A0A061AKM4_CAEEL Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A061AKM4, Species CAEEL (Caenorhabditis elegans), Gene n/a, Length 234 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.7	Very low	43.8	Very low	216 Å²	216	135.4 Å²	135.4	100%	1.064	71%	0.714	S	S	*	*				0	40	0	-94.5	-169.1	-86.2	0	0	108.9
2	D	49.1	Very low	43.3	Very low	126 Å²	126	133.3 Å²	133.3	67%	0.674	71%	0.711	S	S	*	*			trans	-119.3	-1.3	-159.9	-60.4	-79.2	0	0	0	113.4
3	V	49.3	Very low	42.9	Very low	117 Å²	117	137.5 Å²	137.5	71%	0.709	72%	0.719	S	S	*	*	H	α-helix	trans	-87.9	-32.8	175.9	-173.8	0	0	0	0	111.2
4	M	42.6	Very low	42.3	Very low	164 Å²	164	140.1 Å²	140.1	81%	0.808	73%	0.726	S	S	*	*	H	α-helix	trans	-74.4	-25.3	177.2	-81.1	-172.7	170.5	0	0	113.3	L8	M4-L8 PolarHBondContact O-N 2.87Å
5	L	46.8	Very low	41.9	Very low	110 Å²	110	136.3 Å²	136.3	58%	0.576	74%	0.735	S	S	*	*	H	α-helix	trans	-73.8	-33.3	178.6	-145	83.6	0	0	0	112.3	I7 L8 M9	L5-I7 VanDerWaalsContact C-N 3.34Å; L5-I7 PolarHBondContact O-N 3.32Å; L5-L8 PolarHBondContact O-N 3.43Å; L5-M9 PolarHBondContact O-N 3.47Å
6	N	41	Very low	41.5	Very low	123 Å²	123	133.7 Å²	133.7	66%	0.658	74%	0.738	S	S	*	*	H	α-helix	trans	-69.6	-29.6	176.3	-92.5	-3.7	0	0	0	113.3	S10	N6-S10 PolarHBondContact O-N 3.18Å
7	I	47.4	Very low	41.4	Very low	121 Å²	121	130.6 Å²	130.6	62%	0.621	73%	0.728	S	S	*	*	H	α-helix	trans	-74	-35.1	175.1	-62	172.8	0	0	0	110.1	L5 S10	L5-I7 VanDerWaalsContact C-N 3.34Å; L5-I7 PolarHBondContact O-N 3.32Å; I7-S10 PolarHBondContact O-N 2.75Å
8	L	39.3	Very low	41.6	Very low	123 Å²	123	133.2 Å²	133.2	64%	0.644	74%	0.74	S	S	*	*	H	α-helix	trans	-74.3	-32.3	178.3	-144.3	78	0	0	0	112.8	M4 L5 S10	M4-L8 PolarHBondContact O-N 2.87Å; L5-L8 PolarHBondContact O-N 3.43Å; L8-S10 VanDerWaalsContact C-N 3.31Å; L8-S10 PolarHBondContact O-N 3.08Å
9	M	42.2	Very low	42.2	Very low	140 Å²	140	128.2 Å²	128.2	69%	0.69	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-77.9	-9.4	174.1	-98.1	-171	164.1	0	0	114.4	L5 M11 T12	L5-M9 PolarHBondContact O-N 3.47Å; M9-M11 VanDerWaalsContact C-N 3.32Å; M9-T12 PolarHBondContact O-OG1 3.33Å
10	S	35.5	Very low	43.6	Very low	89 Å²	89	124.7 Å²	124.7	62%	0.622	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-83.6	-5.9	174.3	-163.8	0	0	0	0	113.5	N6 I7 L8	N6-S10 PolarHBondContact O-N 3.18Å; I7-S10 PolarHBondContact O-N 2.75Å; L8-S10 VanDerWaalsContact C-N 3.31Å; L8-S10 PolarHBondContact O-N 3.08Å
11	M	40.8	Very low	44.9	Very low	160 Å²	160	126.7 Å²	126.7	79%	0.788	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-93.7	0.7	177.3	-63.6	-144.9	-56	0	0	114.4	M9	M9-M11 VanDerWaalsContact C-N 3.32Å
12	T	38.5	Very low	46.3	Very low	110 Å²	110	117.4 Å²	117.4	68%	0.675	66%	0.662	S	S	*	*			trans	-111.8	9.6	175.9	46.5	0	0	0	0	113.5	M9 E14	M9-T12 PolarHBondContact O-OG1 3.33Å; T12-E14 PolarHBondContact O-N 2.76Å
13	K	36.9	Very low	47.5	Very low	189 Å²	189	115.5 Å²	115.5	82%	0.822	65%	0.654	S	S	*	*	S	Bend	trans	-78.4	86.3	167.9	-154.7	173.5	-175	179.5	0	108.8
14	E	35.2	Very low	48.4	Very low	173 Å²	173	109.9 Å²	109.9	81%	0.808	62%	0.621	S	S	*	*			trans	1.8	121.5	154.8	-64.7	179.6	150.4	0	0	114.5	T12 A16	T12-E14 PolarHBondContact O-N 2.76Å; E14-A16 PolarHBondContact O-N 2.91Å
15	G	35.5	Very low	49.4	Very low	84 Å²	84	104.5 Å²	104.5	87%	0.866	60%	0.598	S	S	*	*			trans	-60.3	85.9	169.7	0	0	0	0	0	111.2	S17	G15-S17 PolarHBondContact O-N 3.43Å
16	A	36.5	Very low	49.6	Very low	94 Å²	94	103.2 Å²	103.2	78%	0.777	60%	0.603	S	S	*	*			trans	-65.9	93.7	150.1	0	0	0	0	0	106.2	E14 D18	E14-A16 PolarHBondContact O-N 2.91Å; A16-D18 PolarHBondContact O-N 3.37Å
17	S	40.1	Very low	50.5	Low	82 Å²	82	107.5 Å²	107.5	57%	0.573	62%	0.616	S	S	*	*			trans	-54.4	104.3	167.3	164.9	0	0	0	0	107.6	G15 G19	G15-S17 PolarHBondContact O-N 3.43Å; S17-G19 PolarHBondContact O-N 3.49Å
18	D	44.5	Very low	51.4	Low	177 Å²	177	104.2 Å²	104.2	95%	0.947	60%	0.601	S	S	*	*			trans	-69.8	58.7	171.3	-161.9	28.5	0	0	0	109.9	A16	A16-D18 PolarHBondContact O-N 3.37Å
19	G	53.7	Low	53.5	Low	38 Å²	38	101.6 Å²	101.6	39%	0.392	59%	0.593	S	S	.	*	S	Bend	trans	-119.8	159.7	-178.8	0	0	0	0	0	109.6	S17 Q21	S17-G19 PolarHBondContact O-N 3.49Å; G19-Q21 PolarHBondContact O-N 3.4Å
20	P	68.6	Low	55.6	Low	58 Å²	58	99.2 Å²	99.2	38%	0.377	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-54.9	134.3	-179.7	18.2	-28.5	0	0	0	111.1	F22 A109 Y177	P20-F22 HydrophobicContact CB-CE2 4.14Å; P20-F22 HydrophobicContact CB-CZ 4.1Å; P20-F22 HydrophobicContact CG-CE2 3.82Å; P20-F22 HydrophobicContact CG-CZ 3.74Å; P20-F22 WeakPolarHBondContact O-CD2 3.47Å; P20-F22 WeakPolarHBondContact O-CE2 3.4Å; P20-A109 HydrophobicContact CB-CB 3.4Å; P20-A109 VanDerWaalsContact CB-CB 3.4Å; P20-A109 HydrophobicContact CG-CB 3.69Å; P20-Y177 HydrophobicContact CG-CD1 4.21Å; P20-Y177 HydrophobicContact CG-CE1 3.8Å
21	Q	71.6	Confident	58.1	Low	166 Å²	166	100.4 Å²	100.4	78%	0.776	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-81.1	122	175.4	-166.7	171.9	0.4	0	0	108.7	G19 N110	G19-Q21 PolarHBondContact O-N 3.4Å; Q21-N110 PolarHBondContact O-ND2 3Å
22	F	76.6	Confident	60.3	Low	21 Å²	21	95.5 Å²	95.5	9%	0.092	56%	0.555	C	S	.	*	P	Polyproline II helix	trans	-96.1	134.6	179	-63.2	-87.9	0	0	0	109.7	P20 A109 N110 V113 Y173 A174 Y177	P20-F22 HydrophobicContact CB-CE2 4.14Å; P20-F22 HydrophobicContact CB-CZ 4.1Å; P20-F22 HydrophobicContact CG-CE2 3.82Å; P20-F22 HydrophobicContact CG-CZ 3.74Å; P20-F22 WeakPolarHBondContact O-CD2 3.47Å; P20-F22 WeakPolarHBondContact O-CE2 3.4Å; F22-A109 HydrophobicContact CE1-CB 3.68Å; F22-A109 HydrophobicContact CZ-CB 3.8Å; F22-N110 WeakPolarHBondContact CA-OD1 3.21Å; F22-N110 WeakPolarHBondContact CB-OD1 3.42Å; F22-N110 VanDerWaalsContact CD1-OD1 3.24Å; F22-N110 WeakPolarHBondContact CD1-OD1 3.4Å; F22-V113 HydrophobicContact CE1-CG2 4.1Å; F22-Y173 HydrophobicContact CD1-CG 4.44Å; F22-A174 HydrophobicContact CD2-CB 3.57Å; F22-A174 HydrophobicContact CE2-CB 3.86Å; F22-A174 HydrophobicContact CG-CB 4.35Å; F22-Y177 HydrophobicContact CE1-CD2 4.37Å; F22-Y177 HydrophobicContact CE1-CG 4.15Å; F22-Y177 HydrophobicContact CE2-CD1 4.47Å; F22-Y177 HydrophobicContact CE2-CG 4.48Å; F22-Y177 VanDerWaalsContact CZ-CB 3.42Å; F22-Y177 AromaticContact CZ-CD1 3.82Å; F22-Y177 HydrophobicContact CZ-CD1 3.82Å; F22-Y177 HydrophobicContact CZ-CD2 4.04Å; F22-Y177 AromaticContact CZ-CG 3.5Å; F22-Y177 HydrophobicContact CZ-CG 3.5Å; F22-Y177 VanDerWaalsContact CZ-CG 3.5Å
23	V	74.2	Confident	62.6	Low	86 Å²	86	90.7 Å²	90.7	52%	0.521	53%	0.525	S	S	.	.			trans	-123	114.7	-176.1	-178.6	0	0	0	0	108	N110	V23-N110 PolarHBondContact N-OD1 3Å; V23-N110 VanDerWaalsContact N-OD1 3.08Å
24	A	67.8	Low	65.1	Low	0 Å²	0	82 Å²	82	0%	0	49%	0.487	C	S	.	.			trans	-67.3	151.2	169.2	0	0	0	0	0	109.3	A26 V166 C169 E170	A24-A26 VanDerWaalsContact C-N 3.34Å; A24-A26 PolarHBondContact O-N 3.3Å; A24-V166 HydrophobicContact CB-CG1 4.18Å; A24-C169 HydrophobicContact CB-CB 3.73Å; A24-E170 HydrophobicContact CB-CG 3.73Å
25	P	64.1	Low	67.6	Low	50 Å²	50	77.1 Å²	77.1	33%	0.325	47%	0.47	S	S	.	.			trans	-63	94.7	176.8	24.5	-31.7	0	0	0	110.2	K27 T28	P25-K27 PolarHBondContact O-N 3.34Å; P25-K27 VanDerWaalsContact O-N 3.08Å; P25-T28 HydrophobicContact CB-CG2 3.87Å; P25-T28 HydrophobicContact CG-CG2 4.38Å; P25-T28 PolarHBondContact O-N 3.49Å; P25-T28 PolarHBondContact O-OG1 3.06Å
26	A	52.3	Low	70.2	Confident	83 Å²	83	74 Å²	74	69%	0.686	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-5.6	-169.6	0	0	0	0	0	114.6	A24	A24-A26 VanDerWaalsContact C-N 3.34Å; A24-A26 PolarHBondContact O-N 3.3Å
27	K	58	Low	72.7	Confident	213 Å²	213	69.5 Å²	69.5	93%	0.926	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.8	21	-176.7	-63.3	-174.9	-179.7	-179.6	0	113.8	P25	P25-K27 PolarHBondContact O-N 3.34Å; P25-K27 VanDerWaalsContact O-N 3.08Å
28	T	67.4	Low	75.1	Confident	53 Å²	53	67.6 Å²	67.6	33%	0.325	38%	0.377	S	S	.	.	S	Bend	trans	-99	153.6	179.4	47.1	0	0	0	0	112.3	P25 T32	P25-T28 HydrophobicContact CB-CG2 3.87Å; P25-T28 HydrophobicContact CG-CG2 4.38Å; P25-T28 PolarHBondContact O-N 3.49Å; P25-T28 PolarHBondContact O-OG1 3.06Å; T28-T32 HydrophobicContact CG2-CG2 3.87Å
29	S	84.3	Confident	77.3	Confident	67 Å²	67	62.7 Å²	62.7	47%	0.469	35%	0.346	S	S	.	.			trans	-59.4	157.2	177.6	71.1	0	0	0	0	111.1	D31 T32 L33	S29-D31 PolarHBondContact O-N 3.01Å; S29-T32 WeakPolarHBondContact O-CB 3.38Å; S29-T32 PolarHBondContact O-N 2.89Å; S29-T32 PolarHBondContact OG-N 3.42Å; S29-T32 PolarHBondContact OG-OG1 2.94Å; S29-L33 PolarHBondContact O-N 3.28Å
30	R	86.3	Confident	79	Confident	90 Å²	90	60.9 Å²	60.9	34%	0.34	33%	0.327	S	S	.	.	H	α-helix	trans	-53.9	-39.8	177	177.9	-180	168.3	78.4	1.7	112	L33 I34 K158 R160 S162	R30-L33 WeakPolarHBondContact O-CB 3.45Å; R30-L33 PolarHBondContact O-N 3.12Å; R30-I34 HydrophobicContact CG-CD1 4.09Å; R30-I34 WeakPolarHBondContact O-CG1 3.16Å; R30-I34 PolarHBondContact O-N 2.9Å; R30-K158 PolarHBondContact NH2-O 2.78Å; R30-R160 PolarHBondContact NH1-O 2.87Å; R30-R160 PolarHBondContact NH2-O 3.1Å; R30-S162 PolarHBondContact NH1-OG 3.45Å
31	D	86.6	Confident	80	Confident	114 Å²	114	59.6 Å²	59.6	61%	0.61	32%	0.316	S	S	*	.	H	α-helix	trans	-64.8	-41.8	178.4	-62.8	-37.6	0	0	0	111.6	S29 L33 I34 T35	S29-D31 PolarHBondContact O-N 3.01Å; D31-L33 VanDerWaalsContact C-N 3.31Å; D31-L33 PolarHBondContact O-N 3.14Å; D31-I34 PolarHBondContact O-N 3.32Å; D31-T35 PolarHBondContact O-N 2.99Å; D31-T35 PolarHBondContact O-OG1 3.24Å; D31-T35 VanDerWaalsContact O-OG1 3.07Å
32	T	86.9	Confident	80.8	Confident	58 Å²	58	57 Å²	57	36%	0.356	30%	0.299	S	S	.	.	H	α-helix	trans	-63	-36.7	174.2	-53.9	0	0	0	0	112.2	T28 S29 T35 T36	T28-T32 HydrophobicContact CG2-CG2 3.87Å; S29-T32 WeakPolarHBondContact O-CB 3.38Å; S29-T32 PolarHBondContact O-N 2.89Å; S29-T32 PolarHBondContact OG-N 3.42Å; S29-T32 PolarHBondContact OG-OG1 2.94Å; T32-T35 PolarHBondContact O-N 3.35Å; T32-T36 WeakPolarHBondContact O-CB 3.24Å; T32-T36 PolarHBondContact O-N 3.02Å; T32-T36 PolarHBondContact O-OG1 3.23Å
33	L	87.3	Confident	81.5	Confident	9 Å²	9	56.1 Å²	56.1	5%	0.047	30%	0.296	C	S	.	.	H	α-helix	trans	-64.8	-43.5	174.6	-71	173.1	0	0	0	111.7	S29 R30 D31 T36 A37 L165 V166	S29-L33 PolarHBondContact O-N 3.28Å; R30-L33 WeakPolarHBondContact O-CB 3.45Å; R30-L33 PolarHBondContact O-N 3.12Å; D31-L33 VanDerWaalsContact C-N 3.31Å; D31-L33 PolarHBondContact O-N 3.14Å; L33-T36 PolarHBondContact O-N 3.08Å; L33-A37 WeakPolarHBondContact O-CB 3.14Å; L33-A37 PolarHBondContact O-N 3.16Å; L33-L165 HydrophobicContact CB-CB 4.44Å; L33-V166 HydrophobicContact CD1-CG2 3.82Å; L33-V166 HydrophobicContact CD2-CG2 4.08Å
34	I	89.1	Confident	82.3	Confident	5 Å²	5	55.2 Å²	55.2	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-61.5	-46.9	176.2	-67.9	165.3	0	0	0	110.3	R30 D31 T36 A37 Y38 L157 K158 L165	R30-I34 HydrophobicContact CG-CD1 4.09Å; R30-I34 WeakPolarHBondContact O-CG1 3.16Å; R30-I34 PolarHBondContact O-N 2.9Å; D31-I34 PolarHBondContact O-N 3.32Å; I34-T36 VanDerWaalsContact C-N 3.33Å; I34-T36 PolarHBondContact O-N 2.74Å; I34-A37 PolarHBondContact O-N 3.36Å; I34-Y38 WeakPolarHBondContact O-CB 3.46Å; I34-Y38 PolarHBondContact O-N 3.02Å; I34-L157 HydrophobicContact CG2-CB 4.08Å; I34-K158 HydrophobicContact CD1-CG 4.13Å; I34-K158 HydrophobicContact CG2-CG 4.46Å; I34-L165 HydrophobicContact CD1-CD1 4.46Å; I34-L165 HydrophobicContact CG1-CD1 3.66Å
35	T	88.9	Confident	83.2	Confident	72 Å²	72	61.9 Å²	61.9	44%	0.442	31%	0.308	S	S	.	.	H	α-helix	trans	-59.6	-44.4	176	-56	0	0	0	0	111.3	D31 T32 Y38 R39	D31-T35 PolarHBondContact O-N 2.99Å; D31-T35 PolarHBondContact O-OG1 3.24Å; D31-T35 VanDerWaalsContact O-OG1 3.07Å; T32-T35 PolarHBondContact O-N 3.35Å; T35-Y38 WeakPolarHBondContact O-CB 3.47Å; T35-Y38 PolarHBondContact O-N 3.07Å; T35-R39 HydrophobicContact CG2-CG 4.45Å; T35-R39 VanDerWaalsContact O-CG 3.25Å; T35-R39 WeakPolarHBondContact O-CG 3.29Å; T35-R39 PolarHBondContact O-N 3.25Å
36	T	89.1	Confident	84.4	Confident	18 Å²	18	62 Å²	62	11%	0.11	30%	0.302	C	S	.	.	H	α-helix	trans	-63.2	-48	179.3	-56.8	0	0	0	0	111.4	T32 L33 I34 Y38 R39 L40	T32-T36 WeakPolarHBondContact O-CB 3.24Å; T32-T36 PolarHBondContact O-N 3.02Å; T32-T36 PolarHBondContact O-OG1 3.23Å; L33-T36 PolarHBondContact O-N 3.08Å; I34-T36 VanDerWaalsContact C-N 3.33Å; I34-T36 PolarHBondContact O-N 2.74Å; T36-Y38 VanDerWaalsContact C-N 3.29Å; T36-Y38 PolarHBondContact O-N 3.44Å; T36-R39 PolarHBondContact O-N 2.94Å; T36-L40 HydrophobicContact CG2-CD1 3.95Å; T36-L40 HydrophobicContact CG2-CG 4.42Å; T36-L40 WeakPolarHBondContact O-CB 3.4Å; T36-L40 VanDerWaalsContact O-CG 3.27Å; T36-L40 WeakPolarHBondContact O-CG 3.18Å; T36-L40 PolarHBondContact O-N 2.88Å
37	A	89.6	Confident	86.2	Confident	0 Å²	0	58 Å²	58	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.3	-42.5	176.3	0	0	0	0	0	111.7	L33 I34 L40 H41 L157 L165	L33-A37 WeakPolarHBondContact O-CB 3.14Å; L33-A37 PolarHBondContact O-N 3.16Å; I34-A37 PolarHBondContact O-N 3.36Å; A37-L40 PolarHBondContact O-N 2.71Å; A37-H41 PolarHBondContact O-CD2 3.32Å; A37-H41 VanDerWaalsContact O-CD2 3.25Å; A37-H41 PolarHBondContact O-N 3.12Å; A37-L157 HydrophobicContact CB-CD1 4.11Å; A37-L157 HydrophobicContact CB-CD2 3.98Å; A37-L165 HydrophobicContact CB-CD2 4.34Å
38	Y	89.9	Confident	87.7	Confident	41 Å²	41	48.5 Å²	48.5	16%	0.161	23%	0.228	C	C	.	.	H	α-helix	trans	-60.4	-49.3	175.6	173.8	-98.2	0	0	0	111.9	I34 T35 T36 L40 H41 R42 D150 L153 H154	I34-Y38 WeakPolarHBondContact O-CB 3.46Å; I34-Y38 PolarHBondContact O-N 3.02Å; T35-Y38 WeakPolarHBondContact O-CB 3.47Å; T35-Y38 PolarHBondContact O-N 3.07Å; T36-Y38 VanDerWaalsContact C-N 3.29Å; T36-Y38 PolarHBondContact O-N 3.44Å; Y38-L40 VanDerWaalsContact C-N 3.32Å; Y38-L40 PolarHBondContact O-N 3.41Å; Y38-H41 PolarHBondContact O-N 3.09Å; Y38-R42 WeakPolarHBondContact O-CB 3.44Å; Y38-R42 PolarHBondContact O-N 3.4Å; Y38-D150 HydrophobicContact CE2-CB 4.39Å; Y38-D150 PolarHBondContact OH-OD1 3.37Å; Y38-D150 PolarHBondContact OH-OD2 3.32Å; Y38-L153 HydrophobicContact CD2-CD2 4.09Å; Y38-H154 HydrophobicContact CD2-CB 4.49Å
39	R	90.1	Very high	88.7	Confident	75 Å²	75	51.7 Å²	51.7	28%	0.283	24%	0.24	S	C	.	.	H	α-helix	trans	-58.8	-43.4	177.3	-66.6	174.7	72.8	-164.2	2	111.7	T35 T36 R42 T43 I117 E121	T35-R39 HydrophobicContact CG2-CG 4.45Å; T35-R39 VanDerWaalsContact O-CG 3.25Å; T35-R39 WeakPolarHBondContact O-CG 3.29Å; T35-R39 PolarHBondContact O-N 3.25Å; T36-R39 PolarHBondContact O-N 2.94Å; R39-R42 PolarHBondContact O-N 3Å; R39-T43 VanDerWaalsContact O-CB 3.31Å; R39-T43 WeakPolarHBondContact O-CB 3.48Å; R39-T43 PolarHBondContact O-N 3.18Å; R39-T43 PolarHBondContact O-OG1 3.44Å; R39-I117 HydrophobicContact CB-CG2 4.01Å; R39-E121 WeakPolarHBondContact CB-OE1 3.22Å; R39-E121 WeakPolarHBondContact CD-OE1 3.5Å; R39-E121 WeakPolarHBondContact CG-OE1 3.32Å; R39-E121 IonicContact CZ-OE1 3.57Å; R39-E121 IonicContact CZ-OE2 3.22Å; R39-E121 VanDerWaalsContact NE-CD 3.26Å; R39-E121 IonicContact NE-OE1 3.43Å; R39-E121 PolarHBondContact NE-OE1 2.89Å; R39-E121 IonicContact NE-OE2 3.95Å; R39-E121 PolarHBondContact NE-OE2 3.3Å; R39-E121 VanDerWaalsContact NE-OE2 3.09Å; R39-E121 IonicContact NH2-OE1 2.87Å; R39-E121 IonicContact NH2-OE2 3.55Å; R39-E121 PolarHBondContact NH2-OE2 2.96Å
40	L	90.8	Very high	89	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.8	-49.8	177.6	-73.6	166.6	0	0	0	112	T36 A37 Y38 R42 T43 R44 I117 C169 L172 Y173 L176	T36-L40 HydrophobicContact CG2-CD1 3.95Å; T36-L40 HydrophobicContact CG2-CG 4.42Å; T36-L40 WeakPolarHBondContact O-CB 3.4Å; T36-L40 VanDerWaalsContact O-CG 3.27Å; T36-L40 WeakPolarHBondContact O-CG 3.18Å; T36-L40 PolarHBondContact O-N 2.88Å; A37-L40 PolarHBondContact O-N 2.71Å; Y38-L40 VanDerWaalsContact C-N 3.32Å; Y38-L40 PolarHBondContact O-N 3.41Å; L40-R42 PolarHBondContact O-N 2.95Å; L40-T43 PolarHBondContact O-N 3.27Å; L40-R44 WeakPolarHBondContact O-CB 3.37Å; L40-R44 PolarHBondContact O-N 3.46Å; L40-I117 HydrophobicContact CD2-CD1 3.46Å; L40-I117 VanDerWaalsContact CD2-CD1 3.46Å; L40-I117 HydrophobicContact CD2-CG1 4.47Å; L40-I117 HydrophobicContact CG-CD1 4.23Å; L40-C169 HydrophobicContact CD1-CB 3.96Å; L40-L172 HydrophobicContact CB-CB 3.96Å; L40-L172 HydrophobicContact CB-CD1 3.83Å; L40-L172 HydrophobicContact CB-CG 4.48Å; L40-L172 HydrophobicContact CD1-CB 4.05Å; L40-L172 HydrophobicContact CD1-CD1 4.38Å; L40-L172 HydrophobicContact CG-CB 4.42Å; L40-Y173 HydrophobicContact CD1-CD2 4.02Å; L40-Y173 HydrophobicContact CD1-CE2 3.83Å; L40-Y173 HydrophobicContact CD2-CD1 4.01Å; L40-Y173 HydrophobicContact CD2-CD2 4.23Å; L40-Y173 HydrophobicContact CD2-CE1 3.93Å; L40-Y173 HydrophobicContact CD2-CE2 4.16Å; L40-Y173 HydrophobicContact CD2-CG 4.13Å; L40-L176 HydrophobicContact CB-CD1 4.3Å; L40-L176 HydrophobicContact CD2-CD1 3.47Å; L40-L176 VanDerWaalsContact CD2-CD1 3.47Å
41	H	90.2	Very high	89.3	Confident	31 Å²	31	45.3 Å²	45.3	14%	0.144	21%	0.207	C	C	.	.	H	α-helix	trans	-57.6	-51.6	176.5	-86.7	-64.2	0	0	0	110.8	A37 Y38 T43 R44 W45 L153 E168	A37-H41 PolarHBondContact O-CD2 3.32Å; A37-H41 VanDerWaalsContact O-CD2 3.25Å; A37-H41 PolarHBondContact O-N 3.12Å; Y38-H41 PolarHBondContact O-N 3.09Å; H41-T43 VanDerWaalsContact C-N 3.34Å; H41-T43 PolarHBondContact O-N 3.09Å; H41-R44 WeakPolarHBondContact O-CB 3.5Å; H41-R44 PolarHBondContact O-N 3.29Å; H41-R44 VanDerWaalsContact O-N 3.09Å; H41-W45 PolarHBondContact O-N 2.93Å; H41-L153 HydrophobicContact CB-CD1 4.28Å; H41-L153 HydrophobicContact CB-CD2 4.01Å; H41-E168 IonicContact CD2-OE1 3.09Å; H41-E168 IonicContact CE1-OE1 3.69Å; H41-E168 IonicContact NE2-OE1 2.67Å; H41-E168 PolarHBondContact NE2-OE1 3.24Å
42	R	88.3	Confident	89.5	Confident	110 Å²	110	42.1 Å²	42.1	42%	0.415	19%	0.187	S	C	.	.	H	α-helix	trans	-59.2	-43.9	-179.1	-173.1	172.6	174.5	-170.3	-6.1	112.4	Y38 R39 L40 R44 W45 R46	Y38-R42 WeakPolarHBondContact O-CB 3.44Å; Y38-R42 PolarHBondContact O-N 3.4Å; R39-R42 PolarHBondContact O-N 3Å; L40-R42 PolarHBondContact O-N 2.95Å; R42-R44 VanDerWaalsContact C-N 3.32Å; R42-R44 PolarHBondContact O-N 3.46Å; R42-W45 PolarHBondContact O-N 3Å; R42-R46 WeakPolarHBondContact O-CG 3.29Å; R42-R46 PolarHBondContact O-N 3.09Å
43	T	90.5	Very high	89.7	Confident	4 Å²	4	43.8 Å²	43.8	3%	0.025	19%	0.186	C	C	.	.	H	α-helix	trans	-59	-45	175.2	-59	0	0	0	0	110.8	R39 L40 H41 W45 R46 I47 I116 I117 L120 L176	R39-T43 VanDerWaalsContact O-CB 3.31Å; R39-T43 WeakPolarHBondContact O-CB 3.48Å; R39-T43 PolarHBondContact O-N 3.18Å; R39-T43 PolarHBondContact O-OG1 3.44Å; L40-T43 PolarHBondContact O-N 3.27Å; H41-T43 VanDerWaalsContact C-N 3.34Å; H41-T43 PolarHBondContact O-N 3.09Å; T43-W45 PolarHBondContact O-N 2.74Å; T43-R46 PolarHBondContact O-N 2.89Å; T43-I47 HydrophobicContact CG2-CD1 4.14Å; T43-I47 WeakPolarHBondContact O-CG1 3.29Å; T43-I47 PolarHBondContact O-N 3.41Å; T43-I47 VanDerWaalsContact O-N 3.12Å; T43-I116 HydrophobicContact CG2-CG2 4.26Å; T43-I117 HydrophobicContact CG2-CG1 3.95Å; T43-L120 HydrophobicContact CG2-CD1 3.87Å; T43-L176 HydrophobicContact CG2-CD1 4.22Å; T43-L176 HydrophobicContact CG2-CD2 3.8Å
44	R	90.9	Very high	90	Very high	66 Å²	66	43.3 Å²	43.3	25%	0.249	18%	0.184	C	C	.	.	H	α-helix	trans	-59.8	-48.5	178.7	178.3	-178.5	174.4	-84.4	-2.2	110.8	L40 H41 R42 R46 I47 L48 Q175 L176 L179	L40-R44 WeakPolarHBondContact O-CB 3.37Å; L40-R44 PolarHBondContact O-N 3.46Å; H41-R44 WeakPolarHBondContact O-CB 3.5Å; H41-R44 PolarHBondContact O-N 3.29Å; H41-R44 VanDerWaalsContact O-N 3.09Å; R42-R44 VanDerWaalsContact C-N 3.32Å; R42-R44 PolarHBondContact O-N 3.46Å; R44-R46 VanDerWaalsContact C-N 3.31Å; R44-R46 PolarHBondContact O-N 3.24Å; R44-I47 PolarHBondContact O-N 3.07Å; R44-L48 WeakPolarHBondContact O-CB 3.49Å; R44-L48 PolarHBondContact O-N 3.48Å; R44-Q175 VanDerWaalsContact NE-OE1 3.08Å; R44-L176 VanDerWaalsContact CA-CD2 3.47Å; R44-L176 HydrophobicContact CB-CD2 3.79Å; R44-L176 HydrophobicContact CB-CG 4.22Å; R44-L179 HydrophobicContact CG-CD2 4.12Å
45	W	87.4	Confident	90.3	Very high	141 Å²	141	43.4 Å²	43.4	53%	0.534	18%	0.184	S	C	.	.	H	α-helix	trans	-56.8	-43.4	176.7	-80.3	100.7	0	0	0	112.4	H41 R42 T43 I47 L48	H41-W45 PolarHBondContact O-N 2.93Å; R42-W45 PolarHBondContact O-N 3Å; T43-W45 PolarHBondContact O-N 2.74Å; W45-I47 PolarHBondContact O-N 3.24Å; W45-L48 PolarHBondContact O-N 3.5Å
46	R	87.7	Confident	90.6	Very high	51 Å²	51	42.8 Å²	42.8	19%	0.192	18%	0.178	C	C	.	.	H	α-helix	trans	-64.9	-37.4	-179.9	-70	-177	103.9	-168.8	-2.3	113.2	R42 T43 R44 P50 L98 L120 T123 T125	R42-R46 WeakPolarHBondContact O-CG 3.29Å; R42-R46 PolarHBondContact O-N 3.09Å; T43-R46 PolarHBondContact O-N 2.89Å; R44-R46 VanDerWaalsContact C-N 3.31Å; R44-R46 PolarHBondContact O-N 3.24Å; R46-P50 WeakPolarHBondContact O-CD 3.34Å; R46-P50 WeakPolarHBondContact O-CG 3.16Å; R46-L98 WeakPolarHBondContact O-CD1 2.98Å; R46-L120 PolarHBondContact NH1-O 3.3Å; R46-T123 PolarHBondContact NH1-O 3.05Å; R46-T123 PolarHBondContact NH2-O 3.38Å; R46-T125 PolarHBondContact NH2-OG1 3.46Å
47	I	91.3	Very high	90.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-77.8	-35	178.2	-58.1	174.6	0	0	0	111.5	T43 R44 W45 E49 P50 Y51 L98 I100 I116 L120 L176 L179 Y183	T43-I47 HydrophobicContact CG2-CD1 4.14Å; T43-I47 WeakPolarHBondContact O-CG1 3.29Å; T43-I47 PolarHBondContact O-N 3.41Å; T43-I47 VanDerWaalsContact O-N 3.12Å; R44-I47 PolarHBondContact O-N 3.07Å; W45-I47 PolarHBondContact O-N 3.24Å; I47-E49 VanDerWaalsContact C-N 3.33Å; I47-E49 PolarHBondContact O-N 3.48Å; I47-P50 WeakPolarHBondContact O-CD 3.36Å; I47-Y51 VanDerWaalsContact O-CB 3.3Å; I47-Y51 WeakPolarHBondContact O-CB 3.47Å; I47-Y51 PolarHBondContact O-N 3.35Å; I47-L98 HydrophobicContact CB-CD1 4.31Å; I47-L98 HydrophobicContact CG1-CD1 3.85Å; I47-I100 HydrophobicContact CD1-CD1 3.89Å; I47-I100 HydrophobicContact CG1-CD1 3.96Å; I47-I100 HydrophobicContact CG2-CD1 4.29Å; I47-I116 HydrophobicContact CD1-CG2 3.88Å; I47-L120 HydrophobicContact CD1-CD1 3.82Å; I47-L120 HydrophobicContact CG1-CD1 3.57Å; I47-L176 HydrophobicContact CD1-CD2 4.05Å; I47-L179 HydrophobicContact CB-CD2 4Å; I47-L179 HydrophobicContact CB-CG 4.4Å; I47-L179 HydrophobicContact CG2-CD2 4Å; I47-L179 HydrophobicContact CG2-CG 3.83Å; I47-Y183 HydrophobicContact CG2-CG 4.3Å
48	L	90.4	Very high	91.1	Very high	13 Å²	13	42.9 Å²	42.9	7%	0.068	18%	0.181	C	C	.	.	H	α-helix	trans	-61	-40.3	-173.7	-173.6	61.8	0	0	0	112.6	R44 W45 Y51 R52 L179	R44-L48 WeakPolarHBondContact O-CB 3.49Å; R44-L48 PolarHBondContact O-N 3.48Å; W45-L48 PolarHBondContact O-N 3.5Å; L48-Y51 HydrophobicContact CD1-CD1 4.25Å; L48-Y51 WeakPolarHBondContact O-CB 3.16Å; L48-Y51 PolarHBondContact O-N 3.44Å; L48-R52 HydrophobicContact CD1-CG 4.47Å; L48-R52 WeakPolarHBondContact O-CB 3.41Å; L48-R52 WeakPolarHBondContact O-CG 3.47Å; L48-R52 PolarHBondContact O-N 3.4Å; L48-L179 HydrophobicContact CB-CD2 4.25Å; L48-L179 HydrophobicContact CD1-CD1 4.13Å; L48-L179 HydrophobicContact CD1-CD2 4.4Å
49	E	87.6	Confident	91.4	Very high	120 Å²	120	42.2 Å²	42.2	56%	0.561	18%	0.179	S	C	*	.	H	α-helix	trans	-67.1	-53.8	-177.3	179.8	60.7	-155.8	0	0	112.9	I47 Y51 R52 R53	I47-E49 VanDerWaalsContact C-N 3.33Å; I47-E49 PolarHBondContact O-N 3.48Å; E49-Y51 VanDerWaalsContact C-N 3.27Å; E49-Y51 PolarHBondContact O-N 2.87Å; E49-R52 PolarHBondContact O-N 3.14Å; E49-R53 PolarHBondContact O-N 3.47Å
50	P	89.4	Confident	91.7	Very high	16 Å²	16	43.2 Å²	43.2	10%	0.104	19%	0.185	C	C	.	.	H	α-helix	trans	-54.4	-41.8	169.3	-24.9	32	0	0	0	112.9	R46 I47 R53 L54 L98 Y183	R46-P50 WeakPolarHBondContact O-CD 3.34Å; R46-P50 WeakPolarHBondContact O-CG 3.16Å; I47-P50 WeakPolarHBondContact O-CD 3.36Å; P50-R53 WeakPolarHBondContact O-CB 3.44Å; P50-R53 PolarHBondContact O-N 3.17Å; P50-L54 WeakPolarHBondContact O-CG 3.38Å; P50-L54 PolarHBondContact O-N 2.97Å; P50-L98 HydrophobicContact CG-CD1 4.14Å; P50-L98 HydrophobicContact CG-CG 4.01Å; P50-Y183 HydrophobicContact CB-CD2 4.4Å; P50-Y183 HydrophobicContact CB-CE2 3.73Å
51	Y	92.8	Very high	92	Very high	7 Å²	7	43.3 Å²	43.3	3%	0.027	19%	0.186	C	C	.	.	H	α-helix	trans	-58.9	-51.1	176.9	168.3	-104.8	0	0	0	112.4	I47 L48 E49 R53 L54 K55 L179 K182 L186 I228 E231	I47-Y51 VanDerWaalsContact O-CB 3.3Å; I47-Y51 WeakPolarHBondContact O-CB 3.47Å; I47-Y51 PolarHBondContact O-N 3.35Å; L48-Y51 HydrophobicContact CD1-CD1 4.25Å; L48-Y51 WeakPolarHBondContact O-CB 3.16Å; L48-Y51 PolarHBondContact O-N 3.44Å; E49-Y51 VanDerWaalsContact C-N 3.27Å; E49-Y51 PolarHBondContact O-N 2.87Å; Y51-R53 PolarHBondContact O-N 3.42Å; Y51-L54 PolarHBondContact O-N 3.13Å; Y51-L54 VanDerWaalsContact O-N 3.16Å; Y51-K55 HydrophobicContact CE1-CD 4.25Å; Y51-K55 WeakPolarHBondContact O-CB 3.45Å; Y51-K55 PolarHBondContact O-N 3.31Å; Y51-L179 HydrophobicContact CD1-CD1 3.59Å; Y51-L179 HydrophobicContact CD2-CD1 4.31Å; Y51-L179 HydrophobicContact CE1-CD1 4.09Å; Y51-L179 HydrophobicContact CG-CD1 3.69Å; Y51-K182 HydrophobicContact CD2-CB 4.33Å; Y51-K182 HydrophobicContact CE2-CB 3.68Å; Y51-L186 HydrophobicContact CD2-CD1 3.84Å; Y51-L186 HydrophobicContact CE2-CD1 3.57Å; Y51-L186 HydrophobicContact CE2-CG 4.3Å; Y51-I228 HydrophobicContact CE2-CG2 4.47Å; Y51-I228 WeakPolarHBondContact OH-CG2 3.4Å; Y51-E231 PolarHBondContact OH-OE2 3.35Å
52	R	91.7	Very high	92.3	Very high	48 Å²	48	44.4 Å²	44.4	18%	0.181	19%	0.191	C	C	.	.	H	α-helix	trans	-56.9	-41.9	177.4	-78.4	-177.2	179.4	140	-4.8	111.2	L48 E49 L54 K55 N56 E234	L48-R52 HydrophobicContact CD1-CG 4.47Å; L48-R52 WeakPolarHBondContact O-CB 3.41Å; L48-R52 WeakPolarHBondContact O-CG 3.47Å; L48-R52 PolarHBondContact O-N 3.4Å; E49-R52 PolarHBondContact O-N 3.14Å; R52-L54 PolarHBondContact O-N 2.83Å; R52-K55 PolarHBondContact O-N 2.98Å; R52-N56 VanDerWaalsContact O-CB 3.28Å; R52-N56 WeakPolarHBondContact O-CB 3.48Å; R52-N56 PolarHBondContact O-N 2.87Å; R52-N56 PolarHBondContact O-ND2 3.4Å; R52-N56 PolarHBondContact O-OD1 3Å; R52-E234 IonicContact CZ-OE2 2.68Å; R52-E234 IonicContact NE-OE2 3.99Å; R52-E234 IonicContact NH2-OE2 3.63Å; R52-E234 PolarHBondContact NH2-OE2 2.99Å
53	R	91.6	Very high	92.6	Very high	92 Å²	92	43.7 Å²	43.7	35%	0.347	19%	0.192	S	C	.	.	H	α-helix	trans	-59.9	-47	176.7	-175.9	175.7	-179.3	158.9	1.1	112.8	E49 P50 Y51 A57 L90	E49-R53 PolarHBondContact O-N 3.47Å; P50-R53 WeakPolarHBondContact O-CB 3.44Å; P50-R53 PolarHBondContact O-N 3.17Å; Y51-R53 PolarHBondContact O-N 3.42Å; R53-A57 WeakPolarHBondContact O-CB 3.32Å; R53-A57 PolarHBondContact O-N 2.87Å; R53-L90 HydrophobicContact CG-CD2 4.42Å
54	L	93.8	Very high	92.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.3	-45.6	177.4	-58.7	-165.7	0	0	0	111.1	P50 Y51 R52 N56 A57 L58 L90 L97 Y183 L186 R187 I190	P50-L54 WeakPolarHBondContact O-CG 3.38Å; P50-L54 PolarHBondContact O-N 2.97Å; Y51-L54 PolarHBondContact O-N 3.13Å; Y51-L54 VanDerWaalsContact O-N 3.16Å; R52-L54 PolarHBondContact O-N 2.83Å; L54-N56 PolarHBondContact O-N 3.48Å; L54-A57 PolarHBondContact O-N 3.04Å; L54-L58 WeakPolarHBondContact O-CG 3.26Å; L54-L58 PolarHBondContact O-N 2.73Å; L54-L58 VanDerWaalsContact O-N 3.09Å; L54-L90 HydrophobicContact CD2-CD1 4.14Å; L54-L97 HydrophobicContact CD2-CD1 4.26Å; L54-L97 HydrophobicContact CD2-CD2 3.63Å; L54-L97 HydrophobicContact CG-CD2 4.35Å; L54-Y183 HydrophobicContact CD1-CD2 4.08Å; L54-Y183 HydrophobicContact CD1-CE2 3.76Å; L54-Y183 HydrophobicContact CG-CE2 4.41Å; L54-L186 HydrophobicContact CB-CB 3.99Å; L54-L186 HydrophobicContact CB-CD1 4.05Å; L54-L186 HydrophobicContact CD1-CB 4.08Å; L54-R187 HydrophobicContact CD1-CB 4.09Å; L54-I190 HydrophobicContact CB-CD1 3.8Å; L54-I190 HydrophobicContact CD1-CD1 4.12Å; L54-I190 HydrophobicContact CD2-CD1 3.52Å; L54-I190 HydrophobicContact CG-CD1 3.96Å
55	K	94.5	Very high	93.2	Very high	7 Å²	7	43.2 Å²	43.2	3%	0.03	19%	0.193	C	C	.	.	H	α-helix	trans	-55	-51.9	177.4	180	179	71.8	168.2	0	111.2	Y51 R52 A57 L58 K59 L186 I228 E231 Q232	Y51-K55 HydrophobicContact CE1-CD 4.25Å; Y51-K55 WeakPolarHBondContact O-CB 3.45Å; Y51-K55 PolarHBondContact O-N 3.31Å; R52-K55 PolarHBondContact O-N 2.98Å; K55-A57 VanDerWaalsContact C-N 3.32Å; K55-A57 PolarHBondContact O-N 3.21Å; K55-L58 PolarHBondContact O-N 3.5Å; K55-K59 HydrophobicContact CG-CD 4.43Å; K55-K59 PolarHBondContact O-N 3.11Å; K55-L186 HydrophobicContact CB-CD1 3.96Å; K55-I228 HydrophobicContact CB-CD1 4.26Å; K55-I228 HydrophobicContact CD-CB 4.49Å; K55-I228 HydrophobicContact CG-CB 4.49Å; K55-I228 HydrophobicContact CG-CD1 3.82Å; K55-E231 IonicContact NZ-OE2 2.78Å; K55-Q232 PolarHBondContact NZ-O 2.9Å
56	N	94.1	Very high	93.7	Very high	58 Å²	58	40.7 Å²	40.7	31%	0.31	19%	0.19	S	C	.	.	H	α-helix	trans	-66.3	-35.9	-175.4	-67.9	-8.3	0	0	0	111.7	R52 L54 K59 K60	R52-N56 VanDerWaalsContact O-CB 3.28Å; R52-N56 WeakPolarHBondContact O-CB 3.48Å; R52-N56 PolarHBondContact O-N 2.87Å; R52-N56 PolarHBondContact O-ND2 3.4Å; R52-N56 PolarHBondContact O-OD1 3Å; L54-N56 PolarHBondContact O-N 3.48Å; N56-K59 PolarHBondContact O-N 3.21Å; N56-K60 WeakPolarHBondContact O-CB 3.37Å; N56-K60 PolarHBondContact O-N 3.46Å
57	A	94.8	Very high	94.1	Very high	20 Å²	20	43.6 Å²	43.6	17%	0.165	20%	0.204	C	C	.	.	H	α-helix	trans	-66.2	-40.8	174.9	0	0	0	0	0	112.6	R53 L54 K55 K60 L61 V87 L90	R53-A57 WeakPolarHBondContact O-CB 3.32Å; R53-A57 PolarHBondContact O-N 2.87Å; L54-A57 PolarHBondContact O-N 3.04Å; K55-A57 VanDerWaalsContact C-N 3.32Å; K55-A57 PolarHBondContact O-N 3.21Å; A57-K60 PolarHBondContact O-N 2.78Å; A57-L61 PolarHBondContact O-N 2.72Å; A57-V87 HydrophobicContact CB-CG2 4.44Å; A57-L90 HydrophobicContact CB-CD1 3.37Å
58	L	96.1	Very high	94.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-69.6	-37.6	176.6	-68.9	170.4	0	0	0	112.2	L54 K55 L61 Q62 V87 L186 L189 I190 T219 F225	L54-L58 WeakPolarHBondContact O-CG 3.26Å; L54-L58 PolarHBondContact O-N 2.73Å; L54-L58 VanDerWaalsContact O-N 3.09Å; K55-L58 PolarHBondContact O-N 3.5Å; L58-L61 WeakPolarHBondContact O-CB 3.25Å; L58-L61 PolarHBondContact O-N 2.95Å; L58-Q62 PolarHBondContact O-N 3.3Å; L58-V87 HydrophobicContact CD2-CG1 4.12Å; L58-L186 HydrophobicContact CD1-CB 4.11Å; L58-L186 HydrophobicContact CD1-CD1 4.43Å; L58-L186 HydrophobicContact CD1-CD2 3.77Å; L58-L186 HydrophobicContact CD1-CG 4.3Å; L58-L189 HydrophobicContact CD1-CD1 4.44Å; L58-I190 HydrophobicContact CD1-CG1 4.41Å; L58-I190 HydrophobicContact CD2-CG1 4.13Å; L58-I190 HydrophobicContact CG-CD1 4.48Å; L58-I190 HydrophobicContact CG-CG1 4.35Å; L58-T219 HydrophobicContact CD2-CG2 3.69Å; L58-F225 HydrophobicContact CB-CD2 3.79Å; L58-F225 HydrophobicContact CB-CE2 3.67Å; L58-F225 HydrophobicContact CD1-CD2 4.39Å
59	K	95.4	Very high	94.5	Very high	28 Å²	28	48.4 Å²	48.4	12%	0.122	22%	0.224	C	C	.	.	H	α-helix	trans	-62.5	-45.6	171.4	-78.7	-172.8	161	-160.6	0	112	K55 N56 L61 Q62 E63 E231 T233	K55-K59 HydrophobicContact CG-CD 4.43Å; K55-K59 PolarHBondContact O-N 3.11Å; N56-K59 PolarHBondContact O-N 3.21Å; K59-L61 VanDerWaalsContact C-N 3.29Å; K59-L61 PolarHBondContact O-N 3.31Å; K59-Q62 WeakPolarHBondContact O-CA 3.25Å; K59-Q62 VanDerWaalsContact O-CB 3.26Å; K59-Q62 WeakPolarHBondContact O-CB 3.49Å; K59-Q62 PolarHBondContact O-N 3.01Å; K59-E63 PolarHBondContact O-N 2.63Å; K59-E231 PolarHBondContact NZ-O 3.27Å; K59-T233 PolarHBondContact NZ-OG1 2.96Å
60	K	95.6	Very high	94.8	Very high	96 Å²	96	51.1 Å²	51.1	42%	0.417	24%	0.237	S	C	.	.	H	α-helix	trans	-58.7	-41.9	174.3	-171.1	-172.9	176.6	-163.8	0	111.4	N56 A57 Q62 E63 D64 E86	N56-K60 WeakPolarHBondContact O-CB 3.37Å; N56-K60 PolarHBondContact O-N 3.46Å; A57-K60 PolarHBondContact O-N 2.78Å; K60-Q62 VanDerWaalsContact C-N 3.29Å; K60-Q62 PolarHBondContact O-N 2.65Å; K60-E63 PolarHBondContact O-N 3.14Å; K60-D64 WeakPolarHBondContact O-CB 3.34Å; K60-D64 VanDerWaalsContact O-CG 3.32Å; K60-D64 PolarHBondContact O-N 2.95Å; K60-E86 IonicContact NZ-OE2 2.69Å; K60-E86 PolarHBondContact NZ-OE2 2.59Å
61	L	97.1	Very high	95.1	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-58	-41	174.3	-179.2	68.3	0	0	0	112.2	A57 L58 K59 Y65 V84 V87 L193 I216 T219	A57-L61 PolarHBondContact O-N 2.72Å; L58-L61 WeakPolarHBondContact O-CB 3.25Å; L58-L61 PolarHBondContact O-N 2.95Å; K59-L61 VanDerWaalsContact C-N 3.29Å; K59-L61 PolarHBondContact O-N 3.31Å; L61-Y65 WeakPolarHBondContact O-CB 3.47Å; L61-Y65 PolarHBondContact O-N 3.29Å; L61-V84 HydrophobicContact CD1-CG2 4.35Å; L61-V87 HydrophobicContact CB-CG2 3.92Å; L61-V87 HydrophobicContact CD1-CG2 4.31Å; L61-V87 HydrophobicContact CD2-CG2 4.24Å; L61-V87 HydrophobicContact CG-CG2 4.38Å; L61-L193 HydrophobicContact CD2-CD2 3.93Å; L61-I216 HydrophobicContact CD1-CG1 4.28Å; L61-I216 HydrophobicContact CG-CG2 4.31Å; L61-T219 HydrophobicContact CD2-CG2 4.33Å
62	Q	96.6	Very high	95.2	Very high	53 Å²	53	56.3 Å²	56.3	25%	0.248	27%	0.267	C	S	.	.	H	α-helix	trans	-62.1	-50.2	175	-171.1	-175.1	25.7	0	0	111.4	L58 K59 K60 Y65 L66 L220 F225 C229	L58-Q62 PolarHBondContact O-N 3.3Å; K59-Q62 WeakPolarHBondContact O-CA 3.25Å; K59-Q62 VanDerWaalsContact O-CB 3.26Å; K59-Q62 WeakPolarHBondContact O-CB 3.49Å; K59-Q62 PolarHBondContact O-N 3.01Å; K60-Q62 VanDerWaalsContact C-N 3.29Å; K60-Q62 PolarHBondContact O-N 2.65Å; Q62-Y65 PolarHBondContact O-N 2.92Å; Q62-L66 HydrophobicContact CG-CD1 4.46Å; Q62-L66 WeakPolarHBondContact O-CG 3.34Å; Q62-L66 PolarHBondContact O-N 2.74Å; Q62-L220 HydrophobicContact CB-CD1 4.35Å; Q62-L220 HydrophobicContact CB-CD2 3.58Å; Q62-L220 HydrophobicContact CG-CD1 4.22Å; Q62-L220 HydrophobicContact CG-CD2 3.96Å; Q62-F225 HydrophobicContact CB-CE1 4.49Å; Q62-F225 HydrophobicContact CB-CZ 3.95Å; Q62-F225 HydrophobicContact CG-CE1 4.42Å; Q62-F225 HydrophobicContact CG-CZ 4.29Å; Q62-C229 PolarHBondContact NE2-SG 3.26Å; Q62-C229 VanDerWaalsContact NE2-SG 3.38Å
63	E	96.3	Very high	95.3	Very high	96 Å²	96	57.4 Å²	57.4	45%	0.449	29%	0.286	S	S	.	.	H	α-helix	trans	-59.3	-49.1	178.8	-70.5	-179.7	-156	0	0	111.7	K59 K60 Y65 L66 K67	K59-E63 PolarHBondContact O-N 2.63Å; K60-E63 PolarHBondContact O-N 3.14Å; E63-Y65 VanDerWaalsContact C-N 3.3Å; E63-Y65 PolarHBondContact O-N 3.46Å; E63-L66 PolarHBondContact O-N 2.72Å; E63-K67 WeakPolarHBondContact O-CB 3.45Å; E63-K67 WeakPolarHBondContact O-CG 3.22Å; E63-K67 PolarHBondContact O-N 3.47Å; E63-K67 IonicContact OE2-NZ 3.73Å; E63-K67 PolarHBondContact OE2-NZ 3.09Å
64	D	96.9	Very high	95.3	Very high	38 Å²	38	59 Å²	59	20%	0.203	30%	0.301	C	S	.	.	H	α-helix	trans	-61.8	-40.1	178.9	-73.2	-11.8	0	0	0	111.4	K60 L66 K67 S68 S83	K60-D64 WeakPolarHBondContact O-CB 3.34Å; K60-D64 VanDerWaalsContact O-CG 3.32Å; K60-D64 PolarHBondContact O-N 2.95Å; D64-L66 VanDerWaalsContact C-N 3.34Å; D64-L66 PolarHBondContact O-N 3.41Å; D64-K67 PolarHBondContact O-N 2.92Å; D64-S68 VanDerWaalsContact O-CB 3.26Å; D64-S68 WeakPolarHBondContact O-CB 3.42Å; D64-S68 PolarHBondContact O-N 2.68Å; D64-S83 WeakPolarHBondContact CB-OG 3.41Å; D64-S83 PolarHBondContact OD2-OG 3.27Å
65	Y	97	Very high	95.4	Very high	21 Å²	21	63 Å²	63	8%	0.082	32%	0.321	C	S	.	.	H	α-helix	trans	-62.3	-41.4	176.2	175.6	-102	0	0	0	111.9	L61 Q62 E63 S68 L80 I216 K217 L220	L61-Y65 WeakPolarHBondContact O-CB 3.47Å; L61-Y65 PolarHBondContact O-N 3.29Å; Q62-Y65 PolarHBondContact O-N 2.92Å; E63-Y65 VanDerWaalsContact C-N 3.3Å; E63-Y65 PolarHBondContact O-N 3.46Å; Y65-S68 PolarHBondContact O-OG 3.23Å; Y65-L80 HydrophobicContact CD2-CD2 3.71Å; Y65-L80 HydrophobicContact CE2-CD2 4.37Å; Y65-I216 HydrophobicContact CD1-CG2 4.43Å; Y65-I216 HydrophobicContact CD2-CB 4.2Å; Y65-I216 HydrophobicContact CD2-CD1 4.16Å; Y65-I216 HydrophobicContact CD2-CG2 3.54Å; Y65-I216 HydrophobicContact CE2-CG2 4.26Å; Y65-I216 HydrophobicContact CG-CG2 3.66Å; Y65-K217 WeakPolarHBondContact OH-CE 3.39Å; Y65-L220 HydrophobicContact CD1-CD1 3.87Å; Y65-L220 HydrophobicContact CG-CD1 4.19Å
66	L	96.5	Very high	95.5	Very high	89 Å²	89	64.9 Å²	64.9	47%	0.466	33%	0.328	S	S	.	.	H	α-helix	trans	-66.5	-51.1	176	-67.9	175	0	0	0	111.2	Q62 E63 D64 S68 K69	Q62-L66 HydrophobicContact CG-CD1 4.46Å; Q62-L66 WeakPolarHBondContact O-CG 3.34Å; Q62-L66 PolarHBondContact O-N 2.74Å; E63-L66 PolarHBondContact O-N 2.72Å; D64-L66 VanDerWaalsContact C-N 3.34Å; D64-L66 PolarHBondContact O-N 3.41Å; L66-S68 PolarHBondContact O-N 2.93Å; L66-K69 VanDerWaalsContact O-CB 3.31Å; L66-K69 WeakPolarHBondContact O-CB 3.13Å; L66-K69 WeakPolarHBondContact O-CG 3.47Å; L66-K69 PolarHBondContact O-N 3.39Å; L66-K69 VanDerWaalsContact O-N 3.08Å
67	K	96.6	Very high	95.6	Very high	111 Å²	111	64.2 Å²	64.2	48%	0.483	32%	0.321	S	S	.	.	H	α-helix	trans	-58.4	-31.2	176.4	-69.5	169.5	-174.2	163.5	0	112.4	E63 D64 K69 E70	E63-K67 WeakPolarHBondContact O-CB 3.45Å; E63-K67 WeakPolarHBondContact O-CG 3.22Å; E63-K67 PolarHBondContact O-N 3.47Å; E63-K67 IonicContact OE2-NZ 3.73Å; E63-K67 PolarHBondContact OE2-NZ 3.09Å; D64-K67 PolarHBondContact O-N 2.92Å; K67-K69 PolarHBondContact O-N 2.96Å; K67-E70 PolarHBondContact O-N 3.34Å
68	S	96.4	Very high	95.7	Very high	0 Å²	0	67 Å²	67	0%	0	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-63.7	-21.6	178.8	82.6	0	0	0	0	113.6	D64 Y65 L66 E70 A71 R76 L80	D64-S68 VanDerWaalsContact O-CB 3.26Å; D64-S68 WeakPolarHBondContact O-CB 3.42Å; D64-S68 PolarHBondContact O-N 2.68Å; Y65-S68 PolarHBondContact O-OG 3.23Å; L66-S68 PolarHBondContact O-N 2.93Å; S68-E70 PolarHBondContact O-N 3.38Å; S68-A71 PolarHBondContact O-N 3.32Å; S68-R76 WeakPolarHBondContact O-CD 3.25Å; S68-R76 WeakPolarHBondContact O-CG 3.31Å; S68-R76 PolarHBondContact OG-NE 2.95Å; S68-L80 WeakPolarHBondContact OG-CD2 3.27Å
69	K	94.3	Very high	95.7	Very high	115 Å²	115	71.3 Å²	71.3	50%	0.5	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-66.3	-24.7	-176.7	-67.5	178.1	179.6	176.4	0	113.1	L66 K67 A71	L66-K69 VanDerWaalsContact O-CB 3.31Å; L66-K69 WeakPolarHBondContact O-CB 3.13Å; L66-K69 WeakPolarHBondContact O-CG 3.47Å; L66-K69 PolarHBondContact O-N 3.39Å; L66-K69 VanDerWaalsContact O-N 3.08Å; K67-K69 PolarHBondContact O-N 2.96Å; K69-A71 VanDerWaalsContact C-N 3.3Å
70	E	94.5	Very high	95.8	Very high	177 Å²	177	70 Å²	70	83%	0.827	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-79	-14.7	178.9	-63.6	167.1	-168.1	0	0	112.6	K67 S68	K67-E70 PolarHBondContact O-N 3.34Å; S68-E70 PolarHBondContact O-N 3.38Å
71	A	94.8	Very high	95.8	Very high	23 Å²	23	66 Å²	66	19%	0.19	34%	0.335	C	S	.	.	S	Bend	trans	-86.2	152.4	-178.9	0	0	0	0	0	112.3	S68 K69 M75 R76 K79	S68-A71 PolarHBondContact O-N 3.32Å; K69-A71 VanDerWaalsContact C-N 3.3Å; A71-M75 HydrophobicContact CB-CB 4.11Å; A71-M75 HydrophobicContact CB-CG 4.01Å; A71-R76 HydrophobicContact CB-CB 4.26Å; A71-K79 HydrophobicContact CB-CD 4.32Å
72	N	95.4	Very high	95.8	Very high	108 Å²	108	69.6 Å²	69.6	58%	0.578	35%	0.352	S	S	*	.			trans	-59.8	161.7	168.1	67.8	58.3	0	0	0	111.7	L74 M75 R76	N72-L74 VanDerWaalsContact C-N 3.32Å; N72-L74 PolarHBondContact O-N 2.98Å; N72-L74 PolarHBondContact OD1-N 3.35Å; N72-M75 PolarHBondContact O-N 2.86Å; N72-M75 WeakPolarHBondContact OD1-CB 3.36Å; N72-M75 PolarHBondContact OD1-N 3.43Å; N72-R76 WeakPolarHBondContact O-CB 3.26Å; N72-R76 PolarHBondContact O-N 3.41Å
73	A	92.3	Very high	95.8	Very high	71 Å²	71	67.4 Å²	67.4	59%	0.587	34%	0.343	S	S	*	.	H	α-helix	trans	-56.6	-40.7	-170.3	0	0	0	0	0	114.2	Y77	A73-Y77 PolarHBondContact O-N 2.84Å
74	L	93	Very high	95.8	Very high	125 Å²	125	62.9 Å²	62.9	65%	0.654	32%	0.321	S	S	*	.	H	α-helix	trans	-70.1	-48.2	-179.3	-175.6	139.2	0	0	0	111.3	N72 R76 Y77 V78	N72-L74 VanDerWaalsContact C-N 3.32Å; N72-L74 PolarHBondContact O-N 2.98Å; N72-L74 PolarHBondContact OD1-N 3.35Å; L74-R76 VanDerWaalsContact C-N 3.28Å; L74-R76 PolarHBondContact O-N 2.99Å; L74-Y77 WeakPolarHBondContact O-CB 3.42Å; L74-Y77 PolarHBondContact O-N 3.43Å; L74-V78 PolarHBondContact O-N 3.34Å; L74-V78 VanDerWaalsContact O-N 3.13Å
75	M	95.6	Very high	95.8	Very high	85 Å²	85	66.9 Å²	66.9	42%	0.419	33%	0.334	S	S	.	.	H	α-helix	trans	-64	-37.8	176.7	-176.4	55.8	64	0	0	111.5	A71 N72 Y77 V78 K79	A71-M75 HydrophobicContact CB-CB 4.11Å; A71-M75 HydrophobicContact CB-CG 4.01Å; N72-M75 PolarHBondContact O-N 2.86Å; N72-M75 WeakPolarHBondContact OD1-CB 3.36Å; N72-M75 PolarHBondContact OD1-N 3.43Å; M75-Y77 PolarHBondContact O-N 3.12Å; M75-V78 PolarHBondContact O-N 3.37Å; M75-K79 HydrophobicContact CG-CD 4.44Å; M75-K79 WeakPolarHBondContact O-CG 3.37Å; M75-K79 PolarHBondContact O-N 2.96Å
76	R	96.7	Very high	95.7	Very high	46 Å²	46	69.2 Å²	69.2	17%	0.174	35%	0.345	C	S	.	.	H	α-helix	trans	-61.7	-43.6	174.6	-173.9	168	-178.7	-163.5	1.1	111.3	S68 A71 N72 L74 V78 K79 L80 Y209	S68-R76 WeakPolarHBondContact O-CD 3.25Å; S68-R76 WeakPolarHBondContact O-CG 3.31Å; S68-R76 PolarHBondContact OG-NE 2.95Å; A71-R76 HydrophobicContact CB-CB 4.26Å; N72-R76 WeakPolarHBondContact O-CB 3.26Å; N72-R76 PolarHBondContact O-N 3.41Å; L74-R76 VanDerWaalsContact C-N 3.28Å; L74-R76 PolarHBondContact O-N 2.99Å; R76-V78 VanDerWaalsContact C-N 3.33Å; R76-V78 PolarHBondContact O-N 2.84Å; R76-K79 PolarHBondContact O-N 3.49Å; R76-L80 HydrophobicContact CG-CD1 4.42Å; R76-L80 HydrophobicContact CG-CG 4.32Å; R76-L80 VanDerWaalsContact O-CG 3.26Å; R76-L80 WeakPolarHBondContact O-CG 3.46Å; R76-L80 PolarHBondContact O-N 2.95Å; R76-Y209 WeakPolarHBondContact CD-OH 3.21Å; R76-Y209 HydrophobicContact CG-CE2 4.19Å
77	Y	96.4	Very high	95.6	Very high	45 Å²	45	65.1 Å²	65.1	18%	0.176	32%	0.324	C	S	.	.	H	α-helix	trans	-56.2	-47.5	173.9	164.9	-103.3	0	0	0	111.9	A73 L74 M75 L80 G81 I205 R208 Y209 L212	A73-Y77 PolarHBondContact O-N 2.84Å; L74-Y77 WeakPolarHBondContact O-CB 3.42Å; L74-Y77 PolarHBondContact O-N 3.43Å; M75-Y77 PolarHBondContact O-N 3.12Å; Y77-L80 PolarHBondContact O-N 2.92Å; Y77-G81 PolarHBondContact O-N 2.67Å; Y77-I205 HydrophobicContact CD1-CG2 4Å; Y77-I205 HydrophobicContact CD2-CG2 4.27Å; Y77-I205 HydrophobicContact CE1-CG1 4.25Å; Y77-I205 HydrophobicContact CE1-CG2 3.96Å; Y77-I205 HydrophobicContact CE2-CG2 4.23Å; Y77-I205 HydrophobicContact CG-CG2 4.15Å; Y77-R208 HydrophobicContact CE2-CB 4.33Å; Y77-R208 HydrophobicContact CE2-CG 4.1Å; Y77-Y209 HydrophobicContact CD2-CD2 4.04Å; Y77-Y209 HydrophobicContact CD2-CG 4.35Å; Y77-Y209 HydrophobicContact CG-CD2 4.44Å; Y77-L212 HydrophobicContact CD2-CD1 3.95Å; Y77-L212 HydrophobicContact CE2-CD1 3.81Å
78	V	96	Very high	95.5	Very high	78 Å²	78	60 Å²	60	47%	0.473	30%	0.302	S	S	.	.	H	α-helix	trans	-59.8	-49.2	177.2	176	0	0	0	0	111.2	L74 M75 R76 L80 G81 Q82	L74-V78 PolarHBondContact O-N 3.34Å; L74-V78 VanDerWaalsContact O-N 3.13Å; M75-V78 PolarHBondContact O-N 3.37Å; R76-V78 VanDerWaalsContact C-N 3.33Å; R76-V78 PolarHBondContact O-N 2.84Å; V78-L80 PolarHBondContact O-N 2.82Å; V78-G81 PolarHBondContact O-N 3.17Å; V78-Q82 PolarHBondContact O-N 3.3Å
79	K	96.8	Very high	95.3	Very high	91 Å²	91	64 Å²	64	40%	0.396	32%	0.322	S	S	.	.	H	α-helix	trans	-58.2	-48.4	178.4	-72.8	-178.3	177.5	-173.6	0	112	A71 M75 R76 G81 Q82 S83	A71-K79 HydrophobicContact CB-CD 4.32Å; M75-K79 HydrophobicContact CG-CD 4.44Å; M75-K79 WeakPolarHBondContact O-CG 3.37Å; M75-K79 PolarHBondContact O-N 2.96Å; R76-K79 PolarHBondContact O-N 3.49Å; K79-G81 VanDerWaalsContact C-N 3.35Å; K79-G81 PolarHBondContact O-N 3.31Å; K79-Q82 PolarHBondContact O-N 3.46Å; K79-S83 PolarHBondContact O-N 3.2Å; K79-S83 PolarHBondContact O-OG 3.25Å
80	L	96.9	Very high	95.1	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-62.3	-42.4	178.8	-66	-171.6	0	0	0	112	Y65 S68 R76 Y77 V78 Q82 V84 Y209 L212 K213 I216	Y65-L80 HydrophobicContact CD2-CD2 3.71Å; Y65-L80 HydrophobicContact CE2-CD2 4.37Å; S68-L80 WeakPolarHBondContact OG-CD2 3.27Å; R76-L80 HydrophobicContact CG-CD1 4.42Å; R76-L80 HydrophobicContact CG-CG 4.32Å; R76-L80 VanDerWaalsContact O-CG 3.26Å; R76-L80 WeakPolarHBondContact O-CG 3.46Å; R76-L80 PolarHBondContact O-N 2.95Å; Y77-L80 PolarHBondContact O-N 2.92Å; V78-L80 PolarHBondContact O-N 2.82Å; L80-Q82 VanDerWaalsContact C-N 3.33Å; L80-Q82 PolarHBondContact O-N 2.87Å; L80-V84 VanDerWaalsContact O-CG2 3.29Å; L80-V84 WeakPolarHBondContact O-CG2 3.27Å; L80-V84 PolarHBondContact O-N 3.4Å; L80-V84 VanDerWaalsContact O-N 3.1Å; L80-Y209 HydrophobicContact CD1-CD2 4.23Å; L80-Y209 HydrophobicContact CD1-CE2 3.74Å; L80-L212 HydrophobicContact CB-CB 4.37Å; L80-K213 HydrophobicContact CD1-CG 3.52Å; L80-I216 HydrophobicContact CB-CD1 4.08Å; L80-I216 HydrophobicContact CD1-CD1 4.46Å; L80-I216 HydrophobicContact CD2-CD1 3.7Å; L80-I216 HydrophobicContact CG-CD1 4.27Å
81	G	96.3	Very high	94.9	Very high	12 Å²	12	52.3 Å²	52.3	12%	0.124	27%	0.27	C	S	.	.	H	α-helix	trans	-61.8	-41.6	177.1	0	0	0	0	0	112.2	Y77 V78 K79 R85	Y77-G81 PolarHBondContact O-N 2.67Å; V78-G81 PolarHBondContact O-N 3.17Å; K79-G81 VanDerWaalsContact C-N 3.35Å; K79-G81 PolarHBondContact O-N 3.31Å; G81-R85 WeakPolarHBondContact O-CB 3.37Å; G81-R85 PolarHBondContact O-N 3.47Å
82	Q	96.4	Very high	94.3	Very high	76 Å²	76	55.9 Å²	55.9	36%	0.355	28%	0.281	S	S	.	.	H	α-helix	trans	-66.2	-49.7	178.1	-178.4	57.9	23.8	0	0	112	V78 K79 L80 V84 R85 E86	V78-Q82 PolarHBondContact O-N 3.3Å; K79-Q82 PolarHBondContact O-N 3.46Å; L80-Q82 VanDerWaalsContact C-N 3.33Å; L80-Q82 PolarHBondContact O-N 2.87Å; Q82-V84 VanDerWaalsContact C-N 3.34Å; Q82-V84 PolarHBondContact O-N 2.68Å; Q82-R85 WeakPolarHBondContact O-CB 3.37Å; Q82-R85 PolarHBondContact O-N 3.05Å; Q82-R85 VanDerWaalsContact O-N 3.13Å; Q82-E86 PolarHBondContact NE2-OE1 2.64Å; Q82-E86 WeakPolarHBondContact O-CG 3.5Å; Q82-E86 PolarHBondContact O-N 3.43Å
83	S	96.9	Very high	93.8	Very high	8 Å²	8	53.1 Å²	53.1	6%	0.056	26%	0.264	C	S	.	.	H	α-helix	trans	-62.5	-40	-179.4	-57.3	0	0	0	0	112.4	D64 K79 E86 V87	D64-S83 WeakPolarHBondContact CB-OG 3.41Å; D64-S83 PolarHBondContact OD2-OG 3.27Å; K79-S83 PolarHBondContact O-N 3.2Å; K79-S83 PolarHBondContact O-OG 3.25Å; S83-E86 PolarHBondContact O-N 3.01Å; S83-V87 PolarHBondContact O-N 2.89Å
84	V	96.8	Very high	92.8	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.5	-42.4	174.5	173.8	0	0	0	0	111.2	L61 L80 Q82 E86 V87 A88 L193 Y197 L212 M215 I216	L61-V84 HydrophobicContact CD1-CG2 4.35Å; L80-V84 VanDerWaalsContact O-CG2 3.29Å; L80-V84 WeakPolarHBondContact O-CG2 3.27Å; L80-V84 PolarHBondContact O-N 3.4Å; L80-V84 VanDerWaalsContact O-N 3.1Å; Q82-V84 VanDerWaalsContact C-N 3.34Å; Q82-V84 PolarHBondContact O-N 2.68Å; V84-E86 VanDerWaalsContact C-N 3.33Å; V84-E86 PolarHBondContact O-N 3.14Å; V84-V87 PolarHBondContact O-N 3.19Å; V84-A88 VanDerWaalsContact O-CB 3.26Å; V84-A88 WeakPolarHBondContact O-CB 3.36Å; V84-A88 PolarHBondContact O-N 3.4Å; V84-L193 HydrophobicContact CG1-CD1 4.18Å; V84-L193 HydrophobicContact CG1-CD2 4.42Å; V84-L193 HydrophobicContact CG1-CG 4.15Å; V84-Y197 HydrophobicContact CB-CD2 4.19Å; V84-Y197 HydrophobicContact CB-CE2 4.47Å; V84-Y197 HydrophobicContact CG1-CD1 4.35Å; V84-Y197 HydrophobicContact CG1-CD2 3.37Å; V84-Y197 HydrophobicContact CG1-CE2 4.08Å; V84-Y197 HydrophobicContact CG1-CG 3.53Å; V84-L212 HydrophobicContact CB-CD2 4.3Å; V84-L212 HydrophobicContact CG1-CD2 4.44Å; V84-L212 HydrophobicContact CG2-CD2 4.15Å; V84-M215 HydrophobicContact CG1-SD 3.67Å; V84-M215 HydrophobicContact CG2-SD 4.12Å; V84-I216 HydrophobicContact CG2-CD1 3.56Å; V84-I216 HydrophobicContact CG2-CG1 3.44Å; V84-I216 VanDerWaalsContact CG2-CG1 3.44Å
85	R	95.6	Very high	91.5	Very high	122 Å²	122	54.9 Å²	54.9	46%	0.46	25%	0.248	S	C	.	.	H	α-helix	trans	-59.2	-44.3	177.1	-176.9	-171.1	-72.2	144.9	-5.3	111.3	G81 Q82 V87 A88 M89 Y197	G81-R85 WeakPolarHBondContact O-CB 3.37Å; G81-R85 PolarHBondContact O-N 3.47Å; Q82-R85 WeakPolarHBondContact O-CB 3.37Å; Q82-R85 PolarHBondContact O-N 3.05Å; Q82-R85 VanDerWaalsContact O-N 3.13Å; R85-V87 VanDerWaalsContact C-N 3.35Å; R85-V87 PolarHBondContact O-N 3.47Å; R85-A88 PolarHBondContact O-N 3.45Å; R85-M89 HydrophobicContact CG-CG 4.48Å; R85-M89 VanDerWaalsContact O-CG 3.26Å; R85-M89 WeakPolarHBondContact O-CG 3.23Å; R85-M89 PolarHBondContact O-N 2.95Å; R85-Y197 HydrophobicContact CB-CE1 4.19Å; R85-Y197 HydrophobicContact CG-CE1 4.42Å; R85-Y197 PolarHBondContact NE-OH 3.13Å
86	E	95.1	Very high	90.3	Very high	70 Å²	70	54.8 Å²	54.8	33%	0.327	25%	0.246	S	C	.	.	H	α-helix	trans	-59.4	-44.3	179.9	-73.9	177.8	-164.5	0	0	112.2	K60 Q82 S83 V84	K60-E86 IonicContact NZ-OE2 2.69Å; K60-E86 PolarHBondContact NZ-OE2 2.59Å; Q82-E86 PolarHBondContact NE2-OE1 2.64Å; Q82-E86 WeakPolarHBondContact O-CG 3.5Å; Q82-E86 PolarHBondContact O-N 3.43Å; S83-E86 PolarHBondContact O-N 3.01Å; V84-E86 VanDerWaalsContact C-N 3.33Å; V84-E86 PolarHBondContact O-N 3.14Å
87	V	95.7	Very high	89.5	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.024	24%	0.239	C	C	.	.	H	α-helix	trans	-69.5	-43.5	175.9	-178.1	0	0	0	0	111.3	A57 L58 L61 S83 V84 R85 M89 L90 I190 L193	A57-V87 HydrophobicContact CB-CG2 4.44Å; L58-V87 HydrophobicContact CD2-CG1 4.12Å; L61-V87 HydrophobicContact CB-CG2 3.92Å; L61-V87 HydrophobicContact CD1-CG2 4.31Å; L61-V87 HydrophobicContact CD2-CG2 4.24Å; L61-V87 HydrophobicContact CG-CG2 4.38Å; S83-V87 PolarHBondContact O-N 2.89Å; V84-V87 PolarHBondContact O-N 3.19Å; R85-V87 VanDerWaalsContact C-N 3.35Å; R85-V87 PolarHBondContact O-N 3.47Å; V87-M89 PolarHBondContact O-N 3.18Å; V87-L90 VanDerWaalsContact O-CB 3.29Å; V87-L90 WeakPolarHBondContact O-CB 3.33Å; V87-L90 PolarHBondContact O-N 3Å; V87-I190 HydrophobicContact CG1-CD1 4.39Å; V87-I190 HydrophobicContact CG1-CG1 3.87Å; V87-I190 HydrophobicContact CG1-CG2 4.46Å; V87-L193 HydrophobicContact CB-CD2 3.76Å; V87-L193 HydrophobicContact CG1-CD2 3.57Å
88	A	93.9	Very high	89	Confident	3 Å²	3	52 Å²	52	3%	0.025	24%	0.237	C	C	.	.	H	α-helix	trans	-62.1	-28.5	179.4	0	0	0	0	0	112.9	V84 R85 L90 E91 H194 Y197	V84-A88 VanDerWaalsContact O-CB 3.26Å; V84-A88 WeakPolarHBondContact O-CB 3.36Å; V84-A88 PolarHBondContact O-N 3.4Å; R85-A88 PolarHBondContact O-N 3.45Å; A88-L90 PolarHBondContact O-N 3.15Å; A88-E91 PolarHBondContact O-N 3.4Å; A88-H194 HydrophobicContact CB-CB 4.13Å; A88-H194 PolarHBondContact O-CD2 2.94Å; A88-Y197 HydrophobicContact CB-CD1 4.05Å
89	M	92.4	Very high	88.5	Confident	83 Å²	83	53.9 Å²	53.9	41%	0.409	25%	0.245	S	C	.	.	H	α-helix	trans	-64.9	-21.3	174.6	-77	-65.5	-65.8	0	0	113.3	R85 V87 E91 K92 Q93	R85-M89 HydrophobicContact CG-CG 4.48Å; R85-M89 VanDerWaalsContact O-CG 3.26Å; R85-M89 WeakPolarHBondContact O-CG 3.23Å; R85-M89 PolarHBondContact O-N 2.95Å; V87-M89 PolarHBondContact O-N 3.18Å; M89-E91 VanDerWaalsContact C-N 3.32Å; M89-K92 PolarHBondContact O-N 2.95Å; M89-K92 HydrophobicContact SD-CD 3.97Å; M89-Q93 WeakPolarHBondContact O-CG 3.5Å; M89-Q93 PolarHBondContact O-N 3.12Å
90	L	90.6	Very high	88.1	Confident	16 Å²	16	49.9 Å²	49.9	8%	0.084	23%	0.227	C	C	.	.	H	α-helix	trans	-66.3	-36	174.2	-64.8	176.7	0	0	0	111.8	R53 L54 A57 V87 A88 K92 Q93 I190	R53-L90 HydrophobicContact CG-CD2 4.42Å; L54-L90 HydrophobicContact CD2-CD1 4.14Å; A57-L90 HydrophobicContact CB-CD1 3.37Å; V87-L90 VanDerWaalsContact O-CB 3.29Å; V87-L90 WeakPolarHBondContact O-CB 3.33Å; V87-L90 PolarHBondContact O-N 3Å; A88-L90 PolarHBondContact O-N 3.15Å; L90-K92 VanDerWaalsContact C-N 3.33Å; L90-K92 PolarHBondContact O-N 3.33Å; L90-Q93 CarbonylContact O-C 3.45Å; L90-Q93 PolarHBondContact O-N 3.43Å; L90-Q93 VanDerWaalsContact O-N 3.11Å; L90-I190 HydrophobicContact CB-CG2 4.24Å; L90-I190 HydrophobicContact CD1-CD1 4.08Å
91	E	88.4	Confident	87.8	Confident	31 Å²	31	52.3 Å²	52.3	15%	0.145	24%	0.243	C	C	.	.	H	α-helix	trans	-65.3	-38.8	175.3	-172.2	60.9	-169.5	0	0	111.2	A88 M89 Q93 Y94 I190 H194	A88-E91 PolarHBondContact O-N 3.4Å; M89-E91 VanDerWaalsContact C-N 3.32Å; E91-Q93 PolarHBondContact O-N 3.39Å; E91-Y94 WeakPolarHBondContact O-CB 3.37Å; E91-Y94 PolarHBondContact O-N 3.21Å; E91-Y94 VanDerWaalsContact O-N 3.15Å; E91-I190 HydrophobicContact CB-CG2 4.14Å; E91-H194 HydrophobicContact CB-CB 3.97Å; E91-H194 HydrophobicContact CG-CB 4.19Å
92	K	83	Confident	87.5	Confident	98 Å²	98	55 Å²	55	43%	0.426	27%	0.265	S	S	.	.	H	α-helix	trans	-66.7	-20.1	175.1	-62.1	-171.9	-178.3	178.9	0	112.9	M89 L90 Y94 H194 E198	M89-K92 PolarHBondContact O-N 2.95Å; M89-K92 HydrophobicContact SD-CD 3.97Å; L90-K92 VanDerWaalsContact C-N 3.33Å; L90-K92 PolarHBondContact O-N 3.33Å; K92-Y94 VanDerWaalsContact C-N 3.27Å; K92-Y94 PolarHBondContact O-N 3.45Å; K92-H194 VanDerWaalsContact CE-NE2 3.26Å; K92-H194 WeakPolarHBondContact CE-NE2 3.47Å; K92-E198 IonicContact NZ-OE1 2.82Å; K92-E198 PolarHBondContact NZ-OE1 3.28Å
93	Q	84.3	Confident	87.2	Confident	50 Å²	50	53.4 Å²	53.4	23%	0.234	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	36.1	173.8	-64	179.3	7.4	0	0	111.5	M89 L90 E91 W95 K96	M89-Q93 WeakPolarHBondContact O-CG 3.5Å; M89-Q93 PolarHBondContact O-N 3.12Å; L90-Q93 CarbonylContact O-C 3.45Å; L90-Q93 PolarHBondContact O-N 3.43Å; L90-Q93 VanDerWaalsContact O-N 3.11Å; E91-Q93 PolarHBondContact O-N 3.39Å; Q93-W95 PolarHBondContact O-N 3.46Å; Q93-K96 HydrophobicContact CB-CD 4.33Å; Q93-K96 HydrophobicContact CB-CG 4.41Å; Q93-K96 WeakPolarHBondContact O-CB 3.45Å; Q93-K96 PolarHBondContact O-N 3.37Å
94	Y	71.2	Confident	86.6	Confident	151 Å²	151	59.1 Å²	59.1	59%	0.592	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-53.1	-28.3	-177.1	72.2	-88.3	0	0	0	114	E91 K92 K96 L97	E91-Y94 WeakPolarHBondContact O-CB 3.37Å; E91-Y94 PolarHBondContact O-N 3.21Å; E91-Y94 VanDerWaalsContact O-N 3.15Å; K92-Y94 VanDerWaalsContact C-N 3.27Å; K92-Y94 PolarHBondContact O-N 3.45Å; Y94-K96 PolarHBondContact O-N 3.4Å; Y94-L97 WeakPolarHBondContact O-CB 3.35Å; Y94-L97 PolarHBondContact O-N 3.06Å
95	W	65.8	Low	85.7	Confident	83 Å²	83	63.4 Å²	63.4	31%	0.314	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-67.8	-19.1	175.7	62.9	-94.1	0	0	0	114	Q93 L97 Q126 P128	Q93-W95 PolarHBondContact O-N 3.46Å; W95-L97 VanDerWaalsContact C-N 3.31Å; W95-Q126 VanDerWaalsContact O-CB 3.32Å; W95-Q126 WeakPolarHBondContact O-CB 3.36Å; W95-Q126 PolarHBondContact O-OE1 3.15Å; W95-Q126 VanDerWaalsContact O-OE1 3.07Å; W95-P128 HydrophobicContact CE3-CB 4.41Å; W95-P128 HydrophobicContact CH2-CB 3.7Å; W95-P128 HydrophobicContact CH2-CG 4.08Å; W95-P128 HydrophobicContact CZ2-CB 4.34Å; W95-P128 HydrophobicContact CZ3-CB 3.78Å; W95-P128 HydrophobicContact CZ3-CG 4.07Å
96	K	71.5	Confident	85.2	Confident	83 Å²	83	64.4 Å²	64.4	36%	0.361	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-86.4	-5.6	171	-60.9	-171.5	-177.5	179	0	112.3	Q93 Y94	Q93-K96 HydrophobicContact CB-CD 4.33Å; Q93-K96 HydrophobicContact CB-CG 4.41Å; Q93-K96 WeakPolarHBondContact O-CB 3.45Å; Q93-K96 PolarHBondContact O-N 3.37Å; Y94-K96 PolarHBondContact O-N 3.4Å
97	L	79.6	Confident	84.9	Confident	5 Å²	5	62.9 Å²	62.9	3%	0.026	34%	0.34	C	S	.	.	S	Bend	trans	-108.4	138	-176.7	-60.8	-177.4	0	0	0	109.6	L54 Y94 W95 N99 Y183	L54-L97 HydrophobicContact CD2-CD1 4.26Å; L54-L97 HydrophobicContact CD2-CD2 3.63Å; L54-L97 HydrophobicContact CG-CD2 4.35Å; Y94-L97 WeakPolarHBondContact O-CB 3.35Å; Y94-L97 PolarHBondContact O-N 3.06Å; W95-L97 VanDerWaalsContact C-N 3.31Å; L97-N99 PolarHBondContact O-N 2.8Å; L97-Y183 WeakPolarHBondContact CB-OH 3.37Å
98	L	84.9	Confident	84.6	Confident	26 Å²	26	66.7 Å²	66.7	14%	0.136	36%	0.36	C	S	.	.			trans	-69.8	127.5	179	-66.7	177	0	0	0	111.3	R46 I47 P50 I100 L120 Y183 R187	R46-L98 WeakPolarHBondContact O-CD1 2.98Å; I47-L98 HydrophobicContact CB-CD1 4.31Å; I47-L98 HydrophobicContact CG1-CD1 3.85Å; P50-L98 HydrophobicContact CG-CD1 4.14Å; P50-L98 HydrophobicContact CG-CG 4.01Å; L98-I100 HydrophobicContact CB-CD1 4.22Å; L98-I100 HydrophobicContact CB-CG1 3.92Å; L98-I100 HydrophobicContact CD1-CD1 4.34Å; L98-I100 PolarHBondContact O-N 2.94Å; L98-L120 HydrophobicContact CD1-CD1 4.17Å; L98-L120 HydrophobicContact CD1-CD2 4.08Å; L98-L120 HydrophobicContact CD2-CD2 3.86Å; L98-L120 HydrophobicContact CG-CD2 4.39Å; L98-Y183 HydrophobicContact CB-CE1 4.32Å; L98-Y183 PolarHBondContact N-OH 3.34Å; L98-Y183 WeakPolarHBondContact O-CE1 3.42Å; L98-Y183 PolarHBondContact O-OH 3.45Å; L98-R187 PolarHBondContact O-NH1 3.43Å
99	N	86	Confident	84.4	Confident	119 Å²	119	66.8 Å²	66.8	64%	0.636	36%	0.361	S	S	*	.			trans	-81.3	81.3	173.9	-168.1	30.2	0	0	0	111.6	L97	L97-N99 PolarHBondContact O-N 2.8Å
100	I	89.4	Confident	84.2	Confident	6 Å²	6	64.1 Å²	64.1	3%	0.031	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-93.6	128.3	178.2	-54.7	-178.8	0	0	0	109.6	I47 L98 I116 T180 Y183 L184	I47-I100 HydrophobicContact CD1-CD1 3.89Å; I47-I100 HydrophobicContact CG1-CD1 3.96Å; I47-I100 HydrophobicContact CG2-CD1 4.29Å; L98-I100 HydrophobicContact CB-CD1 4.22Å; L98-I100 HydrophobicContact CB-CG1 3.92Å; L98-I100 HydrophobicContact CD1-CD1 4.34Å; L98-I100 PolarHBondContact O-N 2.94Å; I100-I116 HydrophobicContact CG2-CD1 4.31Å; I100-I116 HydrophobicContact CG2-CG1 3.99Å; I100-T180 HydrophobicContact CD1-CG2 4.18Å; I100-T180 HydrophobicContact CG2-CG2 3.68Å; I100-Y183 HydrophobicContact CD1-CD1 3.86Å; I100-Y183 HydrophobicContact CD1-CE1 3.99Å; I100-Y183 HydrophobicContact CG1-CD1 4.5Å; I100-Y183 HydrophobicContact CG1-CE1 4.23Å; I100-L184 HydrophobicContact CB-CD2 4.14Å; I100-L184 WeakPolarHBondContact O-CD2 3.36Å
101	P	89.9	Confident	84.2	Confident	52 Å²	52	67 Å²	67	34%	0.338	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-69.6	148.8	175.3	29.2	-34.6	0	0	0	111.1	Y112 L119	P101-Y112 WeakPolarHBondContact O-CE2 3.37Å; P101-Y112 PolarHBondContact O-OH 2.87Å; P101-L119 VanDerWaalsContact CD-CD2 3.41Å; P101-L119 HydrophobicContact CG-CD2 4.26Å
102	A	90	Very high	84.4	Confident	70 Å²	70	65.5 Å²	65.5	58%	0.579	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-67.7	149.9	168.3	0	0	0	0	0	110.2
103	Q	89.7	Confident	84.8	Confident	42 Å²	42	60.9 Å²	60.9	20%	0.196	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-64.4	134.4	172.2	-173.2	-179.1	10.4	0	0	109.8	E107 Y112 Y177 K181	Q103-E107 HydrophobicContact CG-CB 4.04Å; Q103-E107 HydrophobicContact CG-CG 4.38Å; Q103-E107 PolarHBondContact NE2-O 3.28Å; Q103-Y112 VanDerWaalsContact CA-CE2 3.44Å; Q103-Y112 HydrophobicContact CB-CD1 3.92Å; Q103-Y112 HydrophobicContact CB-CD2 3.74Å; Q103-Y112 HydrophobicContact CB-CE1 3.91Å; Q103-Y112 HydrophobicContact CB-CE2 3.76Å; Q103-Y112 HydrophobicContact CB-CG 3.82Å; Q103-Y112 HydrophobicContact CG-CD1 4.1Å; Q103-Y112 HydrophobicContact CG-CD2 3.95Å; Q103-Y112 HydrophobicContact CG-CE2 4.48Å; Q103-Y112 HydrophobicContact CG-CG 3.74Å; Q103-Y177 PolarHBondContact OE1-OH 2.98Å; Q103-Y177 VanDerWaalsContact OE1-OH 3.09Å; Q103-K181 VanDerWaalsContact OE1-CE 3.29Å
104	E	85.9	Confident	85.1	Confident	127 Å²	127	60.7 Å²	60.7	59%	0.593	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-75.3	150.2	175.8	-65.6	171.4	-159.4	0	0	110.4	T106 E107	E104-T106 PolarHBondContact O-N 2.7Å; E104-E107 HydrophobicContact CB-CB 4.08Å; E104-E107 PolarHBondContact N-OE2 2.92Å; E104-E107 WeakPolarHBondContact O-CB 3.48Å; E104-E107 PolarHBondContact O-N 3.09Å
105	G	77.1	Confident	86.1	Confident	91 Å²	91	56.2 Å²	56.2	94%	0.938	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-24	-167.8	0	0	0	0	0	115.7
106	T	84.3	Confident	87.3	Confident	143 Å²	143	52.3 Å²	52.3	88%	0.877	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	1.3	178.4	54.9	0	0	0	0	113.2	E104	E104-T106 PolarHBondContact O-N 2.7Å
107	E	88.6	Confident	88.2	Confident	38 Å²	38	48.7 Å²	48.7	18%	0.178	30%	0.297	C	S	.	.			trans	-77.6	128.6	-175.2	-177.9	178	-153.4	0	0	110.9	Q103 E104 C111 Y112 K115	Q103-E107 HydrophobicContact CG-CB 4.04Å; Q103-E107 HydrophobicContact CG-CG 4.38Å; Q103-E107 PolarHBondContact NE2-O 3.28Å; E104-E107 HydrophobicContact CB-CB 4.08Å; E104-E107 PolarHBondContact N-OE2 2.92Å; E104-E107 WeakPolarHBondContact O-CB 3.48Å; E104-E107 PolarHBondContact O-N 3.09Å; E107-C111 HydrophobicContact CG-CB 4.42Å; E107-Y112 WeakPolarHBondContact OE1-CA 3.47Å; E107-Y112 VanDerWaalsContact OE2-CD2 3.29Å; E107-Y112 WeakPolarHBondContact OE2-CD2 3.21Å; E107-K115 VanDerWaalsContact OE1-CE 3.29Å; E107-K115 WeakPolarHBondContact OE1-CE 3.2Å; E107-K115 IonicContact OE1-NZ 2.71Å; E107-K115 PolarHBondContact OE1-NZ 3.26Å; E107-K115 IonicContact OE2-NZ 2.88Å; E107-K115 PolarHBondContact OE2-NZ 3.07Å
108	D	90.4	Very high	88.8	Confident	84 Å²	84	53 Å²	53	45%	0.449	32%	0.318	S	S	.	.			trans	-61.8	145.3	173.9	175.4	62	0	0	0	111.7	N110 C111 Y112	D108-N110 PolarHBondContact O-N 3.02Å; D108-N110 WeakPolarHBondContact OD2-CA 3.46Å; D108-N110 WeakPolarHBondContact OD2-CB 3.33Å; D108-N110 PolarHBondContact OD2-N 2.87Å; D108-N110 PolarHBondContact OD2-ND2 3.5Å; D108-C111 HydrophobicContact CB-CB 4.16Å; D108-C111 PolarHBondContact O-N 3.5Å; D108-C111 PolarHBondContact OD2-N 3.05Å; D108-Y112 WeakPolarHBondContact O-CB 3.39Å; D108-Y112 PolarHBondContact O-N 2.96Å
109	A	89.1	Confident	89	Confident	5 Å²	5	54.6 Å²	54.6	4%	0.041	33%	0.326	C	S	.	.	H	α-helix	trans	-66.2	-34.9	-176.4	0	0	0	0	0	113	P20 F22 V113 Y177	P20-A109 HydrophobicContact CB-CB 3.4Å; P20-A109 VanDerWaalsContact CB-CB 3.4Å; P20-A109 HydrophobicContact CG-CB 3.69Å; F22-A109 HydrophobicContact CE1-CB 3.68Å; F22-A109 HydrophobicContact CZ-CB 3.8Å; A109-V113 WeakPolarHBondContact O-CG2 3.44Å; A109-V113 PolarHBondContact O-N 3.26Å; A109-V113 VanDerWaalsContact O-N 3.14Å; A109-Y177 HydrophobicContact CB-CD2 4.15Å; A109-Y177 HydrophobicContact CB-CE2 3.93Å
110	N	88.6	Confident	89	Confident	26 Å²	26	49.1 Å²	49.1	14%	0.139	30%	0.297	C	S	.	.	H	α-helix	trans	-67.1	-47.4	174.1	-65.2	-79.1	0	0	0	110.1	Q21 F22 V23 D108 Y112 V113 V114	Q21-N110 PolarHBondContact O-ND2 3Å; F22-N110 WeakPolarHBondContact CA-OD1 3.21Å; F22-N110 WeakPolarHBondContact CB-OD1 3.42Å; F22-N110 VanDerWaalsContact CD1-OD1 3.24Å; F22-N110 WeakPolarHBondContact CD1-OD1 3.4Å; V23-N110 PolarHBondContact N-OD1 3Å; V23-N110 VanDerWaalsContact N-OD1 3.08Å; D108-N110 PolarHBondContact O-N 3.02Å; D108-N110 WeakPolarHBondContact OD2-CA 3.46Å; D108-N110 WeakPolarHBondContact OD2-CB 3.33Å; D108-N110 PolarHBondContact OD2-N 2.87Å; D108-N110 PolarHBondContact OD2-ND2 3.5Å; N110-Y112 VanDerWaalsContact C-N 3.26Å; N110-Y112 PolarHBondContact O-N 3.34Å; N110-V113 PolarHBondContact O-N 3.29Å; N110-V113 VanDerWaalsContact O-N 3.12Å; N110-V114 WeakPolarHBondContact O-CG2 3.39Å; N110-V114 PolarHBondContact O-N 3.43Å
111	C	89.6	Confident	88.7	Confident	76 Å²	76	52.5 Å²	52.5	51%	0.514	31%	0.312	S	S	.	.	H	α-helix	trans	-55.5	-43.6	176.5	-72.4	0	0	0	0	111.8	E107 D108 V113 V114 K115	E107-C111 HydrophobicContact CG-CB 4.42Å; D108-C111 HydrophobicContact CB-CB 4.16Å; D108-C111 PolarHBondContact O-N 3.5Å; D108-C111 PolarHBondContact OD2-N 3.05Å; C111-V113 PolarHBondContact O-N 3.04Å; C111-V114 PolarHBondContact O-N 3.26Å; C111-K115 WeakPolarHBondContact O-CB 3.44Å; C111-K115 PolarHBondContact O-N 2.61Å
112	Y	92.8	Very high	88.1	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-60.7	-44.2	177	179.7	-120.4	0	0	0	112.6	P101 Q103 E107 D108 N110 K115 I116 Y177 T180 L184	P101-Y112 WeakPolarHBondContact O-CE2 3.37Å; P101-Y112 PolarHBondContact O-OH 2.87Å; Q103-Y112 VanDerWaalsContact CA-CE2 3.44Å; Q103-Y112 HydrophobicContact CB-CD1 3.92Å; Q103-Y112 HydrophobicContact CB-CD2 3.74Å; Q103-Y112 HydrophobicContact CB-CE1 3.91Å; Q103-Y112 HydrophobicContact CB-CE2 3.76Å; Q103-Y112 HydrophobicContact CB-CG 3.82Å; Q103-Y112 HydrophobicContact CG-CD1 4.1Å; Q103-Y112 HydrophobicContact CG-CD2 3.95Å; Q103-Y112 HydrophobicContact CG-CE2 4.48Å; Q103-Y112 HydrophobicContact CG-CG 3.74Å; E107-Y112 WeakPolarHBondContact OE1-CA 3.47Å; E107-Y112 VanDerWaalsContact OE2-CD2 3.29Å; E107-Y112 WeakPolarHBondContact OE2-CD2 3.21Å; D108-Y112 WeakPolarHBondContact O-CB 3.39Å; D108-Y112 PolarHBondContact O-N 2.96Å; N110-Y112 VanDerWaalsContact C-N 3.26Å; N110-Y112 PolarHBondContact O-N 3.34Å; Y112-K115 WeakPolarHBondContact O-CB 3.31Å; Y112-K115 PolarHBondContact O-N 2.92Å; Y112-I116 HydrophobicContact CD1-CD1 3.82Å; Y112-I116 HydrophobicContact CD2-CD1 4.3Å; Y112-I116 HydrophobicContact CE1-CD1 3.48Å; Y112-I116 VanDerWaalsContact CE1-CD1 3.48Å; Y112-I116 HydrophobicContact CE2-CD1 3.99Å; Y112-I116 HydrophobicContact CE2-CG1 4.3Å; Y112-I116 HydrophobicContact CG-CD1 4.23Å; Y112-I116 WeakPolarHBondContact O-CD1 3.4Å; Y112-I116 VanDerWaalsContact O-CG1 3.29Å; Y112-I116 WeakPolarHBondContact O-CG1 3.44Å; Y112-I116 PolarHBondContact O-N 3.09Å; Y112-I116 VanDerWaalsContact O-N 3.12Å; Y112-Y177 AromaticContact CD1-CD2 3.95Å; Y112-Y177 HydrophobicContact CD1-CD2 3.95Å; Y112-Y177 AromaticContact CD1-CE2 3.98Å; Y112-Y177 HydrophobicContact CD1-CE2 3.98Å; Y112-Y177 HydrophobicContact CE1-CD2 4.5Å; Y112-T180 HydrophobicContact CE1-CG2 4.26Å; Y112-L184 WeakPolarHBondContact OH-CD1 3.44Å
113	V	92.1	Very high	87.1	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.006	31%	0.314	C	S	.	.	H	α-helix	trans	-66.6	-41.2	177.9	177	0	0	0	0	111.3	F22 A109 N110 C111 K115 I116 I117 Y173 L176 Y177	F22-V113 HydrophobicContact CE1-CG2 4.1Å; A109-V113 WeakPolarHBondContact O-CG2 3.44Å; A109-V113 PolarHBondContact O-N 3.26Å; A109-V113 VanDerWaalsContact O-N 3.14Å; N110-V113 PolarHBondContact O-N 3.29Å; N110-V113 VanDerWaalsContact O-N 3.12Å; C111-V113 PolarHBondContact O-N 3.04Å; V113-K115 VanDerWaalsContact C-N 3.33Å; V113-K115 PolarHBondContact O-N 3.31Å; V113-I116 WeakPolarHBondContact O-CB 3.33Å; V113-I116 PolarHBondContact O-N 3.33Å; V113-I116 VanDerWaalsContact O-N 3.14Å; V113-I117 HydrophobicContact CG1-CD1 4.13Å; V113-I117 HydrophobicContact CG1-CG1 4.47Å; V113-I117 WeakPolarHBondContact O-CG1 3.28Å; V113-I117 PolarHBondContact O-N 2.87Å; V113-Y173 HydrophobicContact CB-CD1 3.81Å; V113-Y173 HydrophobicContact CB-CE1 4.2Å; V113-Y173 HydrophobicContact CG1-CD1 3.45Å; V113-Y173 VanDerWaalsContact CG1-CD1 3.45Å; V113-Y173 HydrophobicContact CG1-CE1 3.84Å; V113-L176 HydrophobicContact CG1-CB 3.91Å; V113-L176 HydrophobicContact CG1-CD1 4Å; V113-Y177 HydrophobicContact CG2-CD2 4.19Å; V113-Y177 HydrophobicContact CG2-CG 4.49Å
114	V	91.1	Very high	85.8	Confident	47 Å²	47	57.8 Å²	57.8	29%	0.285	34%	0.336	S	S	.	.	H	α-helix	trans	-58.5	-46.3	175.2	173.5	0	0	0	0	110.8	N110 C111 I116 I117 E118 Y173	N110-V114 WeakPolarHBondContact O-CG2 3.39Å; N110-V114 PolarHBondContact O-N 3.43Å; C111-V114 PolarHBondContact O-N 3.26Å; V114-I116 VanDerWaalsContact C-N 3.26Å; V114-I116 PolarHBondContact O-N 3.21Å; V114-I117 WeakPolarHBondContact O-CB 3.25Å; V114-I117 PolarHBondContact O-N 3.01Å; V114-I117 VanDerWaalsContact O-N 3.09Å; V114-E118 HydrophobicContact CG1-CG 4.48Å; V114-E118 WeakPolarHBondContact O-CG 3.47Å; V114-E118 PolarHBondContact O-N 2.69Å; V114-Y173 HydrophobicContact CG2-CE1 3.95Å
115	K	91.6	Very high	84.4	Confident	56 Å²	56	56.1 Å²	56.1	24%	0.243	34%	0.335	C	S	.	.	H	α-helix	trans	-56.4	-39.4	175.3	-175.6	176	74.9	-165.3	0	112.4	E107 C111 Y112 V113 L119	E107-K115 VanDerWaalsContact OE1-CE 3.29Å; E107-K115 WeakPolarHBondContact OE1-CE 3.2Å; E107-K115 IonicContact OE1-NZ 2.71Å; E107-K115 PolarHBondContact OE1-NZ 3.26Å; E107-K115 IonicContact OE2-NZ 2.88Å; E107-K115 PolarHBondContact OE2-NZ 3.07Å; C111-K115 WeakPolarHBondContact O-CB 3.44Å; C111-K115 PolarHBondContact O-N 2.61Å; Y112-K115 WeakPolarHBondContact O-CB 3.31Å; Y112-K115 PolarHBondContact O-N 2.92Å; V113-K115 VanDerWaalsContact C-N 3.33Å; V113-K115 PolarHBondContact O-N 3.31Å; K115-L119 WeakPolarHBondContact O-CB 3.41Å; K115-L119 PolarHBondContact O-N 2.98Å
116	I	91.9	Very high	83.1	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-67.9	-41.5	177.4	-65.5	158.2	0	0	0	111.4	T43 I47 I100 Y112 V113 V114 L119 L120 T180	T43-I116 HydrophobicContact CG2-CG2 4.26Å; I47-I116 HydrophobicContact CD1-CG2 3.88Å; I100-I116 HydrophobicContact CG2-CD1 4.31Å; I100-I116 HydrophobicContact CG2-CG1 3.99Å; Y112-I116 HydrophobicContact CD1-CD1 3.82Å; Y112-I116 HydrophobicContact CD2-CD1 4.3Å; Y112-I116 HydrophobicContact CE1-CD1 3.48Å; Y112-I116 VanDerWaalsContact CE1-CD1 3.48Å; Y112-I116 HydrophobicContact CE2-CD1 3.99Å; Y112-I116 HydrophobicContact CE2-CG1 4.3Å; Y112-I116 HydrophobicContact CG-CD1 4.23Å; Y112-I116 WeakPolarHBondContact O-CD1 3.4Å; Y112-I116 VanDerWaalsContact O-CG1 3.29Å; Y112-I116 WeakPolarHBondContact O-CG1 3.44Å; Y112-I116 PolarHBondContact O-N 3.09Å; Y112-I116 VanDerWaalsContact O-N 3.12Å; V113-I116 WeakPolarHBondContact O-CB 3.33Å; V113-I116 PolarHBondContact O-N 3.33Å; V113-I116 VanDerWaalsContact O-N 3.14Å; V114-I116 VanDerWaalsContact C-N 3.26Å; V114-I116 PolarHBondContact O-N 3.21Å; I116-L119 PolarHBondContact O-N 2.94Å; I116-L120 HydrophobicContact CG2-CD1 4Å; I116-L120 HydrophobicContact CG2-CG 4.31Å; I116-L120 WeakPolarHBondContact O-CB 3.41Å; I116-L120 WeakPolarHBondContact O-CG 3.46Å; I116-L120 PolarHBondContact O-N 2.91Å; I116-T180 HydrophobicContact CD1-CG2 3.67Å
117	I	90.3	Very high	81.3	Confident	6 Å²	6	55.1 Å²	55.1	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-59.6	-51	177.2	-64.7	163.9	0	0	0	109.5	R39 L40 T43 V113 V114 L120 E121 Y173	R39-I117 HydrophobicContact CB-CG2 4.01Å; L40-I117 HydrophobicContact CD2-CD1 3.46Å; L40-I117 VanDerWaalsContact CD2-CD1 3.46Å; L40-I117 HydrophobicContact CD2-CG1 4.47Å; L40-I117 HydrophobicContact CG-CD1 4.23Å; T43-I117 HydrophobicContact CG2-CG1 3.95Å; V113-I117 HydrophobicContact CG1-CD1 4.13Å; V113-I117 HydrophobicContact CG1-CG1 4.47Å; V113-I117 WeakPolarHBondContact O-CG1 3.28Å; V113-I117 PolarHBondContact O-N 2.87Å; V114-I117 WeakPolarHBondContact O-CB 3.25Å; V114-I117 PolarHBondContact O-N 3.01Å; V114-I117 VanDerWaalsContact O-N 3.09Å; I117-L120 PolarHBondContact O-N 3.39Å; I117-E121 WeakPolarHBondContact O-CG 3.44Å; I117-E121 PolarHBondContact O-N 2.87Å; I117-Y173 HydrophobicContact CD1-CE1 4.27Å
118	E	90.7	Very high	79.3	Confident	96 Å²	96	55.8 Å²	55.8	45%	0.449	31%	0.307	S	S	.	.	H	α-helix	trans	-59.5	-49.3	178.9	-68.6	173.9	172.2	0	0	111.6	V114 L120 E121 D122	V114-E118 HydrophobicContact CG1-CG 4.48Å; V114-E118 WeakPolarHBondContact O-CG 3.47Å; V114-E118 PolarHBondContact O-N 2.69Å; E118-L120 VanDerWaalsContact C-N 3.31Å; E118-L120 PolarHBondContact O-N 3.2Å; E118-E121 PolarHBondContact O-N 3.39Å; E118-D122 PolarHBondContact O-N 3.02Å; E118-D122 VanDerWaalsContact O-N 3.11Å
119	L	89.8	Confident	77.1	Confident	60 Å²	60	57.7 Å²	57.7	31%	0.314	32%	0.324	S	S	.	.	H	α-helix	trans	-56	-45.2	177.4	177.7	70.7	0	0	0	112.3	P101 K115 I116 T123	P101-L119 VanDerWaalsContact CD-CD2 3.41Å; P101-L119 HydrophobicContact CG-CD2 4.26Å; K115-L119 WeakPolarHBondContact O-CB 3.41Å; K115-L119 PolarHBondContact O-N 2.98Å; I116-L119 PolarHBondContact O-N 2.94Å; L119-T123 WeakPolarHBondContact O-CB 3.4Å; L119-T123 PolarHBondContact O-N 3.34Å; L119-T123 VanDerWaalsContact O-N 3.14Å; L119-T123 PolarHBondContact O-OG1 3.38Å
120	L	86.5	Confident	74.9	Confident	3 Å²	3	60.2 Å²	60.2	2%	0.016	34%	0.339	C	S	.	.	H	α-helix	trans	-72.8	-35.1	-177.7	-70	-175.1	0	0	0	111.2	T43 R46 I47 L98 I116 I117 E118 D122 T123	T43-L120 HydrophobicContact CG2-CD1 3.87Å; R46-L120 PolarHBondContact NH1-O 3.3Å; I47-L120 HydrophobicContact CD1-CD1 3.82Å; I47-L120 HydrophobicContact CG1-CD1 3.57Å; L98-L120 HydrophobicContact CD1-CD1 4.17Å; L98-L120 HydrophobicContact CD1-CD2 4.08Å; L98-L120 HydrophobicContact CD2-CD2 3.86Å; L98-L120 HydrophobicContact CG-CD2 4.39Å; I116-L120 HydrophobicContact CG2-CD1 4Å; I116-L120 HydrophobicContact CG2-CG 4.31Å; I116-L120 WeakPolarHBondContact O-CB 3.41Å; I116-L120 WeakPolarHBondContact O-CG 3.46Å; I116-L120 PolarHBondContact O-N 2.91Å; I117-L120 PolarHBondContact O-N 3.39Å; E118-L120 VanDerWaalsContact C-N 3.31Å; E118-L120 PolarHBondContact O-N 3.2Å; L120-D122 VanDerWaalsContact C-N 3.34Å; L120-D122 PolarHBondContact O-N 3.38Å; L120-T123 PolarHBondContact O-N 3Å
121	E	83.4	Confident	72.9	Confident	77 Å²	77	71.1 Å²	71.1	36%	0.36	38%	0.378	S	S	.	.	H	α-helix	trans	-60.2	-43.1	174.2	-76.3	176.3	173.8	0	0	113	R39 I117 E118 T123	R39-E121 WeakPolarHBondContact CB-OE1 3.22Å; R39-E121 WeakPolarHBondContact CD-OE1 3.5Å; R39-E121 WeakPolarHBondContact CG-OE1 3.32Å; R39-E121 IonicContact CZ-OE1 3.57Å; R39-E121 IonicContact CZ-OE2 3.22Å; R39-E121 VanDerWaalsContact NE-CD 3.26Å; R39-E121 IonicContact NE-OE1 3.43Å; R39-E121 PolarHBondContact NE-OE1 2.89Å; R39-E121 IonicContact NE-OE2 3.95Å; R39-E121 PolarHBondContact NE-OE2 3.3Å; R39-E121 VanDerWaalsContact NE-OE2 3.09Å; R39-E121 IonicContact NH2-OE1 2.87Å; R39-E121 IonicContact NH2-OE2 3.55Å; R39-E121 PolarHBondContact NH2-OE2 2.96Å; I117-E121 WeakPolarHBondContact O-CG 3.44Å; I117-E121 PolarHBondContact O-N 2.87Å; E118-E121 PolarHBondContact O-N 3.39Å; E121-T123 PolarHBondContact O-N 3.27Å
122	D	75.6	Confident	71.1	Confident	137 Å²	137	69.8 Å²	69.8	73%	0.733	38%	0.377	S	S	*	.	H	α-helix	trans	-75	-15.8	178	-70.1	-19.3	0	0	0	113.1	E118 L120 P124	E118-D122 PolarHBondContact O-N 3.02Å; E118-D122 VanDerWaalsContact O-N 3.11Å; L120-D122 VanDerWaalsContact C-N 3.34Å; L120-D122 PolarHBondContact O-N 3.38Å; D122-P124 WeakPolarHBondContact O-CD 3.3Å
123	T	70.1	Confident	69.3	Low	35 Å²	35	76.3 Å²	76.3	22%	0.215	41%	0.411	C	S	.	.	S	Bend	trans	-87	102.8	177.7	-56.9	0	0	0	0	109.8	R46 L119 L120 E121 T125 Q126	R46-T123 PolarHBondContact NH1-O 3.05Å; R46-T123 PolarHBondContact NH2-O 3.38Å; L119-T123 WeakPolarHBondContact O-CB 3.4Å; L119-T123 PolarHBondContact O-N 3.34Å; L119-T123 VanDerWaalsContact O-N 3.14Å; L119-T123 PolarHBondContact O-OG1 3.38Å; L120-T123 PolarHBondContact O-N 3Å; E121-T123 PolarHBondContact O-N 3.27Å; T123-T125 PolarHBondContact O-N 2.99Å; T123-Q126 HydrophobicContact CG2-CG 4.32Å
124	P	62.7	Low	67.3	Low	104 Å²	104	78 Å²	78	68%	0.675	43%	0.427	S	S	*	.			trans	-56.6	136.3	166.6	22.6	-30.7	0	0	0	108	D122 Q126	D122-P124 WeakPolarHBondContact O-CD 3.3Å; P124-Q126 PolarHBondContact O-N 2.62Å
125	T	56.9	Low	65.5	Low	92 Å²	92	78 Å²	78	56%	0.564	43%	0.433	S	S	*	.			trans	-45.8	114.2	178.2	-56.5	0	0	0	0	107.7	R46 T123 L127	R46-T125 PolarHBondContact NH2-OG1 3.46Å; T123-T125 PolarHBondContact O-N 2.99Å; T125-L127 VanDerWaalsContact C-N 3.28Å; T125-L127 PolarHBondContact O-N 3.19Å
126	Q	49.2	Very low	63.6	Low	94 Å²	94	81.3 Å²	81.3	44%	0.439	45%	0.452	S	S	.	.			trans	-61.5	93.1	-171	-70.8	-163	-10.1	0	0	109	W95 T123 P124	W95-Q126 VanDerWaalsContact O-CB 3.32Å; W95-Q126 WeakPolarHBondContact O-CB 3.36Å; W95-Q126 PolarHBondContact O-OE1 3.15Å; W95-Q126 VanDerWaalsContact O-OE1 3.07Å; T123-Q126 HydrophobicContact CG2-CG 4.32Å; P124-Q126 PolarHBondContact O-N 2.62Å
127	L	45.5	Very low	61.6	Low	118 Å²	118	86.2 Å²	86.2	62%	0.618	48%	0.478	S	S	*	.			trans	-74.2	144.5	171.3	-84.9	129.2	0	0	0	107.5	T125	T125-L127 VanDerWaalsContact C-N 3.28Å; T125-L127 PolarHBondContact O-N 3.19Å
128	P	47.1	Very low	59.5	Low	52 Å²	52	91.3 Å²	91.3	34%	0.338	50%	0.502	S	S	.	.			trans	-55.1	154	174.4	20.3	-26.3	0	0	0	110	W95 T130	W95-P128 HydrophobicContact CE3-CB 4.41Å; W95-P128 HydrophobicContact CH2-CB 3.7Å; W95-P128 HydrophobicContact CH2-CG 4.08Å; W95-P128 HydrophobicContact CZ2-CB 4.34Å; W95-P128 HydrophobicContact CZ3-CB 3.78Å; W95-P128 HydrophobicContact CZ3-CG 4.07Å; P128-T130 PolarHBondContact O-N 3.45Å; P128-T130 PolarHBondContact O-OG1 2.94Å
129	P	43.8	Very low	57.4	Low	124 Å²	124	91.1 Å²	91.1	81%	0.805	51%	0.511	S	S	*	.			trans	-64.6	85.9	158.2	27.4	-30.7	0	0	0	107.8	R131	P129-R131 PolarHBondContact O-N 3.25Å
130	T	44	Very low	55.2	Low	58 Å²	58	93.6 Å²	93.6	36%	0.356	53%	0.529	S	S	.	.			trans	-77.4	87.2	179	-38.6	0	0	0	0	108.5	P128 G132	P128-T130 PolarHBondContact O-N 3.45Å; P128-T130 PolarHBondContact O-OG1 2.94Å; T130-G132 PolarHBondContact O-N 2.94Å
131	R	45.5	Very low	53.3	Low	255 Å²	255	99.6 Å²	99.6	96%	0.962	56%	0.56	S	S	*	*			trans	-76.9	104.8	159	-80.9	-175.3	174.6	175.4	-1.3	107.9	P129	P129-R131 PolarHBondContact O-N 3.25Å
132	G	52.5	Low	51.3	Low	48 Å²	48	98.3 Å²	98.3	50%	0.495	57%	0.567	S	S	.	*	S	Bend	trans	147.7	177.8	171.3	0	0	0	0	0	115.5	T130 G134 A135	T130-G132 PolarHBondContact O-N 2.94Å; G132-G134 PolarHBondContact O-N 3.22Å; G132-A135 WeakPolarHBondContact O-CB 3.4Å; G132-A135 PolarHBondContact O-N 3.43Å
133	I	55.2	Low	49.9	Very low	138 Å²	138	99.7 Å²	99.7	71%	0.708	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.1	-23.9	-175.2	-60.4	169.2	0	0	0	113.1	A135 L136	I133-A135 PolarHBondContact O-N 3.12Å; I133-L136 PolarHBondContact O-N 3.36Å; I133-L136 VanDerWaalsContact O-N 3.11Å
134	G	48.9	Very low	48.6	Very low	35 Å²	35	103.2 Å²	103.2	36%	0.361	59%	0.59	S	S	.	*	H	α-helix	trans	-59.1	-26.3	173	0	0	0	0	0	114.3	G132 L136 Q138	G132-G134 PolarHBondContact O-N 3.22Å; G134-L136 VanDerWaalsContact C-N 3.32Å; G134-L136 PolarHBondContact O-N 2.88Å; G134-Q138 PolarHBondContact O-N 3.32Å
135	A	53.2	Low	47.8	Very low	48 Å²	48	101.7 Å²	101.7	40%	0.397	59%	0.586	S	S	.	*	H	α-helix	trans	-67.7	-29.5	175.8	0	0	0	0	0	113.2	G132 I133	G132-A135 WeakPolarHBondContact O-CB 3.4Å; G132-A135 PolarHBondContact O-N 3.43Å; I133-A135 PolarHBondContact O-N 3.12Å
136	L	52.2	Low	47.4	Very low	125 Å²	125	103.9 Å²	103.9	65%	0.654	59%	0.59	S	S	*	*	H	α-helix	trans	-76.8	-38.9	-179.9	-66.3	171.1	0	0	0	111.5	I133 G134 Q138 S139	I133-L136 PolarHBondContact O-N 3.36Å; I133-L136 VanDerWaalsContact O-N 3.11Å; G134-L136 VanDerWaalsContact C-N 3.32Å; G134-L136 PolarHBondContact O-N 2.88Å; L136-Q138 VanDerWaalsContact C-N 3.34Å; L136-S139 PolarHBondContact O-N 3.37Å; L136-S139 PolarHBondContact O-OG 3.05Å
137	L	49.8	Very low	47.8	Very low	106 Å²	106	101.7 Å²	101.7	56%	0.555	59%	0.588	S	S	*	*	H	α-helix	trans	-70.6	-28.8	175.7	-65.2	175.2	0	0	0	112.6	S139 T140 I141	L137-S139 VanDerWaalsContact C-N 3.28Å; L137-S139 PolarHBondContact O-N 3.04Å; L137-T140 PolarHBondContact O-N 3.27Å; L137-T140 PolarHBondContact O-OG1 2.85Å; L137-I141 WeakPolarHBondContact O-CG1 3.02Å; L137-I141 PolarHBondContact O-N 3.16Å
138	Q	47	Very low	48.6	Very low	112 Å²	112	101.2 Å²	101.2	52%	0.523	59%	0.586	S	S	.	*	H	α-helix	trans	-70.8	-23.3	175.2	-130.3	100.2	67	0	0	112.9	G134 L136 T140	G134-Q138 PolarHBondContact O-N 3.32Å; L136-Q138 VanDerWaalsContact C-N 3.34Å; Q138-T140 VanDerWaalsContact C-N 3.28Å; Q138-T140 PolarHBondContact O-N 3.32Å
139	S	46.2	Very low	49.5	Very low	93 Å²	93	103.1 Å²	103.1	65%	0.65	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-21.3	177.4	81.1	0	0	0	0	113.2	L136 L137	L136-S139 PolarHBondContact O-N 3.37Å; L136-S139 PolarHBondContact O-OG 3.05Å; L137-S139 VanDerWaalsContact C-N 3.28Å; L137-S139 PolarHBondContact O-N 3.04Å
140	T	44.5	Very low	50.9	Low	112 Å²	112	99.5 Å²	99.5	69%	0.687	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	-14.3	179.8	45.1	0	0	0	0	113.9	L137 Q138	L137-T140 PolarHBondContact O-N 3.27Å; L137-T140 PolarHBondContact O-OG1 2.85Å; Q138-T140 VanDerWaalsContact C-N 3.28Å; Q138-T140 PolarHBondContact O-N 3.32Å
141	I	45.1	Very low	52.6	Low	129 Å²	129	100.3 Å²	100.3	66%	0.662	58%	0.576	S	S	*	*	S	Bend	trans	-103.1	38.9	176.5	-54	163.5	0	0	0	110.6	L137	L137-I141 WeakPolarHBondContact O-CG1 3.02Å; L137-I141 PolarHBondContact O-N 3.16Å
142	G	41.3	Very low	54.4	Low	50 Å²	50	92.4 Å²	92.4	52%	0.515	56%	0.555	S	S	.	*			trans	-84.7	112.7	177.5	0	0	0	0	0	112.8	P144	G142-P144 VanDerWaalsContact C-CD 3.48Å; G142-P144 WeakPolarHBondContact O-CD 3.41Å
143	K	47.1	Very low	56	Low	166 Å²	166	91.6 Å²	91.6	72%	0.722	54%	0.539	S	S	*	.	S	Bend	trans	76.5	19.8	140.8	-55.1	179.6	174.4	178.8	0	123.1	A147	K143-A147 WeakPolarHBondContact O-CB 3.49Å
144	P	41.9	Very low	57.3	Low	108 Å²	108	87.7 Å²	87.7	70%	0.701	52%	0.518	S	S	*	.	H	α-helix	trans	-74.6	-32.5	174.5	27.5	-31.3	0	0	0	113.6	G142 N148	G142-P144 VanDerWaalsContact C-CD 3.48Å; G142-P144 WeakPolarHBondContact O-CD 3.41Å; P144-N148 PolarHBondContact O-N 3.47Å
145	A	46.8	Very low	59.1	Low	73 Å²	73	90.2 Å²	90.2	60%	0.603	52%	0.523	S	S	*	.	H	α-helix	trans	-79.7	-42.3	-174.7	0	0	0	0	0	113.8	N148 V149	A145-N148 PolarHBondContact O-N 3.49Å; A145-V149 WeakPolarHBondContact O-CG2 3.4Å; A145-V149 PolarHBondContact O-N 2.92Å
146	E	48.2	Very low	60.8	Low	138 Å²	138	90.3 Å²	90.3	65%	0.645	52%	0.521	S	S	*	.	H	α-helix	trans	-68.7	-38.1	177.5	-69.5	-168.1	160.9	0	0	112	N148 V149 D150	E146-N148 VanDerWaalsContact C-N 3.28Å; E146-N148 PolarHBondContact O-N 3.32Å; E146-V149 PolarHBondContact O-N 3.36Å; E146-D150 WeakPolarHBondContact O-CB 3.41Å; E146-D150 PolarHBondContact O-N 3.38Å
147	A	57.5	Low	62.6	Low	48 Å²	48	84.4 Å²	84.4	40%	0.397	49%	0.49	S	S	.	.	H	α-helix	trans	-61.3	-37.6	176.8	0	0	0	0	0	112.1	K143 T151	K143-A147 WeakPolarHBondContact O-CB 3.49Å; A147-T151 WeakPolarHBondContact O-CB 3.46Å; A147-T151 PolarHBondContact O-N 2.92Å; A147-T151 PolarHBondContact O-OG1 3.35Å
148	N	62.7	Low	64.5	Low	108 Å²	108	84.6 Å²	84.6	58%	0.578	49%	0.487	S	S	*	.	H	α-helix	trans	-69.7	-41.5	178.2	-157.6	-1.4	0	0	0	111.4	P144 A145 E146 T151 V152	P144-N148 PolarHBondContact O-N 3.47Å; A145-N148 PolarHBondContact O-N 3.49Å; E146-N148 VanDerWaalsContact C-N 3.28Å; E146-N148 PolarHBondContact O-N 3.32Å; N148-T151 PolarHBondContact O-N 3.34Å; N148-V152 WeakPolarHBondContact O-CB 3.39Å; N148-V152 WeakPolarHBondContact O-CG2 3.48Å; N148-V152 PolarHBondContact O-N 3.06Å
149	V	65.1	Low	66.5	Low	92 Å²	92	83.4 Å²	83.4	56%	0.558	50%	0.496	S	S	*	.	H	α-helix	trans	-65	-42.5	175.8	176.5	0	0	0	0	111.5	A145 E146 T151 V152 L153	A145-V149 WeakPolarHBondContact O-CG2 3.4Å; A145-V149 PolarHBondContact O-N 2.92Å; E146-V149 PolarHBondContact O-N 3.36Å; V149-T151 VanDerWaalsContact C-N 3.34Å; V149-T151 PolarHBondContact O-N 3.35Å; V149-V152 PolarHBondContact O-N 3.32Å; V149-L153 VanDerWaalsContact O-CB 3.28Å; V149-L153 WeakPolarHBondContact O-CB 3.44Å; V149-L153 PolarHBondContact O-N 3.17Å
150	D	74.4	Confident	68.5	Low	48 Å²	48	84 Å²	84	26%	0.257	48%	0.484	S	S	.	.	H	α-helix	trans	-62.4	-41.3	175.9	-84.2	-34.3	0	0	0	111.9	Y38 E146 H154	Y38-D150 HydrophobicContact CE2-CB 4.39Å; Y38-D150 PolarHBondContact OH-OD1 3.37Å; Y38-D150 PolarHBondContact OH-OD2 3.32Å; E146-D150 WeakPolarHBondContact O-CB 3.41Å; E146-D150 PolarHBondContact O-N 3.38Å; D150-H154 VanDerWaalsContact O-CB 3.25Å; D150-H154 WeakPolarHBondContact O-CB 3.47Å; D150-H154 PolarHBondContact O-N 3.12Å
151	T	79.4	Confident	70.7	Confident	75 Å²	75	85.9 Å²	85.9	46%	0.46	48%	0.483	S	S	.	.	H	α-helix	trans	-66.4	-47.2	178.3	-49.7	0	0	0	0	111	A147 N148 V149 L153 H154 D155	A147-T151 WeakPolarHBondContact O-CB 3.46Å; A147-T151 PolarHBondContact O-N 2.92Å; A147-T151 PolarHBondContact O-OG1 3.35Å; N148-T151 PolarHBondContact O-N 3.34Å; V149-T151 VanDerWaalsContact C-N 3.34Å; V149-T151 PolarHBondContact O-N 3.35Å; T151-L153 VanDerWaalsContact C-N 3.35Å; T151-L153 PolarHBondContact O-N 2.91Å; T151-H154 PolarHBondContact O-N 3.24Å; T151-D155 WeakPolarHBondContact O-CB 3.3Å; T151-D155 VanDerWaalsContact O-CG 3.32Å; T151-D155 PolarHBondContact O-N 2.62Å
152	V	83.7	Confident	72.7	Confident	88 Å²	88	82 Å²	82	53%	0.533	47%	0.467	S	S	.	.	H	α-helix	trans	-61.3	-42.4	177.1	171	0	0	0	0	111.6	N148 V149 D155 S156	N148-V152 WeakPolarHBondContact O-CB 3.39Å; N148-V152 WeakPolarHBondContact O-CG2 3.48Å; N148-V152 PolarHBondContact O-N 3.06Å; V149-V152 PolarHBondContact O-N 3.32Å; V152-D155 PolarHBondContact O-N 3.02Å; V152-S156 WeakPolarHBondContact O-CB 3.49Å; V152-S156 PolarHBondContact O-N 2.7Å
153	L	84.8	Confident	74.9	Confident	31 Å²	31	86.7 Å²	86.7	16%	0.162	48%	0.475	C	S	.	.	H	α-helix	trans	-64.9	-45.8	178.6	-158.1	153.4	0	0	0	110.1	Y38 H41 V149 T151 D155 S156 L157	Y38-L153 HydrophobicContact CD2-CD2 4.09Å; H41-L153 HydrophobicContact CB-CD1 4.28Å; H41-L153 HydrophobicContact CB-CD2 4.01Å; V149-L153 VanDerWaalsContact O-CB 3.28Å; V149-L153 WeakPolarHBondContact O-CB 3.44Å; V149-L153 PolarHBondContact O-N 3.17Å; T151-L153 VanDerWaalsContact C-N 3.35Å; T151-L153 PolarHBondContact O-N 2.91Å; L153-D155 PolarHBondContact O-N 2.91Å; L153-S156 PolarHBondContact O-N 2.75Å; L153-S156 PolarHBondContact O-OG 3.38Å; L153-L157 HydrophobicContact CD2-CD1 3.67Å; L153-L157 HydrophobicContact CD2-CG 4.14Å; L153-L157 WeakPolarHBondContact O-CG 3.2Å; L153-L157 PolarHBondContact O-N 3.23Å
154	H	84.4	Confident	76.9	Confident	57 Å²	57	82.4 Å²	82.4	26%	0.264	46%	0.46	S	S	.	.	H	α-helix	trans	-63.1	-42.4	178.2	-172.4	-99.3	0	0	0	112.9	Y38 D150 T151 L157 K158	Y38-H154 HydrophobicContact CD2-CB 4.49Å; D150-H154 VanDerWaalsContact O-CB 3.25Å; D150-H154 WeakPolarHBondContact O-CB 3.47Å; D150-H154 PolarHBondContact O-N 3.12Å; T151-H154 PolarHBondContact O-N 3.24Å; H154-L157 PolarHBondContact O-N 3.14Å; H154-K158 WeakPolarHBondContact CE1-CE 3.38Å; H154-K158 PolarHBondContact O-N 3.48Å
155	D	86.6	Confident	79.1	Confident	87 Å²	87	77.2 Å²	77.2	47%	0.465	43%	0.427	S	S	.	.	H	α-helix	trans	-66.8	-37.8	176.2	-70.9	-18.3	0	0	0	111.8	T151 V152 L153 L157 K158 A159	T151-D155 WeakPolarHBondContact O-CB 3.3Å; T151-D155 VanDerWaalsContact O-CG 3.32Å; T151-D155 PolarHBondContact O-N 2.62Å; V152-D155 PolarHBondContact O-N 3.02Å; L153-D155 PolarHBondContact O-N 2.91Å; D155-L157 VanDerWaalsContact C-N 3.3Å; D155-L157 PolarHBondContact O-N 3.45Å; D155-K158 PolarHBondContact O-N 3.1Å; D155-A159 PolarHBondContact O-N 3.44Å
156	S	88.8	Confident	81.1	Confident	51 Å²	51	75.4 Å²	75.4	36%	0.357	41%	0.408	S	S	.	.	H	α-helix	trans	-63.5	-35.1	174.1	81.8	0	0	0	0	112.7	V152 L153 A159	V152-S156 WeakPolarHBondContact O-CB 3.49Å; V152-S156 PolarHBondContact O-N 2.7Å; L153-S156 PolarHBondContact O-N 2.75Å; L153-S156 PolarHBondContact O-OG 3.38Å; S156-A159 PolarHBondContact O-N 3.48Å
157	L	89.6	Confident	83	Confident	1 Å²	1	75.4 Å²	75.4	1%	0.005	41%	0.406	C	S	.	.	H	α-helix	trans	-71.1	-38.3	176.1	-69.4	173.2	0	0	0	111.5	I34 A37 L153 H154 D155 A159 R160 L165	I34-L157 HydrophobicContact CG2-CB 4.08Å; A37-L157 HydrophobicContact CB-CD1 4.11Å; A37-L157 HydrophobicContact CB-CD2 3.98Å; L153-L157 HydrophobicContact CD2-CD1 3.67Å; L153-L157 HydrophobicContact CD2-CG 4.14Å; L153-L157 WeakPolarHBondContact O-CG 3.2Å; L153-L157 PolarHBondContact O-N 3.23Å; H154-L157 PolarHBondContact O-N 3.14Å; D155-L157 VanDerWaalsContact C-N 3.3Å; D155-L157 PolarHBondContact O-N 3.45Å; L157-A159 PolarHBondContact O-N 2.86Å; L157-R160 PolarHBondContact O-N 3.45Å; L157-L165 HydrophobicContact CD2-CD2 4.07Å
158	K	88.8	Confident	84.5	Confident	110 Å²	110	74.6 Å²	74.6	48%	0.478	39%	0.394	S	S	.	.	H	α-helix	trans	-61.8	-29.4	174.9	-79.3	179.1	171.9	172.4	0	113.4	R30 I34 H154 D155 R160	R30-K158 PolarHBondContact NH2-O 2.78Å; I34-K158 HydrophobicContact CD1-CG 4.13Å; I34-K158 HydrophobicContact CG2-CG 4.46Å; H154-K158 WeakPolarHBondContact CE1-CE 3.38Å; H154-K158 PolarHBondContact O-N 3.48Å; D155-K158 PolarHBondContact O-N 3.1Å; K158-R160 VanDerWaalsContact C-N 3.31Å
159	A	89.4	Confident	85.8	Confident	87 Å²	87	69.4 Å²	69.4	72%	0.719	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-15.9	178.2	0	0	0	0	0	113.8	D155 S156 L157	D155-A159 PolarHBondContact O-N 3.44Å; S156-A159 PolarHBondContact O-N 3.48Å; L157-A159 PolarHBondContact O-N 2.86Å
160	R	89	Confident	87.1	Confident	105 Å²	105	68.4 Å²	68.4	40%	0.396	36%	0.355	S	S	.	.	S	Bend	trans	-82	154.1	-176.5	-66.7	-178	-175.9	-148.4	-0.2	112.8	R30 L157 K158 L165 E168	R30-R160 PolarHBondContact NH1-O 2.87Å; R30-R160 PolarHBondContact NH2-O 3.1Å; L157-R160 PolarHBondContact O-N 3.45Å; K158-R160 VanDerWaalsContact C-N 3.31Å; R160-L165 HydrophobicContact CB-CD2 4.11Å; R160-L165 HydrophobicContact CB-CG 4.07Å; R160-E168 WeakPolarHBondContact CD-OE2 3.46Å; R160-E168 IonicContact CZ-OE1 2.89Å; R160-E168 IonicContact CZ-OE2 3.76Å; R160-E168 IonicContact NE-OE2 3.93Å; R160-E168 IonicContact NH1-OE1 2.61Å; R160-E168 PolarHBondContact NH1-OE1 3.01Å; R160-E168 IonicContact NH1-OE2 2.75Å; R160-E168 PolarHBondContact NH1-OE2 3.26Å; R160-E168 IonicContact NH2-OE1 3.9Å
161	K	89.8	Confident	87.8	Confident	152 Å²	152	67.5 Å²	67.5	66%	0.661	36%	0.357	S	S	*	.			trans	-75.7	155.3	174.2	-63.3	176.8	-179	176.8	0	110.8	E163 D164 L165	K161-E163 VanDerWaalsContact C-N 3.32Å; K161-E163 PolarHBondContact O-N 3.44Å; K161-D164 PolarHBondContact O-N 3.24Å; K161-L165 WeakPolarHBondContact O-CG 3.43Å; K161-L165 PolarHBondContact O-N 3.15Å
162	S	87.1	Confident	88.4	Confident	48 Å²	48	64.1 Å²	64.1	34%	0.336	34%	0.337	S	S	.	.	H	α-helix	trans	-62.7	-36.8	-176.7	-55.2	0	0	0	0	112.9	R30 L165 V166	R30-S162 PolarHBondContact NH1-OG 3.45Å; S162-L165 PolarHBondContact O-N 3.03Å; S162-V166 WeakPolarHBondContact O-CG2 3.35Å; S162-V166 PolarHBondContact O-N 3.5Å; S162-V166 VanDerWaalsContact O-N 3.09Å
163	E	87.6	Confident	88.9	Confident	147 Å²	147	60.8 Å²	60.8	69%	0.687	32%	0.315	S	S	*	.	H	α-helix	trans	-64	-40.4	175.8	-65.4	174.3	-165.8	0	0	112.4	K161 L165 V166 K167	K161-E163 VanDerWaalsContact C-N 3.32Å; K161-E163 PolarHBondContact O-N 3.44Å; E163-L165 VanDerWaalsContact C-N 3.34Å; E163-V166 PolarHBondContact O-N 3.35Å; E163-K167 PolarHBondContact O-N 3.01Å
164	D	89.6	Confident	89.2	Confident	76 Å²	76	60.3 Å²	60.3	41%	0.406	32%	0.315	S	S	.	.	H	α-helix	trans	-67	-38.1	176.9	-61.5	-34.3	0	0	0	110.9	K161 K167 E168	K161-D164 PolarHBondContact O-N 3.24Å; D164-K167 PolarHBondContact O-N 3.35Å; D164-E168 VanDerWaalsContact O-CB 3.25Å; D164-E168 WeakPolarHBondContact O-CB 3.16Å; D164-E168 PolarHBondContact O-N 2.84Å
165	L	87.4	Confident	89.6	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-64	-39.1	176.2	-73.6	170.1	0	0	0	112.5	L33 I34 A37 L157 R160 K161 S162 E163 E168 C169	L33-L165 HydrophobicContact CB-CB 4.44Å; I34-L165 HydrophobicContact CD1-CD1 4.46Å; I34-L165 HydrophobicContact CG1-CD1 3.66Å; A37-L165 HydrophobicContact CB-CD2 4.34Å; L157-L165 HydrophobicContact CD2-CD2 4.07Å; R160-L165 HydrophobicContact CB-CD2 4.11Å; R160-L165 HydrophobicContact CB-CG 4.07Å; K161-L165 WeakPolarHBondContact O-CG 3.43Å; K161-L165 PolarHBondContact O-N 3.15Å; S162-L165 PolarHBondContact O-N 3.03Å; E163-L165 VanDerWaalsContact C-N 3.34Å; L165-E168 PolarHBondContact O-N 2.84Å; L165-C169 WeakPolarHBondContact O-CB 3.48Å; L165-C169 PolarHBondContact O-N 2.9Å; L165-C169 PolarHBondContact O-SG 3.44Å
166	V	89.3	Confident	89.9	Confident	34 Å²	34	57.6 Å²	57.6	21%	0.206	30%	0.3	C	S	.	.	H	α-helix	trans	-62.6	-51.6	176.1	171.5	0	0	0	0	110.2	A24 L33 S162 E163 E168 C169 E170	A24-V166 HydrophobicContact CB-CG1 4.18Å; L33-V166 HydrophobicContact CD1-CG2 3.82Å; L33-V166 HydrophobicContact CD2-CG2 4.08Å; S162-V166 WeakPolarHBondContact O-CG2 3.35Å; S162-V166 PolarHBondContact O-N 3.5Å; S162-V166 VanDerWaalsContact O-N 3.09Å; E163-V166 PolarHBondContact O-N 3.35Å; V166-E168 VanDerWaalsContact C-N 3.29Å; V166-E168 PolarHBondContact O-N 3.23Å; V166-C169 WeakPolarHBondContact O-CB 3.43Å; V166-C169 PolarHBondContact O-N 3.21Å; V166-C169 VanDerWaalsContact O-N 3.16Å; V166-E170 WeakPolarHBondContact O-CG 3.14Å; V166-E170 PolarHBondContact O-N 3.11Å
167	K	88.9	Confident	90.2	Very high	139 Å²	139	57.1 Å²	57.1	60%	0.604	29%	0.291	S	S	*	.	H	α-helix	trans	-60.1	-39.7	177.8	-69.9	177.6	-179	172.7	0	112.1	E163 D164 G171	E163-K167 PolarHBondContact O-N 3.01Å; D164-K167 PolarHBondContact O-N 3.35Å; K167-G171 PolarHBondContact O-N 3.12Å
168	E	89.1	Confident	90.3	Very high	30 Å²	30	63.9 Å²	63.9	14%	0.14	32%	0.316	C	S	.	.	H	α-helix	trans	-64.4	-44	176	178.3	169	-152.3	0	0	111.7	H41 R160 D164 L165 V166 G171 L172	H41-E168 IonicContact CD2-OE1 3.09Å; H41-E168 IonicContact CE1-OE1 3.69Å; H41-E168 IonicContact NE2-OE1 2.67Å; H41-E168 PolarHBondContact NE2-OE1 3.24Å; R160-E168 WeakPolarHBondContact CD-OE2 3.46Å; R160-E168 IonicContact CZ-OE1 2.89Å; R160-E168 IonicContact CZ-OE2 3.76Å; R160-E168 IonicContact NE-OE2 3.93Å; R160-E168 IonicContact NH1-OE1 2.61Å; R160-E168 PolarHBondContact NH1-OE1 3.01Å; R160-E168 IonicContact NH1-OE2 2.75Å; R160-E168 PolarHBondContact NH1-OE2 3.26Å; R160-E168 IonicContact NH2-OE1 3.9Å; D164-E168 VanDerWaalsContact O-CB 3.25Å; D164-E168 WeakPolarHBondContact O-CB 3.16Å; D164-E168 PolarHBondContact O-N 2.84Å; L165-E168 PolarHBondContact O-N 2.84Å; V166-E168 VanDerWaalsContact C-N 3.29Å; V166-E168 PolarHBondContact O-N 3.23Å; E168-G171 PolarHBondContact O-N 2.98Å; E168-L172 HydrophobicContact CG-CD1 3.84Å; E168-L172 HydrophobicContact CG-CG 4.29Å; E168-L172 WeakPolarHBondContact O-CB 3.34Å; E168-L172 VanDerWaalsContact O-CG 3.25Å; E168-L172 WeakPolarHBondContact O-CG 3.39Å; E168-L172 PolarHBondContact O-N 3.44Å
169	C	90.1	Very high	90.6	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-59.2	-49.5	176	-71.4	0	0	0	0	111.3	A24 L40 L165 V166 G171 L172 Y173	A24-C169 HydrophobicContact CB-CB 3.73Å; L40-C169 HydrophobicContact CD1-CB 3.96Å; L165-C169 WeakPolarHBondContact O-CB 3.48Å; L165-C169 PolarHBondContact O-N 2.9Å; L165-C169 PolarHBondContact O-SG 3.44Å; V166-C169 WeakPolarHBondContact O-CB 3.43Å; V166-C169 PolarHBondContact O-N 3.21Å; V166-C169 VanDerWaalsContact O-N 3.16Å; C169-G171 VanDerWaalsContact C-N 3.31Å; C169-G171 PolarHBondContact O-N 3.36Å; C169-L172 PolarHBondContact O-N 3.48Å; C169-L172 VanDerWaalsContact O-N 3.13Å; C169-Y173 WeakPolarHBondContact O-CD2 3.19Å; C169-Y173 PolarHBondContact O-N 3.13Å
170	E	90.7	Very high	90.8	Very high	70 Å²	70	55.4 Å²	55.4	33%	0.327	26%	0.264	S	S	.	.	H	α-helix	trans	-56.6	-45.7	176.8	-69.1	175.8	170.3	0	0	111.7	A24 V166 L172 Y173 A174	A24-E170 HydrophobicContact CB-CG 3.73Å; V166-E170 WeakPolarHBondContact O-CG 3.14Å; V166-E170 PolarHBondContact O-N 3.11Å; E170-L172 PolarHBondContact O-N 2.87Å; E170-Y173 PolarHBondContact O-N 2.95Å; E170-A174 PolarHBondContact O-N 3.35Å
171	G	91	Very high	91	Very high	29 Å²	29	54.3 Å²	54.3	30%	0.299	26%	0.262	S	S	.	.	H	α-helix	trans	-62	-40.6	175.6	0	0	0	0	0	112.9	K167 E168 C169 A174 Q175	K167-G171 PolarHBondContact O-N 3.12Å; E168-G171 PolarHBondContact O-N 2.98Å; C169-G171 VanDerWaalsContact C-N 3.31Å; C169-G171 PolarHBondContact O-N 3.36Å; G171-A174 PolarHBondContact O-N 3.19Å; G171-Q175 WeakPolarHBondContact O-CB 3.46Å; G171-Q175 VanDerWaalsContact O-CG 3.26Å; G171-Q175 WeakPolarHBondContact O-CG 3.32Å; G171-Q175 PolarHBondContact O-N 3.46Å; G171-Q175 PolarHBondContact O-NE2 3.43Å
172	L	91.9	Very high	91.2	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.026	25%	0.246	C	C	.	.	H	α-helix	trans	-70	-38.4	178.6	-75.2	170.1	0	0	0	112.5	L40 E168 C169 E170 A174 Q175 L176	L40-L172 HydrophobicContact CB-CB 3.96Å; L40-L172 HydrophobicContact CB-CD1 3.83Å; L40-L172 HydrophobicContact CB-CG 4.48Å; L40-L172 HydrophobicContact CD1-CB 4.05Å; L40-L172 HydrophobicContact CD1-CD1 4.38Å; L40-L172 HydrophobicContact CG-CB 4.42Å; E168-L172 HydrophobicContact CG-CD1 3.84Å; E168-L172 HydrophobicContact CG-CG 4.29Å; E168-L172 WeakPolarHBondContact O-CB 3.34Å; E168-L172 VanDerWaalsContact O-CG 3.25Å; E168-L172 WeakPolarHBondContact O-CG 3.39Å; E168-L172 PolarHBondContact O-N 3.44Å; C169-L172 PolarHBondContact O-N 3.48Å; C169-L172 VanDerWaalsContact O-N 3.13Å; E170-L172 PolarHBondContact O-N 2.87Å; L172-A174 VanDerWaalsContact C-N 3.35Å; L172-A174 PolarHBondContact O-N 3.41Å; L172-Q175 PolarHBondContact O-N 3.41Å; L172-L176 WeakPolarHBondContact O-CB 3.35Å; L172-L176 WeakPolarHBondContact O-CG 3.26Å; L172-L176 PolarHBondContact O-N 3.49Å
173	Y	92.6	Very high	91.6	Very high	18 Å²	18	48.3 Å²	48.3	7%	0.071	23%	0.23	C	C	.	.	H	α-helix	trans	-56.7	-49.6	172.4	-88.3	-70.8	0	0	0	110.9	F22 L40 V113 V114 I117 C169 E170 Q175 L176 Y177	F22-Y173 HydrophobicContact CD1-CG 4.44Å; L40-Y173 HydrophobicContact CD1-CD2 4.02Å; L40-Y173 HydrophobicContact CD1-CE2 3.83Å; L40-Y173 HydrophobicContact CD2-CD1 4.01Å; L40-Y173 HydrophobicContact CD2-CD2 4.23Å; L40-Y173 HydrophobicContact CD2-CE1 3.93Å; L40-Y173 HydrophobicContact CD2-CE2 4.16Å; L40-Y173 HydrophobicContact CD2-CG 4.13Å; V113-Y173 HydrophobicContact CB-CD1 3.81Å; V113-Y173 HydrophobicContact CB-CE1 4.2Å; V113-Y173 HydrophobicContact CG1-CD1 3.45Å; V113-Y173 VanDerWaalsContact CG1-CD1 3.45Å; V113-Y173 HydrophobicContact CG1-CE1 3.84Å; V114-Y173 HydrophobicContact CG2-CE1 3.95Å; I117-Y173 HydrophobicContact CD1-CE1 4.27Å; C169-Y173 WeakPolarHBondContact O-CD2 3.19Å; C169-Y173 PolarHBondContact O-N 3.13Å; E170-Y173 PolarHBondContact O-N 2.95Å; Y173-Q175 PolarHBondContact O-N 3.44Å; Y173-L176 PolarHBondContact O-N 3.09Å; Y173-Y177 WeakPolarHBondContact O-CB 3.42Å; Y173-Y177 PolarHBondContact O-N 3.23Å
174	A	92.1	Very high	91.9	Very high	21 Å²	21	42.6 Å²	42.6	17%	0.174	20%	0.204	C	C	.	.	H	α-helix	trans	-62.1	-42.2	177.6	0	0	0	0	0	112.6	F22 E170 G171 L172 R178	F22-A174 HydrophobicContact CD2-CB 3.57Å; F22-A174 HydrophobicContact CE2-CB 3.86Å; F22-A174 HydrophobicContact CG-CB 4.35Å; E170-A174 PolarHBondContact O-N 3.35Å; G171-A174 PolarHBondContact O-N 3.19Å; L172-A174 VanDerWaalsContact C-N 3.35Å; L172-A174 PolarHBondContact O-N 3.41Å; A174-R178 WeakPolarHBondContact O-CG 3.18Å; A174-R178 PolarHBondContact O-N 3.06Å; A174-R178 VanDerWaalsContact O-N 3.12Å
175	Q	92.4	Very high	92.2	Very high	86 Å²	86	39.2 Å²	39.2	40%	0.402	19%	0.187	S	C	.	.	H	α-helix	trans	-63.4	-45.7	176.9	-76	176.2	53.9	0	0	112.2	R44 G171 L172 Y173 R178 L179	R44-Q175 VanDerWaalsContact NE-OE1 3.08Å; G171-Q175 WeakPolarHBondContact O-CB 3.46Å; G171-Q175 VanDerWaalsContact O-CG 3.26Å; G171-Q175 WeakPolarHBondContact O-CG 3.32Å; G171-Q175 PolarHBondContact O-N 3.46Å; G171-Q175 PolarHBondContact O-NE2 3.43Å; L172-Q175 PolarHBondContact O-N 3.41Å; Y173-Q175 PolarHBondContact O-N 3.44Å; Q175-R178 PolarHBondContact O-N 3.42Å; Q175-L179 VanDerWaalsContact O-CB 3.23Å; Q175-L179 WeakPolarHBondContact O-CB 3.44Å; Q175-L179 PolarHBondContact O-N 3.4Å
176	L	93.7	Very high	92.5	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-61.9	-44.1	178.6	-88.3	172.1	0	0	0	111.9	L40 T43 R44 I47 V113 L172 Y173 L179 T180	L40-L176 HydrophobicContact CB-CD1 4.3Å; L40-L176 HydrophobicContact CD2-CD1 3.47Å; L40-L176 VanDerWaalsContact CD2-CD1 3.47Å; T43-L176 HydrophobicContact CG2-CD1 4.22Å; T43-L176 HydrophobicContact CG2-CD2 3.8Å; R44-L176 VanDerWaalsContact CA-CD2 3.47Å; R44-L176 HydrophobicContact CB-CD2 3.79Å; R44-L176 HydrophobicContact CB-CG 4.22Å; I47-L176 HydrophobicContact CD1-CD2 4.05Å; V113-L176 HydrophobicContact CG1-CB 3.91Å; V113-L176 HydrophobicContact CG1-CD1 4Å; L172-L176 WeakPolarHBondContact O-CB 3.35Å; L172-L176 WeakPolarHBondContact O-CG 3.26Å; L172-L176 PolarHBondContact O-N 3.49Å; Y173-L176 PolarHBondContact O-N 3.09Å; L176-L179 PolarHBondContact O-N 2.85Å; L176-T180 VanDerWaalsContact O-CB 3.26Å; L176-T180 WeakPolarHBondContact O-CB 3.29Å; L176-T180 PolarHBondContact O-N 3.26Å; L176-T180 PolarHBondContact O-OG1 2.97Å
177	Y	93.9	Very high	92.8	Very high	41 Å²	41	39.6 Å²	39.6	16%	0.161	19%	0.185	C	C	.	.	H	α-helix	trans	-57.2	-52	175.9	-179.9	-101.8	0	0	0	111.3	P20 F22 Q103 A109 Y112 V113 Y173 T180 K181	P20-Y177 HydrophobicContact CG-CD1 4.21Å; P20-Y177 HydrophobicContact CG-CE1 3.8Å; F22-Y177 HydrophobicContact CE1-CD2 4.37Å; F22-Y177 HydrophobicContact CE1-CG 4.15Å; F22-Y177 HydrophobicContact CE2-CD1 4.47Å; F22-Y177 HydrophobicContact CE2-CG 4.48Å; F22-Y177 VanDerWaalsContact CZ-CB 3.42Å; F22-Y177 AromaticContact CZ-CD1 3.82Å; F22-Y177 HydrophobicContact CZ-CD1 3.82Å; F22-Y177 HydrophobicContact CZ-CD2 4.04Å; F22-Y177 AromaticContact CZ-CG 3.5Å; F22-Y177 HydrophobicContact CZ-CG 3.5Å; F22-Y177 VanDerWaalsContact CZ-CG 3.5Å; Q103-Y177 PolarHBondContact OE1-OH 2.98Å; Q103-Y177 VanDerWaalsContact OE1-OH 3.09Å; A109-Y177 HydrophobicContact CB-CD2 4.15Å; A109-Y177 HydrophobicContact CB-CE2 3.93Å; Y112-Y177 AromaticContact CD1-CD2 3.95Å; Y112-Y177 HydrophobicContact CD1-CD2 3.95Å; Y112-Y177 AromaticContact CD1-CE2 3.98Å; Y112-Y177 HydrophobicContact CD1-CE2 3.98Å; Y112-Y177 HydrophobicContact CE1-CD2 4.5Å; V113-Y177 HydrophobicContact CG2-CD2 4.19Å; V113-Y177 HydrophobicContact CG2-CG 4.49Å; Y173-Y177 WeakPolarHBondContact O-CB 3.42Å; Y173-Y177 PolarHBondContact O-N 3.23Å; Y177-T180 PolarHBondContact O-N 3.06Å; Y177-K181 HydrophobicContact CE1-CG 4.23Å; Y177-K181 HydrophobicContact CE2-CG 4.48Å; Y177-K181 WeakPolarHBondContact O-CG 3.33Å; Y177-K181 PolarHBondContact O-N 3.48Å; Y177-K181 WeakPolarHBondContact OH-CE 3.46Å
178	R	93.1	Very high	93.1	Very high	143 Å²	143	39.6 Å²	39.6	54%	0.54	18%	0.181	S	C	.	.	H	α-helix	trans	-61.5	-46.9	178.9	-68.9	173.2	-174.2	-179.6	1.2	111.9	A174 Q175 T180 K181 K182	A174-R178 WeakPolarHBondContact O-CG 3.18Å; A174-R178 PolarHBondContact O-N 3.06Å; A174-R178 VanDerWaalsContact O-N 3.12Å; Q175-R178 PolarHBondContact O-N 3.42Å; R178-T180 VanDerWaalsContact C-N 3.31Å; R178-T180 PolarHBondContact O-N 3.06Å; R178-K181 PolarHBondContact O-N 2.91Å; R178-K182 WeakPolarHBondContact O-CG 3.35Å; R178-K182 PolarHBondContact O-N 3.31Å
179	L	94.2	Very high	93.4	Very high	19 Å²	19	38.5 Å²	38.5	10%	0.099	18%	0.176	C	C	.	.	H	α-helix	trans	-59.9	-43.2	179	178.5	61.7	0	0	0	111.2	R44 I47 L48 Y51 Q175 L176 K182 Y183	R44-L179 HydrophobicContact CG-CD2 4.12Å; I47-L179 HydrophobicContact CB-CD2 4Å; I47-L179 HydrophobicContact CB-CG 4.4Å; I47-L179 HydrophobicContact CG2-CD2 4Å; I47-L179 HydrophobicContact CG2-CG 3.83Å; L48-L179 HydrophobicContact CB-CD2 4.25Å; L48-L179 HydrophobicContact CD1-CD1 4.13Å; L48-L179 HydrophobicContact CD1-CD2 4.4Å; Y51-L179 HydrophobicContact CD1-CD1 3.59Å; Y51-L179 HydrophobicContact CD2-CD1 4.31Å; Y51-L179 HydrophobicContact CE1-CD1 4.09Å; Y51-L179 HydrophobicContact CG-CD1 3.69Å; Q175-L179 VanDerWaalsContact O-CB 3.23Å; Q175-L179 WeakPolarHBondContact O-CB 3.44Å; Q175-L179 PolarHBondContact O-N 3.4Å; L176-L179 PolarHBondContact O-N 2.85Å; L179-K182 PolarHBondContact O-N 2.89Å; L179-Y183 WeakPolarHBondContact O-CB 3.21Å; L179-Y183 PolarHBondContact O-N 2.77Å
180	T	93.8	Very high	93.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.5	-45.3	179.2	-57.9	0	0	0	0	111.6	I100 Y112 I116 L176 Y177 R178 K182 Y183 L184	I100-T180 HydrophobicContact CD1-CG2 4.18Å; I100-T180 HydrophobicContact CG2-CG2 3.68Å; Y112-T180 HydrophobicContact CE1-CG2 4.26Å; I116-T180 HydrophobicContact CD1-CG2 3.67Å; L176-T180 VanDerWaalsContact O-CB 3.26Å; L176-T180 WeakPolarHBondContact O-CB 3.29Å; L176-T180 PolarHBondContact O-N 3.26Å; L176-T180 PolarHBondContact O-OG1 2.97Å; Y177-T180 PolarHBondContact O-N 3.06Å; R178-T180 VanDerWaalsContact C-N 3.31Å; R178-T180 PolarHBondContact O-N 3.06Å; T180-K182 PolarHBondContact O-N 3.05Å; T180-Y183 PolarHBondContact O-N 3.37Å; T180-L184 HydrophobicContact CG2-CD1 4.16Å; T180-L184 HydrophobicContact CG2-CG 4.4Å; T180-L184 WeakPolarHBondContact O-CG 3.41Å; T180-L184 PolarHBondContact O-N 3.36Å
181	K	93.8	Very high	93.9	Very high	82 Å²	82	40.2 Å²	40.2	36%	0.357	18%	0.182	S	C	.	.	H	α-helix	trans	-59.2	-46.1	175.8	-70.9	-70.7	-170.6	177.5	0	111.5	Q103 Y177 R178 L184 G185	Q103-K181 VanDerWaalsContact OE1-CE 3.29Å; Y177-K181 HydrophobicContact CE1-CG 4.23Å; Y177-K181 HydrophobicContact CE2-CG 4.48Å; Y177-K181 WeakPolarHBondContact O-CG 3.33Å; Y177-K181 PolarHBondContact O-N 3.48Å; Y177-K181 WeakPolarHBondContact OH-CE 3.46Å; R178-K181 PolarHBondContact O-N 2.91Å; K181-L184 PolarHBondContact O-N 3.46Å; K181-G185 PolarHBondContact O-N 3.1Å
182	K	93.9	Very high	94.2	Very high	73 Å²	73	42.6 Å²	42.6	32%	0.317	19%	0.186	S	C	.	.	H	α-helix	trans	-59.7	-49.1	175.7	-72.2	-179.4	177.9	-175.1	0	111.4	Y51 R178 L179 T180 L184 G185 L186 E231	Y51-K182 HydrophobicContact CD2-CB 4.33Å; Y51-K182 HydrophobicContact CE2-CB 3.68Å; R178-K182 WeakPolarHBondContact O-CG 3.35Å; R178-K182 PolarHBondContact O-N 3.31Å; L179-K182 PolarHBondContact O-N 2.89Å; T180-K182 PolarHBondContact O-N 3.05Å; K182-L184 PolarHBondContact O-N 3.27Å; K182-G185 PolarHBondContact O-N 3.18Å; K182-G185 VanDerWaalsContact O-N 3.15Å; K182-L186 WeakPolarHBondContact O-CG 3.5Å; K182-L186 PolarHBondContact O-N 3.12Å; K182-E231 IonicContact NZ-OE1 3.63Å; K182-E231 PolarHBondContact NZ-OE1 3.43Å
183	Y	94.6	Very high	94.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-54.7	-49	177	171.7	-104.7	0	0	0	112.7	I47 P50 L54 L97 L98 I100 L179 T180 G185 L186 R187	I47-Y183 HydrophobicContact CG2-CG 4.3Å; P50-Y183 HydrophobicContact CB-CD2 4.4Å; P50-Y183 HydrophobicContact CB-CE2 3.73Å; L54-Y183 HydrophobicContact CD1-CD2 4.08Å; L54-Y183 HydrophobicContact CD1-CE2 3.76Å; L54-Y183 HydrophobicContact CG-CE2 4.41Å; L97-Y183 WeakPolarHBondContact CB-OH 3.37Å; L98-Y183 HydrophobicContact CB-CE1 4.32Å; L98-Y183 PolarHBondContact N-OH 3.34Å; L98-Y183 WeakPolarHBondContact O-CE1 3.42Å; L98-Y183 PolarHBondContact O-OH 3.45Å; I100-Y183 HydrophobicContact CD1-CD1 3.86Å; I100-Y183 HydrophobicContact CD1-CE1 3.99Å; I100-Y183 HydrophobicContact CG1-CD1 4.5Å; I100-Y183 HydrophobicContact CG1-CE1 4.23Å; L179-Y183 WeakPolarHBondContact O-CB 3.21Å; L179-Y183 PolarHBondContact O-N 2.77Å; T180-Y183 PolarHBondContact O-N 3.37Å; Y183-G185 VanDerWaalsContact C-N 3.32Å; Y183-G185 PolarHBondContact O-N 3.4Å; Y183-L186 PolarHBondContact O-N 2.78Å; Y183-R187 WeakPolarHBondContact O-CB 3.2Å; Y183-R187 PolarHBondContact O-N 2.78Å
184	L	94.5	Very high	94.6	Very high	28 Å²	28	42.9 Å²	42.9	15%	0.147	19%	0.188	C	C	.	.	H	α-helix	trans	-63.5	-38.2	177.7	-70.2	178	0	0	0	112.4	I100 Y112 T180 K181 K182 R187 R188	I100-L184 HydrophobicContact CB-CD2 4.14Å; I100-L184 WeakPolarHBondContact O-CD2 3.36Å; Y112-L184 WeakPolarHBondContact OH-CD1 3.44Å; T180-L184 HydrophobicContact CG2-CD1 4.16Å; T180-L184 HydrophobicContact CG2-CG 4.4Å; T180-L184 WeakPolarHBondContact O-CG 3.41Å; T180-L184 PolarHBondContact O-N 3.36Å; K181-L184 PolarHBondContact O-N 3.46Å; K182-L184 PolarHBondContact O-N 3.27Å; L184-R187 PolarHBondContact O-N 3.48Å; L184-R188 PolarHBondContact O-N 3.06Å
185	G	94.7	Very high	94.7	Very high	5 Å²	5	45.7 Å²	45.7	5%	0.052	20%	0.2	C	C	.	.	H	α-helix	trans	-58.6	-52	173	0	0	0	0	0	112.1	K181 K182 Y183 R187 R188 L189	K181-G185 PolarHBondContact O-N 3.1Å; K182-G185 PolarHBondContact O-N 3.18Å; K182-G185 VanDerWaalsContact O-N 3.15Å; Y183-G185 VanDerWaalsContact C-N 3.32Å; Y183-G185 PolarHBondContact O-N 3.4Å; G185-R187 VanDerWaalsContact C-N 3.31Å; G185-R187 PolarHBondContact O-N 3.19Å; G185-R188 WeakPolarHBondContact O-CB 3.28Å; G185-R188 PolarHBondContact O-N 2.72Å; G185-L189 PolarHBondContact O-N 3.22Å
186	L	95.3	Very high	94.9	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-63.1	-38.5	178.7	-58.1	-168.4	0	0	0	112.3	Y51 L54 K55 L58 K182 Y183 R188 L189 I190 I228	Y51-L186 HydrophobicContact CD2-CD1 3.84Å; Y51-L186 HydrophobicContact CE2-CD1 3.57Å; Y51-L186 HydrophobicContact CE2-CG 4.3Å; L54-L186 HydrophobicContact CB-CB 3.99Å; L54-L186 HydrophobicContact CB-CD1 4.05Å; L54-L186 HydrophobicContact CD1-CB 4.08Å; K55-L186 HydrophobicContact CB-CD1 3.96Å; L58-L186 HydrophobicContact CD1-CB 4.11Å; L58-L186 HydrophobicContact CD1-CD1 4.43Å; L58-L186 HydrophobicContact CD1-CD2 3.77Å; L58-L186 HydrophobicContact CD1-CG 4.3Å; K182-L186 WeakPolarHBondContact O-CG 3.5Å; K182-L186 PolarHBondContact O-N 3.12Å; Y183-L186 PolarHBondContact O-N 2.78Å; L186-R188 VanDerWaalsContact C-N 3.32Å; L186-R188 PolarHBondContact O-N 3.29Å; L186-L189 HydrophobicContact CD2-CD1 4.42Å; L186-L189 PolarHBondContact O-N 3.43Å; L186-I190 WeakPolarHBondContact O-CG1 3.49Å; L186-I190 PolarHBondContact O-N 3.01Å; L186-I228 HydrophobicContact CD1-CD1 3.8Å; L186-I228 HydrophobicContact CD2-CD1 3.44Å; L186-I228 VanDerWaalsContact CD2-CD1 3.44Å; L186-I228 HydrophobicContact CD2-CG1 4.17Å; L186-I228 HydrophobicContact CG-CD1 4.25Å
187	R	94.9	Very high	95	Very high	40 Å²	40	46 Å²	46	15%	0.151	20%	0.2	C	C	.	.	H	α-helix	trans	-61.3	-42.7	176.1	-169.3	178.3	-174.7	168.3	6.5	111.5	L54 L98 Y183 L184 G185 I190 K191	L54-R187 HydrophobicContact CD1-CB 4.09Å; L98-R187 PolarHBondContact O-NH1 3.43Å; Y183-R187 WeakPolarHBondContact O-CB 3.2Å; Y183-R187 PolarHBondContact O-N 2.78Å; L184-R187 PolarHBondContact O-N 3.48Å; G185-R187 VanDerWaalsContact C-N 3.31Å; G185-R187 PolarHBondContact O-N 3.19Å; R187-I190 PolarHBondContact O-N 3.45Å; R187-K191 WeakPolarHBondContact O-CB 2.92Å; R187-K191 PolarHBondContact O-N 3.34Å
188	R	95.2	Very high	95	Very high	139 Å²	139	46.5 Å²	46.5	53%	0.525	20%	0.203	S	C	.	.	H	α-helix	trans	-60	-46.5	174.8	-169.7	-169.9	-53.5	167.4	2.9	111.5	L184 G185 L186 I190 K191 E192 E224	L184-R188 PolarHBondContact O-N 3.06Å; G185-R188 WeakPolarHBondContact O-CB 3.28Å; G185-R188 PolarHBondContact O-N 2.72Å; L186-R188 VanDerWaalsContact C-N 3.32Å; L186-R188 PolarHBondContact O-N 3.29Å; R188-I190 VanDerWaalsContact C-N 3.31Å; R188-I190 PolarHBondContact O-N 3.15Å; R188-K191 PolarHBondContact O-N 3.07Å; R188-E192 WeakPolarHBondContact O-CB 3.25Å; R188-E192 WeakPolarHBondContact O-CG 3.37Å; R188-E192 PolarHBondContact O-N 3.05Å; R188-E224 IonicContact NH1-OE1 2.65Å
189	L	96.1	Very high	95.1	Very high	7 Å²	7	42.5 Å²	42.5	4%	0.037	20%	0.2	C	C	.	.	H	α-helix	trans	-59.2	-42.2	177.9	-67.5	-176.3	0	0	0	112.7	L58 G185 L186 L193 T219 A222 E224 F225	L58-L189 HydrophobicContact CD1-CD1 4.44Å; G185-L189 PolarHBondContact O-N 3.22Å; L186-L189 HydrophobicContact CD2-CD1 4.42Å; L186-L189 PolarHBondContact O-N 3.43Å; L189-L193 VanDerWaalsContact O-CB 3.3Å; L189-L193 WeakPolarHBondContact O-CB 3.44Å; L189-L193 PolarHBondContact O-N 2.88Å; L189-T219 HydrophobicContact CB-CG2 4.44Å; L189-A222 HydrophobicContact CD1-CB 4Å; L189-A222 HydrophobicContact CD2-CB 3.38Å; L189-A222 HydrophobicContact CG-CB 4.33Å; L189-E224 HydrophobicContact CD1-CB 4.04Å; L189-E224 HydrophobicContact CG-CB 4.49Å; L189-F225 HydrophobicContact CD1-CB 3.9Å
190	I	95.6	Very high	95.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-67.6	-44.1	179.2	-71.5	174.5	0	0	0	110.9	L54 L58 V87 L90 E91 L186 R187 R188 L193 H194	L54-I190 HydrophobicContact CB-CD1 3.8Å; L54-I190 HydrophobicContact CD1-CD1 4.12Å; L54-I190 HydrophobicContact CD2-CD1 3.52Å; L54-I190 HydrophobicContact CG-CD1 3.96Å; L58-I190 HydrophobicContact CD1-CG1 4.41Å; L58-I190 HydrophobicContact CD2-CG1 4.13Å; L58-I190 HydrophobicContact CG-CD1 4.48Å; L58-I190 HydrophobicContact CG-CG1 4.35Å; V87-I190 HydrophobicContact CG1-CD1 4.39Å; V87-I190 HydrophobicContact CG1-CG1 3.87Å; V87-I190 HydrophobicContact CG1-CG2 4.46Å; L90-I190 HydrophobicContact CB-CG2 4.24Å; L90-I190 HydrophobicContact CD1-CD1 4.08Å; E91-I190 HydrophobicContact CB-CG2 4.14Å; L186-I190 WeakPolarHBondContact O-CG1 3.49Å; L186-I190 PolarHBondContact O-N 3.01Å; R187-I190 PolarHBondContact O-N 3.45Å; R188-I190 VanDerWaalsContact C-N 3.31Å; R188-I190 PolarHBondContact O-N 3.15Å; I190-L193 PolarHBondContact O-N 3.36Å; I190-H194 WeakPolarHBondContact O-CB 3.35Å; I190-H194 PolarHBondContact O-N 3.44Å
191	K	95.1	Very high	94.9	Very high	106 Å²	106	48.4 Å²	48.4	46%	0.461	22%	0.222	S	C	.	.	H	α-helix	trans	-60.4	-48	175.5	-177.8	171.1	-179.7	171.6	0	111.7	R187 R188 L193 H194 D195	R187-K191 WeakPolarHBondContact O-CB 2.92Å; R187-K191 PolarHBondContact O-N 3.34Å; R188-K191 PolarHBondContact O-N 3.07Å; K191-L193 VanDerWaalsContact C-N 3.33Å; K191-L193 PolarHBondContact O-N 2.88Å; K191-H194 WeakPolarHBondContact O-CB 3.27Å; K191-H194 PolarHBondContact O-N 3.45Å; K191-D195 VanDerWaalsContact O-CG 3.22Å; K191-D195 PolarHBondContact O-N 3.23Å
192	E	96.1	Very high	94.8	Very high	80 Å²	80	53 Å²	53	37%	0.374	25%	0.246	S	C	.	.	H	α-helix	trans	-61.1	-40.7	176.2	-77.5	-172	-149.2	0	0	113	R188 K196	R188-E192 WeakPolarHBondContact O-CB 3.25Å; R188-E192 WeakPolarHBondContact O-CG 3.37Å; R188-E192 PolarHBondContact O-N 3.05Å; E192-K196 WeakPolarHBondContact O-CB 3.49Å; E192-K196 WeakPolarHBondContact O-CD 3.39Å; E192-K196 WeakPolarHBondContact O-CG 3.39Å; E192-K196 PolarHBondContact O-N 3.3Å; E192-K196 IonicContact OE2-NZ 3.69Å; E192-K196 PolarHBondContact OE2-NZ 3.13Å
193	L	96.7	Very high	94.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.6	-44.4	176	-177.2	73.8	0	0	0	110.5	L61 V84 V87 L189 I190 K191 Y197 M215	L61-L193 HydrophobicContact CD2-CD2 3.93Å; V84-L193 HydrophobicContact CG1-CD1 4.18Å; V84-L193 HydrophobicContact CG1-CD2 4.42Å; V84-L193 HydrophobicContact CG1-CG 4.15Å; V87-L193 HydrophobicContact CB-CD2 3.76Å; V87-L193 HydrophobicContact CG1-CD2 3.57Å; L189-L193 VanDerWaalsContact O-CB 3.3Å; L189-L193 WeakPolarHBondContact O-CB 3.44Å; L189-L193 PolarHBondContact O-N 2.88Å; I190-L193 PolarHBondContact O-N 3.36Å; K191-L193 VanDerWaalsContact C-N 3.33Å; K191-L193 PolarHBondContact O-N 2.88Å; L193-Y197 WeakPolarHBondContact O-CB 3.26Å; L193-Y197 PolarHBondContact O-N 3.4Å; L193-M215 HydrophobicContact CD1-CB 4.09Å; L193-M215 HydrophobicContact CD1-CG 3.82Å; L193-M215 HydrophobicContact CD1-SD 3.95Å
194	H	96.3	Very high	94.7	Very high	29 Å²	29	58.2 Å²	58.2	13%	0.134	28%	0.279	C	S	.	.	H	α-helix	trans	-58.2	-51.9	175.7	168	-85	0	0	0	111.3	A88 E91 K92 I190 K191 K196 Y197 E198	A88-H194 HydrophobicContact CB-CB 4.13Å; A88-H194 PolarHBondContact O-CD2 2.94Å; E91-H194 HydrophobicContact CB-CB 3.97Å; E91-H194 HydrophobicContact CG-CB 4.19Å; K92-H194 VanDerWaalsContact CE-NE2 3.26Å; K92-H194 WeakPolarHBondContact CE-NE2 3.47Å; I190-H194 WeakPolarHBondContact O-CB 3.35Å; I190-H194 PolarHBondContact O-N 3.44Å; K191-H194 WeakPolarHBondContact O-CB 3.27Å; K191-H194 PolarHBondContact O-N 3.45Å; H194-K196 PolarHBondContact O-N 3.46Å; H194-Y197 WeakPolarHBondContact O-CB 3.01Å; H194-Y197 PolarHBondContact O-N 2.96Å; H194-Y197 VanDerWaalsContact O-N 3.1Å; H194-E198 PolarHBondContact O-N 3.1Å
195	D	95.9	Very high	94.5	Very high	80 Å²	80	62 Å²	62	43%	0.428	30%	0.298	S	S	.	.	H	α-helix	trans	-64.3	-43.5	-175.8	-65.1	-13.8	0	0	0	111	K191 Y197 E198 A199	K191-D195 VanDerWaalsContact O-CG 3.22Å; K191-D195 PolarHBondContact O-N 3.23Å; D195-Y197 VanDerWaalsContact C-N 3.33Å; D195-Y197 PolarHBondContact O-N 3.42Å; D195-E198 PolarHBondContact O-N 3.38Å; D195-A199 PolarHBondContact O-N 2.69Å; D195-A199 VanDerWaalsContact O-N 3.1Å
196	K	95.3	Very high	94.4	Very high	82 Å²	82	67.5 Å²	67.5	36%	0.357	33%	0.33	S	S	.	.	H	α-helix	trans	-61.3	-41.8	173.1	-71.9	166.5	-169.7	155.8	0	111	E192 H194 A199 T200 M215	E192-K196 WeakPolarHBondContact O-CB 3.49Å; E192-K196 WeakPolarHBondContact O-CD 3.39Å; E192-K196 WeakPolarHBondContact O-CG 3.39Å; E192-K196 PolarHBondContact O-N 3.3Å; E192-K196 IonicContact OE2-NZ 3.69Å; E192-K196 PolarHBondContact OE2-NZ 3.13Å; H194-K196 PolarHBondContact O-N 3.46Å; K196-A199 PolarHBondContact O-N 3.41Å; K196-T200 WeakPolarHBondContact O-CG2 3.44Å; K196-T200 PolarHBondContact O-N 3.29Å; K196-M215 HydrophobicContact CB-CB 4.43Å; K196-M215 HydrophobicContact CB-CE 4.47Å; K196-M215 HydrophobicContact CD-CB 4.47Å
197	Y	95.9	Very high	94.3	Very high	12 Å²	12	70 Å²	70	5%	0.047	35%	0.347	C	S	.	.	H	α-helix	trans	-65.7	-44.9	179.7	177.1	-114.4	0	0	0	112.8	V84 R85 A88 L193 H194 D195 A199 T200 L212	V84-Y197 HydrophobicContact CB-CD2 4.19Å; V84-Y197 HydrophobicContact CB-CE2 4.47Å; V84-Y197 HydrophobicContact CG1-CD1 4.35Å; V84-Y197 HydrophobicContact CG1-CD2 3.37Å; V84-Y197 HydrophobicContact CG1-CE2 4.08Å; V84-Y197 HydrophobicContact CG1-CG 3.53Å; R85-Y197 HydrophobicContact CB-CE1 4.19Å; R85-Y197 HydrophobicContact CG-CE1 4.42Å; R85-Y197 PolarHBondContact NE-OH 3.13Å; A88-Y197 HydrophobicContact CB-CD1 4.05Å; L193-Y197 WeakPolarHBondContact O-CB 3.26Å; L193-Y197 PolarHBondContact O-N 3.4Å; H194-Y197 WeakPolarHBondContact O-CB 3.01Å; H194-Y197 PolarHBondContact O-N 2.96Å; H194-Y197 VanDerWaalsContact O-N 3.1Å; D195-Y197 VanDerWaalsContact C-N 3.33Å; D195-Y197 PolarHBondContact O-N 3.42Å; Y197-A199 VanDerWaalsContact C-N 3.31Å; Y197-A199 PolarHBondContact O-N 2.96Å; Y197-T200 PolarHBondContact O-N 3.3Å; Y197-T200 PolarHBondContact O-OG1 3.35Å; Y197-L212 HydrophobicContact CD2-CD2 3.91Å; Y197-L212 HydrophobicContact CE2-CD2 4.08Å
198	E	94.7	Very high	94.4	Very high	50 Å²	50	70 Å²	70	23%	0.234	35%	0.346	C	S	.	.	H	α-helix	trans	-61.2	-41.6	176.3	-72.6	-65.5	154.8	0	0	110.6	K92 H194 D195 T200 R201	K92-E198 IonicContact NZ-OE1 2.82Å; K92-E198 PolarHBondContact NZ-OE1 3.28Å; H194-E198 PolarHBondContact O-N 3.1Å; D195-E198 PolarHBondContact O-N 3.38Å; E198-T200 PolarHBondContact O-N 2.85Å; E198-R201 WeakPolarHBondContact O-CB 3.39Å; E198-R201 WeakPolarHBondContact O-CG 3.21Å; E198-R201 PolarHBondContact O-N 3.23Å; E198-R201 VanDerWaalsContact O-N 3.12Å; E198-R201 IonicContact OE1-NH1 3.53Å; E198-R201 WeakPolarHBondContact OE2-CD 3.26Å; E198-R201 IonicContact OE2-CZ 3.78Å; E198-R201 IonicContact OE2-NE 3.34Å; E198-R201 IonicContact OE2-NH1 2.78Å; E198-R201 PolarHBondContact OE2-NH1 3.49Å
199	A	94.1	Very high	94.4	Very high	59 Å²	59	65.2 Å²	65.2	49%	0.488	33%	0.329	S	S	.	.	H	α-helix	trans	-60.2	-27.6	174.4	0	0	0	0	0	113.6	D195 K196 Y197 R201 F203	D195-A199 PolarHBondContact O-N 2.69Å; D195-A199 VanDerWaalsContact O-N 3.1Å; K196-A199 PolarHBondContact O-N 3.41Å; Y197-A199 VanDerWaalsContact C-N 3.31Å; Y197-A199 PolarHBondContact O-N 2.96Å; A199-R201 VanDerWaalsContact C-N 3.29Å; A199-R201 PolarHBondContact O-N 3.4Å; A199-F203 WeakPolarHBondContact O-CD2 3.31Å; A199-F203 WeakPolarHBondContact O-CE2 3.33Å
200	T	94.8	Very high	94.4	Very high	1 Å²	1	67.3 Å²	67.3	1%	0.006	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-76.2	-12.2	178.6	71.1	0	0	0	0	114.7	K196 Y197 E198 M202 F203 R208 M211 M215	K196-T200 WeakPolarHBondContact O-CG2 3.44Å; K196-T200 PolarHBondContact O-N 3.29Å; Y197-T200 PolarHBondContact O-N 3.3Å; Y197-T200 PolarHBondContact O-OG1 3.35Å; E198-T200 PolarHBondContact O-N 2.85Å; T200-M202 PolarHBondContact O-N 3.08Å; T200-F203 PolarHBondContact O-N 3.22Å; T200-F203 VanDerWaalsContact O-N 3.1Å; T200-R208 WeakPolarHBondContact O-CD 3.4Å; T200-M211 HydrophobicContact CG2-CB 3.69Å; T200-M211 HydrophobicContact CG2-CE 3.74Å; T200-M211 HydrophobicContact CG2-CG 4.38Å; T200-M211 HydrophobicContact CG2-SD 3.85Å; T200-M215 HydrophobicContact CG2-CE 3.33Å
201	R	90.4	Very high	94.5	Very high	143 Å²	143	70.3 Å²	70.3	54%	0.54	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-64.8	-26.2	-169.9	-68.8	177.9	65.9	-176.6	-2.9	113.7	E198 A199 F203	E198-R201 WeakPolarHBondContact O-CB 3.39Å; E198-R201 WeakPolarHBondContact O-CG 3.21Å; E198-R201 PolarHBondContact O-N 3.23Å; E198-R201 VanDerWaalsContact O-N 3.12Å; E198-R201 IonicContact OE1-NH1 3.53Å; E198-R201 WeakPolarHBondContact OE2-CD 3.26Å; E198-R201 IonicContact OE2-CZ 3.78Å; E198-R201 IonicContact OE2-NE 3.34Å; E198-R201 IonicContact OE2-NH1 2.78Å; E198-R201 PolarHBondContact OE2-NH1 3.49Å; A199-R201 VanDerWaalsContact C-N 3.29Å; A199-R201 PolarHBondContact O-N 3.4Å; R201-F203 VanDerWaalsContact C-N 3.31Å
202	M	90.5	Very high	94.5	Very high	177 Å²	177	65.2 Å²	65.2	87%	0.872	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-78.2	-14.7	-179.9	-59.8	-70.4	-80.6	0	0	113.1	T200	T200-M202 PolarHBondContact O-N 3.08Å
203	F	93.4	Very high	94.6	Very high	93 Å²	93	64.2 Å²	64.2	41%	0.408	33%	0.334	S	S	.	.	S	Bend	trans	-92	144.6	-172.3	-68	-90.2	0	0	0	112.4	A199 T200 R201 P207 R208 M211	A199-F203 WeakPolarHBondContact O-CD2 3.31Å; A199-F203 WeakPolarHBondContact O-CE2 3.33Å; T200-F203 PolarHBondContact O-N 3.22Å; T200-F203 VanDerWaalsContact O-N 3.1Å; R201-F203 VanDerWaalsContact C-N 3.31Å; F203-P207 HydrophobicContact CB-CG 4.3Å; F203-P207 HydrophobicContact CD1-CB 4.48Å; F203-R208 HydrophobicContact CB-CB 4.2Å; F203-M211 HydrophobicContact CB-SD 4.43Å; F203-M211 HydrophobicContact CD1-SD 4.37Å; F203-M211 HydrophobicContact CD2-CE 4.08Å; F203-M211 HydrophobicContact CD2-SD 3.82Å; F203-M211 HydrophobicContact CE2-CE 3.82Å; F203-M211 HydrophobicContact CE2-SD 4.11Å; F203-M211 HydrophobicContact CG-SD 3.94Å; F203-M211 HydrophobicContact CZ-CE 4.27Å
204	P	93.3	Very high	94.6	Very high	91 Å²	91	72.1 Å²	72.1	59%	0.591	37%	0.369	S	S	*	.			trans	-68.1	169.3	173.5	26.9	-31.3	0	0	0	111.9	V206 P207 R208	P204-V206 PolarHBondContact O-N 2.88Å; P204-P207 HydrophobicContact CG-CG 3.6Å; P204-P207 WeakPolarHBondContact O-CD 3.29Å; P204-P207 VanDerWaalsContact O-CG 3.31Å; P204-P207 WeakPolarHBondContact O-CG 3.26Å; P204-R208 WeakPolarHBondContact O-CB 3.43Å; P204-R208 PolarHBondContact O-N 3Å
205	I	90.8	Very high	94.6	Very high	108 Å²	108	71.2 Å²	71.2	55%	0.554	37%	0.365	S	S	*	.	H	α-helix	trans	-52.9	-49.3	-167.2	-63.7	171.3	0	0	0	113	Y77 R208 Y209	Y77-I205 HydrophobicContact CD1-CG2 4Å; Y77-I205 HydrophobicContact CD2-CG2 4.27Å; Y77-I205 HydrophobicContact CE1-CG1 4.25Å; Y77-I205 HydrophobicContact CE1-CG2 3.96Å; Y77-I205 HydrophobicContact CE2-CG2 4.23Å; Y77-I205 HydrophobicContact CG-CG2 4.15Å; I205-R208 PolarHBondContact O-N 3.35Å; I205-Y209 VanDerWaalsContact O-CB 3.31Å; I205-Y209 WeakPolarHBondContact O-CB 3.13Å; I205-Y209 PolarHBondContact O-N 3.47Å
206	V	91.8	Very high	94.7	Very high	120 Å²	120	67.4 Å²	67.4	73%	0.727	34%	0.344	S	S	*	.	H	α-helix	trans	-62.8	-56.3	-174.1	177.4	0	0	0	0	112.8	P204 R208 Y209 A210	P204-V206 PolarHBondContact O-N 2.88Å; V206-R208 VanDerWaalsContact C-N 3.32Å; V206-R208 PolarHBondContact O-N 3.11Å; V206-Y209 PolarHBondContact O-N 3.47Å; V206-A210 PolarHBondContact O-N 3.18Å
207	P	94.4	Very high	94.8	Very high	54 Å²	54	67.4 Å²	67.4	35%	0.351	34%	0.344	S	S	.	.	H	α-helix	trans	-64.1	-38.6	176.4	22.1	-31.7	0	0	0	111.9	F203 P204 Y209 A210 M211	F203-P207 HydrophobicContact CB-CG 4.3Å; F203-P207 HydrophobicContact CD1-CB 4.48Å; P204-P207 HydrophobicContact CG-CG 3.6Å; P204-P207 WeakPolarHBondContact O-CD 3.29Å; P204-P207 VanDerWaalsContact O-CG 3.31Å; P204-P207 WeakPolarHBondContact O-CG 3.26Å; P207-Y209 VanDerWaalsContact C-N 3.3Å; P207-Y209 PolarHBondContact O-N 3.01Å; P207-A210 PolarHBondContact O-N 2.82Å; P207-A210 VanDerWaalsContact O-N 3.15Å; P207-M211 WeakPolarHBondContact O-CG 3.41Å; P207-M211 PolarHBondContact O-N 3.34Å; P207-M211 VanDerWaalsContact O-N 3.07Å
208	R	95.9	Very high	94.8	Very high	38 Å²	38	69.1 Å²	69.1	14%	0.143	36%	0.361	C	S	.	.	H	α-helix	trans	-60.3	-39.7	177.9	-174.9	167.5	-176.5	170.7	-0.4	112.4	Y77 T200 F203 P204 I205 V206 A210 M211 L212	Y77-R208 HydrophobicContact CE2-CB 4.33Å; Y77-R208 HydrophobicContact CE2-CG 4.1Å; T200-R208 WeakPolarHBondContact O-CD 3.4Å; F203-R208 HydrophobicContact CB-CB 4.2Å; P204-R208 WeakPolarHBondContact O-CB 3.43Å; P204-R208 PolarHBondContact O-N 3Å; I205-R208 PolarHBondContact O-N 3.35Å; V206-R208 VanDerWaalsContact C-N 3.32Å; V206-R208 PolarHBondContact O-N 3.11Å; R208-A210 VanDerWaalsContact C-N 3.35Å; R208-A210 PolarHBondContact O-N 3.46Å; R208-M211 PolarHBondContact O-N 2.85Å; R208-L212 HydrophobicContact CG-CD1 4.26Å; R208-L212 HydrophobicContact CG-CG 4.39Å; R208-L212 WeakPolarHBondContact O-CG 3.26Å; R208-L212 PolarHBondContact O-N 3.22Å
209	Y	96.1	Very high	94.9	Very high	39 Å²	39	67 Å²	67	15%	0.153	35%	0.351	C	S	.	.	H	α-helix	trans	-60.7	-41.6	176.1	176.5	-122	0	0	0	112.7	R76 Y77 L80 I205 V206 P207 K213	R76-Y209 WeakPolarHBondContact CD-OH 3.21Å; R76-Y209 HydrophobicContact CG-CE2 4.19Å; Y77-Y209 HydrophobicContact CD2-CD2 4.04Å; Y77-Y209 HydrophobicContact CD2-CG 4.35Å; Y77-Y209 HydrophobicContact CG-CD2 4.44Å; L80-Y209 HydrophobicContact CD1-CD2 4.23Å; L80-Y209 HydrophobicContact CD1-CE2 3.74Å; I205-Y209 VanDerWaalsContact O-CB 3.31Å; I205-Y209 WeakPolarHBondContact O-CB 3.13Å; I205-Y209 PolarHBondContact O-N 3.47Å; V206-Y209 PolarHBondContact O-N 3.47Å; P207-Y209 VanDerWaalsContact C-N 3.3Å; P207-Y209 PolarHBondContact O-N 3.01Å; Y209-K213 HydrophobicContact CE1-CD 3.98Å; Y209-K213 VanDerWaalsContact CE1-CE 3.41Å; Y209-K213 HydrophobicContact CE2-CD 4.04Å; Y209-K213 HydrophobicContact CE2-CG 4.16Å; Y209-K213 PolarHBondContact O-N 3.25Å; Y209-K213 VanDerWaalsContact O-N 3.13Å
210	A	95.5	Very high	95	Very high	52 Å²	52	65.6 Å²	65.6	43%	0.43	34%	0.335	S	S	.	.	H	α-helix	trans	-64	-42.5	175.3	0	0	0	0	0	111.6	V206 P207 R208 K213 K214	V206-A210 PolarHBondContact O-N 3.18Å; P207-A210 PolarHBondContact O-N 2.82Å; P207-A210 VanDerWaalsContact O-N 3.15Å; R208-A210 VanDerWaalsContact C-N 3.35Å; R208-A210 PolarHBondContact O-N 3.46Å; A210-K213 PolarHBondContact O-N 3.45Å; A210-K214 WeakPolarHBondContact O-CB 3.31Å; A210-K214 PolarHBondContact O-N 3.25Å
211	M	96.9	Very high	95	Very high	62 Å²	62	74.6 Å²	74.6	31%	0.305	37%	0.369	S	S	.	.	H	α-helix	trans	-63.2	-45.3	177.1	-62.3	172.1	90.1	0	0	112	T200 F203 P207 R208 K213 K214 M215	T200-M211 HydrophobicContact CG2-CB 3.69Å; T200-M211 HydrophobicContact CG2-CE 3.74Å; T200-M211 HydrophobicContact CG2-CG 4.38Å; T200-M211 HydrophobicContact CG2-SD 3.85Å; F203-M211 HydrophobicContact CB-SD 4.43Å; F203-M211 HydrophobicContact CD1-SD 4.37Å; F203-M211 HydrophobicContact CD2-CE 4.08Å; F203-M211 HydrophobicContact CD2-SD 3.82Å; F203-M211 HydrophobicContact CE2-CE 3.82Å; F203-M211 HydrophobicContact CE2-SD 4.11Å; F203-M211 HydrophobicContact CG-SD 3.94Å; F203-M211 HydrophobicContact CZ-CE 4.27Å; P207-M211 WeakPolarHBondContact O-CG 3.41Å; P207-M211 PolarHBondContact O-N 3.34Å; P207-M211 VanDerWaalsContact O-N 3.07Å; R208-M211 PolarHBondContact O-N 2.85Å; M211-K213 PolarHBondContact O-N 3.32Å; M211-K214 PolarHBondContact O-N 3.42Å; M211-K214 VanDerWaalsContact O-N 3.12Å; M211-M215 HydrophobicContact CB-CE 4.43Å; M211-M215 WeakPolarHBondContact O-CG 3.14Å; M211-M215 PolarHBondContact O-N 3.18Å
212	L	96.8	Very high	95.2	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-57.3	-46.7	176.1	-72.5	171.3	0	0	0	111.5	Y77 L80 V84 Y197 R208 K214 M215 I216	Y77-L212 HydrophobicContact CD2-CD1 3.95Å; Y77-L212 HydrophobicContact CE2-CD1 3.81Å; L80-L212 HydrophobicContact CB-CB 4.37Å; V84-L212 HydrophobicContact CB-CD2 4.3Å; V84-L212 HydrophobicContact CG1-CD2 4.44Å; V84-L212 HydrophobicContact CG2-CD2 4.15Å; Y197-L212 HydrophobicContact CD2-CD2 3.91Å; Y197-L212 HydrophobicContact CE2-CD2 4.08Å; R208-L212 HydrophobicContact CG-CD1 4.26Å; R208-L212 HydrophobicContact CG-CG 4.39Å; R208-L212 WeakPolarHBondContact O-CG 3.26Å; R208-L212 PolarHBondContact O-N 3.22Å; L212-K214 VanDerWaalsContact C-N 3.34Å; L212-K214 PolarHBondContact O-N 3.24Å; L212-M215 HydrophobicContact CD2-CE 3.99Å; L212-M215 HydrophobicContact CD2-SD 3.99Å; L212-M215 WeakPolarHBondContact O-CG 3.36Å; L212-I216 WeakPolarHBondContact O-CD1 3.4Å; L212-I216 WeakPolarHBondContact O-CG1 3.32Å; L212-I216 PolarHBondContact O-N 3.42Å; L212-I216 VanDerWaalsContact O-N 3.13Å
213	K	96.8	Very high	95.3	Very high	58 Å²	58	64 Å²	64	25%	0.252	33%	0.333	S	S	.	.	H	α-helix	trans	-60.9	-43.5	174.9	-74.2	-176.5	-67.1	-175.3	0	112.1	L80 Y209 A210 M211 K217	L80-K213 HydrophobicContact CD1-CG 3.52Å; Y209-K213 HydrophobicContact CE1-CD 3.98Å; Y209-K213 VanDerWaalsContact CE1-CE 3.41Å; Y209-K213 HydrophobicContact CE2-CD 4.04Å; Y209-K213 HydrophobicContact CE2-CG 4.16Å; Y209-K213 PolarHBondContact O-N 3.25Å; Y209-K213 VanDerWaalsContact O-N 3.13Å; A210-K213 PolarHBondContact O-N 3.45Å; M211-K213 PolarHBondContact O-N 3.32Å; K213-K217 WeakPolarHBondContact O-CB 3.46Å; K213-K217 VanDerWaalsContact O-CG 3.27Å; K213-K217 WeakPolarHBondContact O-CG 3.37Å; K213-K217 PolarHBondContact O-N 2.91Å
214	K	97	Very high	95.3	Very high	167 Å²	167	62 Å²	62	73%	0.726	33%	0.325	S	S	*	.	H	α-helix	trans	-64.5	-46.8	-178	-175.3	179	177.1	-178.7	0	111.2	A210 M211 L212 K217 A218	A210-K214 WeakPolarHBondContact O-CB 3.31Å; A210-K214 PolarHBondContact O-N 3.25Å; M211-K214 PolarHBondContact O-N 3.42Å; M211-K214 VanDerWaalsContact O-N 3.12Å; L212-K214 VanDerWaalsContact C-N 3.34Å; L212-K214 PolarHBondContact O-N 3.24Å; K214-K217 PolarHBondContact O-N 2.84Å; K214-A218 WeakPolarHBondContact O-CB 3.31Å; K214-A218 PolarHBondContact O-N 3.48Å
215	M	97	Very high	95.3	Very high	9 Å²	9	57.7 Å²	57.7	4%	0.044	30%	0.297	C	S	.	.	H	α-helix	trans	-64.7	-44.2	-179.4	70	179.9	70.1	0	0	111.6	V84 L193 K196 T200 M211 L212 K217 A218 T219	V84-M215 HydrophobicContact CG1-SD 3.67Å; V84-M215 HydrophobicContact CG2-SD 4.12Å; L193-M215 HydrophobicContact CD1-CB 4.09Å; L193-M215 HydrophobicContact CD1-CG 3.82Å; L193-M215 HydrophobicContact CD1-SD 3.95Å; K196-M215 HydrophobicContact CB-CB 4.43Å; K196-M215 HydrophobicContact CB-CE 4.47Å; K196-M215 HydrophobicContact CD-CB 4.47Å; T200-M215 HydrophobicContact CG2-CE 3.33Å; M211-M215 HydrophobicContact CB-CE 4.43Å; M211-M215 WeakPolarHBondContact O-CG 3.14Å; M211-M215 PolarHBondContact O-N 3.18Å; L212-M215 HydrophobicContact CD2-CE 3.99Å; L212-M215 HydrophobicContact CD2-SD 3.99Å; L212-M215 WeakPolarHBondContact O-CG 3.36Å; M215-K217 PolarHBondContact O-N 3.29Å; M215-A218 WeakPolarHBondContact O-CB 3.34Å; M215-A218 PolarHBondContact O-N 2.98Å; M215-A218 VanDerWaalsContact O-N 3.15Å; M215-T219 PolarHBondContact O-N 3.44Å; M215-T219 PolarHBondContact O-OG1 3.48Å
216	I	97.3	Very high	95.2	Very high	1 Å²	1	55 Å²	55	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-62.2	-48.1	178.9	-64.5	166.7	0	0	0	109.8	L61 Y65 L80 V84 L212 A218 T219 L220	L61-I216 HydrophobicContact CD1-CG1 4.28Å; L61-I216 HydrophobicContact CG-CG2 4.31Å; Y65-I216 HydrophobicContact CD1-CG2 4.43Å; Y65-I216 HydrophobicContact CD2-CB 4.2Å; Y65-I216 HydrophobicContact CD2-CD1 4.16Å; Y65-I216 HydrophobicContact CD2-CG2 3.54Å; Y65-I216 HydrophobicContact CE2-CG2 4.26Å; Y65-I216 HydrophobicContact CG-CG2 3.66Å; L80-I216 HydrophobicContact CB-CD1 4.08Å; L80-I216 HydrophobicContact CD1-CD1 4.46Å; L80-I216 HydrophobicContact CD2-CD1 3.7Å; L80-I216 HydrophobicContact CG-CD1 4.27Å; V84-I216 HydrophobicContact CG2-CD1 3.56Å; V84-I216 HydrophobicContact CG2-CG1 3.44Å; V84-I216 VanDerWaalsContact CG2-CG1 3.44Å; L212-I216 WeakPolarHBondContact O-CD1 3.4Å; L212-I216 WeakPolarHBondContact O-CG1 3.32Å; L212-I216 PolarHBondContact O-N 3.42Å; L212-I216 VanDerWaalsContact O-N 3.13Å; I216-A218 VanDerWaalsContact C-N 3.27Å; I216-A218 PolarHBondContact O-N 3.33Å; I216-T219 PolarHBondContact O-N 3.21Å; I216-L220 HydrophobicContact CG2-CD1 3.7Å; I216-L220 HydrophobicContact CG2-CG 4.14Å; I216-L220 WeakPolarHBondContact O-CB 3.4Å; I216-L220 VanDerWaalsContact O-CG 3.25Å; I216-L220 WeakPolarHBondContact O-CG 3.34Å; I216-L220 PolarHBondContact O-N 2.69Å
217	K	96.9	Very high	94.9	Very high	82 Å²	82	54.4 Å²	54.4	36%	0.357	28%	0.284	S	S	.	.	H	α-helix	trans	-59.1	-37.9	176.5	-75	178.8	179.2	-174.3	0	112.5	Y65 K213 K214 M215 R221	Y65-K217 WeakPolarHBondContact OH-CE 3.39Å; K213-K217 WeakPolarHBondContact O-CB 3.46Å; K213-K217 VanDerWaalsContact O-CG 3.27Å; K213-K217 WeakPolarHBondContact O-CG 3.37Å; K213-K217 PolarHBondContact O-N 2.91Å; K214-K217 PolarHBondContact O-N 2.84Å; M215-K217 PolarHBondContact O-N 3.29Å; K217-R221 VanDerWaalsContact O-CB 3.31Å; K217-R221 WeakPolarHBondContact O-CB 3.2Å; K217-R221 WeakPolarHBondContact O-CD 3.34Å; K217-R221 WeakPolarHBondContact O-CG 3.19Å; K217-R221 PolarHBondContact O-N 2.91Å; K217-R221 VanDerWaalsContact O-N 3.12Å
218	A	97.1	Very high	94.6	Very high	47 Å²	47	51.9 Å²	51.9	39%	0.388	27%	0.267	S	S	.	.	H	α-helix	trans	-65.5	-47.5	177.8	0	0	0	0	0	110.9	K214 M215 I216 L220 R221 A222	K214-A218 WeakPolarHBondContact O-CB 3.31Å; K214-A218 PolarHBondContact O-N 3.48Å; M215-A218 WeakPolarHBondContact O-CB 3.34Å; M215-A218 PolarHBondContact O-N 2.98Å; M215-A218 VanDerWaalsContact O-N 3.15Å; I216-A218 VanDerWaalsContact C-N 3.27Å; I216-A218 PolarHBondContact O-N 3.33Å; A218-L220 VanDerWaalsContact C-N 3.35Å; A218-L220 PolarHBondContact O-N 2.97Å; A218-R221 PolarHBondContact O-N 2.97Å; A218-A222 PolarHBondContact O-N 3.26Å; A218-A222 VanDerWaalsContact O-N 3.12Å
219	T	96.7	Very high	93.6	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-59	-44.2	175.5	-59.1	0	0	0	0	112	L58 L61 L189 M215 I216 R221 A222 F225	L58-T219 HydrophobicContact CD2-CG2 3.69Å; L61-T219 HydrophobicContact CD2-CG2 4.33Å; L189-T219 HydrophobicContact CB-CG2 4.44Å; M215-T219 PolarHBondContact O-N 3.44Å; M215-T219 PolarHBondContact O-OG1 3.48Å; I216-T219 PolarHBondContact O-N 3.21Å; T219-R221 VanDerWaalsContact C-N 3.26Å; T219-R221 PolarHBondContact O-N 2.86Å; T219-A222 WeakPolarHBondContact O-CB 3.26Å; T219-A222 PolarHBondContact O-N 2.96Å; T219-F225 WeakPolarHBondContact O-CB 3.42Å
220	L	95	Very high	92.5	Very high	30 Å²	30	58 Å²	58	16%	0.157	30%	0.301	C	S	.	.	H	α-helix	trans	-74.2	-12.4	-179	-63.3	179.3	0	0	0	114.4	Q62 Y65 I216 A218 F225	Q62-L220 HydrophobicContact CB-CD1 4.35Å; Q62-L220 HydrophobicContact CB-CD2 3.58Å; Q62-L220 HydrophobicContact CG-CD1 4.22Å; Q62-L220 HydrophobicContact CG-CD2 3.96Å; Y65-L220 HydrophobicContact CD1-CD1 3.87Å; Y65-L220 HydrophobicContact CG-CD1 4.19Å; I216-L220 HydrophobicContact CG2-CD1 3.7Å; I216-L220 HydrophobicContact CG2-CG 4.14Å; I216-L220 WeakPolarHBondContact O-CB 3.4Å; I216-L220 VanDerWaalsContact O-CG 3.25Å; I216-L220 WeakPolarHBondContact O-CG 3.34Å; I216-L220 PolarHBondContact O-N 2.69Å; A218-L220 VanDerWaalsContact C-N 3.35Å; A218-L220 PolarHBondContact O-N 2.97Å; L220-F225 HydrophobicContact CB-CD1 4.42Å; L220-F225 HydrophobicContact CB-CE1 4.41Å; L220-F225 HydrophobicContact CD2-CD1 4.06Å; L220-F225 HydrophobicContact CD2-CE1 3.55Å; L220-F225 HydrophobicContact CD2-CE2 4.3Å; L220-F225 HydrophobicContact CD2-CZ 3.69Å; L220-F225 WeakPolarHBondContact O-CD1 3.47Å
221	R	94.9	Very high	91.6	Very high	191 Å²	191	57.9 Å²	57.9	72%	0.721	29%	0.292	S	S	*	.	H	α-helix	trans	-103.8	-5.3	176.5	-72.1	171.6	178.3	175.8	-7.6	112.7	K217 A218 T219	K217-R221 VanDerWaalsContact O-CB 3.31Å; K217-R221 WeakPolarHBondContact O-CB 3.2Å; K217-R221 WeakPolarHBondContact O-CD 3.34Å; K217-R221 WeakPolarHBondContact O-CG 3.19Å; K217-R221 PolarHBondContact O-N 2.91Å; K217-R221 VanDerWaalsContact O-N 3.12Å; A218-R221 PolarHBondContact O-N 2.97Å; T219-R221 VanDerWaalsContact C-N 3.26Å; T219-R221 PolarHBondContact O-N 2.86Å
222	A	94.9	Very high	89.9	Confident	13 Å²	13	63 Å²	63	11%	0.107	32%	0.315	C	S	.	.	S	Bend	trans	-64.6	139.7	178.5	0	0	0	0	0	109.8	L189 A218 T219 E224 F225 A226	L189-A222 HydrophobicContact CD1-CB 4Å; L189-A222 HydrophobicContact CD2-CB 3.38Å; L189-A222 HydrophobicContact CG-CB 4.33Å; A218-A222 PolarHBondContact O-N 3.26Å; A218-A222 VanDerWaalsContact O-N 3.12Å; T219-A222 WeakPolarHBondContact O-CB 3.26Å; T219-A222 PolarHBondContact O-N 2.96Å; A222-E224 PolarHBondContact O-N 3.5Å; A222-F225 PolarHBondContact O-N 2.82Å; A222-A226 PolarHBondContact O-N 3.2Å
223	P	92.8	Very high	87.9	Confident	85 Å²	85	67.2 Å²	67.2	55%	0.552	34%	0.341	S	S	*	.	H	α-helix	trans	-57.8	-38.1	-178.5	22.9	-31.9	0	0	0	111.4	F225 A226 D227	P223-F225 PolarHBondContact O-N 3.43Å; P223-A226 PolarHBondContact O-N 3.2Å; P223-A226 VanDerWaalsContact O-N 3.09Å; P223-D227 VanDerWaalsContact O-CG 3.3Å; P223-D227 PolarHBondContact O-N 3.32Å
224	E	93.1	Very high	85.2	Confident	49 Å²	49	72.8 Å²	72.8	23%	0.229	37%	0.368	C	S	.	.	H	α-helix	trans	-63.4	-28.6	179.5	-53.9	91.7	155.2	0	0	112.9	R188 L189 A222	R188-E224 IonicContact NH1-OE1 2.65Å; L189-E224 HydrophobicContact CD1-CB 4.04Å; L189-E224 HydrophobicContact CG-CB 4.49Å; A222-E224 PolarHBondContact O-N 3.5Å
225	F	92.9	Very high	84.7	Confident	2 Å²	2	68.1 Å²	68.1	1%	0.009	35%	0.35	C	S	.	.	H	α-helix	trans	-82.4	-38.8	172.7	-178.9	-99.8	0	0	0	112	L58 Q62 L189 T219 L220 A222 P223 D227 I228 C229	L58-F225 HydrophobicContact CB-CD2 3.79Å; L58-F225 HydrophobicContact CB-CE2 3.67Å; L58-F225 HydrophobicContact CD1-CD2 4.39Å; Q62-F225 HydrophobicContact CB-CE1 4.49Å; Q62-F225 HydrophobicContact CB-CZ 3.95Å; Q62-F225 HydrophobicContact CG-CE1 4.42Å; Q62-F225 HydrophobicContact CG-CZ 4.29Å; L189-F225 HydrophobicContact CD1-CB 3.9Å; T219-F225 WeakPolarHBondContact O-CB 3.42Å; L220-F225 HydrophobicContact CB-CD1 4.42Å; L220-F225 HydrophobicContact CB-CE1 4.41Å; L220-F225 HydrophobicContact CD2-CD1 4.06Å; L220-F225 HydrophobicContact CD2-CE1 3.55Å; L220-F225 HydrophobicContact CD2-CE2 4.3Å; L220-F225 HydrophobicContact CD2-CZ 3.69Å; L220-F225 WeakPolarHBondContact O-CD1 3.47Å; A222-F225 PolarHBondContact O-N 2.82Å; P223-F225 PolarHBondContact O-N 3.43Å; F225-D227 VanDerWaalsContact C-N 3.26Å; F225-D227 PolarHBondContact O-N 3.18Å; F225-I228 HydrophobicContact CD2-CD1 3.91Å; F225-I228 HydrophobicContact CD2-CG1 4.14Å; F225-I228 HydrophobicContact CE2-CD1 4.31Å; F225-I228 WeakPolarHBondContact O-CG1 3.37Å; F225-I228 PolarHBondContact O-N 3.05Å; F225-I228 VanDerWaalsContact O-N 3.17Å; F225-C229 HydrophobicContact CE1-CB 4.34Å; F225-C229 PolarHBondContact O-N 2.99Å
226	A	89.5	Confident	84	Confident	50 Å²	50	71.2 Å²	71.2	41%	0.413	37%	0.366	S	S	.	.	H	α-helix	trans	-58.1	-41.2	178.3	0	0	0	0	0	111.5	A222 P223 I228 C229	A222-A226 PolarHBondContact O-N 3.2Å; P223-A226 PolarHBondContact O-N 3.2Å; P223-A226 VanDerWaalsContact O-N 3.09Å; A226-I228 PolarHBondContact O-N 3.41Å; A226-C229 PolarHBondContact O-N 3.13Å
227	D	84.9	Confident	83.3	Confident	109 Å²	109	75.1 Å²	75.1	58%	0.583	39%	0.386	S	S	*	.	H	α-helix	trans	-61.6	-29.7	178.9	-69.4	-14.8	0	0	0	113.6	P223 F225	P223-D227 VanDerWaalsContact O-CG 3.3Å; P223-D227 PolarHBondContact O-N 3.32Å; F225-D227 VanDerWaalsContact C-N 3.26Å; F225-D227 PolarHBondContact O-N 3.18Å
228	I	87.6	Confident	82.5	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.005	39%	0.388	C	S	.	.	H	α-helix	trans	-101	-9.5	-177	63.8	155.2	0	0	0	113.4	Y51 K55 L186 F225 A226 H230 E231	Y51-I228 HydrophobicContact CE2-CG2 4.47Å; Y51-I228 WeakPolarHBondContact OH-CG2 3.4Å; K55-I228 HydrophobicContact CB-CD1 4.26Å; K55-I228 HydrophobicContact CD-CB 4.49Å; K55-I228 HydrophobicContact CG-CB 4.49Å; K55-I228 HydrophobicContact CG-CD1 3.82Å; L186-I228 HydrophobicContact CD1-CD1 3.8Å; L186-I228 HydrophobicContact CD2-CD1 3.44Å; L186-I228 VanDerWaalsContact CD2-CD1 3.44Å; L186-I228 HydrophobicContact CD2-CG1 4.17Å; L186-I228 HydrophobicContact CG-CD1 4.25Å; F225-I228 HydrophobicContact CD2-CD1 3.91Å; F225-I228 HydrophobicContact CD2-CG1 4.14Å; F225-I228 HydrophobicContact CE2-CD1 4.31Å; F225-I228 WeakPolarHBondContact O-CG1 3.37Å; F225-I228 PolarHBondContact O-N 3.05Å; F225-I228 VanDerWaalsContact O-N 3.17Å; A226-I228 PolarHBondContact O-N 3.41Å; I228-H230 PolarHBondContact O-N 3.45Å; I228-E231 PolarHBondContact O-N 2.94Å
229	C	75.6	Confident	81.5	Confident	33 Å²	33	76.4 Å²	76.4	22%	0.223	39%	0.388	C	S	.	.	H	α-helix	trans	-61.2	-33.8	-173.2	-171.8	0	0	0	0	111.9	Q62 F225 A226	Q62-C229 PolarHBondContact NE2-SG 3.26Å; Q62-C229 VanDerWaalsContact NE2-SG 3.38Å; F225-C229 HydrophobicContact CE1-CB 4.34Å; F225-C229 PolarHBondContact O-N 2.99Å; A226-C229 PolarHBondContact O-N 3.13Å
230	H	72.8	Confident	80.5	Confident	171 Å²	171	81.2 Å²	81.2	79%	0.792	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-6.3	-178.3	-59.2	-64.3	0	0	0	114.3	I228 Q232	I228-H230 PolarHBondContact O-N 3.45Å; H230-Q232 PolarHBondContact O-N 3.22Å
231	E	77.5	Confident	79.5	Confident	50 Å²	50	84.9 Å²	84.9	23%	0.234	43%	0.43	C	S	.	.	S	Bend	trans	-66	135.8	175.1	-68	-174.6	174.1	0	0	109.7	Y51 K55 K59 K182 I228	Y51-E231 PolarHBondContact OH-OE2 3.35Å; K55-E231 IonicContact NZ-OE2 2.78Å; K59-E231 PolarHBondContact NZ-O 3.27Å; K182-E231 IonicContact NZ-OE1 3.63Å; K182-E231 PolarHBondContact NZ-OE1 3.43Å; I228-E231 PolarHBondContact O-N 2.94Å
232	Q	61.1	Low	78.3	Confident	170 Å²	170	76.7 Å²	76.7	79%	0.794	41%	0.408	S	S	*	.			trans	-61.4	148.1	175.3	-65.3	-174.6	11.4	0	0	110.8	K55 H230 E234	K55-Q232 PolarHBondContact NZ-O 2.9Å; H230-Q232 PolarHBondContact O-N 3.22Å; Q232-E234 VanDerWaalsContact C-N 3.34Å; Q232-E234 PolarHBondContact O-N 2.8Å; Q232-E234 VanDerWaalsContact O-N 3.14Å
233	T	54.4	Low	76.9	Confident	88 Å²	88	82 Å²	82	54%	0.54	43%	0.433	S	S	.	.			trans	-79	90.7	169.7	-53	0	0	0	0	106.4	K59	K59-T233 PolarHBondContact NZ-OG1 2.96Å
234	E	40.9	Very low	75.5	Confident	176 Å²	176	81.7 Å²	81.7	82%	0.822	42%	0.422	S	S	*	.			trans	-70.6	0	165.6	-67.7	-179.2	174	0	0	111	R52 Q232	R52-E234 IonicContact CZ-OE2 2.68Å; R52-E234 IonicContact NE-OE2 3.99Å; R52-E234 IonicContact NH2-OE2 3.63Å; R52-E234 PolarHBondContact NH2-OE2 2.99Å; Q232-E234 VanDerWaalsContact C-N 3.34Å; Q232-E234 PolarHBondContact O-N 2.8Å; Q232-E234 VanDerWaalsContact O-N 3.14Å

Retrieved 234 of 234 residues in 153.4 ms (Link to these results)

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