48-Q52 PolarHBondContact O-N 2.98Å; Q52-M54 VanDerWaalsContact C-N 3.28Å; Q52-M54 PolarHBondContact O-N 2.87Å; Q52-E55 PolarHBondContact O-N 2.88Å; Q52-E56 PolarHBondContact NE2-OE1 3.49Å; Q52-E56 VanDerWaalsContact NE2-OE1 3.16Å; Q52-E56 WeakPolarHBondContact O-CG 3.44Å; Q52-E56 PolarHBondContact O-N 2.96Å
53	R	98.3	Very high	98.2	Very high	170 Å²	170	103.5 Å²	103.5	64%	0.642	51%	0.508	S	S	*	.	H	α-helix	trans	-62.1	-36.5	177.1	-167.8	-172.4	-55.8	157.3	6.8	112.2	S49 C50 Q51 R57	S49-R53 PolarHBondContact O-N 3.42Å; S49-R53 VanDerWaalsContact O-N 3.16Å; C50-R53 PolarHBondContact O-N 2.83Å; Q51-R53 VanDerWaalsContact C-N 3.33Å; Q51-R53 PolarHBondContact O-N 3.34Å; R53-R57 WeakPolarHBondContact O-CB 3.41Å; R53-R57 PolarHBondContact O-N 3.43Å; R53-R57 VanDerWaalsContact O-N 3.13Å
54	M	98	Very high	98.2	Very high	114 Å²	114	102.7 Å²	102.7	56%	0.562	51%	0.505	S	S	*	.	H	α-helix	trans	-67.2	-44.5	176.3	-175.5	64.8	77.2	0	0	111.2	C50 Q51 Q52 R57 Q58	C50-M54 WeakPolarHBondContact O-CB 3.46Å; C50-M54 PolarHBondContact O-N 3.08Å; Q51-M54 WeakPolarHBondContact O-CB 3.46Å; Q51-M54 PolarHBondContact O-N 3.37Å; Q51-M54 VanDerWaalsContact O-N 3.09Å; Q52-M54 VanDerWaalsContact C-N 3.28Å; Q52-M54 PolarHBondContact O-N 2.87Å; M54-R57 PolarHBondContact O-N 3.32Å; M54-Q58 WeakPolarHBondContact O-CB 3.49Å; M54-Q58 PolarHBondContact O-N 3.21Å
55	E	97.9	Very high	98.3	Very high	106 Å²	106	103.1 Å²	103.1	50%	0.495	51%	0.507	S	S	.	.	H	α-helix	trans	-62.7	-43.5	178.5	-72.4	174.4	-169.1	0	0	111.7	Q51 Q52 R57 Q58 L59	Q51-E55 HydrophobicContact CG-CG 4.43Å; Q51-E55 WeakPolarHBondContact CG-OE1 3.44Å; Q51-E55 PolarHBondContact NE2-OE1 3.46Å; Q51-E55 WeakPolarHBondContact O-CG 3.39Å; Q51-E55 PolarHBondContact O-N 3.3Å; Q52-E55 PolarHBondContact O-N 2.88Å; E55-R57 PolarHBondContact O-N 2.98Å; E55-Q58 PolarHBondContact O-N 3.23Å; E55-L59 WeakPolarHBondContact O-CB 3.4Å; E55-L59 PolarHBondContact O-N 3.01Å
56	E	98.3	Very high	98.3	Very high	113 Å²	113	104.1 Å²	104.1	53%	0.528	51%	0.506	S	S	.	.	H	α-helix	trans	-60.5	-46.3	175.1	-72.7	172	-172.1	0	0	111.7	Q52 Q58 L59 E60	Q52-E56 PolarHBondContact NE2-OE1 3.49Å; Q52-E56 VanDerWaalsContact NE2-OE1 3.16Å; Q52-E56 WeakPolarHBondContact O-CG 3.44Å; Q52-E56 PolarHBondContact O-N 2.96Å; E56-Q58 VanDerWaalsContact C-N 3.35Å; E56-Q58 PolarHBondContact O-N 3.42Å; E56-L59 PolarHBondContact O-N 3.01Å; E56-E60 PolarHBondContact O-N 2.63Å
57	R	98.3	Very high	98.3	Very high	168 Å²	168	102.4 Å²	102.4	63%	0.634	50%	0.501	S	S	*	.	H	α-helix	trans	-65.5	-38.4	177.6	-173.4	176.4	-178.8	170.9	0.7	112	R53 M54 E55 E60 L61	R53-R57 WeakPolarHBondContact O-CB 3.41Å; R53-R57 PolarHBondContact O-N 3.43Å; R53-R57 VanDerWaalsContact O-N 3.13Å; M54-R57 PolarHBondContact O-N 3.32Å; E55-R57 PolarHBondContact O-N 2.98Å; R57-E60 PolarHBondContact O-N 3.37Å; R57-L61 HydrophobicContact CG-CD1 4.28Å; R57-L61 WeakPolarHBondContact O-CB 3.48Å; R57-L61 VanDerWaalsContact O-CG 3.28Å; R57-L61 WeakPolarHBondContact O-CG 3.44Å; R57-L61 PolarHBondContact O-N 3.27Å
58	Q	98.1	Very high	98.3	Very high	103 Å²	103	103.3 Å²	103.3	48%	0.481	50%	0.502	S	S	.	.	H	α-helix	trans	-64.9	-43.1	177.2	-176.2	174	-16.8	0	0	110.8	M54 E55 E56 E60 L61 E62	M54-Q58 WeakPolarHBondContact O-CB 3.49Å; M54-Q58 PolarHBondContact O-N 3.21Å; E55-Q58 PolarHBondContact O-N 3.23Å; E56-Q58 VanDerWaalsContact C-N 3.35Å; E56-Q58 PolarHBondContact O-N 3.42Å; Q58-E60 VanDerWaalsContact C-N 3.33Å; Q58-E60 PolarHBondContact O-N 2.96Å; Q58-L61 PolarHBondContact O-N 3.28Å; Q58-E62 PolarHBondContact NE2-OE1 3.42Å; Q58-E62 WeakPolarHBondContact O-CG 3.44Å; Q58-E62 PolarHBondContact O-N 3.04Å
59	L	98.3	Very high	98.4	Very high	101 Å²	101	103.2 Å²	103.2	53%	0.529	50%	0.501	S	S	.	.	H	α-helix	trans	-60.7	-42.9	175.5	-176.9	68.1	0	0	0	111.8	E55 E56 E62 N63	E55-L59 WeakPolarHBondContact O-CB 3.4Å; E55-L59 PolarHBondContact O-N 3.01Å; E56-L59 PolarHBondContact O-N 3.01Å; L59-E62 PolarHBondContact O-N 3.39Å; L59-N63 PolarHBondContact O-N 3.28Å; L59-N63 VanDerWaalsContact O-N 3.09Å; L59-N63 PolarHBondContact O-ND2 3.36Å
60	E	98.5	Very high	98.4	Very high	118 Å²	118	102.2 Å²	102.2	55%	0.551	50%	0.5	S	S	*	.	H	α-helix	trans	-61.8	-46.4	175.3	-170.8	-174.2	173.1	0	0	111.5	E56 R57 Q58 E62 N63 N64	E56-E60 PolarHBondContact O-N 2.63Å; R57-E60 PolarHBondContact O-N 3.37Å; Q58-E60 VanDerWaalsContact C-N 3.33Å; Q58-E60 PolarHBondContact O-N 2.96Å; E60-E62 VanDerWaalsContact C-N 3.34Å; E60-E62 PolarHBondContact O-N 3.47Å; E60-N63 PolarHBondContact O-N 2.9Å; E60-N64 PolarHBondContact O-N 2.96Å; E60-N64 PolarHBondContact O-ND2 3.43Å
61	L	98.6	Very high	98.4	Very high	90 Å²	90	103.3 Å²	103.3	47%	0.471	50%	0.501	S	S	.	.	H	α-helix	trans	-60.2	-42.8	176.9	-74	171.5	0	0	0	111.9	R57 Q58 N63 N64 I65	R57-L61 HydrophobicContact CG-CD1 4.28Å; R57-L61 WeakPolarHBondContact O-CB 3.48Å; R57-L61 VanDerWaalsContact O-CG 3.28Å; R57-L61 WeakPolarHBondContact O-CG 3.44Å; R57-L61 PolarHBondContact O-N 3.27Å; Q58-L61 PolarHBondContact O-N 3.28Å; L61-N63 VanDerWaalsContact C-N 3.31Å; L61-N63 PolarHBondContact O-N 3.46Å; L61-N64 PolarHBondContact O-N 2.86Å; L61-I65 WeakPolarHBondContact O-CB 3.39Å; L61-I65 VanDerWaalsContact O-CG1 3.23Å; L61-I65 WeakPolarHBondContact O-CG1 3.39Å; L61-I65 PolarHBondContact O-N 2.88Å
62	E	98.3	Very high	98.4	Very high	79 Å²	79	102.5 Å²	102.5	37%	0.369	50%	0.503	S	S	.	.	H	α-helix	trans	-60.8	-39.9	175.8	-75	179.3	-165.5	0	0	112.2	Q58 L59 E60 I65 K66	Q58-E62 PolarHBondContact NE2-OE1 3.42Å; Q58-E62 WeakPolarHBondContact O-CG 3.44Å; Q58-E62 PolarHBondContact O-N 3.04Å; L59-E62 PolarHBondContact O-N 3.39Å; E60-E62 VanDerWaalsContact C-N 3.34Å; E60-E62 PolarHBondContact O-N 3.47Å; E62-I65 PolarHBondContact O-N 3.21Å; E62-K66 VanDerWaalsContact O-CG 3.29Å; E62-K66 WeakPolarHBondContact O-CG 3.37Å; E62-K66 PolarHBondContact O-N 3.48Å
63	N	98.6	Very high	98.5	Very high	75 Å²	75	103.3 Å²	103.3	40%	0.401	51%	0.51	S	S	.	.	H	α-helix	trans	-69.5	-39.2	177	-70.6	-29.2	0	0	0	112.3	L59 E60 L61 K66 T67	L59-N63 PolarHBondContact O-N 3.28Å; L59-N63 VanDerWaalsContact O-N 3.09Å; L59-N63 PolarHBondContact O-ND2 3.36Å; E60-N63 PolarHBondContact O-N 2.9Å; L61-N63 VanDerWaalsContact C-N 3.31Å; L61-N63 PolarHBondContact O-N 3.46Å; N63-K66 PolarHBondContact O-N 3.04Å; N63-T67 PolarHBondContact O-N 3.37Å; N63-T67 PolarHBondContact O-OG1 3.41Å
64	N	98.7	Very high	98.5	Very high	75 Å²	75	101.4 Å²	101.4	40%	0.401	51%	0.507	S	S	.	.	H	α-helix	trans	-63.4	-44.3	173.8	-70.8	-22	0	0	0	110.8	E60 L61 K66 T67 I68	E60-N64 PolarHBondContact O-N 2.96Å; E60-N64 PolarHBondContact O-ND2 3.43Å; L61-N64 PolarHBondContact O-N 2.86Å; N64-K66 PolarHBondContact O-N 2.85Å; N64-T67 WeakPolarHBondContact O-CB 3.36Å; N64-T67 PolarHBondContact O-N 2.81Å; N64-I68 VanDerWaalsContact O-CG1 3.27Å; N64-I68 WeakPolarHBondContact O-CG1 3.32Å; N64-I68 PolarHBondContact O-N 3.41Å
65	I	98.8	Very high	98.5	Very high	90 Å²	90	101.6 Å²	101.6	46%	0.462	51%	0.509	S	S	.	.	H	α-helix	trans	-60.6	-45.2	175.7	-70.4	165.3	0	0	0	110.8	L61 E62 T67 I68 Q69	L61-I65 WeakPolarHBondContact O-CB 3.39Å; L61-I65 VanDerWaalsContact O-CG1 3.23Å; L61-I65 WeakPolarHBondContact O-CG1 3.39Å; L61-I65 PolarHBondContact O-N 2.88Å; E62-I65 PolarHBondContact O-N 3.21Å; I65-T67 VanDerWaalsContact C-N 3.31Å; I65-T67 PolarHBondContact O-N 3.37Å; I65-I68 PolarHBondContact O-N 3.37Å; I65-Q69 HydrophobicContact CG2-CG 4.31Å; I65-Q69 WeakPolarHBondContact O-CB 3.48Å; I65-Q69 VanDerWaalsContact O-CG 3.27Å; I65-Q69 WeakPolarHBondContact O-CG 3.18Å; I65-Q69 PolarHBondContact O-N 3.32Å
66	K	98.6	Very high	98.6	Very high	118 Å²	118	99.4 Å²	99.4	51%	0.513	51%	0.509	S	S	.	.	H	α-helix	trans	-60.2	-40.9	176.2	-74.5	168.9	-169.9	161.8	0	112	E62 N63 N64 Q69 G70	E62-K66 VanDerWaalsContact O-CG 3.29Å; E62-K66 WeakPolarHBondContact O-CG 3.37Å; E62-K66 PolarHBondContact O-N 3.48Å; N63-K66 PolarHBondContact O-N 3.04Å; N64-K66 PolarHBondContact O-N 2.85Å; K66-Q69 PolarHBondContact O-N 3.26Å; K66-G70 PolarHBondContact O-N 3.32Å
67	T	98.7	Very high	98.6	Very high	81 Å²	81	100.7 Å²	100.7	50%	0.497	51%	0.513	S	S	.	.	H	α-helix	trans	-62.9	-49.2	176.1	-56.3	0	0	0	0	110.8	N63 N64 I65 Q69 G70 D71	N63-T67 PolarHBondContact O-N 3.37Å; N63-T67 PolarHBondContact O-OG1 3.41Å; N64-T67 WeakPolarHBondContact O-CB 3.36Å; N64-T67 PolarHBondContact O-N 2.81Å; I65-T67 VanDerWaalsContact C-N 3.31Å; I65-T67 PolarHBondContact O-N 3.37Å; T67-Q69 VanDerWaalsContact C-N 3.33Å; T67-Q69 PolarHBondContact O-N 3.39Å; T67-G70 WeakPolarHBondContact O-CA 3.34Å; T67-G70 PolarHBondContact O-N 3.46Å; T67-G70 VanDerWaalsContact O-N 3.08Å; T67-D71 PolarHBondContact O-N 2.79Å
68	I	98.7	Very high	98.6	Very high	102 Å²	102	96.1 Å²	96.1	52%	0.523	50%	0.501	S	S	.	.	H	α-helix	trans	-59.6	-43.4	177.5	-68.1	165.1	0	0	0	110.9	N64 I65 G70 D71 V72	N64-I68 VanDerWaalsContact O-CG1 3.27Å; N64-I68 WeakPolarHBondContact O-CG1 3.32Å; N64-I68 PolarHBondContact O-N 3.41Å; I65-I68 PolarHBondContact O-N 3.37Å; I68-G70 VanDerWaalsContact C-N 3.3Å; I68-G70 PolarHBondContact O-N 3.3Å; I68-D71 PolarHBondContact O-N 2.87Å; I68-V72 HydrophobicContact CG2-CG2 4.25Å; I68-V72 WeakPolarHBondContact O-CB 3.31Å; I68-V72 VanDerWaalsContact O-CG2 3.27Å; I68-V72 WeakPolarHBondContact O-CG2 3.48Å; I68-V72 PolarHBondContact O-N 3.17Å
69	Q	98.6	Very high	98.6	Very high	112 Å²	112	97.3 Å²	97.3	52%	0.523	51%	0.507	S	S	.	.	H	α-helix	trans	-59	-42.9	175.4	-75.5	174.4	-9.7	0	0	111.6	I65 K66 T67 L73	I65-Q69 HydrophobicContact CG2-CG 4.31Å; I65-Q69 WeakPolarHBondContact O-CB 3.48Å; I65-Q69 VanDerWaalsContact O-CG 3.27Å; I65-Q69 WeakPolarHBondContact O-CG 3.18Å; I65-Q69 PolarHBondContact O-N 3.32Å; K66-Q69 PolarHBondContact O-N 3.26Å; T67-Q69 VanDerWaalsContact C-N 3.33Å; T67-Q69 PolarHBondContact O-N 3.39Å; Q69-L73 WeakPolarHBondContact O-CG 3.35Å; Q69-L73 PolarHBondContact O-N 3.23Å
70	G	98.6	Very high	98.6	Very high	38 Å²	38	96.1 Å²	96.1	39%	0.392	51%	0.507	S	S	.	.	H	α-helix	trans	-61.7	-45.1	174.3	0	0	0	0	0	112.8	K66 T67 I68 L73 K74	K66-G70 PolarHBondContact O-N 3.32Å; T67-G70 WeakPolarHBondContact O-CA 3.34Å; T67-G70 PolarHBondContact O-N 3.46Å; T67-G70 VanDerWaalsContact O-N 3.08Å; I68-G70 VanDerWaalsContact C-N 3.3Å; I68-G70 PolarHBondContact O-N 3.3Å; G70-L73 PolarHBondContact O-N 3.38Å; G70-K74 WeakPolarHBondContact O-CB 3.47Å; G70-K74 PolarHBondContact O-N 3.4Å
71	D	98.7	Very high	98.6	Very high	97 Å²	97	95 Å²	95	52%	0.519	50%	0.504	S	S	.	.	H	α-helix	trans	-65.8	-39.9	179.2	-72	-23.2	0	0	0	112.1	T67 I68 K74 L75	T67-D71 PolarHBondContact O-N 2.79Å; I68-D71 PolarHBondContact O-N 2.87Å; D71-K74 PolarHBondContact O-N 3.03Å; D71-L75 VanDerWaalsContact O-CB 3.3Å; D71-L75 WeakPolarHBondContact O-CB 3.5Å; D71-L75 PolarHBondContact O-N 2.97Å
72	V	98.8	Very high	98.6	Very high	90 Å²	90	94.7 Å²	94.7	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-63.9	-43.8	175.2	170.7	0	0	0	0	111	I68 L75 A76	I68-V72 HydrophobicContact CG2-CG2 4.25Å; I68-V72 WeakPolarHBondContact O-CB 3.31Å; I68-V72 VanDerWaalsContact O-CG2 3.27Å; I68-V72 WeakPolarHBondContact O-CG2 3.48Å; I68-V72 PolarHBondContact O-N 3.17Å; V72-L75 PolarHBondContact O-N 3.38Å; V72-A76 WeakPolarHBondContact O-CB 3.31Å; V72-A76 PolarHBondContact O-N 2.83Å
73	L	98.6	Very high	98.7	Very high	129 Å²	129	94 Å²	94	68%	0.675	51%	0.511	S	S	*	.	H	α-helix	trans	-63.9	-41.2	176	-74.2	174.4	0	0	0	112	Q69 G70 A76 K77	Q69-L73 WeakPolarHBondContact O-CG 3.35Å; Q69-L73 PolarHBondContact O-N 3.23Å; G70-L73 PolarHBondContact O-N 3.38Å; L73-A76 PolarHBondContact O-N 3.09Å; L73-K77 PolarHBondContact O-N 3.02Å; L73-K77 VanDerWaalsContact O-N 3.1Å
74	K	98.7	Very high	98.7	Very high	130 Å²	130	92 Å²	92	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-63.1	-46.3	175.5	-175.9	-178.6	173.6	-170.9	0	111.1	G70 D71 A76 K77 D78	G70-K74 WeakPolarHBondContact O-CB 3.47Å; G70-K74 PolarHBondContact O-N 3.4Å; D71-K74 PolarHBondContact O-N 3.03Å; K74-A76 VanDerWaalsContact C-N 3.33Å; K74-A76 PolarHBondContact O-N 3.12Å; K74-K77 WeakPolarHBondContact O-CB 3.42Å; K74-K77 PolarHBondContact O-N 2.88Å; K74-K77 VanDerWaalsContact O-N 3.16Å; K74-D78 PolarHBondContact O-N 3.05Å
75	L	98.7	Very high	98.7	Very high	119 Å²	119	92.2 Å²	92.2	62%	0.623	51%	0.512	S	S	*	.	H	α-helix	trans	-61.2	-41.2	177.1	-178.4	62.4	0	0	0	111.9	D71 V72 K77 D78 H79	D71-L75 VanDerWaalsContact O-CB 3.3Å; D71-L75 WeakPolarHBondContact O-CB 3.5Å; D71-L75 PolarHBondContact O-N 2.97Å; V72-L75 PolarHBondContact O-N 3.38Å; L75-K77 VanDerWaalsContact C-N 3.29Å; L75-K77 PolarHBondContact O-N 3.02Å; L75-D78 PolarHBondContact O-N 3.13Å; L75-H79 VanDerWaalsContact O-CB 3.28Å; L75-H79 WeakPolarHBondContact O-CB 3.39Å; L75-H79 PolarHBondContact O-N 3.34Å
76	A	98.6	Very high	98.7	Very high	60 Å²	60	91.4 Å²	91.4	50%	0.496	51%	0.511	S	S	.	.	H	α-helix	trans	-61	-39.7	175.9	0	0	0	0	0	111.8	V72 L73 K74 S80	V72-A76 WeakPolarHBondContact O-CB 3.31Å; V72-A76 PolarHBondContact O-N 2.83Å; L73-A76 PolarHBondContact O-N 3.09Å; K74-A76 VanDerWaalsContact C-N 3.33Å; K74-A76 PolarHBondContact O-N 3.12Å; A76-S80 PolarHBondContact O-N 2.96Å
77	K	98.7	Very high	98.6	Very high	139 Å²	139	89.7 Å²	89.7	60%	0.604	50%	0.504	S	S	*	.	H	α-helix	trans	-65.7	-48.7	174.4	-173.2	-177.3	177.6	-178.8	0	111.8	L73 K74 L75 H79 S80 D81	L73-K77 PolarHBondContact O-N 3.02Å; L73-K77 VanDerWaalsContact O-N 3.1Å; K74-K77 WeakPolarHBondContact O-CB 3.42Å; K74-K77 PolarHBondContact O-N 2.88Å; K74-K77 VanDerWaalsContact O-N 3.16Å; L75-K77 VanDerWaalsContact C-N 3.29Å; L75-K77 PolarHBondContact O-N 3.02Å; K77-H79 VanDerWaalsContact C-N 3.26Å; K77-H79 PolarHBondContact O-N 2.94Å; K77-S80 WeakPolarHBondContact O-CA 3.43Å; K77-S80 WeakPolarHBondContact O-CB 3.44Å; K77-S80 PolarHBondContact O-N 3.46Å; K77-D81 PolarHBondContact O-N 2.95Å
78	D	98.6	Very high	98.6	Very high	72 Å²	72	92.2 Å²	92.2	39%	0.385	51%	0.509	S	S	.	.	H	α-helix	trans	-62	-36.8	179.1	-66.5	-15.6	0	0	0	111.2	K74 L75 D81 T82	K74-D78 PolarHBondContact O-N 3.05Å; L75-D78 PolarHBondContact O-N 3.13Å; D78-D81 PolarHBondContact O-N 3.41Å; D78-T82 WeakPolarHBondContact O-CB 3.38Å; D78-T82 PolarHBondContact O-N 2.91Å; D78-T82 PolarHBondContact O-OG1 2.88Å
79	H	98.6	Very high	98.6	Very high	129 Å²	129	92.1 Å²	92.1	60%	0.597	51%	0.509	S	S	*	.	H	α-helix	trans	-64.9	-41.9	172.6	-179.7	-93.2	0	0	0	111.8	L75 K77 D81 T82 S83	L75-H79 VanDerWaalsContact O-CB 3.28Å; L75-H79 WeakPolarHBondContact O-CB 3.39Å; L75-H79 PolarHBondContact O-N 3.34Å; K77-H79 VanDerWaalsContact C-N 3.26Å; K77-H79 PolarHBondContact O-N 2.94Å; H79-D81 PolarHBondContact O-N 2.8Å; H79-T82 PolarHBondContact O-N 3.25Å; H79-S83 VanDerWaalsContact O-CB 3.27Å; H79-S83 WeakPolarHBondContact O-CB 3.49Å; H79-S83 PolarHBondContact O-N 3.37Å
80	S	98.6	Very high	98.6	Very high	75 Å²	75	90.5 Å²	90.5	52%	0.524	50%	0.503	S	S	.	.	H	α-helix	trans	-60.5	-43.8	174	-177.1	0	0	0	0	111.9	A76 K77 S83 G84	A76-S80 PolarHBondContact O-N 2.96Å; K77-S80 WeakPolarHBondContact O-CA 3.43Å; K77-S80 WeakPolarHBondContact O-CB 3.44Å; K77-S80 PolarHBondContact O-N 3.46Å; S80-S83 PolarHBondContact O-N 3.01Å; S80-G84 PolarHBondContact O-N 3.05Å
81	D	98.6	Very high	98.6	Very high	94 Å²	94	93.7 Å²	93.7	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-65.2	-41.3	177.6	-71.6	-19.6	0	0	0	111.8	K77 D78 H79 G84 T85	K77-D81 PolarHBondContact O-N 2.95Å; D78-D81 PolarHBondContact O-N 3.41Å; H79-D81 PolarHBondContact O-N 2.8Å; D81-G84 PolarHBondContact O-N 3.23Å; D81-T85 PolarHBondContact O-N 2.92Å; D81-T85 PolarHBondContact O-OG1 2.98Å
82	T	98.8	Very high	98.6	Very high	85 Å²	85	95.9 Å²	95.9	52%	0.521	51%	0.513	S	S	.	.	H	α-helix	trans	-63.8	-47.7	174.9	-57.4	0	0	0	0	110.9	D78 H79 G84 T85 V86	D78-T82 WeakPolarHBondContact O-CB 3.38Å; D78-T82 PolarHBondContact O-N 2.91Å; D78-T82 PolarHBondContact O-OG1 2.88Å; H79-T82 PolarHBondContact O-N 3.25Å; T82-G84 VanDerWaalsContact C-N 3.31Å; T82-G84 PolarHBondContact O-N 3.37Å; T82-T85 WeakPolarHBondContact O-CA 3.37Å; T82-T85 WeakPolarHBondContact O-CB 3.37Å; T82-T85 PolarHBondContact O-N 3.33Å; T82-V86 WeakPolarHBondContact O-CG2 3.24Å; T82-V86 PolarHBondContact O-N 3.27Å
83	S	98.6	Very high	98.6	Very high	65 Å²	65	95.8 Å²	95.8	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-57.2	-43.6	175.9	-175.7	0	0	0	0	111.6	H79 S80 T85 V86 E87	H79-S83 VanDerWaalsContact O-CB 3.27Å; H79-S83 WeakPolarHBondContact O-CB 3.49Å; H79-S83 PolarHBondContact O-N 3.37Å; S80-S83 PolarHBondContact O-N 3.01Å; S83-T85 VanDerWaalsContact C-N 3.28Å; S83-T85 PolarHBondContact O-N 3.38Å; S83-V86 PolarHBondContact O-N 3.48Å; S83-E87 PolarHBondContact O-N 2.98Å
84	G	98.6	Very high	98.6	Very high	33 Å²	33	96.7 Å²	96.7	34%	0.34	51%	0.507	S	S	.	.	H	α-helix	trans	-62.9	-33.3	174.9	0	0	0	0	0	113.4	S80 D81 T82 K88	S80-G84 PolarHBondContact O-N 3.05Å; D81-G84 PolarHBondContact O-N 3.23Å; T82-G84 VanDerWaalsContact C-N 3.31Å; T82-G84 PolarHBondContact O-N 3.37Å; G84-K88 WeakPolarHBondContact O-CG 3.48Å; G84-K88 PolarHBondContact O-N 3.42Å
85	T	98.6	Very high	98.6	Very high	79 Å²	79	97.4 Å²	97.4	49%	0.485	51%	0.51	S	S	.	.	H	α-helix	trans	-71.9	-40.9	174.6	-57.3	0	0	0	0	111.7	D81 T82 S83 K88 L89	D81-T85 PolarHBondContact O-N 2.92Å; D81-T85 PolarHBondContact O-OG1 2.98Å; T82-T85 WeakPolarHBondContact O-CA 3.37Å; T82-T85 WeakPolarHBondContact O-CB 3.37Å; T82-T85 PolarHBondContact O-N 3.33Å; S83-T85 VanDerWaalsContact C-N 3.28Å; S83-T85 PolarHBondContact O-N 3.38Å; T85-K88 PolarHBondContact O-N 3.36Å; T85-L89 HydrophobicContact CG2-CD1 4.36Å; T85-L89 PolarHBondContact O-N 3.5Å
86	V	98.8	Very high	98.6	Very high	73 Å²	73	95.8 Å²	95.8	44%	0.442	51%	0.505	S	S	.	.	H	α-helix	trans	-61.6	-44.1	174.4	172.5	0	0	0	0	110.8	T82 S83 K88 L89 L90	T82-V86 WeakPolarHBondContact O-CG2 3.24Å; T82-V86 PolarHBondContact O-N 3.27Å; S83-V86 PolarHBondContact O-N 3.48Å; V86-K88 VanDerWaalsContact C-N 3.35Å; V86-K88 PolarHBondContact O-N 3.12Å; V86-L89 CarbonylContact O-C 3.58Å; V86-L89 WeakPolarHBondContact O-CA 3.28Å; V86-L89 WeakPolarHBondContact O-CB 3.33Å; V86-L89 PolarHBondContact O-N 2.82Å; V86-L89 VanDerWaalsContact O-N 3.09Å; V86-L90 HydrophobicContact CG1-CD1 4.26Å; V86-L90 HydrophobicContact CG1-CG 4.37Å; V86-L90 WeakPolarHBondContact O-CG 3.27Å; V86-L90 PolarHBondContact O-N 3.35Å
87	E	98.6	Very high	98.6	Very high	81 Å²	81	95.7 Å²	95.7	38%	0.379	50%	0.501	S	S	.	.	H	α-helix	trans	-59.7	-44.5	176.6	179.9	53.3	-142.6	0	0	111.6	S83 L89 L90 Q91 R94	S83-E87 PolarHBondContact O-N 2.98Å; E87-L89 VanDerWaalsContact C-N 3.3Å; E87-L89 PolarHBondContact O-N 3.42Å; E87-L90 PolarHBondContact O-N 3.43Å; E87-Q91 WeakPolarHBondContact O-CG 3.39Å; E87-Q91 PolarHBondContact O-N 2.99Å; E87-Q91 PolarHBondContact OE1-NE2 2.9Å; E87-R94 IonicContact OE1-NH1 2.7Å
88	K	98.6	Very high	98.5	Very high	135 Å²	135	91.6 Å²	91.6	59%	0.587	49%	0.493	S	S	*	.	H	α-helix	trans	-61.1	-38.8	174.4	-71	171	-173.4	171.2	0	112.1	G84 T85 V86 K92	G84-K88 WeakPolarHBondContact O-CG 3.48Å; G84-K88 PolarHBondContact O-N 3.42Å; T85-K88 PolarHBondContact O-N 3.36Å; V86-K88 VanDerWaalsContact C-N 3.35Å; V86-K88 PolarHBondContact O-N 3.12Å; K88-K92 WeakPolarHBondContact O-CG 3.38Å; K88-K92 PolarHBondContact O-N 2.92Å
89	L	98.7	Very high	98.5	Very high	99 Å²	99	91.9 Å²	91.9	52%	0.518	50%	0.495	S	S	.	.	H	α-helix	trans	-64.9	-45.4	175.1	-85.8	161	0	0	0	111.2	T85 V86 E87 Q91 K92 T93	T85-L89 HydrophobicContact CG2-CD1 4.36Å; T85-L89 PolarHBondContact O-N 3.5Å; V86-L89 CarbonylContact O-C 3.58Å; V86-L89 WeakPolarHBondContact O-CA 3.28Å; V86-L89 WeakPolarHBondContact O-CB 3.33Å; V86-L89 PolarHBondContact O-N 2.82Å; V86-L89 VanDerWaalsContact O-N 3.09Å; E87-L89 VanDerWaalsContact C-N 3.3Å; E87-L89 PolarHBondContact O-N 3.42Å; L89-Q91 VanDerWaalsContact C-N 3.31Å; L89-Q91 PolarHBondContact O-N 2.81Å; L89-K92 CarbonylContact O-C 3.58Å; L89-K92 WeakPolarHBondContact O-CB 3.42Å; L89-K92 PolarHBondContact O-N 2.95Å; L89-K92 VanDerWaalsContact O-N 3.12Å; L89-T93 PolarHBondContact O-N 2.97Å; L89-T93 PolarHBondContact O-OG1 2.97Å; L89-T93 VanDerWaalsContact O-OG1 3.04Å
90	L	98.6	Very high	98.5	Very high	78 Å²	78	90.1 Å²	90.1	41%	0.408	49%	0.492	S	S	.	.	H	α-helix	trans	-58.7	-42.7	176.2	-71.2	176.1	0	0	0	111.6	V86 E87 T93 R94	V86-L90 HydrophobicContact CG1-CD1 4.26Å; V86-L90 HydrophobicContact CG1-CG 4.37Å; V86-L90 WeakPolarHBondContact O-CG 3.27Å; V86-L90 PolarHBondContact O-N 3.35Å; E87-L90 PolarHBondContact O-N 3.43Å; L90-T93 PolarHBondContact O-N 3.41Å; L90-R94 WeakPolarHBondContact O-CG 3.39Å; L90-R94 PolarHBondContact O-N 3.07Å
91	Q	98.4	Very high	98.5	Very high	106 Å²	106	93.3 Å²	93.3	50%	0.495	50%	0.497	S	S	.	.	H	α-helix	trans	-62.5	-43.2	174.6	-69.2	176.8	7.2	0	0	112.4	E87 L89 R94 K95	E87-Q91 WeakPolarHBondContact O-CG 3.39Å; E87-Q91 PolarHBondContact O-N 2.99Å; E87-Q91 PolarHBondContact OE1-NE2 2.9Å; L89-Q91 VanDerWaalsContact C-N 3.31Å; L89-Q91 PolarHBondContact O-N 2.81Å; Q91-R94 PolarHBondContact O-N 3.21Å; Q91-K95 PolarHBondContact O-N 3.14Å
92	K	98.4	Very high	98.5	Very high	142 Å²	142	93.2 Å²	93.2	62%	0.617	49%	0.494	S	S	*	.	H	α-helix	trans	-62.6	-41.6	174.2	-74.4	177.8	179.9	-177.9	0	111.6	K88 L89 K95 V96	K88-K92 WeakPolarHBondContact O-CG 3.38Å; K88-K92 PolarHBondContact O-N 2.92Å; L89-K92 CarbonylContact O-C 3.58Å; L89-K92 WeakPolarHBondContact O-CB 3.42Å; L89-K92 PolarHBondContact O-N 2.95Å; L89-K92 VanDerWaalsContact O-N 3.12Å; K92-K95 PolarHBondContact O-N 3.36Å; K92-V96 WeakPolarHBondContact O-CB 3.33Å; K92-V96 VanDerWaalsContact O-CG2 3.31Å; K92-V96 WeakPolarHBondContact O-CG2 3.46Å; K92-V96 PolarHBondContact O-N 2.91Å
93	T	98.5	Very high	98.5	Very high	88 Å²	88	93.1 Å²	93.1	54%	0.54	49%	0.493	S	S	.	.	H	α-helix	trans	-62	-44.8	176.3	-61.1	0	0	0	0	111.3	L89 L90 K95 V96 S97	L89-T93 PolarHBondContact O-N 2.97Å; L89-T93 PolarHBondContact O-OG1 2.97Å; L89-T93 VanDerWaalsContact O-OG1 3.04Å; L90-T93 PolarHBondContact O-N 3.41Å; T93-K95 VanDerWaalsContact C-N 3.33Å; T93-K95 PolarHBondContact O-N 3Å; T93-V96 PolarHBondContact O-N 2.7Å; T93-S97 WeakPolarHBondContact O-CB 3.25Å; T93-S97 PolarHBondContact O-N 3.06Å
94	R	98.3	Very high	98.5	Very high	148 Å²	148	99.3 Å²	99.3	56%	0.558	51%	0.506	S	S	*	.	H	α-helix	trans	-59	-44	173.6	-69.4	178.2	-164.3	121.3	0.5	111.3	E87 L90 Q91 S97 A98	E87-R94 IonicContact OE1-NH1 2.7Å; L90-R94 WeakPolarHBondContact O-CG 3.39Å; L90-R94 PolarHBondContact O-N 3.07Å; Q91-R94 PolarHBondContact O-N 3.21Å; R94-S97 WeakPolarHBondContact O-CB 3.36Å; R94-S97 PolarHBondContact O-N 3.27Å; R94-A98 PolarHBondContact O-N 3.1Å
95	K	98.3	Very high	98.4	Very high	145 Å²	145	101.4 Å²	101.4	63%	0.63	51%	0.512	S	S	*	.	H	α-helix	trans	-64.6	-45.7	177.7	-173.3	174.1	-176.4	174.2	0	112.5	Q91 K92 T93 S97 A98 N99	Q91-K95 PolarHBondContact O-N 3.14Å; K92-K95 PolarHBondContact O-N 3.36Å; T93-K95 VanDerWaalsContact C-N 3.33Å; T93-K95 PolarHBondContact O-N 3Å; K95-S97 VanDerWaalsContact C-N 3.32Å; K95-S97 PolarHBondContact O-N 3.4Å; K95-A98 PolarHBondContact O-N 3.16Å; K95-N99 VanDerWaalsContact O-CG 3.28Å; K95-N99 PolarHBondContact O-N 3.23Å; K95-N99 PolarHBondContact O-OD1 2.82Å
96	V	98.7	Very high	98.4	Very high	85 Å²	85	104.8 Å²	104.8	52%	0.515	52%	0.516	S	S	.	.	H	α-helix	trans	-62.3	-42.2	176.2	171.3	0	0	0	0	110.2	K92 T93 A98 N99 V100	K92-V96 WeakPolarHBondContact O-CB 3.33Å; K92-V96 VanDerWaalsContact O-CG2 3.31Å; K92-V96 WeakPolarHBondContact O-CG2 3.46Å; K92-V96 PolarHBondContact O-N 2.91Å; T93-V96 PolarHBondContact O-N 2.7Å; V96-A98 VanDerWaalsContact C-N 3.34Å; V96-A98 PolarHBondContact O-N 3.41Å; V96-N99 PolarHBondContact O-N 2.86Å; V96-V100 HydrophobicContact CG1-CG2 4.26Å; V96-V100 VanDerWaalsContact O-CG2 3.31Å; V96-V100 WeakPolarHBondContact O-CG2 3.42Å; V96-V100 PolarHBondContact O-N 3.35Å
97	S	98.1	Very high	98.4	Very high	58 Å²	58	105.1 Å²	105.1	41%	0.406	52%	0.518	S	S	.	.	H	α-helix	trans	-58	-45	175.1	-175.5	0	0	0	0	112	T93 R94 K95 V100 K101	T93-S97 WeakPolarHBondContact O-CB 3.25Å; T93-S97 PolarHBondContact O-N 3.06Å; R94-S97 WeakPolarHBondContact O-CB 3.36Å; R94-S97 PolarHBondContact O-N 3.27Å; K95-S97 VanDerWaalsContact C-N 3.32Å; K95-S97 PolarHBondContact O-N 3.4Å; S97-V100 PolarHBondContact O-N 3.35Å; S97-K101 WeakPolarHBondContact O-CG 3.34Å; S97-K101 PolarHBondContact O-N 3.37Å
98	A	98.3	Very high	98.4	Very high	54 Å²	54	106.2 Å²	106.2	45%	0.446	52%	0.523	S	S	.	.	H	α-helix	trans	-61.3	-45.8	175.4	0	0	0	0	0	112	R94 K95 V96 V100 K101 E102	R94-A98 PolarHBondContact O-N 3.1Å; K95-A98 PolarHBondContact O-N 3.16Å; V96-A98 VanDerWaalsContact C-N 3.34Å; V96-A98 PolarHBondContact O-N 3.41Å; A98-V100 VanDerWaalsContact C-N 3.34Å; A98-V100 PolarHBondContact O-N 2.91Å; A98-K101 PolarHBondContact O-N 3.31Å; A98-E102 PolarHBondContact O-N 3.42Å
99	N	98.4	Very high	98.3	Very high	78 Å²	78	106.3 Å²	106.3	42%	0.417	52%	0.524	S	S	.	.	H	α-helix	trans	-61.5	-41	177.5	-67.5	-3	0	0	0	112	K95 V96 E102 V103	K95-N99 VanDerWaalsContact O-CG 3.28Å; K95-N99 PolarHBondContact O-N 3.23Å; K95-N99 PolarHBondContact O-OD1 2.82Å; V96-N99 PolarHBondContact O-N 2.86Å; N99-E102 PolarHBondContact O-N 3.39Å; N99-V103 VanDerWaalsContact O-CG2 3.32Å; N99-V103 WeakPolarHBondContact O-CG2 3.41Å; N99-V103 PolarHBondContact O-N 2.84Å
100	V	98.5	Very high	98.3	Very high	91 Å²	91	106.7 Å²	106.7	55%	0.552	52%	0.523	S	S	*	.	H	α-helix	trans	-64.2	-41.8	176.9	170.7	0	0	0	0	110.9	V96 S97 A98 E102 V103 R104	V96-V100 HydrophobicContact CG1-CG2 4.26Å; V96-V100 VanDerWaalsContact O-CG2 3.31Å; V96-V100 WeakPolarHBondContact O-CG2 3.42Å; V96-V100 PolarHBondContact O-N 3.35Å; S97-V100 PolarHBondContact O-N 3.35Å; A98-V100 VanDerWaalsContact C-N 3.34Å; A98-V100 PolarHBondContact O-N 2.91Å; V100-E102 VanDerWaalsContact C-N 3.32Å; V100-E102 PolarHBondContact O-N 3.19Å; V100-V103 PolarHBondContact O-N 2.91Å; V100-R104 WeakPolarHBondContact O-CB 3.28Å; V100-R104 PolarHBondContact O-N 2.89Å
101	K	98.3	Very high	98.2	Very high	142 Å²	142	105.9 Å²	105.9	62%	0.617	52%	0.519	S	S	*	.	H	α-helix	trans	-61.5	-40.5	174.4	-72.1	177.7	-178.8	-176.4	0	111.9	S97 A98 T105	S97-K101 WeakPolarHBondContact O-CG 3.34Å; S97-K101 PolarHBondContact O-N 3.37Å; A98-K101 PolarHBondContact O-N 3.31Å; K101-T105 PolarHBondContact O-N 3Å; K101-T105 PolarHBondContact O-OG1 3.01Å
102	E	98.2	Very high	98.2	Very high	93 Å²	93	105 Å²	105	44%	0.435	52%	0.521	S	S	.	.	H	α-helix	trans	-65.2	-47.6	176	-175.1	-179.1	-174.2	0	0	111.7	A98 N99 V100 R104 T105 R106	A98-E102 PolarHBondContact O-N 3.42Å; N99-E102 PolarHBondContact O-N 3.39Å; V100-E102 VanDerWaalsContact C-N 3.32Å; V100-E102 PolarHBondContact O-N 3.19Å; E102-R104 VanDerWaalsContact C-N 3.34Å; E102-R104 PolarHBondContact O-N 3.11Å; E102-T105 WeakPolarHBondContact O-CB 3.27Å; E102-T105 PolarHBondContact O-N 3.41Å; E102-T105 VanDerWaalsContact O-N 3.17Å; E102-R106 WeakPolarHBondContact O-CG 3.49Å; E102-R106 PolarHBondContact O-N 3.08Å; E102-R106 IonicContact OE1-CZ 2.63Å; E102-R106 VanDerWaalsContact OE1-CZ 3.24Å; E102-R106 IonicContact OE1-NE 3.7Å; E102-R106 PolarHBondContact OE1-NE 2.86Å; E102-R106 IonicContact OE1-NH2 3.37Å; E102-R106 PolarHBondContact OE1-NH2 3.06Å
103	V	98.7	Very high	98.1	Very high	83 Å²	83	105.8 Å²	105.8	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-59.1	-46.4	176.9	170.9	0	0	0	0	110.5	N99 V100 T105 R106 V107	N99-V103 VanDerWaalsContact O-CG2 3.32Å; N99-V103 WeakPolarHBondContact O-CG2 3.41Å; N99-V103 PolarHBondContact O-N 2.84Å; V100-V103 PolarHBondContact O-N 2.91Å; V103-T105 VanDerWaalsContact C-N 3.3Å; V103-T105 PolarHBondContact O-N 2.77Å; V103-R106 PolarHBondContact O-N 3.42Å; V103-R106 VanDerWaalsContact O-N 3.08Å; V103-V107 HydrophobicContact CG1-CG2 4.28Å; V103-V107 WeakPolarHBondContact O-CG2 3.3Å; V103-V107 PolarHBondContact O-N 3.31Å
104	R	98.3	Very high	98	Very high	195 Å²	195	105 Å²	105	74%	0.736	52%	0.515	S	S	*	.	H	α-helix	trans	-55.2	-45.6	175	-173.9	-179.3	-175.9	-176.8	2.5	111.7	V100 E102 R106 V107 E108	V100-R104 WeakPolarHBondContact O-CB 3.28Å; V100-R104 PolarHBondContact O-N 2.89Å; E102-R104 VanDerWaalsContact C-N 3.34Å; E102-R104 PolarHBondContact O-N 3.11Å; R104-R106 VanDerWaalsContact C-N 3.33Å; R104-R106 PolarHBondContact O-N 3.29Å; R104-V107 PolarHBondContact O-N 3.45Å; R104-E108 PolarHBondContact O-N 2.85Å
105	T	98.3	Very high	97.9	Very high	76 Å²	76	103.3 Å²	103.3	47%	0.466	51%	0.511	S	S	.	.	H	α-helix	trans	-62.2	-39.3	177.6	-54.9	0	0	0	0	112	K101 E102 V103 K109	K101-T105 PolarHBondContact O-N 3Å; K101-T105 PolarHBondContact O-OG1 3.01Å; E102-T105 WeakPolarHBondContact O-CB 3.27Å; E102-T105 PolarHBondContact O-N 3.41Å; E102-T105 VanDerWaalsContact O-N 3.17Å; V103-T105 VanDerWaalsContact C-N 3.3Å; V103-T105 PolarHBondContact O-N 2.77Å; T105-K109 WeakPolarHBondContact O-CG 3.27Å; T105-K109 PolarHBondContact O-N 2.95Å; T105-K109 VanDerWaalsContact O-N 3.13Å
106	R	98.2	Very high	97.9	Very high	151 Å²	151	103.7 Å²	103.7	57%	0.57	51%	0.513	S	S	*	.	H	α-helix	trans	-68.3	-41.1	176.9	-69.2	175.1	-179.6	-171.9	-0.9	112	E102 V103 R104 K109 Q110	E102-R106 WeakPolarHBondContact O-CG 3.49Å; E102-R106 PolarHBondContact O-N 3.08Å; E102-R106 IonicContact OE1-CZ 2.63Å; E102-R106 VanDerWaalsContact OE1-CZ 3.24Å; E102-R106 IonicContact OE1-NE 3.7Å; E102-R106 PolarHBondContact OE1-NE 2.86Å; E102-R106 IonicContact OE1-NH2 3.37Å; E102-R106 PolarHBondContact OE1-NH2 3.06Å; V103-R106 PolarHBondContact O-N 3.42Å; V103-R106 VanDerWaalsContact O-N 3.08Å; R104-R106 VanDerWaalsContact C-N 3.33Å; R104-R106 PolarHBondContact O-N 3.29Å; R106-K109 PolarHBondContact O-N 3.37Å; R106-Q110 PolarHBondContact O-N 3.29Å
107	V	98.3	Very high	97.7	Very high	80 Å²	80	104.2 Å²	104.2	49%	0.485	52%	0.516	S	S	.	.	H	α-helix	trans	-62.8	-43.9	175.5	171.3	0	0	0	0	110.3	V103 R104 K109 Q110 N111	V103-V107 HydrophobicContact CG1-CG2 4.28Å; V103-V107 WeakPolarHBondContact O-CG2 3.3Å; V103-V107 PolarHBondContact O-N 3.31Å; R104-V107 PolarHBondContact O-N 3.45Å; V107-K109 VanDerWaalsContact C-N 3.34Å; V107-K109 PolarHBondContact O-N 3.47Å; V107-Q110 CarbonylContact O-C 3.59Å; V107-Q110 WeakPolarHBondContact O-CA 3.47Å; V107-Q110 WeakPolarHBondContact O-CB 3.41Å; V107-Q110 PolarHBondContact O-N 3.41Å; V107-Q110 VanDerWaalsContact O-N 3.07Å; V107-N111 WeakPolarHBondContact O-CB 3.31Å; V107-N111 PolarHBondContact O-N 3.08Å
108	E	97.7	Very high	97.6	Very high	104 Å²	104	106.1 Å²	106.1	49%	0.486	52%	0.519	S	S	.	.	H	α-helix	trans	-61.3	-42.2	177.1	-166.5	57.1	-138.1	0	0	111.9	R104 Q110 N111 V112	R104-E108 PolarHBondContact O-N 2.85Å; E108-Q110 VanDerWaalsContact C-N 3.32Å; E108-Q110 PolarHBondContact O-N 3.47Å; E108-N111 WeakPolarHBondContact O-CB 3.26Å; E108-N111 PolarHBondContact O-N 3.01Å; E108-V112 WeakPolarHBondContact O-CG2 3.19Å; E108-V112 PolarHBondContact O-N 3.39Å
109	K	97.8	Very high	97.4	Very high	137 Å²	137	107.1 Å²	107.1	60%	0.596	52%	0.519	S	S	*	.	H	α-helix	trans	-62.8	-36.7	173.4	-72.1	177.1	-178.7	-178	0	112.7	T105 R106 V107 R113	T105-K109 WeakPolarHBondContact O-CG 3.27Å; T105-K109 PolarHBondContact O-N 2.95Å; T105-K109 VanDerWaalsContact O-N 3.13Å; R106-K109 PolarHBondContact O-N 3.37Å; V107-K109 VanDerWaalsContact C-N 3.34Å; V107-K109 PolarHBondContact O-N 3.47Å; K109-R113 WeakPolarHBondContact O-CG 3.47Å; K109-R113 PolarHBondContact O-N 2.83Å
110	Q	97.6	Very high	97	Very high	107 Å²	107	106.8 Å²	106.8	50%	0.5	52%	0.52	S	S	.	.	H	α-helix	trans	-66.5	-44.8	173.5	-80.5	176.3	-15.2	0	0	111.2	R106 V107 E108 V112 R113 V114	R106-Q110 PolarHBondContact O-N 3.29Å; V107-Q110 CarbonylContact O-C 3.59Å; V107-Q110 WeakPolarHBondContact O-CA 3.47Å; V107-Q110 WeakPolarHBondContact O-CB 3.41Å; V107-Q110 PolarHBondContact O-N 3.41Å; V107-Q110 VanDerWaalsContact O-N 3.07Å; E108-Q110 VanDerWaalsContact C-N 3.32Å; E108-Q110 PolarHBondContact O-N 3.47Å; Q110-V112 VanDerWaalsContact C-N 3.33Å; Q110-V112 PolarHBondContact O-N 3.45Å; Q110-R113 WeakPolarHBondContact O-CB 3.37Å; Q110-R113 PolarHBondContact O-N 2.88Å; Q110-V114 WeakPolarHBondContact O-CG2 3.46Å; Q110-V114 PolarHBondContact O-N 2.97Å
111	N	97.4	Very high	96.6	Very high	61 Å²	61	107.4 Å²	107.4	33%	0.326	52%	0.517	S	S	.	.	H	α-helix	trans	-55.3	-46.9	177.2	-170.1	18.4	0	0	0	111.5	V107 E108 R113 V114 K115	V107-N111 WeakPolarHBondContact O-CB 3.31Å; V107-N111 PolarHBondContact O-N 3.08Å; E108-N111 WeakPolarHBondContact O-CB 3.26Å; E108-N111 PolarHBondContact O-N 3.01Å; N111-R113 VanDerWaalsContact C-N 3.33Å; N111-R113 PolarHBondContact O-N 2.88Å; N111-V114 PolarHBondContact O-N 3.21Å; N111-K115 WeakPolarHBondContact O-CB 3.36Å; N111-K115 WeakPolarHBondContact O-CG 3.33Å; N111-K115 PolarHBondContact O-N 2.91Å
112	V	97.3	Very high	96.2	Very high	88 Å²	88	105.1 Å²	105.1	53%	0.533	51%	0.512	S	S	.	.	H	α-helix	trans	-60.6	-40.6	175.5	174.3	0	0	0	0	112.2	E108 Q110 K116	E108-V112 WeakPolarHBondContact O-CG2 3.19Å; E108-V112 PolarHBondContact O-N 3.39Å; Q110-V112 VanDerWaalsContact C-N 3.33Å; Q110-V112 PolarHBondContact O-N 3.45Å; V112-K116 WeakPolarHBondContact O-CB 3.46Å; V112-K116 PolarHBondContact O-N 3.47Å
113	R	96.1	Very high	95.7	Very high	157 Å²	157	104.9 Å²	104.9	59%	0.592	51%	0.511	S	S	*	.	H	α-helix	trans	-67.2	-40.9	177	-72.5	-174.3	-65.6	-179.4	0.1	112.2	K109 Q110 N111 K116 V117	K109-R113 WeakPolarHBondContact O-CG 3.47Å; K109-R113 PolarHBondContact O-N 2.83Å; Q110-R113 WeakPolarHBondContact O-CB 3.37Å; Q110-R113 PolarHBondContact O-N 2.88Å; N111-R113 VanDerWaalsContact C-N 3.33Å; N111-R113 PolarHBondContact O-N 2.88Å; R113-K116 PolarHBondContact O-N 3.39Å; R113-V117 WeakPolarHBondContact O-CG2 3.47Å; R113-V117 PolarHBondContact O-N 3.42Å
114	V	97.3	Very high	95.1	Very high	73 Å²	73	104.2 Å²	104.2	44%	0.442	50%	0.504	S	S	.	.	H	α-helix	trans	-62.8	-51.1	176.1	171.6	0	0	0	0	109.7	Q110 N111 K116 V117 E118	Q110-V114 WeakPolarHBondContact O-CG2 3.46Å; Q110-V114 PolarHBondContact O-N 2.97Å; N111-V114 PolarHBondContact O-N 3.21Å; V114-K116 PolarHBondContact O-N 2.85Å; V114-V117 WeakPolarHBondContact O-CA 3.43Å; V114-V117 WeakPolarHBondContact O-CB 3.35Å; V114-V117 PolarHBondContact O-N 2.81Å; V114-E118 HydrophobicContact CG1-CG 4.22Å; V114-E118 WeakPolarHBondContact CG1-OE1 3.47Å; V114-E118 WeakPolarHBondContact O-CG 3.44Å; V114-E118 PolarHBondContact O-N 3.44Å
115	K	97.1	Very high	94.3	Very high	111 Å²	111	99.3 Å²	99.3	48%	0.483	49%	0.492	S	S	.	.	H	α-helix	trans	-54.4	-39.4	175.2	-75.3	-177.8	177.4	-176.7	0	113	N111 V117 E118 T119	N111-K115 WeakPolarHBondContact O-CB 3.36Å; N111-K115 WeakPolarHBondContact O-CG 3.33Å; N111-K115 PolarHBondContact O-N 2.91Å; K115-V117 VanDerWaalsContact C-N 3.35Å; K115-V117 PolarHBondContact O-N 2.91Å; K115-E118 PolarHBondContact O-N 2.8Å; K115-T119 WeakPolarHBondContact O-CB 3.45Å; K115-T119 PolarHBondContact O-N 3.32Å; K115-T119 PolarHBondContact O-OG1 3.47Å
116	K	96.8	Very high	93.7	Very high	154 Å²	154	100.8 Å²	100.8	67%	0.67	50%	0.501	S	S	*	.	H	α-helix	trans	-62.6	-40.6	175.7	-172.9	176.1	-177.8	177	0	112.2	V112 R113 V114 T120	V112-K116 WeakPolarHBondContact O-CB 3.46Å; V112-K116 PolarHBondContact O-N 3.47Å; R113-K116 PolarHBondContact O-N 3.39Å; V114-K116 PolarHBondContact O-N 2.85Å; K116-T120 WeakPolarHBondContact O-CB 3.27Å; K116-T120 PolarHBondContact O-N 3.43Å; K116-T120 VanDerWaalsContact O-N 3.1Å; K116-T120 PolarHBondContact O-OG1 2.77Å
117	V	95.7	Very high	92.9	Very high	96 Å²	96	100.7 Å²	100.7	58%	0.582	50%	0.501	S	S	*	.	H	α-helix	trans	-68.4	-44.9	175.8	175	0	0	0	0	110.5	R113 V114 K115 T119 T120 Q121	R113-V117 WeakPolarHBondContact O-CG2 3.47Å; R113-V117 PolarHBondContact O-N 3.42Å; V114-V117 WeakPolarHBondContact O-CA 3.43Å; V114-V117 WeakPolarHBondContact O-CB 3.35Å; V114-V117 PolarHBondContact O-N 2.81Å; K115-V117 VanDerWaalsContact C-N 3.35Å; K115-V117 PolarHBondContact O-N 2.91Å; V117-T119 PolarHBondContact O-N 3.43Å; V117-T120 WeakPolarHBondContact O-CB 3.23Å; V117-T120 PolarHBondContact O-N 2.98Å; V117-T120 VanDerWaalsContact O-N 3.17Å; V117-Q121 WeakPolarHBondContact O-CB 3.45Å; V117-Q121 PolarHBondContact O-N 2.88Å
118	E	94.4	Very high	91.4	Very high	97 Å²	97	104.1 Å²	104.1	45%	0.453	52%	0.516	S	S	.	.	H	α-helix	trans	-58.2	-47.7	176.3	-68.9	171.3	161.9	0	0	111.4	V114 K115 T120 Q121 D122	V114-E118 HydrophobicContact CG1-CG 4.22Å; V114-E118 WeakPolarHBondContact CG1-OE1 3.47Å; V114-E118 WeakPolarHBondContact O-CG 3.44Å; V114-E118 PolarHBondContact O-N 3.44Å; K115-E118 PolarHBondContact O-N 2.8Å; E118-T120 VanDerWaalsContact C-N 3.3Å; E118-T120 PolarHBondContact O-N 2.99Å; E118-Q121 WeakPolarHBondContact O-CB 3.28Å; E118-Q121 PolarHBondContact O-N 3.23Å; E118-Q121 VanDerWaalsContact O-N 3.16Å; E118-D122 PolarHBondContact O-N 2.83Å
119	T	94.1	Very high	89.8	Confident	75 Å²	75	106.4 Å²	106.4	46%	0.46	52%	0.524	S	S	.	.	H	α-helix	trans	-61.7	-39.9	176.9	-53	0	0	0	0	111.4	K115 V117 D122 E123	K115-T119 WeakPolarHBondContact O-CB 3.45Å; K115-T119 PolarHBondContact O-N 3.32Å; K115-T119 PolarHBondContact O-OG1 3.47Å; V117-T119 PolarHBondContact O-N 3.43Å; T119-D122 PolarHBondContact O-N 3.13Å; T119-E123 WeakPolarHBondContact O-CB 3.48Å; T119-E123 WeakPolarHBondContact O-CG 3.5Å; T119-E123 PolarHBondContact O-N 2.8Å
120	T	90.9	Very high	87.9	Confident	71 Å²	71	104.5 Å²	104.5	44%	0.436	52%	0.516	S	S	.	.	H	α-helix	trans	-65.6	-40.9	177.1	-53.6	0	0	0	0	111.1	K116 V117 E118 E123 L124	K116-T120 WeakPolarHBondContact O-CB 3.27Å; K116-T120 PolarHBondContact O-N 3.43Å; K116-T120 VanDerWaalsContact O-N 3.1Å; K116-T120 PolarHBondContact O-OG1 2.77Å; V117-T120 WeakPolarHBondContact O-CB 3.23Å; V117-T120 PolarHBondContact O-N 2.98Å; V117-T120 VanDerWaalsContact O-N 3.17Å; E118-T120 VanDerWaalsContact C-N 3.3Å; E118-T120 PolarHBondContact O-N 2.99Å; T120-E123 PolarHBondContact O-N 3.3Å; T120-L124 HydrophobicContact CG2-CD1 4.16Å; T120-L124 VanDerWaalsContact O-CG 3.25Å; T120-L124 WeakPolarHBondContact O-CG 3.42Å; T120-L124 PolarHBondContact O-N 3.44Å; T120-L124 VanDerWaalsContact O-N 3.08Å
121	Q	89.4	Confident	86.3	Confident	104 Å²	104	108.6 Å²	108.6	49%	0.486	53%	0.527	S	S	.	.	H	α-helix	trans	-62.5	-48.3	175.4	177.1	179.9	-24.6	0	0	111	V117 E118 E123 L124 L125	V117-Q121 WeakPolarHBondContact O-CB 3.45Å; V117-Q121 PolarHBondContact O-N 2.88Å; E118-Q121 WeakPolarHBondContact O-CB 3.28Å; E118-Q121 PolarHBondContact O-N 3.23Å; E118-Q121 VanDerWaalsContact O-N 3.16Å; Q121-E123 VanDerWaalsContact C-N 3.34Å; Q121-E123 PolarHBondContact O-N 3.43Å; Q121-L124 PolarHBondContact O-N 3.26Å; Q121-L125 HydrophobicContact CG-CD1 3.97Å; Q121-L125 HydrophobicContact CG-CG 4.44Å; Q121-L125 WeakPolarHBondContact O-CG 3.17Å; Q121-L125 PolarHBondContact O-N 3.18Å
122	D	90.1	Very high	84.9	Confident	94 Å²	94	110.6 Å²	110.6	50%	0.503	54%	0.541	S	S	.	.	H	α-helix	trans	-60.5	-41.7	177.6	-75	-13.4	0	0	0	111.9	E118 T119 L124 L125 T126	E118-D122 PolarHBondContact O-N 2.83Å; T119-D122 PolarHBondContact O-N 3.13Å; D122-L124 VanDerWaalsContact C-N 3.33Å; D122-L124 PolarHBondContact O-N 3.45Å; D122-L125 PolarHBondContact O-N 3.09Å; D122-T126 WeakPolarHBondContact O-CB 3.17Å; D122-T126 WeakPolarHBondContact O-CG2 3.17Å; D122-T126 PolarHBondContact O-N 2.87Å; D122-T126 PolarHBondContact O-OG1 3.36Å
123	E	88.3	Confident	83.3	Confident	89 Å²	89	109.8 Å²	109.8	42%	0.416	54%	0.536	S	S	.	.	H	α-helix	trans	-62.2	-38.3	175.2	-82.2	-169.3	-145.4	0	0	113.1	T119 T120 Q121 T126 R127	T119-E123 WeakPolarHBondContact O-CB 3.48Å; T119-E123 WeakPolarHBondContact O-CG 3.5Å; T119-E123 PolarHBondContact O-N 2.8Å; T120-E123 PolarHBondContact O-N 3.3Å; Q121-E123 VanDerWaalsContact C-N 3.34Å; Q121-E123 PolarHBondContact O-N 3.43Å; E123-T126 WeakPolarHBondContact CA-OG1 3.1Å; E123-T126 PolarHBondContact O-OG1 2.89Å; E123-R127 WeakPolarHBondContact O-CB 3.31Å; E123-R127 VanDerWaalsContact O-CG 3.3Å; E123-R127 WeakPolarHBondContact O-CG 3.5Å; E123-R127 PolarHBondContact O-N 3.41Å; E123-R127 IonicContact OE2-CZ 3.82Å; E123-R127 IonicContact OE2-NH1 2.75Å; E123-R127 PolarHBondContact OE2-NH1 3.37Å
124	L	86.1	Confident	82.1	Confident	68 Å²	68	108.8 Å²	108.8	36%	0.356	54%	0.541	S	S	.	.	H	α-helix	trans	-76.1	-34	179.2	-69	168.8	0	0	0	111.6	T120 Q121 D122 K129 F130	T120-L124 HydrophobicContact CG2-CD1 4.16Å; T120-L124 VanDerWaalsContact O-CG 3.25Å; T120-L124 WeakPolarHBondContact O-CG 3.42Å; T120-L124 PolarHBondContact O-N 3.44Å; T120-L124 VanDerWaalsContact O-N 3.08Å; Q121-L124 PolarHBondContact O-N 3.26Å; D122-L124 VanDerWaalsContact C-N 3.33Å; D122-L124 PolarHBondContact O-N 3.45Å; L124-K129 PolarHBondContact O-N 2.83Å; L124-F130 VanDerWaalsContact C-CD2 3.42Å; L124-F130 HydrophobicContact CB-CD2 3.78Å; L124-F130 HydrophobicContact CB-CE1 4.13Å; L124-F130 HydrophobicContact CB-CE2 2.96Å; L124-F130 HydrophobicContact CB-CZ 3.17Å; L124-F130 HydrophobicContact CD1-CE1 4.06Å; L124-F130 HydrophobicContact CD1-CE2 4.2Å; L124-F130 HydrophobicContact CD1-CZ 3.45Å; L124-F130 VanDerWaalsContact CD1-CZ 3.45Å; L124-F130 HydrophobicContact CG-CE2 4.17Å; L124-F130 HydrophobicContact CG-CZ 3.91Å; L124-F130 WeakPolarHBondContact O-CD2 3.31Å
125	L	82.3	Confident	79.8	Confident	92 Å²	92	113.2 Å²	113.2	48%	0.482	55%	0.551	S	S	.	*	H	α-helix	trans	-67.5	-49.1	173.8	-73.7	172	0	0	0	111.3	Q121 D122 R127 N128 F130	Q121-L125 HydrophobicContact CG-CD1 3.97Å; Q121-L125 HydrophobicContact CG-CG 4.44Å; Q121-L125 WeakPolarHBondContact O-CG 3.17Å; Q121-L125 PolarHBondContact O-N 3.18Å; D122-L125 PolarHBondContact O-N 3.09Å; L125-R127 VanDerWaalsContact C-N 3.34Å; L125-R127 PolarHBondContact O-N 3.09Å; L125-N128 PolarHBondContact O-N 3.25Å; L125-N128 VanDerWaalsContact O-N 3.17Å; L125-F130 HydrophobicContact CD2-CD2 3.88Å; L125-F130 HydrophobicContact CD2-CE2 4.06Å; L125-F130 HydrophobicContact CG-CD2 4.2Å; L125-F130 HydrophobicContact CG-CE2 3.98Å
126	T	84.9	Confident	77.5	Confident	108 Å²	108	116.2 Å²	116.2	66%	0.663	57%	0.567	S	S	*	*	H	α-helix	trans	-65.8	-32.8	-179.5	48.1	0	0	0	0	113.3	D122 E123 N128	D122-T126 WeakPolarHBondContact O-CB 3.17Å; D122-T126 WeakPolarHBondContact O-CG2 3.17Å; D122-T126 PolarHBondContact O-N 2.87Å; D122-T126 PolarHBondContact O-OG1 3.36Å; E123-T126 WeakPolarHBondContact CA-OG1 3.1Å; E123-T126 PolarHBondContact O-OG1 2.89Å; T126-N128 PolarHBondContact O-N 2.94Å
127	R	81.4	Confident	75.3	Confident	149 Å²	149	111.9 Å²	111.9	56%	0.562	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	6	176.5	-68.2	-172.3	177.3	112.1	-2.5	114.1	E123 L125 K129	E123-R127 WeakPolarHBondContact O-CB 3.31Å; E123-R127 VanDerWaalsContact O-CG 3.3Å; E123-R127 WeakPolarHBondContact O-CG 3.5Å; E123-R127 PolarHBondContact O-N 3.41Å; E123-R127 IonicContact OE2-CZ 3.82Å; E123-R127 IonicContact OE2-NH1 2.75Å; E123-R127 PolarHBondContact OE2-NH1 3.37Å; L125-R127 VanDerWaalsContact C-N 3.34Å; L125-R127 PolarHBondContact O-N 3.09Å; R127-K129 HydrophobicContact CB-CD 4.31Å; R127-K129 HydrophobicContact CB-CG 4.03Å; R127-K129 WeakPolarHBondContact O-CG 3.33Å; R127-K129 PolarHBondContact O-N 3.31Å; R127-K129 VanDerWaalsContact O-N 3.13Å
128	N	66.6	Low	73.4	Confident	152 Å²	152	117.3 Å²	117.3	81%	0.813	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.8	33.6	-178.2	-80.2	-50	0	0	0	113.2	L125 T126 F130	L125-N128 PolarHBondContact O-N 3.25Å; L125-N128 VanDerWaalsContact O-N 3.17Å; T126-N128 PolarHBondContact O-N 2.94Å; N128-F130 VanDerWaalsContact C-N 3.35Å
129	K	63.8	Low	71.4	Confident	152 Å²	152	117.9 Å²	117.9	66%	0.661	60%	0.595	S	S	*	*			trans	-93.6	13.4	-177.8	-66.9	-169.7	179.9	-173	0	113.7	L124 R127	L124-K129 PolarHBondContact O-N 2.83Å; R127-K129 HydrophobicContact CB-CD 4.31Å; R127-K129 HydrophobicContact CB-CG 4.03Å; R127-K129 WeakPolarHBondContact O-CG 3.33Å; R127-K129 PolarHBondContact O-N 3.31Å; R127-K129 VanDerWaalsContact O-N 3.13Å
130	F	58.4	Low	69.5	Low	96 Å²	96	121 Å²	121	42%	0.421	61%	0.605	S	S	.	*			trans	-107.6	114.2	178.1	-73.4	-67.5	0	0	0	111.4	L124 L125 N128 V132	L124-F130 VanDerWaalsContact C-CD2 3.42Å; L124-F130 HydrophobicContact CB-CD2 3.78Å; L124-F130 HydrophobicContact CB-CE1 4.13Å; L124-F130 HydrophobicContact CB-CE2 2.96Å; L124-F130 HydrophobicContact CB-CZ 3.17Å; L124-F130 HydrophobicContact CD1-CE1 4.06Å; L124-F130 HydrophobicContact CD1-CE2 4.2Å; L124-F130 HydrophobicContact CD1-CZ 3.45Å; L124-F130 VanDerWaalsContact CD1-CZ 3.45Å; L124-F130 HydrophobicContact CG-CE2 4.17Å; L124-F130 HydrophobicContact CG-CZ 3.91Å; L124-F130 WeakPolarHBondContact O-CD2 3.31Å; L125-F130 HydrophobicContact CD2-CD2 3.88Å; L125-F130 HydrophobicContact CD2-CE2 4.06Å; L125-F130 HydrophobicContact CG-CD2 4.2Å; L125-F130 HydrophobicContact CG-CE2 3.98Å; N128-F130 VanDerWaalsContact C-N 3.35Å; F130-V132 HydrophobicContact CB-CG2 4.44Å
131	R	63.6	Low	67.4	Low	194 Å²	194	123.3 Å²	123.3	73%	0.732	62%	0.619	S	S	*	*			trans	-98.9	92.9	154.7	-71.2	-177.8	71	-150.9	-0.3	107.1	V133	R131-V133 PolarHBondContact O-N 3.49Å
132	V	67.3	Low	65.3	Low	103 Å²	103	123.4 Å²	123.4	62%	0.624	63%	0.628	S	S	*	*			trans	-72.7	109.7	170	-179.8	0	0	0	0	106.8	F130 I134	F130-V132 HydrophobicContact CB-CG2 4.44Å; V132-I134 HydrophobicContact CG1-CD1 4.48Å; V132-I134 HydrophobicContact CG1-CG1 3.87Å
133	V	65.6	Low	63.3	Low	70 Å²	70	122.1 Å²	122.1	42%	0.424	63%	0.626	S	S	.	*			trans	-97.1	104.5	173.6	-171.5	0	0	0	0	107.1	R131 Y135	R131-V133 PolarHBondContact O-N 3.49Å; V133-Y135 HydrophobicContact CB-CD2 4.36Å; V133-Y135 HydrophobicContact CB-CE2 3.91Å; V133-Y135 HydrophobicContact CG1-CD2 3.79Å; V133-Y135 HydrophobicContact CG1-CE1 4.26Å; V133-Y135 HydrophobicContact CG1-CE2 3.29Å; V133-Y135 HydrophobicContact CG1-CG 4.46Å; V133-Y135 PolarHBondContact O-N 3.32Å
134	I	69.9	Low	61.2	Low	136 Å²	136	123.8 Å²	123.8	70%	0.697	64%	0.643	S	S	*	*			trans	-86.1	105.7	175.8	-55.8	-179.9	0	0	0	107	V132 Q136	V132-I134 HydrophobicContact CG1-CD1 4.48Å; V132-I134 HydrophobicContact CG1-CG1 3.87Å; I134-Q136 PolarHBondContact O-N 3.5Å
135	Y	49.2	Very low	59.2	Low	166 Å²	166	124.2 Å²	124.2	65%	0.651	66%	0.656	S	S	*	*			trans	-84.4	98.4	173.5	-76	-81.4	0	0	0	109.4	V133 E140	V133-Y135 HydrophobicContact CB-CD2 4.36Å; V133-Y135 HydrophobicContact CB-CE2 3.91Å; V133-Y135 HydrophobicContact CG1-CD2 3.79Å; V133-Y135 HydrophobicContact CG1-CE1 4.26Å; V133-Y135 HydrophobicContact CG1-CE2 3.29Å; V133-Y135 HydrophobicContact CG1-CG 4.46Å; V133-Y135 PolarHBondContact O-N 3.32Å; Y135-E140 HydrophobicContact CE1-CG 3.87Å; Y135-E140 WeakPolarHBondContact CE1-OE1 3.47Å; Y135-E140 PolarHBondContact OH-OE1 2.94Å
136	Q	48.9	Very low	57.6	Low	175 Å²	175	126.7 Å²	126.7	82%	0.818	67%	0.674	S	S	*	*			trans	-113.8	87.8	168.9	-163.3	174.9	28.8	0	0	108.1	I134	I134-Q136 PolarHBondContact O-N 3.5Å
137	G	50.5	Low	55.6	Low	63 Å²	63	126.9 Å²	126.9	65%	0.649	68%	0.676	S	S	*	*	S	Bend	trans	59.8	100.5	169.5	0	0	0	0	0	116.4	T139	G137-T139 PolarHBondContact O-N 3.13Å
138	E	55.8	Low	53.8	Low	210 Å²	210	129.2 Å²	129.2	98%	0.981	69%	0.69	S	S	*	*	S	Bend	trans	45.7	9	162.1	-62.9	-168.5	171.1	0	0	120.4
139	T	52.7	Low	52.7	Low	109 Å²	109	126.9 Å²	126.9	67%	0.669	69%	0.686	S	S	*	*			trans	-135.2	114.2	170.8	-36.1	0	0	0	0	110.8	G137 V141	G137-T139 PolarHBondContact O-N 3.13Å; T139-V141 PolarHBondContact O-N 3.39Å
140	E	53.5	Low	51.4	Low	140 Å²	140	125.8 Å²	125.8	65%	0.654	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-73.6	118.7	176.4	-64.8	-171.3	152.1	0	0	110.4	Y135	Y135-E140 HydrophobicContact CE1-CG 3.87Å; Y135-E140 WeakPolarHBondContact CE1-OE1 3.47Å; Y135-E140 PolarHBondContact OH-OE1 2.94Å
141	V	47	Very low	50.5	Low	120 Å²	120	130.4 Å²	130.4	73%	0.727	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-97.3	127.2	172.7	-156.9	0	0	0	0	109	T139	T139-V141 PolarHBondContact O-N 3.39Å
142	P	46.5	Very low	49	Very low	105 Å²	105	124.2 Å²	124.2	68%	0.682	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-67	139.5	-178.4	-11.7	25	0	0	0	111.1	V144	P142-V144 PolarHBondContact O-N 3.03Å
143	S	46.5	Very low	47.5	Very low	67 Å²	67	128.1 Å²	128.1	47%	0.469	73%	0.73	S	S	.	*			trans	-59	105.6	174.5	59.4	0	0	0	0	110.9	A145	S143-A145 PolarHBondContact O-N 3.23Å
144	V	44.9	Very low	46	Very low	125 Å²	125	128.1 Å²	128.1	76%	0.758	74%	0.744	S	S	*	*			trans	-76.2	113.8	173.2	177.4	0	0	0	0	108.4	P142 V146	P142-V144 PolarHBondContact O-N 3.03Å; V144-V146 PolarHBondContact O-N 3.35Å
145	A	44.8	Very low	44.4	Very low	77 Å²	77	129.5 Å²	129.5	64%	0.636	75%	0.752	S	S	*	*			trans	-58.6	114.3	163.1	0	0	0	0	0	108.4	S143 T147	S143-A145 PolarHBondContact O-N 3.23Å; A145-T147 PolarHBondContact O-N 2.92Å
146	V	47.5	Very low	44	Very low	144 Å²	144	130.8 Å²	130.8	87%	0.873	76%	0.764	S	S	*	*			trans	-72.2	77.8	172.8	-177.7	0	0	0	0	108.1	V144	V144-V146 PolarHBondContact O-N 3.35Å
147	T	44	Very low	43.9	Very low	112 Å²	112	125.6 Å²	125.6	69%	0.687	76%	0.757	S	S	*	*			trans	-131.9	83.1	161.8	56.5	0	0	0	0	106.6	A145	A145-T147 PolarHBondContact O-N 2.92Å
148	K	42.3	Very low	43.1	Very low	197 Å²	197	129.7 Å²	129.7	86%	0.857	76%	0.764	S	S	*	*			trans	176.7	110.6	154.1	-96.6	157.5	-167.1	-169.6	0	109.6
149	S	43.2	Very low	42.3	Very low	104 Å²	104	129.5 Å²	129.5	73%	0.727	76%	0.763	S	S	*	*			trans	-56.2	127.7	158.7	47.7	0	0	0	0	110.6
150	P	38.3	Very low	41.7	Very low	129 Å²	129	131 Å²	131	84%	0.838	77%	0.766	S	S	*	*			trans	-87.7	107.9	159.8	19.4	-3.7	0	0	0	108
151	Q	38.3	Very low	41	Very low	192 Å²	192	131.6 Å²	131.6	90%	0.897	77%	0.768	S	S	*	*			trans	-81.3	120.6	167.5	-159.2	146.9	-3.4	0	0	107.7
152	G	32.8	Very low	40.9	Very low	65 Å²	65	131.5 Å²	131.5	67%	0.67	77%	0.77	S	S	*	*			trans	113.1	112.8	150.2	0	0	0	0	0	117.7
153	L	35.9	Very low	40.6	Very low	185 Å²	185	132.7 Å²	132.7	97%	0.969	77%	0.77	S	S	*	*			trans	95	102.6	133.7	-57.9	169.7	0	0	0	118.4
154	G	32.7	Very low	40.6	Very low	70 Å²	70	133.3 Å²	133.3	72%	0.722	78%	0.78	S	S	*	*				137.8	122.3	122.4	0	0	0	0	0	115.9
155	L	37.3	Very low	40.3	Very low	164 Å²	164	136.9 Å²	136.9	86%	0.859	78%	0.781	S	S	*	*			trans	90.8	83.5	162.6	-47.6	178.3	0	0	0	114.2
156	E	41.4	Very low	40.3	Very low	193 Å²	193	140.4 Å²	140.4	90%	0.902	79%	0.789	S	S	*	*				67.5	107.7	76.4	-159.4	167.6	-160.9	0	0	112.1
157	G	45.3	Very low	40.3	Very low	66 Å²	66	140 Å²	140	68%	0.68	78%	0.781	S	S	*	*			trans	111	72.9	166.5	0	0	0	0	0	116.2
158	L	34.4	Very low	40.4	Very low	150 Å²	150	140.6 Å²	140.6	79%	0.785	79%	0.787	S	S	*	*			trans	171.9	101.5	130.5	-111.1	76	0	0	0	108.1	I160	L158-I160 HydrophobicContact CB-CG1 4.45Å; L158-I160 HydrophobicContact CD2-CD1 4.01Å; L158-I160 HydrophobicContact CD2-CG1 4.21Å; L158-I160 PolarHBondContact O-N 3.03Å; L158-I160 VanDerWaalsContact O-N 3.16Å
159	E	39.4	Very low	40.9	Very low	205 Å²	205	136.1 Å²	136.1	96%	0.958	79%	0.786	S	S	*	*			trans	-64.1	107	156.6	-82.9	-179.8	147.7	0	0	107.4
160	I	39.7	Very low	41.3	Very low	142 Å²	142	138.1 Å²	138.1	73%	0.728	79%	0.789	S	S	*	*			trans	-106.6	105.6	161	-64.9	170	0	0	0	105.8	L158	L158-I160 HydrophobicContact CB-CG1 4.45Å; L158-I160 HydrophobicContact CD2-CD1 4.01Å; L158-I160 HydrophobicContact CD2-CG1 4.21Å; L158-I160 PolarHBondContact O-N 3.03Å; L158-I160 VanDerWaalsContact O-N 3.16Å
161	E	38.2	Very low	41.8	Very low	152 Å²	152	140.3 Å²	140.3	71%	0.71	79%	0.792	S	S	*	*			trans	-41.3	140.5	169.8	-169.6	-152.1	-165.3	0	0	112.8	D163	E161-D163 PolarHBondContact O-N 3.49Å; E161-D163 VanDerWaalsContact O-N 3.14Å
162	P	45.4	Very low	41.9	Very low	117 Å²	117	137 Å²	137	76%	0.76	79%	0.79	S	S	*	*			trans	-63.4	113.2	168.2	25.8	-32.4	0	0	0	110.7	A164	P162-A164 PolarHBondContact O-N 2.87Å; P162-A164 VanDerWaalsContact O-N 3.11Å
163	D	40.2	Very low	42.3	Very low	130 Å²	130	139.4 Å²	139.4	70%	0.695	80%	0.797	S	S	*	*			trans	-44.3	109.1	175.2	-164.7	15	0	0	0	111.9	E161 Y165	E161-D163 PolarHBondContact O-N 3.49Å; E161-D163 VanDerWaalsContact O-N 3.14Å; D163-Y165 PolarHBondContact O-N 2.97Å
164	A	45.9	Very low	42.6	Very low	80 Å²	80	138.4 Å²	138.4	66%	0.661	79%	0.793	S	S	*	*			trans	-68.5	93.1	172.6	0	0	0	0	0	109.7	P162 D166	P162-A164 PolarHBondContact O-N 2.87Å; P162-A164 VanDerWaalsContact O-N 3.11Å; A164-D166 PolarHBondContact O-N 2.91Å; A164-D166 VanDerWaalsContact O-N 3.14Å
165	Y	40.1	Very low	42.9	Very low	200 Å²	200	143.1 Å²	143.1	78%	0.784	80%	0.796	S	S	*	*			trans	-78.1	93.7	166	-124.2	-95.6	0	0	0	109.4	D163 I167	D163-Y165 PolarHBondContact O-N 2.97Å; Y165-I167 PolarHBondContact O-N 2.99Å; Y165-I167 VanDerWaalsContact O-N 3.14Å
166	D	44.4	Very low	43.1	Very low	151 Å²	151	143.2 Å²	143.2	81%	0.807	79%	0.792	S	S	*	*			trans	-70.2	101.2	172.4	-145	2.6	0	0	0	108.7	A164 P168	A164-D166 PolarHBondContact O-N 2.91Å; A164-D166 VanDerWaalsContact O-N 3.14Å; D166-P168 WeakPolarHBondContact O-CD 3.34Å
167	I	47.5	Very low	42.7	Very low	136 Å²	136	144.3 Å²	144.3	70%	0.697	79%	0.789	S	S	*	*			trans	-72.1	122.1	174.8	-61.1	166.7	0	0	0	106.9	Y165 A169	Y165-I167 PolarHBondContact O-N 2.99Å; Y165-I167 VanDerWaalsContact O-N 3.14Å; I167-A169 PolarHBondContact O-N 3.13Å
168	P	45.8	Very low	42.6	Very low	125 Å²	125	149 Å²	149	81%	0.812	80%	0.798	S	S	*	*			trans	-64.5	100.5	173.5	-17	30	0	0	0	109.6	D166 D170	D166-P168 WeakPolarHBondContact O-CD 3.34Å; P168-D170 PolarHBondContact O-N 3.23Å; P168-D170 VanDerWaalsContact O-N 3.08Å
169	A	53.8	Low	42.6	Very low	102 Å²	102	152.2 Å²	152.2	84%	0.843	80%	0.8	S	S	*	*			trans	-76.6	83.7	171.9	0	0	0	0	0	109.4	I167	I167-A169 PolarHBondContact O-N 3.13Å
170	D	51.5	Low	42.5	Very low	146 Å²	146	148.8 Å²	148.8	78%	0.781	79%	0.788	S	S	*	*			trans	-161.2	48.5	153.5	-160.5	15.4	0	0	0	114.3	P168	P168-D170 PolarHBondContact O-N 3.23Å; P168-D170 VanDerWaalsContact O-N 3.08Å
171	L	47.5	Very low	42.6	Very low	175 Å²	175	150.9 Å²	150.9	92%	0.916	80%	0.795	S	S	*	*	S	Bend	trans	-147.2	72.2	164.3	-72	-179.9	0	0	0	110.7
172	S	41	Very low	42.7	Very low	122 Å²	122	152.6 Å²	152.6	85%	0.853	80%	0.803	S	S	*	*			trans	175.3	92.2	151.8	173	0	0	0	0	111.9
173	S	41.3	Very low	42.7	Very low	116 Å²	116	152.9 Å²	152.9	81%	0.811	80%	0.804	S	S	*	*			trans	-168.7	101.1	134.9	-162.6	0	0	0	0	109.7
174	D	42.2	Very low	42.7	Very low	165 Å²	165	152.2 Å²	152.2	88%	0.882	80%	0.801	S	S	*	*			trans	-98.4	98.1	164.5	176.1	34.3	0	0	0	106.1
175	E	38.4	Very low	43	Very low	169 Å²	169	153.5 Å²	153.5	79%	0.79	80%	0.802	S	S	*	*			trans	-146.5	102.8	159.4	-153.9	-169.6	-148.1	0	0	109.6
176	E	42.3	Very low	44.1	Very low	166 Å²	166	147.7 Å²	147.7	78%	0.776	79%	0.791	S	S	*	*			trans	26.2	112.5	140.1	-159.1	171.2	-153.9	0	0	118.6
177	Y	32.5	Very low	44.5	Very low	216 Å²	216	150.7 Å²	150.7	85%	0.847	79%	0.791	S	S	*	*			trans	-161.4	123.4	130.5	-126	-93	0	0	0	112.1	R179	Y177-R179 PolarHBondContact O-N 3.4Å
178	L	42.9	Very low	44.8	Very low	164 Å²	164	147.1 Å²	147.1	86%	0.859	78%	0.782	S	S	*	*			trans	-57	116.3	163.2	-91.4	157.3	0	0	0	110.6
179	R	34	Very low	45.2	Very low	217 Å²	217	144.5 Å²	144.5	82%	0.819	77%	0.771	S	S	*	*			trans	-158.3	144.6	152.7	-163.3	153.1	-77.2	-98.7	-0.8	112.1	Y177	Y177-R179 PolarHBondContact O-N 3.4Å
180	D	38.5	Very low	45.5	Very low	133 Å²	133	149.4 Å²	149.4	71%	0.711	77%	0.767	S	S	*	*			trans	-63.7	161.1	-165.8	-58.7	-77.8	0	0	0	118
181	E	40.7	Very low	45.8	Very low	187 Å²	187	147.7 Å²	147.7	87%	0.874	76%	0.758	S	S	*	*			trans	45.8	104.9	145.5	-86	-172.5	126.4	0	0	120.6
182	E	40.8	Very low	46.3	Very low	187 Å²	187	146.9 Å²	146.9	87%	0.874	75%	0.747	S	S	*	*				-175.9	137.3	115.5	-116.2	-157.1	149.9	0	0	111.5	D184	E182-D184 PolarHBondContact O-N 3.29Å
183	P	45.2	Very low	47.1	Very low	123 Å²	123	148.6 Å²	148.6	80%	0.799	74%	0.739	S	S	*	*			trans	-88.1	105.4	178.9	32.5	-30.6	0	0	0	112.2	P185	P183-P185 WeakPolarHBondContact O-CD 3.38Å
184	D	41.2	Very low	47.7	Very low	117 Å²	117	146.6 Å²	146.6	63%	0.626	73%	0.725	S	S	*	*			trans	-72.3	118.4	178.5	-157.9	-12.8	0	0	0	112.3	E182 S186	E182-D184 PolarHBondContact O-N 3.29Å; D184-S186 PolarHBondContact O-N 2.95Å; D184-S186 VanDerWaalsContact O-N 3.08Å
185	P	52	Low	48.4	Very low	106 Å²	106	144 Å²	144	69%	0.688	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-5.4	-173.9	25.5	-34	0	0	0	115.1	P183	P183-P185 WeakPolarHBondContact O-CD 3.38Å
186	S	62.2	Low	49.3	Very low	79 Å²	79	140.7 Å²	140.7	55%	0.552	70%	0.7	S	S	*	*	H	α-helix	trans	-80	-18.5	-172.5	-72.4	0	0	0	0	115.8	D184	D184-S186 PolarHBondContact O-N 2.95Å; D184-S186 VanDerWaalsContact O-N 3.08Å
187	R	53.8	Low	50.2	Low	214 Å²	214	139.4 Å²	139.4	81%	0.808	69%	0.691	S	S	*	*	H	α-helix	trans	-78.4	-29.7	177.6	-65.3	177.4	90.7	172.6	6.5	112.7	L191	R187-L191 PolarHBondContact O-N 3.05Å
188	A	52.8	Low	51.6	Low	60 Å²	60	131.3 Å²	131.3	50%	0.496	67%	0.667	S	S	.	*	H	α-helix	trans	-72.1	-31.7	-177.2	0	0	0	0	0	113.5	K192	A188-K192 PolarHBondContact O-N 2.88Å
189	A	55.6	Low	52.4	Low	70 Å²	70	127.8 Å²	127.8	58%	0.579	65%	0.652	S	S	*	*	H	α-helix	trans	-72.4	-35.1	-179.8	0	0	0	0	0	113
190	R	58.8	Low	53.7	Low	206 Å²	206	124.2 Å²	124.2	78%	0.777	64%	0.644	S	S	*	*	H	α-helix	trans	-72.2	-34.7	178	-64.3	176.7	77.7	171.2	2.3	111.9	S194	R190-S194 PolarHBondContact O-N 3.1Å
191	L	58.3	Low	54.9	Low	110 Å²	110	122.4 Å²	122.4	58%	0.576	64%	0.638	S	S	*	*	H	α-helix	trans	-66	-40.2	178.1	-154.2	100.4	0	0	0	112.3	R187 K193 S194 M195	R187-L191 PolarHBondContact O-N 3.05Å; L191-K193 PolarHBondContact O-N 3.18Å; L191-S194 PolarHBondContact O-N 3.38Å; L191-M195 WeakPolarHBondContact O-CB 3.29Å; L191-M195 WeakPolarHBondContact O-CG 3.47Å; L191-M195 PolarHBondContact O-N 3.3Å
192	K	58.6	Low	55.9	Low	158 Å²	158	118.3 Å²	118.3	69%	0.687	62%	0.622	S	S	*	*	H	α-helix	trans	-66.4	-36.2	179.8	-71.3	-177.9	180	-177.7	0	113.2	A188 V196	A188-K192 PolarHBondContact O-N 2.88Å; K192-V196 WeakPolarHBondContact O-CG2 3.42Å
193	K	57.8	Low	57	Low	158 Å²	158	117.5 Å²	117.5	69%	0.687	62%	0.616	S	S	*	*	H	α-helix	trans	-75.9	-26.8	179	-162.6	164.9	-175.5	172.9	0	113	L191	L191-K193 PolarHBondContact O-N 3.18Å
194	S	53.9	Low	58.1	Low	74 Å²	74	114.2 Å²	114.2	52%	0.517	60%	0.599	S	S	.	*	H	α-helix	trans	-76.9	-40.5	174.2	148.8	0	0	0	0	112.2	R190 L191 V196 K197 S198	R190-S194 PolarHBondContact O-N 3.1Å; L191-S194 PolarHBondContact O-N 3.38Å; S194-V196 PolarHBondContact O-N 3.45Å; S194-K197 PolarHBondContact O-N 2.81Å; S194-S198 PolarHBondContact O-N 3.38Å; S194-S198 PolarHBondContact O-OG 3.34Å
195	M	55.3	Low	59	Low	111 Å²	111	111.6 Å²	111.6	55%	0.547	59%	0.593	S	S	.	*	H	α-helix	trans	-62.5	-37.6	-179	-74.3	-100.3	155.6	0	0	113.6	L191 S198 T199	L191-M195 WeakPolarHBondContact O-CB 3.29Å; L191-M195 WeakPolarHBondContact O-CG 3.47Å; L191-M195 PolarHBondContact O-N 3.3Å; M195-S198 WeakPolarHBondContact CA-OG 3.41Å; M195-S198 PolarHBondContact O-OG 2.82Å; M195-T199 PolarHBondContact O-N 3.46Å; M195-T199 PolarHBondContact O-OG1 2.92Å
196	V	58.6	Low	59.1	Low	98 Å²	98	113.3 Å²	113.3	59%	0.594	59%	0.59	S	S	*	*	H	α-helix	trans	-68.6	-37.4	-179.3	175.2	0	0	0	0	112.3	K192 S194 T199	K192-V196 WeakPolarHBondContact O-CG2 3.42Å; S194-V196 PolarHBondContact O-N 3.45Å; V196-T199 PolarHBondContact O-OG1 3.13Å
197	K	61	Low	59.3	Low	139 Å²	139	111.9 Å²	111.9	60%	0.604	58%	0.58	S	S	*	*	H	α-helix	trans	-75.2	-32.6	179.5	-69.7	-178.7	176	-178.3	0	112.7	S194 E200 T201	S194-K197 PolarHBondContact O-N 2.81Å; K197-E200 PolarHBondContact O-N 3.28Å; K197-T201 PolarHBondContact O-N 2.98Å; K197-T201 PolarHBondContact O-OG1 2.91Å
198	S	61	Low	59.9	Low	47 Å²	47	110.8 Å²	110.8	33%	0.329	58%	0.581	S	S	.	*	H	α-helix	trans	-70.1	-31.1	175.6	46.1	0	0	0	0	113.4	S194 M195 E200 T201 L202	S194-S198 PolarHBondContact O-N 3.38Å; S194-S198 PolarHBondContact O-OG 3.34Å; M195-S198 WeakPolarHBondContact CA-OG 3.41Å; M195-S198 PolarHBondContact O-OG 2.82Å; S198-E200 VanDerWaalsContact C-N 3.33Å; S198-T201 PolarHBondContact O-OG1 3.14Å; S198-T201 VanDerWaalsContact O-OG1 3.13Å; S198-L202 WeakPolarHBondContact O-CB 3.4Å; S198-L202 WeakPolarHBondContact O-CD1 3.34Å; S198-L202 VanDerWaalsContact O-CG 3.28Å; S198-L202 WeakPolarHBondContact O-CG 3.3Å; S198-L202 PolarHBondContact O-N 3.01Å
199	T	60.4	Low	60.7	Low	89 Å²	89	113.6 Å²	113.6	55%	0.546	58%	0.584	S	S	.	*	H	α-helix	trans	-72	-27.9	176.5	50.1	0	0	0	0	112.9	M195 V196 K203	M195-T199 PolarHBondContact O-N 3.46Å; M195-T199 PolarHBondContact O-OG1 2.92Å; V196-T199 PolarHBondContact O-OG1 3.13Å; T199-K203 VanDerWaalsContact O-CB 3.24Å; T199-K203 WeakPolarHBondContact O-CB 3.46Å; T199-K203 PolarHBondContact O-N 2.87Å
200	E	61.1	Low	61.5	Low	142 Å²	142	113.9 Å²	113.9	66%	0.664	58%	0.576	S	S	*	*	H	α-helix	trans	-76.4	-40.6	178.4	-163.9	170.9	-167.3	0	0	111.5	K197 S198 K203 A204	K197-E200 PolarHBondContact O-N 3.28Å; S198-E200 VanDerWaalsContact C-N 3.33Å; E200-K203 PolarHBondContact O-N 3.48Å; E200-A204 WeakPolarHBondContact O-CB 3.31Å; E200-A204 PolarHBondContact O-N 3.4Å
201	T	63.1	Low	62.1	Low	95 Å²	95	109.2 Å²	109.2	58%	0.583	56%	0.564	S	S	*	*	H	α-helix	trans	-70.5	-35.3	174.6	55.1	0	0	0	0	112.7	K197 S198 A204 A205	K197-T201 PolarHBondContact O-N 2.98Å; K197-T201 PolarHBondContact O-OG1 2.91Å; S198-T201 PolarHBondContact O-OG1 3.14Å; S198-T201 VanDerWaalsContact O-OG1 3.13Å; T201-A204 PolarHBondContact O-N 2.91Å; T201-A205 WeakPolarHBondContact O-CB 3.31Å; T201-A205 PolarHBondContact O-N 3.3Å
202	L	61.3	Low	62.8	Low	101 Å²	101	106.5 Å²	106.5	53%	0.529	55%	0.554	S	S	.	*	H	α-helix	trans	-66.6	-40.6	171.3	-77.7	164.3	0	0	0	111.7	S198 A204 A205 F206	S198-L202 WeakPolarHBondContact O-CB 3.4Å; S198-L202 WeakPolarHBondContact O-CD1 3.34Å; S198-L202 VanDerWaalsContact O-CG 3.28Å; S198-L202 WeakPolarHBondContact O-CG 3.3Å; S198-L202 PolarHBondContact O-N 3.01Å; L202-A204 VanDerWaalsContact C-N 3.33Å; L202-A204 PolarHBondContact O-N 2.94Å; L202-A205 PolarHBondContact O-N 3.16Å; L202-F206 WeakPolarHBondContact O-CD2 3.46Å; L202-F206 PolarHBondContact O-N 3.22Å
203	K	65.7	Low	63.7	Low	171 Å²	171	104 Å²	104	74%	0.743	54%	0.543	S	S	*	.	H	α-helix	trans	-68	-32.9	176.6	-163.2	171.7	-176.2	177.8	0	112.4	T199 E200 F206 S207	T199-K203 VanDerWaalsContact O-CB 3.24Å; T199-K203 WeakPolarHBondContact O-CB 3.46Å; T199-K203 PolarHBondContact O-N 2.87Å; E200-K203 PolarHBondContact O-N 3.48Å; K203-F206 CarbonylContact O-C 3.57Å; K203-S207 PolarHBondContact O-N 3.39Å; K203-S207 VanDerWaalsContact O-N 3.14Å
204	A	68.1	Low	64.4	Low	54 Å²	54	100.9 Å²	100.9	45%	0.446	54%	0.538	S	S	.	.	H	α-helix	trans	-70.6	-36.4	171.8	0	0	0	0	0	112.7	E200 T201 L202 F206 S207 N210	E200-A204 WeakPolarHBondContact O-CB 3.31Å; E200-A204 PolarHBondContact O-N 3.4Å; T201-A204 PolarHBondContact O-N 2.91Å; L202-A204 VanDerWaalsContact C-N 3.33Å; L202-A204 PolarHBondContact O-N 2.94Å; A204-F206 VanDerWaalsContact C-N 3.35Å; A204-S207 VanDerWaalsContact O-CB 3.25Å; A204-S207 WeakPolarHBondContact O-CB 3.39Å; A204-S207 PolarHBondContact O-N 2.86Å; A204-N210 PolarHBondContact O-ND2 3.16Å; A204-N210 VanDerWaalsContact O-ND2 3.12Å
205	A	59.6	Low	65.5	Low	61 Å²	61	104.2 Å²	104.2	50%	0.504	54%	0.543	S	S	.	.	H	α-helix	trans	-69.8	-29.7	175.1	0	0	0	0	0	113	T201 L202	T201-A205 WeakPolarHBondContact O-CB 3.31Å; T201-A205 PolarHBondContact O-N 3.3Å; L202-A205 PolarHBondContact O-N 3.16Å
206	F	54.4	Low	66.5	Low	142 Å²	142	102.9 Å²	102.9	62%	0.623	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	11.2	172.2	-77.9	-77.6	0	0	0	114.2	L202 K203 A204 K208	L202-F206 WeakPolarHBondContact O-CD2 3.46Å; L202-F206 PolarHBondContact O-N 3.22Å; K203-F206 CarbonylContact O-C 3.57Å; A204-F206 VanDerWaalsContact C-N 3.35Å; F206-K208 PolarHBondContact O-N 3.02Å
207	S	66.4	Low	67.5	Low	49 Å²	49	102.6 Å²	102.6	34%	0.343	53%	0.534	S	S	.	.			trans	-59.6	132.9	174.7	-178.5	0	0	0	0	110.2	K203 A204 E209 N210 M211	K203-S207 PolarHBondContact O-N 3.39Å; K203-S207 VanDerWaalsContact O-N 3.14Å; A204-S207 VanDerWaalsContact O-CB 3.25Å; A204-S207 WeakPolarHBondContact O-CB 3.39Å; A204-S207 PolarHBondContact O-N 2.86Å; S207-E209 PolarHBondContact O-N 3.47Å; S207-N210 PolarHBondContact O-N 2.95Å; S207-M211 PolarHBondContact O-N 2.79Å
208	K	65.4	Low	68.3	Low	191 Å²	191	101.5 Å²	101.5	83%	0.83	53%	0.534	S	S	*	.	H	α-helix	trans	-51.1	-28.9	-178.1	-71.3	-179.8	176.6	178.8	0	112.7	F206 S212	F206-K208 PolarHBondContact O-N 3.02Å; K208-S212 WeakPolarHBondContact O-CB 3.31Å; K208-S212 PolarHBondContact O-N 2.86Å
209	E	70.9	Confident	68.9	Low	119 Å²	119	101.2 Å²	101.2	56%	0.556	54%	0.538	S	S	*	.	H	α-helix	trans	-71.4	-42.8	178.6	-167.4	-179	161.2	0	0	113.1	S207 S212 K213	S207-E209 PolarHBondContact O-N 3.47Å; E209-S212 PolarHBondContact O-N 3.49Å; E209-K213 WeakPolarHBondContact O-CG 3.32Å; E209-K213 PolarHBondContact O-N 3.48Å; E209-K213 WeakPolarHBondContact OE1-CE 3.41Å; E209-K213 IonicContact OE1-NZ 3.5Å; E209-K213 PolarHBondContact OE1-NZ 3.01Å
210	N	71.3	Confident	69.6	Low	77 Å²	77	100.7 Å²	100.7	41%	0.412	54%	0.535	S	S	.	.	H	α-helix	trans	-69.7	-39.7	176.9	-75.9	-25.7	0	0	0	111.2	A204 S207 K213 T214	A204-N210 PolarHBondContact O-ND2 3.16Å; A204-N210 VanDerWaalsContact O-ND2 3.12Å; S207-N210 PolarHBondContact O-N 2.95Å; N210-K213 PolarHBondContact O-N 2.9Å; N210-T214 PolarHBondContact O-N 3.28Å; N210-T214 PolarHBondContact O-OG1 2.89Å
211	M	70.9	Confident	70.1	Confident	108 Å²	108	100.6 Å²	100.6	53%	0.532	53%	0.532	S	S	.	.	H	α-helix	trans	-65.9	-37.5	174.3	-76.5	-137.4	-69.9	0	0	113.2	S207 T214 K215	S207-M211 PolarHBondContact O-N 2.79Å; M211-T214 PolarHBondContact O-N 2.88Å; M211-K215 VanDerWaalsContact O-CB 3.31Å; M211-K215 WeakPolarHBondContact O-CB 3.45Å; M211-K215 PolarHBondContact O-N 2.83Å
212	S	72.9	Confident	70.5	Confident	52 Å²	52	103.3 Å²	103.3	36%	0.364	54%	0.536	S	S	.	.	H	α-helix	trans	-63.8	-48.1	174.1	-164.1	0	0	0	0	110.7	K208 E209 T214 K215 D216	K208-S212 WeakPolarHBondContact O-CB 3.31Å; K208-S212 PolarHBondContact O-N 2.86Å; E209-S212 PolarHBondContact O-N 3.49Å; S212-T214 VanDerWaalsContact C-N 3.29Å; S212-T214 PolarHBondContact O-N 3.13Å; S212-K215 WeakPolarHBondContact O-CB 3.34Å; S212-K215 PolarHBondContact O-N 3.28Å; S212-K215 VanDerWaalsContact O-N 3.08Å; S212-D216 WeakPolarHBondContact O-CB 3.43Å; S212-D216 PolarHBondContact O-N 2.89Å; S212-D216 PolarHBondContact OG-OD2 3.33Å
213	K	77.5	Confident	70.7	Confident	105 Å²	105	104 Å²	104	46%	0.457	54%	0.536	S	S	.	.	H	α-helix	trans	-58.8	-40	176.8	-70.4	172.9	-172.8	169.6	0	111.7	E209 N210 N217	E209-K213 WeakPolarHBondContact O-CG 3.32Å; E209-K213 PolarHBondContact O-N 3.48Å; E209-K213 WeakPolarHBondContact OE1-CE 3.41Å; E209-K213 IonicContact OE1-NZ 3.5Å; E209-K213 PolarHBondContact OE1-NZ 3.01Å; N210-K213 PolarHBondContact O-N 2.9Å; K213-N217 WeakPolarHBondContact O-CB 3.3Å; K213-N217 PolarHBondContact O-N 3.21Å; K213-N217 PolarHBondContact O-ND2 3.46Å
214	T	73	Confident	70.9	Confident	94 Å²	94	100.9 Å²	100.9	58%	0.577	53%	0.528	S	S	*	.	H	α-helix	trans	-68.3	-39.4	174.8	-56.4	0	0	0	0	112.4	N210 M211 S212 L218	N210-T214 PolarHBondContact O-N 3.28Å; N210-T214 PolarHBondContact O-OG1 2.89Å; M211-T214 PolarHBondContact O-N 2.88Å; S212-T214 VanDerWaalsContact C-N 3.29Å; S212-T214 PolarHBondContact O-N 3.13Å; T214-L218 VanDerWaalsContact O-CB 3.26Å; T214-L218 WeakPolarHBondContact O-CB 3.21Å; T214-L218 PolarHBondContact O-N 3.14Å
215	K	76.8	Confident	70.7	Confident	143 Å²	143	103.3 Å²	103.3	62%	0.622	53%	0.533	S	S	*	.	H	α-helix	trans	-63.9	-40.9	175.9	-169	-171.3	69.5	165.4	0	111.7	M211 S212 L218 G219	M211-K215 VanDerWaalsContact O-CB 3.31Å; M211-K215 WeakPolarHBondContact O-CB 3.45Å; M211-K215 PolarHBondContact O-N 2.83Å; S212-K215 WeakPolarHBondContact O-CB 3.34Å; S212-K215 PolarHBondContact O-N 3.28Å; S212-K215 VanDerWaalsContact O-N 3.08Å; K215-L218 PolarHBondContact O-N 3.08Å; K215-G219 PolarHBondContact O-N 3.04Å
216	D	76.8	Confident	70.6	Confident	84 Å²	84	102 Å²	102	45%	0.449	53%	0.525	S	S	.	.	H	α-helix	trans	-73.4	-38.3	-178.8	-60	-27.7	0	0	0	111.1	S212 G219 T220	S212-D216 WeakPolarHBondContact O-CB 3.43Å; S212-D216 PolarHBondContact O-N 2.89Å; S212-D216 PolarHBondContact OG-OD2 3.33Å; D216-G219 PolarHBondContact O-N 3.4Å; D216-T220 WeakPolarHBondContact O-CB 3.49Å; D216-T220 VanDerWaalsContact O-CG2 3.31Å; D216-T220 WeakPolarHBondContact O-CG2 3.4Å; D216-T220 PolarHBondContact O-N 3.29Å; D216-T220 PolarHBondContact O-OG1 2.9Å
217	N	80	Confident	71	Confident	92 Å²	92	101.6 Å²	101.6	49%	0.492	53%	0.526	S	S	.	.	H	α-helix	trans	-67.1	-34.9	171.2	-82.3	-71.9	0	0	0	112.9	K213 T220 K221	K213-N217 WeakPolarHBondContact O-CB 3.3Å; K213-N217 PolarHBondContact O-N 3.21Å; K213-N217 PolarHBondContact O-ND2 3.46Å; N217-T220 WeakPolarHBondContact CA-OG1 3.39Å; N217-T220 PolarHBondContact O-OG1 3.33Å; N217-T220 VanDerWaalsContact O-OG1 3.11Å; N217-K221 WeakPolarHBondContact O-CB 3.22Å; N217-K221 WeakPolarHBondContact O-CG 3.47Å; N217-K221 PolarHBondContact O-N 3.14Å
218	L	78.4	Confident	70.9	Confident	116 Å²	116	108.2 Å²	108.2	61%	0.607	55%	0.548	S	S	*	.	H	α-helix	trans	-74.1	-40.1	175.6	-173.2	64.9	0	0	0	111	T214 K215 K221 F222	T214-L218 VanDerWaalsContact O-CB 3.26Å; T214-L218 WeakPolarHBondContact O-CB 3.21Å; T214-L218 PolarHBondContact O-N 3.14Å; K215-L218 PolarHBondContact O-N 3.08Å; L218-K221 PolarHBondContact O-N 2.92Å; L218-F222 WeakPolarHBondContact O-CB 3.31Å; L218-F222 PolarHBondContact O-N 3.04Å
219	G	73.4	Confident	70.7	Confident	41 Å²	41	104.1 Å²	104.1	42%	0.423	54%	0.539	S	S	.	.	H	α-helix	trans	-63.2	-43.2	177.5	0	0	0	0	0	112.5	K215 D216 F222 H223	K215-G219 PolarHBondContact O-N 3.04Å; D216-G219 PolarHBondContact O-N 3.4Å; G219-F222 PolarHBondContact O-N 3.46Å; G219-H223 WeakPolarHBondContact O-CB 3.48Å; G219-H223 PolarHBondContact O-N 3.46Å
220	T	74.1	Confident	70	Confident	77 Å²	77	101.8 Å²	101.8	47%	0.472	53%	0.529	S	S	.	.	H	α-helix	trans	-68.1	-41.2	176	49.4	0	0	0	0	112.4	D216 N217 H223 N224	D216-T220 WeakPolarHBondContact O-CB 3.49Å; D216-T220 VanDerWaalsContact O-CG2 3.31Å; D216-T220 WeakPolarHBondContact O-CG2 3.4Å; D216-T220 PolarHBondContact O-N 3.29Å; D216-T220 PolarHBondContact O-OG1 2.9Å; N217-T220 WeakPolarHBondContact CA-OG1 3.39Å; N217-T220 PolarHBondContact O-OG1 3.33Å; N217-T220 VanDerWaalsContact O-OG1 3.11Å; T220-H223 PolarHBondContact O-N 3.4Å; T220-N224 WeakPolarHBondContact O-CB 3.47Å; T220-N224 PolarHBondContact O-N 3.5Å
221	K	72.3	Confident	69.6	Low	140 Å²	140	101.8 Å²	101.8	61%	0.609	53%	0.533	S	S	*	.	H	α-helix	trans	-66.9	-36.3	174.1	-71.6	177.3	-173	-173.7	0	112.5	N217 L218 L225	N217-K221 WeakPolarHBondContact O-CB 3.22Å; N217-K221 WeakPolarHBondContact O-CG 3.47Å; N217-K221 PolarHBondContact O-N 3.14Å; L218-K221 PolarHBondContact O-N 2.92Å; K221-L225 WeakPolarHBondContact O-CB 3.41Å; K221-L225 PolarHBondContact O-N 3.25Å
222	F	70.9	Confident	69.2	Low	152 Å²	152	101.7 Å²	101.7	67%	0.667	54%	0.541	S	S	*	.	H	α-helix	trans	-72.8	-33.1	176.5	-163.8	-94.9	0	0	0	112	L218 G219 G226	L218-F222 WeakPolarHBondContact O-CB 3.31Å; L218-F222 PolarHBondContact O-N 3.04Å; G219-F222 PolarHBondContact O-N 3.46Å; F222-G226 WeakPolarHBondContact O-CA 3.29Å; F222-G226 PolarHBondContact O-N 3.03Å
223	H	66.8	Low	68.7	Low	115 Å²	115	105.9 Å²	105.9	53%	0.532	55%	0.554	S	S	.	*	H	α-helix	trans	-64.6	-50.3	171.2	-168.6	-78.2	0	0	0	110.9	G219 T220 L225 G226 E227	G219-H223 WeakPolarHBondContact O-CB 3.48Å; G219-H223 PolarHBondContact O-N 3.46Å; T220-H223 PolarHBondContact O-N 3.4Å; H223-L225 VanDerWaalsContact C-N 3.35Å; H223-L225 PolarHBondContact O-N 2.91Å; H223-G226 PolarHBondContact O-N 2.85Å; H223-E227 IonicContact CE1-OE2 3.49Å; H223-E227 IonicContact ND1-OE2 2.63Å; H223-E227 PolarHBondContact ND1-OE2 2.95Å; H223-E227 VanDerWaalsContact O-CB 3.31Å; H223-E227 WeakPolarHBondContact O-CB 3.34Å; H223-E227 PolarHBondContact O-N 3.25Å
224	N	69.6	Low	67.9	Low	106 Å²	106	109.4 Å²	109.4	57%	0.567	57%	0.565	S	S	*	*	H	α-helix	trans	-66.1	-35.9	179.4	-69.7	-3.6	0	0	0	112.6	T220 K228	T220-N224 WeakPolarHBondContact O-CB 3.47Å; T220-N224 PolarHBondContact O-N 3.5Å; N224-K228 VanDerWaalsContact O-CB 3.31Å; N224-K228 WeakPolarHBondContact O-CB 3.28Å; N224-K228 PolarHBondContact O-N 2.97Å; N224-K228 VanDerWaalsContact O-N 3.13Å
225	L	64.2	Low	67.5	Low	105 Å²	105	112 Å²	112	55%	0.55	56%	0.564	S	S	.	*	H	α-helix	trans	-72.6	-39.6	174	-169.7	68.8	0	0	0	111.1	K221 H223 E227 K228 V229	K221-L225 WeakPolarHBondContact O-CB 3.41Å; K221-L225 PolarHBondContact O-N 3.25Å; H223-L225 VanDerWaalsContact C-N 3.35Å; H223-L225 PolarHBondContact O-N 2.91Å; L225-E227 VanDerWaalsContact C-N 3.32Å; L225-E227 PolarHBondContact O-N 3.5Å; L225-K228 PolarHBondContact O-N 3.3Å; L225-V229 HydrophobicContact CD1-CG2 3.52Å; L225-V229 HydrophobicContact CG-CG2 3.82Å; L225-V229 WeakPolarHBondContact O-CA 3.48Å; L225-V229 WeakPolarHBondContact O-CB 3.4Å; L225-V229 WeakPolarHBondContact O-CG2 3.42Å; L225-V229 PolarHBondContact O-N 3.39Å
226	G	57.4	Low	67	Low	34 Å²	34	112 Å²	112	35%	0.351	57%	0.566	S	S	.	*	H	α-helix	trans	-62.4	-39.3	175.7	0	0	0	0	0	112.5	F222 H223 M230	F222-G226 WeakPolarHBondContact O-CA 3.29Å; F222-G226 PolarHBondContact O-N 3.03Å; H223-G226 PolarHBondContact O-N 2.85Å; G226-M230 WeakPolarHBondContact O-CB 3.33Å; G226-M230 PolarHBondContact O-N 3.5Å
227	E	62.2	Low	66.6	Low	134 Å²	134	114.5 Å²	114.5	63%	0.626	57%	0.573	S	S	*	*	H	α-helix	trans	-72.4	-32.1	177.6	-164.2	167.1	-170.7	0	0	112.5	H223 L225	H223-E227 IonicContact CE1-OE2 3.49Å; H223-E227 IonicContact ND1-OE2 2.63Å; H223-E227 PolarHBondContact ND1-OE2 2.95Å; H223-E227 VanDerWaalsContact O-CB 3.31Å; H223-E227 WeakPolarHBondContact O-CB 3.34Å; H223-E227 PolarHBondContact O-N 3.25Å; L225-E227 VanDerWaalsContact C-N 3.32Å; L225-E227 PolarHBondContact O-N 3.5Å
228	K	63.5	Low	65.9	Low	187 Å²	187	115.8 Å²	115.8	81%	0.813	58%	0.578	S	S	*	*	H	α-helix	trans	-87.9	-25.2	177.9	-166.5	170	-177.4	176.1	0	114.4	N224 L225	N224-K228 VanDerWaalsContact O-CB 3.31Å; N224-K228 WeakPolarHBondContact O-CB 3.28Å; N224-K228 PolarHBondContact O-N 2.97Å; N224-K228 VanDerWaalsContact O-N 3.13Å; L225-K228 PolarHBondContact O-N 3.3Å
229	V	61.9	Low	65.6	Low	106 Å²	106	115.5 Å²	115.5	64%	0.642	57%	0.573	S	S	*	*	H	α-helix	trans	-101.9	-20.6	-174.8	178	0	0	0	0	112.3	L225	L225-V229 HydrophobicContact CD1-CG2 3.52Å; L225-V229 HydrophobicContact CG-CG2 3.82Å; L225-V229 WeakPolarHBondContact O-CA 3.48Å; L225-V229 WeakPolarHBondContact O-CB 3.4Å; L225-V229 WeakPolarHBondContact O-CG2 3.42Å; L225-V229 PolarHBondContact O-N 3.39Å
230	M	56.3	Low	65.6	Low	69 Å²	69	118.8 Å²	118.8	34%	0.34	58%	0.577	S	S	.	*	S	Bend	trans	-129.9	106.8	179.3	-161.7	-177.4	-60.2	0	0	111.6	G226 R234 R235	G226-M230 WeakPolarHBondContact O-CB 3.33Å; G226-M230 PolarHBondContact O-N 3.5Å; M230-R234 HydrophobicContact CG-CB 4.17Å; M230-R235 HydrophobicContact SD-CB 4.01Å
231	P	62.7	Low	65.4	Low	78 Å²	78	117.7 Å²	117.7	51%	0.506	58%	0.576	S	S	.	*			trans	-57.6	146	173.4	-22.7	32.6	0	0	0	111.5	E233 R234 R235	P231-E233 PolarHBondContact O-N 2.88Å; P231-E233 VanDerWaalsContact O-N 3.14Å; P231-R234 PolarHBondContact O-N 2.8Å; P231-R235 PolarHBondContact O-N 3.4Å
232	P	63.6	Low	65.6	Low	106 Å²	106	112.5 Å²	112.5	69%	0.688	56%	0.563	S	S	*	*	H	α-helix	trans	-56.5	-34.7	-174.1	21.2	-32.7	0	0	0	113.1	R234 R235 E236	P232-R234 VanDerWaalsContact C-N 3.28Å; P232-R234 PolarHBondContact O-N 3.24Å; P232-R235 PolarHBondContact O-N 3.25Å; P232-E236 PolarHBondContact O-N 3.44Å
233	E	61.5	Low	65.7	Low	139 Å²	139	111.1 Å²	111.1	65%	0.65	56%	0.558	S	S	*	*	H	α-helix	trans	-63.2	-29.4	177.2	-64.4	-176.4	172.1	0	0	113.8	P231 K237	P231-E233 PolarHBondContact O-N 2.88Å; P231-E233 VanDerWaalsContact O-N 3.14Å; E233-K237 WeakPolarHBondContact O-CD 3.49Å; E233-K237 VanDerWaalsContact O-CG 3.29Å; E233-K237 WeakPolarHBondContact O-CG 3.5Å; E233-K237 PolarHBondContact O-N 2.92Å
234	R	61.2	Low	66	Low	179 Å²	179	113.8 Å²	113.8	68%	0.675	56%	0.564	S	S	*	*	H	α-helix	trans	-82.4	-31.4	179.1	-148.7	177.4	-164.6	-102.3	3.8	111.1	M230 P231 P232 M238	M230-R234 HydrophobicContact CG-CB 4.17Å; P231-R234 PolarHBondContact O-N 2.8Å; P232-R234 VanDerWaalsContact C-N 3.28Å; P232-R234 PolarHBondContact O-N 3.24Å; R234-M238 WeakPolarHBondContact O-CB 3.24Å; R234-M238 PolarHBondContact O-N 2.87Å; R234-M238 VanDerWaalsContact O-N 3.13Å
235	R	65.1	Low	66.3	Low	148 Å²	148	114.8 Å²	114.8	56%	0.558	57%	0.568	S	S	*	*	H	α-helix	trans	-66.6	-43.6	173.5	-177.4	174.1	176.6	179.3	-1	111	M230 P231 P232 M238 H239	M230-R235 HydrophobicContact SD-CB 4.01Å; P231-R235 PolarHBondContact O-N 3.4Å; P232-R235 PolarHBondContact O-N 3.25Å; R235-M238 PolarHBondContact O-N 2.96Å; R235-H239 PolarHBondContact O-CD2 3.45Å; R235-H239 PolarHBondContact O-N 3.03Å
236	E	64.5	Low	66.8	Low	144 Å²	144	117.2 Å²	117.2	67%	0.673	57%	0.574	S	S	*	*	H	α-helix	trans	-65.9	-41.6	178.1	-163.4	173.9	-167	0	0	112.3	P232 M238 H239 Q240	P232-E236 PolarHBondContact O-N 3.44Å; E236-M238 VanDerWaalsContact C-N 3.26Å; E236-M238 PolarHBondContact O-N 3.25Å; E236-H239 PolarHBondContact O-N 3.28Å; E236-Q240 VanDerWaalsContact O-CB 3.31Å; E236-Q240 WeakPolarHBondContact O-CB 3.46Å; E236-Q240 PolarHBondContact O-N 2.89Å
237	K	68.4	Low	67.7	Low	137 Å²	137	120.7 Å²	120.7	60%	0.596	58%	0.581	S	S	*	*	H	α-helix	trans	-62	-33.7	172.9	-73.2	172.2	-175.5	171.8	0	112.6	E233 A241	E233-K237 WeakPolarHBondContact O-CD 3.49Å; E233-K237 VanDerWaalsContact O-CG 3.29Å; E233-K237 WeakPolarHBondContact O-CG 3.5Å; E233-K237 PolarHBondContact O-N 2.92Å; K237-A241 WeakPolarHBondContact O-CB 3.36Å; K237-A241 PolarHBondContact O-N 3.48Å
238	M	66.3	Low	68.2	Low	119 Å²	119	117.7 Å²	117.7	59%	0.586	58%	0.575	S	S	*	*	H	α-helix	trans	-76.7	-37.1	177.6	-141.9	179.9	71.1	0	0	112.1	R234 R235 E236 G242	R234-M238 WeakPolarHBondContact O-CB 3.24Å; R234-M238 PolarHBondContact O-N 2.87Å; R234-M238 VanDerWaalsContact O-N 3.13Å; R235-M238 PolarHBondContact O-N 2.96Å; E236-M238 VanDerWaalsContact C-N 3.26Å; E236-M238 PolarHBondContact O-N 3.25Å; M238-G242 PolarHBondContact O-N 2.92Å
239	H	72.1	Confident	68.7	Low	110 Å²	110	110.1 Å²	110.1	51%	0.509	55%	0.55	S	S	.	.	H	α-helix	trans	-64	-44.8	170.1	-77.2	-69	0	0	0	111.2	R235 E236 A241 G242 E243	R235-H239 PolarHBondContact O-CD2 3.45Å; R235-H239 PolarHBondContact O-N 3.03Å; E236-H239 PolarHBondContact O-N 3.28Å; H239-A241 PolarHBondContact O-N 3.4Å; H239-G242 CarbonylContact O-C 3.58Å; H239-G242 WeakPolarHBondContact O-CA 3.42Å; H239-G242 PolarHBondContact O-N 3.21Å; H239-G242 VanDerWaalsContact O-N 3.13Å; H239-E243 PolarHBondContact O-N 3.01Å
240	Q	73.8	Confident	69.3	Low	109 Å²	109	111.1 Å²	111.1	51%	0.509	55%	0.548	S	S	.	.	H	α-helix	trans	-65.5	-37.6	177	-168.2	178.1	57.7	0	0	112.4	E236 E243 R244	E236-Q240 VanDerWaalsContact O-CB 3.31Å; E236-Q240 WeakPolarHBondContact O-CB 3.46Å; E236-Q240 PolarHBondContact O-N 2.89Å; Q240-E243 PolarHBondContact O-N 3.42Å; Q240-R244 WeakPolarHBondContact O-CB 3.31Å; Q240-R244 VanDerWaalsContact O-CG 3.32Å; Q240-R244 WeakPolarHBondContact O-CG 3.29Å; Q240-R244 PolarHBondContact O-N 2.9Å
241	A	68.5	Low	70.1	Confident	55 Å²	55	115.8 Å²	115.8	46%	0.455	56%	0.562	S	S	.	*	H	α-helix	trans	-66.4	-37.9	171.5	0	0	0	0	0	111.8	K237 H239 R244 L245	K237-A241 WeakPolarHBondContact O-CB 3.36Å; K237-A241 PolarHBondContact O-N 3.48Å; H239-A241 PolarHBondContact O-N 3.4Å; A241-R244 PolarHBondContact O-N 3.35Å; A241-L245 WeakPolarHBondContact O-CB 3.43Å; A241-L245 PolarHBondContact O-N 3.48Å
242	G	76.8	Confident	70.4	Confident	31 Å²	31	117.3 Å²	117.3	32%	0.32	57%	0.565	S	S	.	*	H	α-helix	trans	-64.7	-39.8	174.3	0	0	0	0	0	113.2	M238 H239 L245 K246	M238-G242 PolarHBondContact O-N 2.92Å; H239-G242 CarbonylContact O-C 3.58Å; H239-G242 WeakPolarHBondContact O-CA 3.42Å; H239-G242 PolarHBondContact O-N 3.21Å; H239-G242 VanDerWaalsContact O-N 3.13Å; G242-L245 PolarHBondContact O-N 2.93Å; G242-K246 WeakPolarHBondContact O-CG 3.43Å; G242-K246 PolarHBondContact O-N 3.18Å
243	E	73.9	Confident	70.9	Confident	123 Å²	123	119.8 Å²	119.8	58%	0.575	57%	0.565	S	S	*	*	H	α-helix	trans	-69.6	-40.6	175	-73.3	-174.4	153.6	0	0	112.3	H239 Q240 L245 K246 Q247	H239-E243 PolarHBondContact O-N 3.01Å; Q240-E243 PolarHBondContact O-N 3.42Å; E243-L245 VanDerWaalsContact C-N 3.29Å; E243-L245 PolarHBondContact O-N 3.42Å; E243-K246 PolarHBondContact O-N 2.76Å; E243-Q247 WeakPolarHBondContact O-CG 3.3Å; E243-Q247 PolarHBondContact O-N 3.33Å
244	R	71.7	Confident	71.2	Confident	171 Å²	171	117.9 Å²	117.9	65%	0.645	56%	0.556	S	S	*	*	H	α-helix	trans	-61.6	-37.6	172.8	-77.4	177.3	137.2	152.9	-2.9	112.4	Q240 A241 S248	Q240-R244 WeakPolarHBondContact O-CB 3.31Å; Q240-R244 VanDerWaalsContact O-CG 3.32Å; Q240-R244 WeakPolarHBondContact O-CG 3.29Å; Q240-R244 PolarHBondContact O-N 2.9Å; A241-R244 PolarHBondContact O-N 3.35Å; R244-S248 VanDerWaalsContact O-CB 3.3Å; R244-S248 WeakPolarHBondContact O-CB 3.09Å; R244-S248 PolarHBondContact O-N 3.42Å
245	L	75.9	Confident	71.6	Confident	126 Å²	126	113.6 Å²	113.6	66%	0.66	55%	0.546	S	S	*	.	H	α-helix	trans	-68.3	-39.4	175.4	-176.9	62.9	0	0	0	111.8	A241 G242 E243 S248 G249	A241-L245 WeakPolarHBondContact O-CB 3.43Å; A241-L245 PolarHBondContact O-N 3.48Å; G242-L245 PolarHBondContact O-N 2.93Å; E243-L245 VanDerWaalsContact C-N 3.29Å; E243-L245 PolarHBondContact O-N 3.42Å; L245-S248 PolarHBondContact O-N 3.43Å; L245-G249 PolarHBondContact O-N 2.99Å
246	K	76.8	Confident	71.7	Confident	156 Å²	156	111.6 Å²	111.6	68%	0.678	55%	0.546	S	S	*	.	H	α-helix	trans	-61.9	-47.7	173.4	-75	-178.9	178	-171.8	0	111.6	G242 E243 S248 G249 E250	G242-K246 WeakPolarHBondContact O-CG 3.43Å; G242-K246 PolarHBondContact O-N 3.18Å; E243-K246 PolarHBondContact O-N 2.76Å; K246-S248 VanDerWaalsContact C-N 3.33Å; K246-S248 PolarHBondContact O-N 3.1Å; K246-G249 PolarHBondContact O-N 3.11Å; K246-E250 WeakPolarHBondContact O-CG 3.32Å; K246-E250 PolarHBondContact O-N 2.95Å
247	Q	76.3	Confident	71.7	Confident	107 Å²	107	108.3 Å²	108.3	50%	0.5	54%	0.543	S	S	.	.	H	α-helix	trans	-63.7	-37.1	176.6	-71.3	177.8	8.3	0	0	112.5	E243 E250 R251	E243-Q247 WeakPolarHBondContact O-CG 3.3Å; E243-Q247 PolarHBondContact O-N 3.33Å; Q247-E250 PolarHBondContact O-N 3.28Å; Q247-R251 WeakPolarHBondContact O-CB 3.44Å; Q247-R251 VanDerWaalsContact O-CG 3.29Å; Q247-R251 WeakPolarHBondContact O-CG 3.12Å; Q247-R251 PolarHBondContact O-N 3.24Å
248	S	71.3	Confident	71.5	Confident	72 Å²	72	108.9 Å²	108.9	50%	0.503	55%	0.545	S	S	.	.	H	α-helix	trans	-67	-40.8	174.1	178.6	0	0	0	0	111.9	R244 L245 K246 R251 L252	R244-S248 VanDerWaalsContact O-CB 3.3Å; R244-S248 WeakPolarHBondContact O-CB 3.09Å; R244-S248 PolarHBondContact O-N 3.42Å; L245-S248 PolarHBondContact O-N 3.43Å; K246-S248 VanDerWaalsContact C-N 3.33Å; K246-S248 PolarHBondContact O-N 3.1Å; S248-R251 PolarHBondContact O-N 3.48Å; S248-L252 WeakPolarHBondContact O-CB 3.45Å; S248-L252 PolarHBondContact O-N 3.17Å
249	G	75.3	Confident	71.1	Confident	27 Å²	27	111.3 Å²	111.3	28%	0.278	55%	0.553	S	S	.	*	H	α-helix	trans	-64.3	-37.1	174.7	0	0	0	0	0	113.1	L245 K246 L252 K253	L245-G249 PolarHBondContact O-N 2.99Å; K246-G249 PolarHBondContact O-N 3.11Å; G249-L252 PolarHBondContact O-N 3.29Å; G249-K253 VanDerWaalsContact O-CG 3.31Å; G249-K253 WeakPolarHBondContact O-CG 3.46Å; G249-K253 PolarHBondContact O-N 3.44Å
250	E	73.4	Confident	70.1	Confident	128 Å²	128	108.9 Å²	108.9	60%	0.598	55%	0.552	S	S	*	*	H	α-helix	trans	-67.1	-44.4	173.4	-74.3	172.2	170.4	0	0	111.8	K246 Q247 L252 K253 E254	K246-E250 WeakPolarHBondContact O-CG 3.32Å; K246-E250 PolarHBondContact O-N 2.95Å; Q247-E250 PolarHBondContact O-N 3.28Å; E250-L252 VanDerWaalsContact C-N 3.31Å; E250-L252 PolarHBondContact O-N 2.76Å; E250-K253 PolarHBondContact O-N 2.99Å; E250-E254 WeakPolarHBondContact O-CB 3.26Å; E250-E254 PolarHBondContact O-N 2.99Å
251	R	73	Confident	69	Low	167 Å²	167	108 Å²	108	63%	0.63	56%	0.556	S	S	*	*	H	α-helix	trans	-64.2	-33.2	174.7	-72.2	174.8	179	-167.4	0.4	113.1	Q247 S248 N255	Q247-R251 WeakPolarHBondContact O-CB 3.44Å; Q247-R251 VanDerWaalsContact O-CG 3.29Å; Q247-R251 WeakPolarHBondContact O-CG 3.12Å; Q247-R251 PolarHBondContact O-N 3.24Å; S248-R251 PolarHBondContact O-N 3.48Å; R251-N255 WeakPolarHBondContact O-CB 3.35Å; R251-N255 PolarHBondContact O-N 3.48Å; R251-N255 PolarHBondContact O-ND2 2.91Å
252	L	69.8	Low	68.6	Low	109 Å²	109	110.6 Å²	110.6	57%	0.571	57%	0.566	S	S	*	*	H	α-helix	trans	-68	-45.6	174.5	-169.3	88.9	0	0	0	110.5	S248 G249 E250 E254 N255 I256	S248-L252 WeakPolarHBondContact O-CB 3.45Å; S248-L252 PolarHBondContact O-N 3.17Å; G249-L252 PolarHBondContact O-N 3.29Å; E250-L252 VanDerWaalsContact C-N 3.31Å; E250-L252 PolarHBondContact O-N 2.76Å; L252-E254 VanDerWaalsContact C-N 3.32Å; L252-E254 PolarHBondContact O-N 3.32Å; L252-N255 PolarHBondContact O-N 3.03Å; L252-I256 HydrophobicContact CD2-CD1 4.06Å; L252-I256 HydrophobicContact CG-CD1 3.88Å; L252-I256 WeakPolarHBondContact O-CB 3.41Å; L252-I256 WeakPolarHBondContact O-CD1 3.42Å; L252-I256 VanDerWaalsContact O-CG1 3.24Å; L252-I256 WeakPolarHBondContact O-CG1 3.3Å; L252-I256 PolarHBondContact O-N 2.91Å
253	K	73.2	Confident	67.6	Low	158 Å²	158	118 Å²	118	69%	0.687	59%	0.589	S	S	*	*	H	α-helix	trans	-60.1	-42.1	174.9	-73.8	174.6	-179.9	-176.2	0	111.7	G249 E250 I256 A257	G249-K253 VanDerWaalsContact O-CG 3.31Å; G249-K253 WeakPolarHBondContact O-CG 3.46Å; G249-K253 PolarHBondContact O-N 3.44Å; E250-K253 PolarHBondContact O-N 2.99Å; K253-I256 PolarHBondContact O-N 2.95Å; K253-A257 WeakPolarHBondContact O-CB 3.38Å; K253-A257 PolarHBondContact O-N 3.45Å
254	E	69.1	Low	66.8	Low	100 Å²	100	119.2 Å²	119.2	47%	0.467	60%	0.595	S	S	.	*	H	α-helix	trans	-66.4	-39.2	177	-167.2	-178.4	176.9	0	0	112.4	E250 L252 A257 K258	E250-E254 WeakPolarHBondContact O-CB 3.26Å; E250-E254 PolarHBondContact O-N 2.99Å; L252-E254 VanDerWaalsContact C-N 3.32Å; L252-E254 PolarHBondContact O-N 3.32Å; E254-A257 PolarHBondContact O-N 2.77Å; E254-K258 HydrophobicContact CG-CD 4.26Å; E254-K258 WeakPolarHBondContact O-CB 3.47Å; E254-K258 VanDerWaalsContact O-CG 3.3Å; E254-K258 WeakPolarHBondContact O-CG 3.49Å; E254-K258 PolarHBondContact O-N 2.63Å; E254-K258 VanDerWaalsContact OE1-CE 3.31Å; E254-K258 WeakPolarHBondContact OE1-CE 3.5Å; E254-K258 IonicContact OE1-NZ 3.24Å; E254-K258 PolarHBondContact OE1-NZ 2.96Å
255	N	68.6	Low	66	Low	88 Å²	88	115.1 Å²	115.1	47%	0.471	59%	0.589	S	S	.	*	H	α-helix	trans	-69.3	-36.8	175.6	-89.7	-75.2	0	0	0	113.1	R251 L252 K258 K259	R251-N255 WeakPolarHBondContact O-CB 3.35Å; R251-N255 PolarHBondContact O-N 3.48Å; R251-N255 PolarHBondContact O-ND2 2.91Å; L252-N255 PolarHBondContact O-N 3.03Å; N255-K258 PolarHBondContact O-N 2.98Å; N255-K259 WeakPolarHBondContact O-CB 3.48Å; N255-K259 PolarHBondContact O-N 2.7Å
256	I	66.9	Low	64.8	Low	107 Å²	107	116.6 Å²	116.6	55%	0.549	59%	0.59	S	S	.	*	H	α-helix	trans	-69	-39.9	175.9	-67.5	164.6	0	0	0	110.1	L252 K253 K259 A260	L252-I256 HydrophobicContact CD2-CD1 4.06Å; L252-I256 HydrophobicContact CG-CD1 3.88Å; L252-I256 WeakPolarHBondContact O-CB 3.41Å; L252-I256 WeakPolarHBondContact O-CD1 3.42Å; L252-I256 VanDerWaalsContact O-CG1 3.24Å; L252-I256 WeakPolarHBondContact O-CG1 3.3Å; L252-I256 PolarHBondContact O-N 2.91Å; K253-I256 PolarHBondContact O-N 2.95Å; I256-K259 PolarHBondContact O-N 2.7Å; I256-A260 WeakPolarHBondContact O-CB 3.31Å; I256-A260 PolarHBondContact O-N 2.82Å
257	A	64.4	Low	63.7	Low	74 Å²	74	118.1 Å²	118.1	61%	0.612	59%	0.592	S	S	*	*	H	α-helix	trans	-65.4	-36.6	175.1	0	0	0	0	0	112.6	K253 E254	K253-A257 WeakPolarHBondContact O-CB 3.38Å; K253-A257 PolarHBondContact O-N 3.45Å; E254-A257 PolarHBondContact O-N 2.77Å
258	K	64.3	Low	62.7	Low	149 Å²	149	119.5 Å²	119.5	65%	0.648	60%	0.601	S	S	*	*	H	α-helix	trans	-80.1	-20.1	178.2	-70.6	177.9	-174.1	175.3	0	114.4	E254 N255	E254-K258 HydrophobicContact CG-CD 4.26Å; E254-K258 WeakPolarHBondContact O-CB 3.47Å; E254-K258 VanDerWaalsContact O-CG 3.3Å; E254-K258 WeakPolarHBondContact O-CG 3.49Å; E254-K258 PolarHBondContact O-N 2.63Å; E254-K258 VanDerWaalsContact OE1-CE 3.31Å; E254-K258 WeakPolarHBondContact OE1-CE 3.5Å; E254-K258 IonicContact OE1-NZ 3.24Å; E254-K258 PolarHBondContact OE1-NZ 2.96Å; N255-K258 PolarHBondContact O-N 2.98Å
259	K	58.9	Low	61.9	Low	170 Å²	170	124.6 Å²	124.6	74%	0.739	62%	0.615	S	S	*	*	H	α-helix	trans	-107.1	5.4	178	-70.7	-173.8	176.7	-174.1	0	114.2	N255 I256 P261	N255-K259 WeakPolarHBondContact O-CB 3.48Å; N255-K259 PolarHBondContact O-N 2.7Å; I256-K259 PolarHBondContact O-N 2.7Å; K259-P261 WeakPolarHBondContact O-CD 3.46Å
260	A	50.3	Low	60.6	Low	60 Å²	60	130.8 Å²	130.8	50%	0.496	64%	0.64	S	S	.	*	S	Bend	trans	-67.1	121.7	172.7	0	0	0	0	0	109.5	I256 T262	I256-A260 WeakPolarHBondContact O-CB 3.31Å; I256-A260 PolarHBondContact O-N 2.82Å; A260-T262 PolarHBondContact O-N 2.83Å
261	P	51.2	Low	59.3	Low	91 Å²	91	134 Å²	134	59%	0.591	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-66.9	126.1	179.8	26.5	-31.3	0	0	0	109.6	K259	K259-P261 WeakPolarHBondContact O-CD 3.46Å
262	T	59.1	Low	58.2	Low	109 Å²	109	135 Å²	135	67%	0.669	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-63.6	150.8	176.4	46.1	0	0	0	0	110.7	A260 E264 T265	A260-T262 PolarHBondContact O-N 2.83Å; T262-E264 PolarHBondContact O-N 2.84Å; T262-T265 PolarHBondContact O-N 2.94Å; T262-T265 PolarHBondContact O-OG1 2.88Å
263	K	56.6	Low	56.8	Low	187 Å²	187	138.7 Å²	138.7	81%	0.813	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.2	-1.9	-169	-67.1	177.3	175.2	178.2	0	116.7
264	E	57.3	Low	55.5	Low	148 Å²	148	142.8 Å²	142.8	69%	0.692	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-28.8	176.6	-77.9	-171.1	143.6	0	0	113.8	T262 F266 R267	T262-E264 PolarHBondContact O-N 2.84Å; E264-F266 PolarHBondContact O-N 3.3Å; E264-R267 PolarHBondContact O-N 3.23Å
265	T	55.3	Low	54	Low	85 Å²	85	142.3 Å²	142.3	52%	0.521	70%	0.7	S	S	.	*	H	α-helix	trans	-70.3	-20.2	-177.3	-10.5	0	0	0	0	113.3	T262	T262-T265 PolarHBondContact O-N 2.94Å; T262-T265 PolarHBondContact O-OG1 2.88Å
266	F	50.3	Low	52.5	Low	156 Å²	156	144.7 Å²	144.7	68%	0.684	72%	0.717	S	S	*	*	H	α-helix	trans	-83.8	-20.7	177.3	-80.2	-84.5	0	0	0	114	E264	E264-F266 PolarHBondContact O-N 3.3Å
267	R	54.2	Low	51.1	Low	188 Å²	188	143.8 Å²	143.8	71%	0.709	73%	0.725	S	S	*	*	H	α-helix	trans	-78.1	-25.1	178.9	-80.9	-171.8	170.7	115.4	-3.9	113.6	E264	E264-R267 PolarHBondContact O-N 3.23Å
268	I	54.6	Low	49.6	Very low	136 Å²	136	149.8 Å²	149.8	70%	0.697	74%	0.741	S	S	*	*	H	α-helix	trans	-75.8	-32.6	-178.2	-61.9	172.3	0	0	0	111.4
269	K	53.5	Low	48	Very low	180 Å²	180	146 Å²	146	78%	0.783	75%	0.745	S	S	*	*	H	α-helix	trans	-76.1	-27.3	178.8	-83.5	-174.6	174.7	-179.3	0	114.2	K271	K269-K271 VanDerWaalsContact C-N 3.32Å; K269-K271 PolarHBondContact O-N 3.46Å
270	L	48.1	Very low	46.5	Very low	157 Å²	157	146.1 Å²	146.1	82%	0.822	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-12.7	-175.3	-148.5	77.6	0	0	0	114.2
271	K	46.3	Very low	45.6	Very low	196 Å²	196	151.9 Å²	151.9	85%	0.852	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-1.4	-178.6	-72.1	-170.6	174.8	-175.6	0	114.9	K269	K269-K271 VanDerWaalsContact C-N 3.32Å; K269-K271 PolarHBondContact O-N 3.46Å
272	K	49.6	Very low	44.6	Very low	187 Å²	187	150.7 Å²	150.7	81%	0.813	77%	0.768	S	S	*	*	S	Bend	trans	-102.9	-0.4	-175.1	-167.1	165	176.3	177.6	0	115.2
273	E	41.7	Very low	43.3	Very low	186 Å²	186	150.2 Å²	150.2	87%	0.869	78%	0.775	S	S	*	*	S	Bend	trans	-126.6	54.1	180	-73.8	-162.5	145.8	0	0	113.1
274	R	45	Very low	42.1	Very low	245 Å²	245	151 Å²	151	93%	0.925	78%	0.782	S	S	*	*			trans	-151.7	77.6	164.6	-160	175.5	-174.3	-176.4	1.2	111.7
275	A	38.6	Very low	40.8	Very low	90 Å²	90	147.4 Å²	147.4	74%	0.744	79%	0.785	S	S	*	*			trans	-161.2	135.1	156.8	0	0	0	0	0	110.5
276	V	36.2	Very low	39.6	Very low	138 Å²	138	152.6 Å²	152.6	84%	0.836	80%	0.803	S	S	*	*			trans	88.3	90.1	162.8	-165.8	0	0	0	0	114.8
277	A	38.3	Very low	38.6	Very low	87 Å²	87	149 Å²	149	72%	0.719	81%	0.811	S	S	*	*				91.6	108.2	84.6	0	0	0	0	0	110.1
278	E	32.5	Very low	37.7	Very low	201 Å²	201	148.2 Å²	148.2	94%	0.939	82%	0.815	S	S	*	*				54	111.5	75.5	-163.4	176.7	-174.6	0	0	113.2
279	G	30.8	Very low	37.3	Very low	70 Å²	70	146.8 Å²	146.8	72%	0.722	82%	0.815	S	S	*	*			trans	121.6	108.3	155.2	0	0	0	0	0	117.6
280	Q	27.5	Very low	36.1	Very low	172 Å²	172	143.1 Å²	143.1	80%	0.804	82%	0.818	S	S	*	*				81.7	110.9	122.9	-152.9	164.7	22	0	0	121.5
281	E	31.8	Very low	35.4	Very low	180 Å²	180	145.2 Å²	145.2	84%	0.841	82%	0.82	S	S	*	*				50	136.2	123.1	-143.7	177.1	-166.9	0	0	121.9
282	G	30.4	Very low	34.6	Very low	66 Å²	66	144.8 Å²	144.8	68%	0.68	82%	0.822	S	S	*	*			trans	120.4	100.4	167.7	0	0	0	0	0	111.6
283	A	30.3	Very low	33.7	Very low	99 Å²	99	145.4 Å²	145.4	82%	0.818	83%	0.827	S	S	*	*				67.7	136	73.7	0	0	0	0	0	113.2
284	E	31.9	Very low	33.2	Very low	203 Å²	203	141.5 Å²	141.5	95%	0.949	82%	0.821	S	S	*	*			trans	84.3	131	179.3	-50.8	-174.1	173.5	0	0	115.2
285	G	30.8	Very low	32.6	Very low	74 Å²	74	134.4 Å²	134.4	76%	0.763	82%	0.815	S	S	*	*			cis	-175.8	145.8	2.7	0	0	0	0	0	108
286	E	29.7	Very low	32.4	Very low	193 Å²	193	134.6 Å²	134.6	90%	0.902	82%	0.816	S	S	*	*			trans	-66.9	150.9	179.5	-68.2	176.6	137.3	0	0	113
287	G	29	Very low	32.2	Very low	82 Å²	82	136.4 Å²	136.4	85%	0.845	82%	0.815	S	S	*	*			trans	-134.3	90.3	161.9	0	0	0	0	0	109.4
288	E	36	Very low	31.9	Very low	171 Å²	171	138.2 Å²	138.2	80%	0.799	82%	0.818	S	S	*	*			trans	-55.3	-178.5	169.8	-101.7	-160.2	146.4	0	0	114.9
289	P	44.8	Very low	32.1	Very low	106 Å²	106	135.9 Å²	135.9	69%	0.688	80%	0.804	S	S	*	*			cis	-139.2	169.3	-28.5	32.1	-13.3	0	0	0	113.8
290	A	29.3	Very low	32.3	Very low	103 Å²	103	142.1 Å²	142.1	85%	0.851	81%	0.806	S	S	*	*			trans	-143.5	97.3	155.1	0	0	0	0	0	111.9
291	K	33.2	Very low	32.7	Very low	200 Å²	200	142.4 Å²	142.4	87%	0.87	81%	0.807	S	S	*	*			trans	17.9	105.8	151.4	-68.9	-179.7	174.1	-177.7	0	120.3
292	E	29.9	Very low	32.9	Very low	188 Å²	188	137 Å²	137	88%	0.879	80%	0.801	S	S	*	*				28.5	118.5	105.7	-132.4	170.4	-158.7	0	0	120.5
293	E	30.6	Very low	33.5	Very low	199 Å²	199	140.2 Å²	140.2	93%	0.93	81%	0.81	S	S	*	*			trans	-144.9	136.2	135.3	-160.5	176.2	-168	0	0	109.5
294	S	30.3	Very low	33.9	Very low	104 Å²	104	142.4 Å²	142.4	73%	0.727	81%	0.812	S	S	*	*			trans	-113.3	149.6	-162.8	58.1	0	0	0	0	113.4
295	A	32.3	Very low	34.3	Very low	97 Å²	97	141.6 Å²	141.6	80%	0.802	81%	0.808	S	S	*	*			trans	-170.4	107.3	142.5	0	0	0	0	0	109.8
296	A	34	Very low	34.6	Very low	94 Å²	94	146.7 Å²	146.7	78%	0.777	81%	0.812	S	S	*	*				68.9	96.1	101.3	0	0	0	0	0	114
297	E	32.3	Very low	35	Very low	175 Å²	175	142 Å²	142	82%	0.818	81%	0.807	S	S	*	*				88.5	121.5	90.5	-166.1	-176.6	159.4	0	0	112.8
298	T	33.4	Very low	35.3	Very low	125 Å²	125	141.8 Å²	141.8	77%	0.767	81%	0.805	S	S	*	*				178.6	109.2	128.4	-62.1	0	0	0	0	111.2
299	K	36.6	Very low	35.4	Very low	152 Å²	152	138 Å²	138	66%	0.661	80%	0.803	S	S	*	*			trans	36.6	123.1	135.7	-93.8	177.6	167.5	175.4	0	120.7
300	R	34.3	Very low	35.3	Very low	201 Å²	201	139.6 Å²	139.6	76%	0.758	81%	0.81	S	S	*	*				75.2	133.7	93.8	-83.9	-166.7	-164	170.3	1.4	112.6
301	E	35.4	Very low	35.9	Very low	178 Å²	178	145.9 Å²	145.9	83%	0.832	81%	0.812	S	S	*	*			cis	-149.4	167.9	30.6	-68.4	-167.3	146.1	0	0	112.1
302	G	36.2	Very low	36.6	Very low	68 Å²	68	143 Å²	143	70%	0.701	81%	0.811	S	S	*	*			trans	-87.6	-160.3	-171.6	0	0	0	0	0	116.8
303	P	44.2	Very low	37.2	Very low	133 Å²	133	139.4 Å²	139.4	86%	0.864	81%	0.807	S	S	*	*			trans	-94.4	156.5	-155	37.6	-34.2	0	0	0	113.4
304	V	36.8	Very low	38	Very low	144 Å²	144	142.6 Å²	142.6	87%	0.873	82%	0.822	S	S	*	*			trans	-108.5	111.4	172.7	-179.6	0	0	0	0	109.1
305	E	41.3	Very low	38.4	Very low	186 Å²	186	144.6 Å²	144.6	87%	0.869	83%	0.826	S	S	*	*			trans	-94.1	140.6	146	-82.8	-158.6	150.3	0	0	107.9
306	E	37.4	Very low	38.7	Very low	181 Å²	181	147.1 Å²	147.1	85%	0.846	83%	0.828	S	S	*	*				-178.2	133.2	116.8	-135.8	-170.1	139.5	0	0	111.9
307	A	38.5	Very low	39	Very low	95 Å²	95	150 Å²	150	79%	0.785	83%	0.831	S	S	*	*			trans	36.7	140.8	139.5	0	0	0	0	0	123.7
308	G	33.6	Very low	39.3	Very low	78 Å²	78	148.5 Å²	148.5	80%	0.804	83%	0.831	S	S	*	*			trans	146.7	90.7	136.4	0	0	0	0	0	118.2
309	A	38.6	Very low	39.7	Very low	92 Å²	92	150 Å²	150	76%	0.76	84%	0.835	S	S	*	*			trans	24.8	128.1	143.4	0	0	0	0	0	121.5
310	T	42.3	Very low	39.9	Very low	138 Å²	138	149.9 Å²	149.9	85%	0.847	85%	0.847	S	S	*	*				-174.5	130.3	97.8	22.5	0	0	0	0	112.1
311	R	41.9	Very low	40.3	Very low	236 Å²	236	146.2 Å²	146.2	89%	0.891	85%	0.853	S	S	*	*			trans	-76.4	139.8	162.8	-76.3	175	171.4	169.8	-3.6	108.2
312	V	48.8	Very low	40.7	Very low	140 Å²	140	143.8 Å²	143.8	85%	0.848	86%	0.855	S	S	*	*			trans	-127.5	123.2	154	179.8	0	0	0	0	107.2
313	S	42.5	Very low	41.1	Very low	112 Å²	112	150.1 Å²	150.1	78%	0.783	87%	0.868	S	S	*	*			trans	-114.4	114.7	166.2	-56.4	0	0	0	0	105.7
314	E	47	Very low	40.8	Very low	266 Å²	266	151.6 Å²	151.6	100%	1.243	87%	0.868	S	S	*	*			trans	-165	0	138.3	-149.6	173.2	145.3	0	0	108.3

Retrieved 314 of 314 residues in 107.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).